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V-type proton ATPase subunit D

Subunit of the V1 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons¹. V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments and in some cell types, is targeted to the plasma membrane, where it is responsible for acidifying the extracellular environment (By similarity). May play a role in cilium biogenesis through regulation of the transport and the localization of proteins to the cilium².

AlphaFold DB , UniProt , Accession Q9Y5K8, Species HUMAN (Homo sapiens, Human), Gene ATP6V1D, Length 247 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	48.9	Very low	76.3	Confident	165 Å²	165	91.5 Å²	91.5	81%	0.813	46%	0.461	S	S	*	.				0	114.1	0	-73.4	-66.6	-142.5	0	0	107.6
2	S	51.8	Low	77.7	Confident	70 Å²	70	87.3 Å²	87.3	49%	0.49	45%	0.447	S	S	.	.			trans	-65	142.8	179.7	-176.7	0	0	0	0	109	K4 D5	S2-K4 PolarHBondContact O-N 3.05Å; S2-D5 WeakPolarHBondContact CB-OD2 3.31Å; S2-D5 PolarHBondContact N-OD2 3.24Å; S2-D5 VanDerWaalsContact N-OD2 3.12Å; S2-D5 PolarHBondContact O-N 3.48Å
3	G	62.3	Low	78.9	Confident	43 Å²	43	93.3 Å²	93.3	44%	0.443	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-53	-24.2	178.7	0	0	0	0	0	113.4	D5	G3-D5 VanDerWaalsContact C-N 3.34Å; G3-D5 PolarHBondContact O-N 3.46Å
4	K	76.6	Confident	80	Confident	183 Å²	183	95.5 Å²	95.5	80%	0.796	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-73.2	-18	178.9	-62.4	-175.5	178	179.4	0	114.9	S2 R6	S2-K4 PolarHBondContact O-N 3.05Å; K4-R6 VanDerWaalsContact C-N 3.29Å; K4-R6 PolarHBondContact O-N 2.94Å
5	D	80.5	Confident	80.9	Confident	60 Å²	60	89.3 Å²	89.3	32%	0.321	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-80.3	-12	-173.9	-63.8	-39.8	0	0	0	113.6	S2 G3 R182	S2-D5 WeakPolarHBondContact CB-OD2 3.31Å; S2-D5 PolarHBondContact N-OD2 3.24Å; S2-D5 VanDerWaalsContact N-OD2 3.12Å; S2-D5 PolarHBondContact O-N 3.48Å; G3-D5 VanDerWaalsContact C-N 3.34Å; G3-D5 PolarHBondContact O-N 3.46Å; D5-R182 PolarHBondContact O-NE 3.47Å; D5-R182 PolarHBondContact O-NH2 3.32Å
6	R	82	Confident	81.7	Confident	71 Å²	71	86.1 Å²	86.1	27%	0.268	43%	0.425	S	S	.	.	S	Bend	trans	-130	165.5	-174.8	-63.7	-176.5	-64.8	-169.5	4.5	110.4	K4 R182 Y186	K4-R6 VanDerWaalsContact C-N 3.29Å; K4-R6 PolarHBondContact O-N 2.94Å; R6-R182 HydrophobicContact CG-CB 4.18Å; R6-Y186 VanDerWaalsContact NH1-CG 3.33Å
7	I	85.3	Confident	82.5	Confident	39 Å²	39	86.1 Å²	86.1	20%	0.2	43%	0.431	C	S	.	.			trans	-86	128.8	168.8	-59.1	175.8	0	0	0	107	I9 M19 R179 I180 T183	I7-I9 VanDerWaalsContact C-N 3.33Å; I7-I9 PolarHBondContact O-N 2.79Å; I7-M19 HydrophobicContact CD1-SD 4.13Å; I7-R179 HydrophobicContact CG1-CG 4.07Å; I7-I180 HydrophobicContact CD1-CG1 4.1Å; I7-T183 HydrophobicContact CB-CG2 4.14Å; I7-T183 PolarHBondContact N-OG1 3.1Å
8	E	84.5	Confident	83.2	Confident	180 Å²	180	85.2 Å²	85.2	84%	0.841	43%	0.427	S	S	*	.			trans	-71.5	86	178	-65.2	176.2	-178.7	0	0	109.8
9	I	85.9	Confident	83.8	Confident	50 Å²	50	80.7 Å²	80.7	26%	0.256	41%	0.405	S	S	.	.			trans	-132.5	136.9	176.7	-166.2	167.2	0	0	0	109.9	I7 A15 M19 T183 I187	I7-I9 VanDerWaalsContact C-N 3.33Å; I7-I9 PolarHBondContact O-N 2.79Å; I9-A15 HydrophobicContact CD1-CB 3.71Å; I9-A15 HydrophobicContact CG1-CB 3.95Å; I9-M19 HydrophobicContact CD1-CE 4.06Å; I9-T183 HydrophobicContact CG2-CG2 3.77Å; I9-I187 HydrophobicContact CG2-CD1 4.02Å
10	F	89.8	Confident	84.4	Confident	139 Å²	139	82.1 Å²	82.1	61%	0.61	41%	0.408	S	S	*	.			trans	-66.8	130.9	178.3	-174.3	-99.7	0	0	0	111	S12 A15	F10-S12 PolarHBondContact O-N 3.11Å; F10-S12 VanDerWaalsContact O-N 3.11Å; F10-A15 WeakPolarHBondContact O-CB 3.45Å
11	P	91.8	Very high	85	Confident	6 Å²	6	81.2 Å²	81.2	4%	0.039	41%	0.414	C	S	.	.			trans	-62.3	112.9	179.2	-23.1	33.6	0	0	0	112.4	Y186 E190	P11-Y186 HydrophobicContact CG-CD1 4.35Å; P11-Y186 HydrophobicContact CG-CE1 3.58Å; P11-E190 HydrophobicContact CB-CB 3.58Å; P11-E190 HydrophobicContact CB-CG 4.17Å; P11-E190 HydrophobicContact CG-CB 3.75Å; P11-E190 HydrophobicContact CG-CG 3.75Å
12	S	93.6	Very high	87.1	Confident	41 Å²	41	79.5 Å²	79.5	29%	0.287	40%	0.398	S	S	.	.			trans	-148.7	156.5	174.1	63.3	0	0	0	0	110	F10 M14 A15 Q16	F10-S12 PolarHBondContact O-N 3.11Å; F10-S12 VanDerWaalsContact O-N 3.11Å; S12-M14 PolarHBondContact O-N 2.94Å; S12-A15 WeakPolarHBondContact O-CB 3.36Å; S12-A15 PolarHBondContact O-N 3.05Å; S12-A15 VanDerWaalsContact OG-CB 3.29Å; S12-A15 WeakPolarHBondContact OG-CB 3.37Å; S12-A15 PolarHBondContact OG-N 3.06Å; S12-Q16 PolarHBondContact O-N 3.14Å
13	R	92.2	Very high	89.2	Confident	166 Å²	166	77.4 Å²	77.4	63%	0.626	38%	0.381	S	S	*	.	H	α-helix	trans	-57.8	-32.6	174.2	-69.4	-175.3	177	173.9	-0.4	112	Q16 T17 L191 E195	R13-Q16 WeakPolarHBondContact O-CB 3.3Å; R13-Q16 PolarHBondContact O-N 3.1Å; R13-T17 PolarHBondContact O-N 3.25Å; R13-T17 PolarHBondContact O-OG1 3.5Å; R13-T17 VanDerWaalsContact O-OG1 3.13Å; R13-L191 HydrophobicContact CG-CD1 4.13Å; R13-L191 HydrophobicContact CG-CD2 4.21Å; R13-E195 IonicContact CZ-OE1 3.25Å; R13-E195 IonicContact NE-OE1 3.64Å; R13-E195 IonicContact NH2-OE1 2.81Å; R13-E195 PolarHBondContact NH2-OE1 2.9Å
14	M	94.7	Very high	90.9	Very high	124 Å²	124	82.5 Å²	82.5	61%	0.611	39%	0.391	S	S	*	.	H	α-helix	trans	-66.9	-47.3	173.4	-171.8	59	-164.8	0	0	111.7	S12 Q16 T17 I18	S12-M14 PolarHBondContact O-N 2.94Å; M14-Q16 VanDerWaalsContact C-N 3.26Å; M14-Q16 PolarHBondContact O-N 3.41Å; M14-T17 WeakPolarHBondContact O-CB 3.26Å; M14-T17 PolarHBondContact O-N 3.23Å; M14-T17 VanDerWaalsContact O-N 3.09Å; M14-I18 HydrophobicContact CE-CD1 3.99Å; M14-I18 HydrophobicContact CE-CG1 3.91Å; M14-I18 HydrophobicContact CG-CD1 4.11Å; M14-I18 WeakPolarHBondContact O-CG1 3.23Å; M14-I18 PolarHBondContact O-N 2.87Å
15	A	93.8	Very high	91.8	Very high	3 Å²	3	75.9 Å²	75.9	3%	0.025	38%	0.375	C	S	.	.	H	α-helix	trans	-58.6	-38.6	175.4	0	0	0	0	0	112	I9 F10 S12 T17 I18 M19 I187	I9-A15 HydrophobicContact CD1-CB 3.71Å; I9-A15 HydrophobicContact CG1-CB 3.95Å; F10-A15 WeakPolarHBondContact O-CB 3.45Å; S12-A15 WeakPolarHBondContact O-CB 3.36Å; S12-A15 PolarHBondContact O-N 3.05Å; S12-A15 VanDerWaalsContact OG-CB 3.29Å; S12-A15 WeakPolarHBondContact OG-CB 3.37Å; S12-A15 PolarHBondContact OG-N 3.06Å; A15-T17 VanDerWaalsContact C-N 3.34Å; A15-T17 PolarHBondContact O-N 2.89Å; A15-I18 PolarHBondContact O-N 2.84Å; A15-M19 WeakPolarHBondContact O-CB 3.46Å; A15-M19 WeakPolarHBondContact O-CG 3.37Å; A15-M19 PolarHBondContact O-N 3.29Å; A15-I187 HydrophobicContact CB-CD1 4.15Å
16	Q	93.7	Very high	92.6	Very high	38 Å²	38	73.8 Å²	73.8	18%	0.178	37%	0.366	C	S	.	.	H	α-helix	trans	-58.9	-45	174.7	-165.2	-169.5	12.8	0	0	111.6	S12 R13 M14 M19 K20 I187	S12-Q16 PolarHBondContact O-N 3.14Å; R13-Q16 WeakPolarHBondContact O-CB 3.3Å; R13-Q16 PolarHBondContact O-N 3.1Å; M14-Q16 VanDerWaalsContact C-N 3.26Å; M14-Q16 PolarHBondContact O-N 3.41Å; Q16-M19 PolarHBondContact O-N 3.45Å; Q16-K20 WeakPolarHBondContact O-CB 3.26Å; Q16-K20 WeakPolarHBondContact O-CG 3.43Å; Q16-K20 PolarHBondContact O-N 2.85Å; Q16-I187 HydrophobicContact CB-CG2 3.83Å; Q16-I187 HydrophobicContact CG-CG2 4.25Å
17	T	95.5	Very high	93.2	Very high	86 Å²	86	74.3 Å²	74.3	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-64.3	-43.7	178.3	-57.1	0	0	0	0	111.4	R13 M14 A15 M19 K20 A21	R13-T17 PolarHBondContact O-N 3.25Å; R13-T17 PolarHBondContact O-OG1 3.5Å; R13-T17 VanDerWaalsContact O-OG1 3.13Å; M14-T17 WeakPolarHBondContact O-CB 3.26Å; M14-T17 PolarHBondContact O-N 3.23Å; M14-T17 VanDerWaalsContact O-N 3.09Å; A15-T17 VanDerWaalsContact C-N 3.34Å; A15-T17 PolarHBondContact O-N 2.89Å; T17-M19 PolarHBondContact O-N 3.35Å; T17-K20 PolarHBondContact O-N 3.37Å; T17-A21 WeakPolarHBondContact O-CB 3.18Å; T17-A21 PolarHBondContact O-N 2.83Å
18	I	95.3	Very high	93.8	Very high	69 Å²	69	75.8 Å²	75.8	35%	0.354	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-43.4	176.3	-62.3	168.2	0	0	0	110.7	M14 A15 A21 R22	M14-I18 HydrophobicContact CE-CD1 3.99Å; M14-I18 HydrophobicContact CE-CG1 3.91Å; M14-I18 HydrophobicContact CG-CD1 4.11Å; M14-I18 WeakPolarHBondContact O-CG1 3.23Å; M14-I18 PolarHBondContact O-N 2.87Å; A15-I18 PolarHBondContact O-N 2.84Å; I18-A21 PolarHBondContact O-N 2.87Å; I18-R22 WeakPolarHBondContact O-CB 3.37Å; I18-R22 PolarHBondContact O-N 3.44Å
19	M	94	Very high	94.3	Very high	1 Å²	1	68.2 Å²	68.2	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-67.6	-38.9	178.7	-70.7	-56.6	101.8	0	0	112.2	I7 I9 A15 Q16 T17 R22 L23 T183 I187	I7-M19 HydrophobicContact CD1-SD 4.13Å; I9-M19 HydrophobicContact CD1-CE 4.06Å; A15-M19 WeakPolarHBondContact O-CB 3.46Å; A15-M19 WeakPolarHBondContact O-CG 3.37Å; A15-M19 PolarHBondContact O-N 3.29Å; Q16-M19 PolarHBondContact O-N 3.45Å; T17-M19 PolarHBondContact O-N 3.35Å; M19-R22 PolarHBondContact O-N 2.91Å; M19-L23 WeakPolarHBondContact O-CB 3.36Å; M19-L23 PolarHBondContact O-N 2.75Å; M19-T183 HydrophobicContact CG-CG2 4.3Å; M19-T183 HydrophobicContact SD-CG2 4.2Å; M19-I187 HydrophobicContact CB-CD1 4.44Å; M19-I187 HydrophobicContact CG-CD1 3.74Å
20	K	95.4	Very high	94.8	Very high	108 Å²	108	69.7 Å²	69.7	47%	0.47	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-45.1	172.7	-76.9	178.2	178.9	176.6	0	111.7	Q16 T17 R22 L23 K24 L184	Q16-K20 WeakPolarHBondContact O-CB 3.26Å; Q16-K20 WeakPolarHBondContact O-CG 3.43Å; Q16-K20 PolarHBondContact O-N 2.85Å; T17-K20 PolarHBondContact O-N 3.37Å; K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 3.25Å; K20-L23 PolarHBondContact O-N 3.29Å; K20-K24 PolarHBondContact O-N 2.93Å; K20-L184 HydrophobicContact CG-CD1 3.58Å
21	A	96.4	Very high	95	Very high	64 Å²	64	67 Å²	67	53%	0.529	35%	0.347	S	S	.	.	H	α-helix	trans	-62.1	-42	175.6	0	0	0	0	0	111.7	T17 I18 K24 G25	T17-A21 WeakPolarHBondContact O-CB 3.18Å; T17-A21 PolarHBondContact O-N 2.83Å; I18-A21 PolarHBondContact O-N 2.87Å; A21-K24 PolarHBondContact O-N 3.35Å; A21-G25 PolarHBondContact O-N 3.41Å
22	R	94.9	Very high	95.2	Very high	128 Å²	128	72 Å²	72	48%	0.483	37%	0.373	S	S	.	.	H	α-helix	trans	-64.5	-39.5	176.2	-167.6	179.6	-73.3	-160.5	-3.4	112.2	I18 M19 K20 G25 A26 I180	I18-R22 WeakPolarHBondContact O-CB 3.37Å; I18-R22 PolarHBondContact O-N 3.44Å; M19-R22 PolarHBondContact O-N 2.91Å; K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 3.25Å; R22-G25 PolarHBondContact O-N 2.87Å; R22-A26 WeakPolarHBondContact O-CB 3.36Å; R22-A26 PolarHBondContact O-N 3.45Å; R22-I180 HydrophobicContact CB-CD1 4.49Å; R22-I180 HydrophobicContact CG-CD1 3.79Å
23	L	95.6	Very high	95.3	Very high	27 Å²	27	71.6 Å²	71.6	14%	0.141	37%	0.367	C	S	.	.	H	α-helix	trans	-62.2	-49.4	175.4	-176	61.9	0	0	0	111	M19 K20 G25 A26 Q27 I177 I180 E181	M19-L23 WeakPolarHBondContact O-CB 3.36Å; M19-L23 PolarHBondContact O-N 2.75Å; K20-L23 PolarHBondContact O-N 3.29Å; L23-G25 VanDerWaalsContact C-N 3.29Å; L23-G25 PolarHBondContact O-N 3.01Å; L23-A26 PolarHBondContact O-N 2.88Å; L23-A26 VanDerWaalsContact O-N 3.16Å; L23-Q27 WeakPolarHBondContact O-CG 3.47Å; L23-Q27 PolarHBondContact O-N 3.22Å; L23-I177 HydrophobicContact CD1-CG2 4.18Å; L23-I180 HydrophobicContact CB-CG2 3.85Å; L23-I180 HydrophobicContact CD1-CB 4.42Å; L23-I180 HydrophobicContact CD1-CG2 4.13Å; L23-E181 HydrophobicContact CD1-CG 4.03Å; L23-E181 HydrophobicContact CD2-CG 4.43Å
24	K	96.8	Very high	95.4	Very high	149 Å²	149	68 Å²	68	65%	0.648	36%	0.356	S	S	*	.	H	α-helix	trans	-59.2	-41.1	175.8	-174	177.7	179.9	179.4	0	111.6	K20 A21 T28	K20-K24 PolarHBondContact O-N 2.93Å; A21-K24 PolarHBondContact O-N 3.35Å; K24-T28 WeakPolarHBondContact O-CB 3.43Å; K24-T28 PolarHBondContact O-N 3.23Å; K24-T28 PolarHBondContact O-OG1 2.89Å
25	G	96.6	Very high	95.4	Very high	45 Å²	45	69.5 Å²	69.5	46%	0.464	36%	0.359	S	S	.	.	H	α-helix	trans	-62	-44.5	174.3	0	0	0	0	0	112.9	A21 R22 L23 T28 G29	A21-G25 PolarHBondContact O-N 3.41Å; R22-G25 PolarHBondContact O-N 2.87Å; L23-G25 VanDerWaalsContact C-N 3.29Å; L23-G25 PolarHBondContact O-N 3.01Å; G25-T28 PolarHBondContact O-N 2.94Å; G25-G29 PolarHBondContact O-N 3.5Å
26	A	96.2	Very high	95.4	Very high	15 Å²	15	72.6 Å²	72.6	12%	0.124	37%	0.372	C	S	.	.	H	α-helix	trans	-64.9	-43.2	177.3	0	0	0	0	0	112.2	R22 L23 G29 R30 I172 I176 I177 I180	R22-A26 WeakPolarHBondContact O-CB 3.36Å; R22-A26 PolarHBondContact O-N 3.45Å; L23-A26 PolarHBondContact O-N 2.88Å; L23-A26 VanDerWaalsContact O-N 3.16Å; A26-G29 PolarHBondContact O-N 3.43Å; A26-R30 PolarHBondContact O-N 2.94Å; A26-I172 HydrophobicContact CB-CG2 4.39Å; A26-I176 HydrophobicContact CB-CG2 4.46Å; A26-I177 HydrophobicContact CB-CG1 4.09Å; A26-I180 HydrophobicContact CB-CD1 4.21Å
27	Q	95.6	Very high	95.3	Very high	83 Å²	83	70.9 Å²	70.9	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-63	-45.4	176	-71.5	173	-15.6	0	0	111.8	L23 R30 N31 I177	L23-Q27 WeakPolarHBondContact O-CG 3.47Å; L23-Q27 PolarHBondContact O-N 3.22Å; Q27-R30 WeakPolarHBondContact O-CB 3.27Å; Q27-R30 PolarHBondContact O-N 2.91Å; Q27-N31 PolarHBondContact O-N 3.35Å; Q27-N31 VanDerWaalsContact O-N 3.14Å; Q27-I177 HydrophobicContact CG-CD1 4.36Å
28	T	96.5	Very high	95.3	Very high	70 Å²	70	70.4 Å²	70.4	43%	0.429	36%	0.359	S	S	.	.	H	α-helix	trans	-63.4	-43.8	176.2	-53.7	0	0	0	0	110.8	K24 G25 R30 N31 L32	K24-T28 WeakPolarHBondContact O-CB 3.43Å; K24-T28 PolarHBondContact O-N 3.23Å; K24-T28 PolarHBondContact O-OG1 2.89Å; G25-T28 PolarHBondContact O-N 2.94Å; T28-R30 PolarHBondContact O-N 3.42Å; T28-N31 PolarHBondContact O-N 3.17Å; T28-L32 HydrophobicContact CG2-CD1 4.13Å; T28-L32 WeakPolarHBondContact O-CG 3.39Å; T28-L32 PolarHBondContact O-N 3.26Å
29	G	95.7	Very high	95.2	Very high	21 Å²	21	69.2 Å²	69.2	22%	0.216	36%	0.359	C	S	.	.	H	α-helix	trans	-60.4	-41.1	175.9	0	0	0	0	0	113.1	G25 A26 L32 L33	G25-G29 PolarHBondContact O-N 3.5Å; A26-G29 PolarHBondContact O-N 3.43Å; G29-L32 PolarHBondContact O-N 3.28Å; G29-L33 WeakPolarHBondContact O-CB 3.43Å; G29-L33 WeakPolarHBondContact O-CG 3.45Å; G29-L33 PolarHBondContact O-N 2.93Å
30	R	95.6	Very high	95.2	Very high	81 Å²	81	69.2 Å²	69.2	31%	0.306	36%	0.359	S	S	.	.	H	α-helix	trans	-58	-50.1	173.7	-169.7	-169.8	71.8	157.4	-3	110.8	A26 Q27 T28 L32 L33 K34 V169 I172 E173	A26-R30 PolarHBondContact O-N 2.94Å; Q27-R30 WeakPolarHBondContact O-CB 3.27Å; Q27-R30 PolarHBondContact O-N 2.91Å; T28-R30 PolarHBondContact O-N 3.42Å; R30-L32 PolarHBondContact O-N 2.87Å; R30-L33 PolarHBondContact O-N 3.36Å; R30-K34 WeakPolarHBondContact O-CB 3.3Å; R30-K34 PolarHBondContact O-N 3.36Å; R30-V169 HydrophobicContact CG-CG1 4.18Å; R30-I172 HydrophobicContact CB-CG2 3.92Å; R30-I172 HydrophobicContact CG-CG2 4.41Å; R30-E173 IonicContact NH1-OE1 2.76Å; R30-E173 PolarHBondContact NH1-OE1 2.92Å
31	N	95.2	Very high	95.1	Very high	82 Å²	82	65.6 Å²	65.6	44%	0.439	35%	0.346	S	S	.	.	H	α-helix	trans	-64.7	-40.1	-177	-66.4	-13.4	0	0	0	111.9	Q27 T28 K34 K35	Q27-N31 PolarHBondContact O-N 3.35Å; Q27-N31 VanDerWaalsContact O-N 3.14Å; T28-N31 PolarHBondContact O-N 3.17Å; N31-K34 PolarHBondContact O-N 3.37Å; N31-K35 WeakPolarHBondContact O-CG 3.42Å; N31-K35 PolarHBondContact O-N 2.96Å
32	L	95.5	Very high	94.9	Very high	112 Å²	112	67.5 Å²	67.5	59%	0.586	35%	0.347	S	S	*	.	H	α-helix	trans	-65.7	-46.1	176.3	-71.5	171.2	0	0	0	112.2	T28 G29 R30 K34 K35 K36	T28-L32 HydrophobicContact CG2-CD1 4.13Å; T28-L32 WeakPolarHBondContact O-CG 3.39Å; T28-L32 PolarHBondContact O-N 3.26Å; G29-L32 PolarHBondContact O-N 3.28Å; R30-L32 PolarHBondContact O-N 2.87Å; L32-K34 VanDerWaalsContact C-N 3.32Å; L32-K34 PolarHBondContact O-N 3.42Å; L32-K35 PolarHBondContact O-N 3.21Å; L32-K36 PolarHBondContact O-N 2.92Å
33	L	95.2	Very high	94.8	Very high	31 Å²	31	67.6 Å²	67.6	16%	0.162	35%	0.347	C	S	.	.	H	α-helix	trans	-66.9	-34.2	177.8	-71.5	174.1	0	0	0	112.2	G29 R30 K36 S37 T165 R168 V169 I172	G29-L33 WeakPolarHBondContact O-CB 3.43Å; G29-L33 WeakPolarHBondContact O-CG 3.45Å; G29-L33 PolarHBondContact O-N 2.93Å; R30-L33 PolarHBondContact O-N 3.36Å; L33-K36 PolarHBondContact O-N 2.9Å; L33-S37 WeakPolarHBondContact O-CB 3.44Å; L33-S37 PolarHBondContact O-N 2.92Å; L33-T165 HydrophobicContact CB-CG2 4.49Å; L33-T165 HydrophobicContact CD2-CG2 4.43Å; L33-R168 HydrophobicContact CD1-CB 4.42Å; L33-R168 HydrophobicContact CD1-CG 3.8Å; L33-V169 HydrophobicContact CB-CG2 3.58Å; L33-I172 HydrophobicContact CD1-CD1 3.7Å
34	K	94.8	Very high	94.6	Very high	92 Å²	92	68 Å²	68	40%	0.4	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-47.3	173.6	-174.7	63.1	175	73.9	0	111.4	R30 N31 L32 K36 S37 D38	R30-K34 WeakPolarHBondContact O-CB 3.3Å; R30-K34 PolarHBondContact O-N 3.36Å; N31-K34 PolarHBondContact O-N 3.37Å; L32-K34 VanDerWaalsContact C-N 3.32Å; L32-K34 PolarHBondContact O-N 3.42Å; K34-K36 VanDerWaalsContact C-N 3.32Å; K34-K36 PolarHBondContact O-N 3.36Å; K34-S37 WeakPolarHBondContact O-CB 3.43Å; K34-S37 PolarHBondContact O-N 2.99Å; K34-S37 VanDerWaalsContact O-N 3.15Å; K34-D38 IonicContact NZ-OD1 2.7Å; K34-D38 PolarHBondContact NZ-OD1 2.94Å; K34-D38 IonicContact NZ-OD2 3.13Å; K34-D38 PolarHBondContact NZ-OD2 3.17Å; K34-D38 VanDerWaalsContact O-CG 3.29Å; K34-D38 PolarHBondContact O-N 2.76Å
35	K	94.7	Very high	94.5	Very high	154 Å²	154	68.7 Å²	68.7	67%	0.67	35%	0.346	S	S	*	.	H	α-helix	trans	-58.9	-41.3	174	-72.8	-177.9	179.2	-172.8	0	112.3	N31 L32 D38 A39	N31-K35 WeakPolarHBondContact O-CG 3.42Å; N31-K35 PolarHBondContact O-N 2.96Å; L32-K35 PolarHBondContact O-N 3.21Å; K35-D38 PolarHBondContact O-N 2.98Å; K35-A39 PolarHBondContact O-N 2.99Å
36	K	94.1	Very high	94.4	Very high	69 Å²	69	70.6 Å²	70.6	30%	0.3	34%	0.343	S	S	.	.	H	α-helix	trans	-60.9	-46.6	173.9	-179.7	174.8	177.8	167.7	0	111.4	L32 L33 K34 D38 A39 L40 A102	L32-K36 PolarHBondContact O-N 2.92Å; L33-K36 PolarHBondContact O-N 2.9Å; K34-K36 VanDerWaalsContact C-N 3.32Å; K34-K36 PolarHBondContact O-N 3.36Å; K36-D38 VanDerWaalsContact C-N 3.33Å; K36-D38 PolarHBondContact O-N 3.24Å; K36-A39 PolarHBondContact O-N 3.47Å; K36-L40 HydrophobicContact CG-CD1 4.09Å; K36-L40 HydrophobicContact CG-CG 4.44Å; K36-L40 WeakPolarHBondContact O-CG 3.15Å; K36-L40 PolarHBondContact O-N 3.37Å; K36-A102 VanDerWaalsContact CE-O 3.24Å; K36-A102 WeakPolarHBondContact CE-O 3.46Å
37	S	92.3	Very high	94.3	Very high	2 Å²	2	71.2 Å²	71.2	1%	0.014	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-41	178.3	-172.3	0	0	0	0	112.2	L33 K34 L40 T41 N166	L33-S37 WeakPolarHBondContact O-CB 3.44Å; L33-S37 PolarHBondContact O-N 2.92Å; K34-S37 WeakPolarHBondContact O-CB 3.43Å; K34-S37 PolarHBondContact O-N 2.99Å; K34-S37 VanDerWaalsContact O-N 3.15Å; S37-L40 PolarHBondContact O-N 3.5Å; S37-T41 WeakPolarHBondContact O-CB 3.46Å; S37-T41 PolarHBondContact O-N 3.44Å; S37-T41 PolarHBondContact O-OG1 2.93Å; S37-N166 WeakPolarHBondContact CB-OD1 3.44Å; S37-N166 PolarHBondContact OG-OD1 3.31Å
38	D	94	Very high	94.2	Very high	76 Å²	76	70.6 Å²	70.6	41%	0.406	34%	0.343	S	S	.	.	H	α-helix	trans	-65.9	-41.4	178.4	-66.4	-25.4	0	0	0	111.7	K34 K35 K36 T41 L42	K34-D38 IonicContact NZ-OD1 2.7Å; K34-D38 PolarHBondContact NZ-OD1 2.94Å; K34-D38 IonicContact NZ-OD2 3.13Å; K34-D38 PolarHBondContact NZ-OD2 3.17Å; K34-D38 VanDerWaalsContact O-CG 3.29Å; K34-D38 PolarHBondContact O-N 2.76Å; K35-D38 PolarHBondContact O-N 2.98Å; K36-D38 VanDerWaalsContact C-N 3.33Å; K36-D38 PolarHBondContact O-N 3.24Å; D38-T41 PolarHBondContact O-N 3.01Å; D38-L42 PolarHBondContact O-N 2.74Å
39	A	93.8	Very high	94.2	Very high	44 Å²	44	74.1 Å²	74.1	36%	0.364	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-43.2	174.3	0	0	0	0	0	112.5	K35 K36 L42 R43	K35-A39 PolarHBondContact O-N 2.99Å; K36-A39 PolarHBondContact O-N 3.47Å; A39-L42 PolarHBondContact O-N 3.44Å; A39-R43 PolarHBondContact O-N 3.47Å; A39-R43 VanDerWaalsContact O-N 3.14Å
40	L	93.6	Very high	94.2	Very high	0 Å²	0	77 Å²	77	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.3	-41.6	175.4	-69.8	173.7	0	0	0	111.4	K36 S37 L42 R43 F44 A102 V104 L158 I162	K36-L40 HydrophobicContact CG-CD1 4.09Å; K36-L40 HydrophobicContact CG-CG 4.44Å; K36-L40 WeakPolarHBondContact O-CG 3.15Å; K36-L40 PolarHBondContact O-N 3.37Å; S37-L40 PolarHBondContact O-N 3.5Å; L40-L42 VanDerWaalsContact C-N 3.34Å; L40-L42 PolarHBondContact O-N 3.39Å; L40-R43 PolarHBondContact O-N 2.92Å; L40-F44 VanDerWaalsContact O-CB 3.23Å; L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 PolarHBondContact O-N 2.88Å; L40-A102 HydrophobicContact CD2-CB 4.02Å; L40-A102 HydrophobicContact CG-CB 4.43Å; L40-V104 HydrophobicContact CD1-CG2 4.04Å; L40-V104 HydrophobicContact CD2-CB 4.36Å; L40-V104 HydrophobicContact CD2-CG2 3.81Å; L40-L158 HydrophobicContact CD2-CD2 3.81Å; L40-I162 HydrophobicContact CB-CD1 4.08Å; L40-I162 HydrophobicContact CB-CG1 3.63Å; L40-I162 HydrophobicContact CD1-CG1 4.3Å
41	T	93.2	Very high	94.2	Very high	33 Å²	33	74.1 Å²	74.1	20%	0.202	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-38.6	178.1	-58.1	0	0	0	0	111.6	S37 D38 F44 R45	S37-T41 WeakPolarHBondContact O-CB 3.46Å; S37-T41 PolarHBondContact O-N 3.44Å; S37-T41 PolarHBondContact O-OG1 2.93Å; D38-T41 PolarHBondContact O-N 3.01Å; T41-F44 PolarHBondContact O-N 3.33Å; T41-R45 WeakPolarHBondContact O-CG 3.43Å; T41-R45 PolarHBondContact O-N 3.13Å
42	L	93.5	Very high	94.2	Very high	104 Å²	104	74.6 Å²	74.6	55%	0.545	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-47.9	174.6	-178.7	64.2	0	0	0	111.2	D38 A39 L40 R45 Q46	D38-L42 PolarHBondContact O-N 2.74Å; A39-L42 PolarHBondContact O-N 3.44Å; L40-L42 VanDerWaalsContact C-N 3.34Å; L40-L42 PolarHBondContact O-N 3.39Å; L42-R45 PolarHBondContact O-N 3.23Å; L42-Q46 WeakPolarHBondContact O-CG 3.37Å; L42-Q46 PolarHBondContact O-N 2.93Å; L42-Q46 VanDerWaalsContact O-N 3.09Å
43	R	91.4	Very high	94.2	Very high	130 Å²	130	75 Å²	75	49%	0.491	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-40.4	177	-74.3	-66.7	-169.9	-174.5	9.4	112.4	A39 L40 R45 Q46 I47 V101	A39-R43 PolarHBondContact O-N 3.47Å; A39-R43 VanDerWaalsContact O-N 3.14Å; L40-R43 PolarHBondContact O-N 2.92Å; R43-R45 VanDerWaalsContact C-N 3.34Å; R43-R45 PolarHBondContact O-N 3.44Å; R43-Q46 WeakPolarHBondContact O-CB 3.32Å; R43-Q46 PolarHBondContact O-N 3.09Å; R43-I47 WeakPolarHBondContact O-CG1 3.39Å; R43-I47 PolarHBondContact O-N 3.19Å; R43-V101 HydrophobicContact CB-CG1 4.16Å; R43-V101 HydrophobicContact CG-CG1 3.7Å
44	F	93.4	Very high	94.1	Very high	36 Å²	36	74.2 Å²	74.2	16%	0.158	35%	0.346	C	S	.	.	H	α-helix	trans	-58	-44.6	175	-179.3	-98.5	0	0	0	112	L40 T41 I47 L48 F155 L158 D159 I162	L40-F44 VanDerWaalsContact O-CB 3.23Å; L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 PolarHBondContact O-N 2.88Å; T41-F44 PolarHBondContact O-N 3.33Å; F44-I47 PolarHBondContact O-N 3.49Å; F44-L48 WeakPolarHBondContact O-CB 3.3Å; F44-L48 PolarHBondContact O-N 2.9Å; F44-F155 HydrophobicContact CD1-CE2 4.41Å; F44-F155 AromaticContact CD2-CD2 3.89Å; F44-F155 HydrophobicContact CD2-CD2 3.89Å; F44-F155 AromaticContact CD2-CE2 3.78Å; F44-F155 HydrophobicContact CD2-CE2 3.78Å; F44-F155 HydrophobicContact CD2-CZ 4.5Å; F44-F155 AromaticContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CZ 4.11Å; F44-F155 HydrophobicContact CE2-CD1 4.36Å; F44-F155 AromaticContact CE2-CD2 3.48Å; F44-F155 HydrophobicContact CE2-CD2 3.48Å; F44-F155 VanDerWaalsContact CE2-CD2 3.48Å; F44-F155 HydrophobicContact CE2-CE1 4.05Å; F44-F155 AromaticContact CE2-CE2 3.1Å; F44-F155 HydrophobicContact CE2-CE2 3.1Å; F44-F155 HydrophobicContact CE2-CG 4.11Å; F44-F155 AromaticContact CE2-CZ 3.43Å; F44-F155 HydrophobicContact CE2-CZ 3.43Å; F44-F155 VanDerWaalsContact CE2-CZ 3.43Å; F44-F155 HydrophobicContact CG-CE2 4.39Å; F44-F155 HydrophobicContact CZ-CD2 4.04Å; F44-F155 HydrophobicContact CZ-CE1 4.09Å; F44-F155 AromaticContact CZ-CE2 3.16Å; F44-F155 HydrophobicContact CZ-CE2 3.16Å; F44-F155 AromaticContact CZ-CZ 3.2Å; F44-F155 HydrophobicContact CZ-CZ 3.2Å; F44-L158 HydrophobicContact CD2-CB 4.25Å; F44-D159 HydrophobicContact CE2-CB 3.86Å; F44-D159 HydrophobicContact CZ-CB 4.45Å; F44-I162 HydrophobicContact CB-CD1 3.68Å; F44-I162 HydrophobicContact CD2-CD1 4.03Å; F44-I162 HydrophobicContact CG-CD1 3.87Å
45	R	94	Very high	94.1	Very high	162 Å²	162	75.9 Å²	75.9	61%	0.611	35%	0.354	S	S	*	.	H	α-helix	trans	-65.4	-38	175.3	-70.9	176.9	-173	175.5	2.7	112.8	T41 L42 R43 L48 K49	T41-R45 WeakPolarHBondContact O-CG 3.43Å; T41-R45 PolarHBondContact O-N 3.13Å; L42-R45 PolarHBondContact O-N 3.23Å; R43-R45 VanDerWaalsContact C-N 3.34Å; R43-R45 PolarHBondContact O-N 3.44Å; R45-L48 PolarHBondContact O-N 3.32Å; R45-K49 WeakPolarHBondContact O-CG 3.43Å; R45-K49 PolarHBondContact O-N 3.32Å; R45-K49 VanDerWaalsContact O-N 3.08Å
46	Q	93.8	Very high	94.2	Very high	86 Å²	86	74.3 Å²	74.3	40%	0.402	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-45.3	175.6	-71.6	174.9	-9.8	0	0	111.4	L42 R43 L48 K49 K50	L42-Q46 WeakPolarHBondContact O-CG 3.37Å; L42-Q46 PolarHBondContact O-N 2.93Å; L42-Q46 VanDerWaalsContact O-N 3.09Å; R43-Q46 WeakPolarHBondContact O-CB 3.32Å; R43-Q46 PolarHBondContact O-N 3.09Å; Q46-L48 VanDerWaalsContact C-N 3.35Å; Q46-K49 PolarHBondContact O-N 3.46Å; Q46-K50 PolarHBondContact O-N 3.06Å
47	I	93.5	Very high	94.2	Very high	27 Å²	27	75.3 Å²	75.3	14%	0.138	36%	0.358	C	S	.	.	H	α-helix	trans	-64.9	-40.3	176.9	-69.1	165.1	0	0	0	110.6	R43 F44 K49 K50 I51 L151 F155 L158	R43-I47 WeakPolarHBondContact O-CG1 3.39Å; R43-I47 PolarHBondContact O-N 3.19Å; F44-I47 PolarHBondContact O-N 3.49Å; I47-K49 PolarHBondContact O-N 2.94Å; I47-K50 PolarHBondContact O-N 3.03Å; I47-I51 HydrophobicContact CG2-CD1 3.72Å; I47-I51 HydrophobicContact CG2-CG1 4.18Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.39Å; I47-I51 PolarHBondContact O-N 3.18Å; I47-L151 HydrophobicContact CG2-CB 4.45Å; I47-L151 HydrophobicContact CG2-CD2 4.39Å; I47-F155 HydrophobicContact CG2-CB 4.14Å; I47-F155 HydrophobicContact CG2-CD2 4.22Å; I47-L158 HydrophobicContact CD1-CD1 3.27Å
48	L	94.8	Very high	94.3	Very high	71 Å²	71	77.3 Å²	77.3	37%	0.372	37%	0.368	S	S	.	.	H	α-helix	trans	-59.4	-45.7	176.5	-177.6	62.2	0	0	0	112.1	F44 R45 Q46 I51 I52 F155	F44-L48 WeakPolarHBondContact O-CB 3.3Å; F44-L48 PolarHBondContact O-N 2.9Å; R45-L48 PolarHBondContact O-N 3.32Å; Q46-L48 VanDerWaalsContact C-N 3.35Å; L48-I51 PolarHBondContact O-N 2.99Å; L48-I52 HydrophobicContact CD1-CD1 4.46Å; L48-I52 HydrophobicContact CG-CD1 4.31Å; L48-I52 WeakPolarHBondContact O-CG1 3.45Å; L48-I52 PolarHBondContact O-N 2.99Å; L48-I52 VanDerWaalsContact O-N 3.09Å; L48-F155 HydrophobicContact CB-CE2 4.08Å; L48-F155 HydrophobicContact CD1-CE2 3.89Å; L48-F155 HydrophobicContact CD1-CZ 4.1Å; L48-F155 HydrophobicContact CG-CE2 4.49Å
49	K	96.1	Very high	94.3	Very high	143 Å²	143	75.4 Å²	75.4	62%	0.622	37%	0.366	S	S	*	.	H	α-helix	trans	-58.8	-48.3	174.9	-72.4	-176	178.7	-168.4	0	111.1	R45 Q46 I47 I51 I52 E53	R45-K49 WeakPolarHBondContact O-CG 3.43Å; R45-K49 PolarHBondContact O-N 3.32Å; R45-K49 VanDerWaalsContact O-N 3.08Å; Q46-K49 PolarHBondContact O-N 3.46Å; I47-K49 PolarHBondContact O-N 2.94Å; K49-I51 VanDerWaalsContact C-N 3.33Å; K49-I51 PolarHBondContact O-N 3.11Å; K49-I52 PolarHBondContact O-N 3Å; K49-I52 VanDerWaalsContact O-N 3.15Å; K49-E53 WeakPolarHBondContact O-CG 3.25Å; K49-E53 PolarHBondContact O-N 2.96Å
50	K	95	Very high	94.3	Very high	83 Å²	83	78.7 Å²	78.7	36%	0.361	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-40.1	178.2	-164.1	176.1	176.4	-172.9	0	112.2	Q46 I47 I52 E53 T54 E147 L151	Q46-K50 PolarHBondContact O-N 3.06Å; I47-K50 PolarHBondContact O-N 3.03Å; K50-I52 PolarHBondContact O-N 2.9Å; K50-E53 PolarHBondContact O-N 3.5Å; K50-T54 VanDerWaalsContact O-CB 3.28Å; K50-T54 WeakPolarHBondContact O-CB 3.48Å; K50-T54 PolarHBondContact O-N 3.28Å; K50-T54 PolarHBondContact O-OG1 3.37Å; K50-E147 WeakPolarHBondContact CE-OE1 3.48Å; K50-E147 IonicContact NZ-OE1 3.97Å; K50-E147 PolarHBondContact NZ-OE1 3.42Å; K50-L151 HydrophobicContact CB-CD1 4.25Å; K50-L151 HydrophobicContact CD-CD1 3.86Å; K50-L151 HydrophobicContact CD-CD2 3.94Å; K50-L151 HydrophobicContact CG-CD1 3.74Å
51	I	95.5	Very high	94.4	Very high	19 Å²	19	80.1 Å²	80.1	10%	0.097	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-43.4	175.8	-73.1	170	0	0	0	111.3	I47 L48 K49 K55 L148 L151 F155	I47-I51 HydrophobicContact CG2-CD1 3.72Å; I47-I51 HydrophobicContact CG2-CG1 4.18Å; I47-I51 VanDerWaalsContact O-CG1 3.28Å; I47-I51 WeakPolarHBondContact O-CG1 3.39Å; I47-I51 PolarHBondContact O-N 3.18Å; L48-I51 PolarHBondContact O-N 2.99Å; K49-I51 VanDerWaalsContact C-N 3.33Å; K49-I51 PolarHBondContact O-N 3.11Å; I51-K55 WeakPolarHBondContact O-CB 3.27Å; I51-K55 PolarHBondContact O-N 2.91Å; I51-L148 HydrophobicContact CG2-CD1 4.34Å; I51-L151 HydrophobicContact CD1-CB 4.14Å; I51-L151 HydrophobicContact CG1-CB 3.62Å; I51-L151 HydrophobicContact CG1-CD1 4.31Å; I51-F155 HydrophobicContact CD1-CB 3.72Å; I51-F155 HydrophobicContact CD1-CD2 3.95Å; I51-F155 HydrophobicContact CD1-CG 3.89Å
52	I	95.4	Very high	94.5	Very high	92 Å²	92	81.7 Å²	81.7	47%	0.472	39%	0.389	S	S	.	.	H	α-helix	trans	-65.2	-47.5	179.8	-65.9	167	0	0	0	110.1	L48 K49 K50 K55 M56	L48-I52 HydrophobicContact CD1-CD1 4.46Å; L48-I52 HydrophobicContact CG-CD1 4.31Å; L48-I52 WeakPolarHBondContact O-CG1 3.45Å; L48-I52 PolarHBondContact O-N 2.99Å; L48-I52 VanDerWaalsContact O-N 3.09Å; K49-I52 PolarHBondContact O-N 3Å; K49-I52 VanDerWaalsContact O-N 3.15Å; K50-I52 PolarHBondContact O-N 2.9Å; I52-K55 PolarHBondContact O-N 3.05Å; I52-M56 HydrophobicContact CG2-CE 4.26Å; I52-M56 WeakPolarHBondContact O-CG 3.36Å; I52-M56 PolarHBondContact O-N 3.11Å
53	E	95.3	Very high	94.6	Very high	122 Å²	122	85.3 Å²	85.3	57%	0.57	40%	0.395	S	S	*	.	H	α-helix	trans	-59.9	-52.3	177.4	-70.4	167.8	-168.4	0	0	111.6	K49 K50 K55 M56 L57	K49-E53 WeakPolarHBondContact O-CG 3.25Å; K49-E53 PolarHBondContact O-N 2.96Å; K50-E53 PolarHBondContact O-N 3.5Å; E53-K55 VanDerWaalsContact C-N 3.29Å; E53-K55 PolarHBondContact O-N 3.4Å; E53-M56 PolarHBondContact O-N 3.02Å; E53-L57 PolarHBondContact O-N 3.31Å
54	T	94.8	Very high	94.7	Very high	13 Å²	13	84.5 Å²	84.5	8%	0.08	40%	0.397	C	S	.	.	H	α-helix	trans	-63.9	-33.8	178.9	-57.4	0	0	0	0	111.8	K50 L57 M58 L144 L148	K50-T54 VanDerWaalsContact O-CB 3.28Å; K50-T54 WeakPolarHBondContact O-CB 3.48Å; K50-T54 PolarHBondContact O-N 3.28Å; K50-T54 PolarHBondContact O-OG1 3.37Å; T54-L57 PolarHBondContact O-N 3.36Å; T54-M58 VanDerWaalsContact O-CB 3.25Å; T54-M58 WeakPolarHBondContact O-CB 3.37Å; T54-M58 PolarHBondContact O-N 3.48Å; T54-L144 HydrophobicContact CG2-CD2 3.59Å; T54-L144 HydrophobicContact CG2-CG 4.25Å; T54-L148 HydrophobicContact CG2-CB 4.09Å; T54-L148 HydrophobicContact CG2-CD1 4.16Å
55	K	94.9	Very high	94.8	Very high	127 Å²	127	82.8 Å²	82.8	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-70.2	-36.6	177.2	-174.7	172.6	-176.3	173.5	0	112.6	I51 I52 E53 G59	I51-K55 WeakPolarHBondContact O-CB 3.27Å; I51-K55 PolarHBondContact O-N 2.91Å; I52-K55 PolarHBondContact O-N 3.05Å; E53-K55 VanDerWaalsContact C-N 3.29Å; E53-K55 PolarHBondContact O-N 3.4Å; K55-G59 PolarHBondContact O-N 3.03Å; K55-G59 VanDerWaalsContact O-N 3.16Å
56	M	95.1	Very high	94.8	Very high	122 Å²	122	77.5 Å²	77.5	60%	0.601	38%	0.38	S	S	*	.	H	α-helix	trans	-65	-48.5	172.5	-69.7	-174.5	-59.2	0	0	110.7	I52 E53 M58 G59 E60	I52-M56 HydrophobicContact CG2-CE 4.26Å; I52-M56 WeakPolarHBondContact O-CG 3.36Å; I52-M56 PolarHBondContact O-N 3.11Å; E53-M56 PolarHBondContact O-N 3.02Å; M56-M58 VanDerWaalsContact C-N 3.32Å; M56-M58 PolarHBondContact O-N 3.3Å; M56-G59 PolarHBondContact O-N 3.28Å; M56-E60 PolarHBondContact O-N 3.48Å
57	L	94.7	Very high	94.9	Very high	89 Å²	89	79.8 Å²	79.8	47%	0.466	39%	0.389	S	S	.	.	H	α-helix	trans	-59.6	-41.5	176.8	-175.1	65.5	0	0	0	112	E53 T54 G59 E60 V61 L144	E53-L57 PolarHBondContact O-N 3.31Å; T54-L57 PolarHBondContact O-N 3.36Å; L57-G59 VanDerWaalsContact C-N 3.26Å; L57-G59 PolarHBondContact O-N 3.4Å; L57-E60 PolarHBondContact O-N 2.9Å; L57-V61 HydrophobicContact CG-CG2 4.45Å; L57-V61 WeakPolarHBondContact O-CG2 3.5Å; L57-V61 PolarHBondContact O-N 3.36Å; L57-L144 HydrophobicContact CB-CD1 4.45Å; L57-L144 HydrophobicContact CD2-CD1 3.8Å; L57-L144 HydrophobicContact CG-CD1 3.81Å
58	M	93.7	Very high	94.8	Very high	45 Å²	45	79 Å²	79	22%	0.222	39%	0.386	C	S	.	.	H	α-helix	trans	-57.1	-40.6	174.1	-173.5	-128.8	65.5	0	0	111.6	T54 M56 E60 V61 M62 L144 L145 L148	T54-M58 VanDerWaalsContact O-CB 3.25Å; T54-M58 WeakPolarHBondContact O-CB 3.37Å; T54-M58 PolarHBondContact O-N 3.48Å; M56-M58 VanDerWaalsContact C-N 3.32Å; M56-M58 PolarHBondContact O-N 3.3Å; M58-E60 VanDerWaalsContact C-N 3.33Å; M58-E60 PolarHBondContact O-N 2.86Å; M58-V61 PolarHBondContact O-N 2.95Å; M58-M62 HydrophobicContact CE-CG 4.21Å; M58-M62 HydrophobicContact CG-CG 4.16Å; M58-M62 VanDerWaalsContact O-CB 3.23Å; M58-M62 WeakPolarHBondContact O-CB 3.43Å; M58-M62 VanDerWaalsContact O-CG 3.24Å; M58-M62 WeakPolarHBondContact O-CG 3.48Å; M58-M62 PolarHBondContact O-N 3.01Å; M58-M62 HydrophobicContact SD-CG 4.48Å; M58-L144 HydrophobicContact CB-CD2 3.48Å; M58-L144 VanDerWaalsContact CB-CD2 3.48Å; M58-L144 HydrophobicContact CG-CD2 3.91Å; M58-L145 HydrophobicContact CG-CD2 3.92Å; M58-L145 HydrophobicContact SD-CD2 3.77Å; M58-L148 HydrophobicContact CG-CD2 4.44Å; M58-L148 HydrophobicContact SD-CD2 4.11Å
59	G	94.6	Very high	94.7	Very high	35 Å²	35	78.7 Å²	78.7	36%	0.361	38%	0.384	S	S	.	.	H	α-helix	trans	-62.2	-40.7	178.4	0	0	0	0	0	112.3	K55 M56 L57 R63	K55-G59 PolarHBondContact O-N 3.03Å; K55-G59 VanDerWaalsContact O-N 3.16Å; M56-G59 PolarHBondContact O-N 3.28Å; L57-G59 VanDerWaalsContact C-N 3.26Å; L57-G59 PolarHBondContact O-N 3.4Å; G59-R63 WeakPolarHBondContact O-CB 3.37Å; G59-R63 PolarHBondContact O-N 3Å; G59-R63 VanDerWaalsContact O-N 3.09Å
60	E	95	Very high	94.6	Very high	114 Å²	114	74.5 Å²	74.5	53%	0.533	38%	0.376	S	S	.	.	H	α-helix	trans	-68.2	-47.8	176.5	-65.8	-178.5	169.8	0	0	112	M56 L57 M58 M62 R63 E64	M56-E60 PolarHBondContact O-N 3.48Å; L57-E60 PolarHBondContact O-N 2.9Å; M58-E60 VanDerWaalsContact C-N 3.33Å; M58-E60 PolarHBondContact O-N 2.86Å; E60-M62 PolarHBondContact O-N 3.35Å; E60-R63 WeakPolarHBondContact O-CB 3.47Å; E60-R63 PolarHBondContact O-N 2.66Å; E60-E64 PolarHBondContact O-N 2.86Å
61	V	95.3	Very high	94.4	Very high	30 Å²	30	74.7 Å²	74.7	18%	0.182	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-40.5	179.5	174.4	0	0	0	0	111.5	L57 M58 R63 E64 A65 A141 L144	L57-V61 HydrophobicContact CG-CG2 4.45Å; L57-V61 WeakPolarHBondContact O-CG2 3.5Å; L57-V61 PolarHBondContact O-N 3.36Å; M58-V61 PolarHBondContact O-N 2.95Å; V61-R63 VanDerWaalsContact C-N 3.35Å; V61-E64 PolarHBondContact O-N 3.5Å; V61-A65 WeakPolarHBondContact O-CB 3.39Å; V61-A65 PolarHBondContact O-N 3.3Å; V61-A141 HydrophobicContact CG1-CB 3.95Å; V61-L144 HydrophobicContact CG2-CD1 4.06Å
62	M	94.7	Very high	94.1	Very high	66 Å²	66	73.8 Å²	73.8	33%	0.325	37%	0.374	S	S	.	.	H	α-helix	trans	-67.8	-35.3	176.5	-75.9	-64.6	-64.1	0	0	112.2	M58 E60 A65 A66 A141 L145	M58-M62 HydrophobicContact CE-CG 4.21Å; M58-M62 HydrophobicContact CG-CG 4.16Å; M58-M62 VanDerWaalsContact O-CB 3.23Å; M58-M62 WeakPolarHBondContact O-CB 3.43Å; M58-M62 VanDerWaalsContact O-CG 3.24Å; M58-M62 WeakPolarHBondContact O-CG 3.48Å; M58-M62 PolarHBondContact O-N 3.01Å; M58-M62 HydrophobicContact SD-CG 4.48Å; E60-M62 PolarHBondContact O-N 3.35Å; M62-A65 PolarHBondContact O-N 3.37Å; M62-A66 VanDerWaalsContact O-CB 3.28Å; M62-A66 WeakPolarHBondContact O-CB 3.22Å; M62-A66 PolarHBondContact O-N 3.41Å; M62-A141 HydrophobicContact SD-CB 3.89Å; M62-L145 HydrophobicContact SD-CD1 4.49Å
63	R	95.2	Very high	93.9	Very high	179 Å²	179	75.1 Å²	75.1	68%	0.675	38%	0.376	S	S	*	.	H	α-helix	trans	-64.6	-43.9	173.7	-179.9	-176.8	61.6	164.7	-3.3	111.1	G59 E60 V61 A66 F67	G59-R63 WeakPolarHBondContact O-CB 3.37Å; G59-R63 PolarHBondContact O-N 3Å; G59-R63 VanDerWaalsContact O-N 3.09Å; E60-R63 WeakPolarHBondContact O-CB 3.47Å; E60-R63 PolarHBondContact O-N 2.66Å; V61-R63 VanDerWaalsContact C-N 3.35Å; R63-A66 PolarHBondContact O-N 2.91Å; R63-F67 WeakPolarHBondContact O-CB 3.46Å; R63-F67 PolarHBondContact O-N 2.78Å
64	E	94.8	Very high	93.6	Very high	113 Å²	113	78.2 Å²	78.2	53%	0.528	39%	0.388	S	S	.	.	H	α-helix	trans	-62.4	-46.2	175.2	-172.4	-178.8	173.4	0	0	111.4	E60 V61 A66 F67 S68	E60-E64 PolarHBondContact O-N 2.86Å; V61-E64 PolarHBondContact O-N 3.5Å; E64-A66 PolarHBondContact O-N 3.16Å; E64-F67 PolarHBondContact O-N 2.9Å; E64-S68 PolarHBondContact O-N 3.36Å; E64-S68 PolarHBondContact O-OG 3.16Å
65	A	94.5	Very high	93.3	Very high	0 Å²	0	80.3 Å²	80.3	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-61.7	-41.1	177	0	0	0	0	0	112.6	V61 M62 F67 S68 L69 N137 Y138	V61-A65 WeakPolarHBondContact O-CB 3.39Å; V61-A65 PolarHBondContact O-N 3.3Å; M62-A65 PolarHBondContact O-N 3.37Å; A65-F67 VanDerWaalsContact C-N 3.35Å; A65-S68 PolarHBondContact O-N 2.96Å; A65-L69 PolarHBondContact O-N 3.33Å; A65-N137 HydrophobicContact CB-CB 4.28Å; A65-Y138 HydrophobicContact CB-CD2 4.11Å; A65-Y138 HydrophobicContact CB-CE1 4.41Å; A65-Y138 HydrophobicContact CB-CE2 3.92Å; A65-Y138 HydrophobicContact CB-CG 4.43Å; A65-Y138 WeakPolarHBondContact O-CE2 3.31Å
66	A	95.1	Very high	92.8	Very high	52 Å²	52	75.7 Å²	75.7	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-65.8	-36.4	175.6	0	0	0	0	0	112.3	M62 R63 E64 L69 A70	M62-A66 VanDerWaalsContact O-CB 3.28Å; M62-A66 WeakPolarHBondContact O-CB 3.22Å; M62-A66 PolarHBondContact O-N 3.41Å; R63-A66 PolarHBondContact O-N 2.91Å; E64-A66 PolarHBondContact O-N 3.16Å; A66-L69 WeakPolarHBondContact O-CB 3.4Å; A66-L69 PolarHBondContact O-N 3.09Å; A66-A70 PolarHBondContact O-N 2.85Å
67	F	94.9	Very high	92.3	Very high	134 Å²	134	71.4 Å²	71.4	59%	0.588	37%	0.374	S	S	*	.	H	α-helix	trans	-66.5	-44.8	174.1	-173	-103.2	0	0	0	111.5	R63 E64 A65 L69 A70 E71	R63-F67 WeakPolarHBondContact O-CB 3.46Å; R63-F67 PolarHBondContact O-N 2.78Å; E64-F67 PolarHBondContact O-N 2.9Å; A65-F67 VanDerWaalsContact C-N 3.35Å; F67-L69 PolarHBondContact O-N 2.87Å; F67-A70 WeakPolarHBondContact O-CB 3.29Å; F67-A70 PolarHBondContact O-N 2.82Å; F67-E71 HydrophobicContact CD1-CG 4.3Å; F67-E71 HydrophobicContact CE1-CG 4.02Å; F67-E71 WeakPolarHBondContact CE1-OE1 3.49Å; F67-E71 HydrophobicContact CZ-CG 4.46Å; F67-E71 PolarHBondContact O-N 3.39Å
68	S	92.3	Very high	91.9	Very high	10 Å²	10	72 Å²	72	7%	0.07	38%	0.378	C	S	.	.	H	α-helix	trans	-60.3	-31.4	173.6	-58.4	0	0	0	0	112.9	E64 A65 E71 A72 N137	E64-S68 PolarHBondContact O-N 3.36Å; E64-S68 PolarHBondContact O-OG 3.16Å; A65-S68 PolarHBondContact O-N 2.96Å; S68-E71 PolarHBondContact O-N 3.14Å; S68-A72 WeakPolarHBondContact O-CB 3.39Å; S68-A72 PolarHBondContact O-N 2.91Å; S68-N137 PolarHBondContact OG-ND2 2.99Å
69	L	92.6	Very high	91.5	Very high	65 Å²	65	71.8 Å²	71.8	34%	0.34	38%	0.375	S	S	.	.	H	α-helix	trans	-64.3	-44.9	173.3	-169.6	161.5	0	0	0	110.7	A65 A66 F67 A72 K73 L134 Y138	A65-L69 PolarHBondContact O-N 3.33Å; A66-L69 WeakPolarHBondContact O-CB 3.4Å; A66-L69 PolarHBondContact O-N 3.09Å; F67-L69 PolarHBondContact O-N 2.87Å; L69-A72 PolarHBondContact O-N 3.43Å; L69-K73 WeakPolarHBondContact O-CB 3.48Å; L69-K73 PolarHBondContact O-N 2.85Å; L69-L134 VanDerWaalsContact CA-CD1 3.42Å; L69-L134 HydrophobicContact CB-CD1 3.77Å; L69-L134 HydrophobicContact CG-CD1 4.42Å; L69-L134 VanDerWaalsContact N-CD1 3.34Å; L69-Y138 HydrophobicContact CB-CE2 4.36Å; L69-Y138 HydrophobicContact CD1-CE2 4.36Å; L69-Y138 WeakPolarHBondContact CD1-OH 3.39Å
70	A	93	Very high	91.1	Very high	54 Å²	54	72.6 Å²	72.6	45%	0.446	38%	0.375	S	S	.	.	H	α-helix	trans	-61.3	-43.5	176.6	0	0	0	0	0	111.9	A66 F67 K73 F74	A66-A70 PolarHBondContact O-N 2.85Å; F67-A70 WeakPolarHBondContact O-CB 3.29Å; F67-A70 PolarHBondContact O-N 2.82Å; A70-K73 PolarHBondContact O-N 2.99Å; A70-F74 WeakPolarHBondContact O-CB 3.44Å; A70-F74 PolarHBondContact O-N 3.21Å
71	E	91.2	Very high	90.7	Very high	88 Å²	88	70.4 Å²	70.4	41%	0.411	37%	0.37	S	S	.	.	H	α-helix	trans	-61.8	-44.1	175	-68	-174.9	153.2	0	0	112.6	F67 S68 K73 F74 T75	F67-E71 HydrophobicContact CD1-CG 4.3Å; F67-E71 HydrophobicContact CE1-CG 4.02Å; F67-E71 WeakPolarHBondContact CE1-OE1 3.49Å; F67-E71 HydrophobicContact CZ-CG 4.46Å; F67-E71 PolarHBondContact O-N 3.39Å; S68-E71 PolarHBondContact O-N 3.14Å; E71-K73 VanDerWaalsContact C-N 3.34Å; E71-F74 PolarHBondContact O-N 3.11Å; E71-T75 PolarHBondContact O-N 2.95Å; E71-T75 VanDerWaalsContact O-N 3.08Å; E71-T75 PolarHBondContact O-OG1 2.7Å
72	A	89.8	Confident	90.2	Very high	0 Å²	0	72 Å²	72	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-63.6	-41.1	176.9	0	0	0	0	0	111.3	S68 L69 T75 A76 F79 Q130 L131 L134	S68-A72 WeakPolarHBondContact O-CB 3.39Å; S68-A72 PolarHBondContact O-N 2.91Å; L69-A72 PolarHBondContact O-N 3.43Å; A72-T75 PolarHBondContact O-N 3.37Å; A72-A76 WeakPolarHBondContact O-CB 3.31Å; A72-A76 PolarHBondContact O-N 3.46Å; A72-F79 HydrophobicContact CB-CE1 3.86Å; A72-F79 HydrophobicContact CB-CZ 4Å; A72-Q130 HydrophobicContact CB-CB 4.11Å; A72-L131 HydrophobicContact CB-CD2 4.34Å; A72-L134 HydrophobicContact CB-CD2 4.09Å
73	K	90.3	Very high	89.9	Confident	119 Å²	119	71 Å²	71	52%	0.517	38%	0.378	S	S	.	.	H	α-helix	trans	-68.1	-36.8	179	-170.9	173.9	-176.4	174.9	0	111.9	L69 A70 E71 G77 F79	L69-K73 WeakPolarHBondContact O-CB 3.48Å; L69-K73 PolarHBondContact O-N 2.85Å; A70-K73 PolarHBondContact O-N 2.99Å; E71-K73 VanDerWaalsContact C-N 3.34Å; K73-G77 WeakPolarHBondContact O-CA 3.37Å; K73-G77 PolarHBondContact O-N 3.25Å; K73-G77 VanDerWaalsContact O-N 3.13Å; K73-F79 HydrophobicContact CB-CE1 4.25Å
74	F	90	Very high	89.5	Confident	188 Å²	188	68.6 Å²	68.6	83%	0.825	38%	0.376	S	S	*	.	H	α-helix	trans	-64.1	-41	174.5	-177.2	-100.2	0	0	0	112	A70 E71	A70-F74 WeakPolarHBondContact O-CB 3.44Å; A70-F74 PolarHBondContact O-N 3.21Å; E71-F74 PolarHBondContact O-N 3.11Å
75	T	88.6	Confident	89.2	Confident	57 Å²	57	70 Å²	70	35%	0.35	38%	0.383	S	S	.	.	H	α-helix	trans	-83.9	-46.4	-174.6	-49.1	0	0	0	0	113.4	E71 A72 Q130	E71-T75 PolarHBondContact O-N 2.95Å; E71-T75 VanDerWaalsContact O-N 3.08Å; E71-T75 PolarHBondContact O-OG1 2.7Å; A72-T75 PolarHBondContact O-N 3.37Å; T75-Q130 HydrophobicContact CG2-CG 4.42Å
76	A	84.2	Confident	88.7	Confident	29 Å²	29	74.3 Å²	74.3	24%	0.24	41%	0.406	C	S	.	.	H	α-helix	trans	-91	-11.4	-173.9	0	0	0	0	0	113.3	A72 F79	A72-A76 WeakPolarHBondContact O-CB 3.31Å; A72-A76 PolarHBondContact O-N 3.46Å; A76-F79 HydrophobicContact CB-CD1 4.09Å
77	G	84.4	Confident	88.3	Confident	33 Å²	33	76.7 Å²	76.7	34%	0.34	42%	0.415	S	S	.	.			trans	76.3	-148	-169.9	0	0	0	0	0	112	K73 F79	K73-G77 WeakPolarHBondContact O-CA 3.37Å; K73-G77 PolarHBondContact O-N 3.25Å; K73-G77 VanDerWaalsContact O-N 3.13Å; G77-F79 WeakPolarHBondContact O-CD1 3.37Å; G77-F79 PolarHBondContact O-N 3.47Å
78	D	85.4	Confident	87.8	Confident	102 Å²	102	76.9 Å²	76.9	55%	0.545	42%	0.422	S	S	.	.			trans	-87.7	88	-177	-168.5	19.9	0	0	0	112.7	S80	D78-S80 WeakPolarHBondContact OD1-CB 3.32Å; D78-S80 PolarHBondContact OD1-N 2.88Å; D78-S80 PolarHBondContact OD1-OG 3.31Å
79	F	85.9	Confident	87.5	Confident	39 Å²	39	84.3 Å²	84.3	17%	0.171	45%	0.453	C	S	.	.			trans	-87.4	-3.4	173.3	61.8	-92.4	0	0	0	113.4	A72 K73 A76 G77 T81 T82 V83 L131 L134	A72-F79 HydrophobicContact CB-CE1 3.86Å; A72-F79 HydrophobicContact CB-CZ 4Å; K73-F79 HydrophobicContact CB-CE1 4.25Å; A76-F79 HydrophobicContact CB-CD1 4.09Å; G77-F79 WeakPolarHBondContact O-CD1 3.37Å; G77-F79 PolarHBondContact O-N 3.47Å; F79-T81 PolarHBondContact O-N 3.14Å; F79-T82 PolarHBondContact O-N 3.34Å; F79-V83 HydrophobicContact CD2-CG2 3.96Å; F79-V83 WeakPolarHBondContact O-CG2 3.28Å; F79-V83 PolarHBondContact O-N 2.87Å; F79-V83 VanDerWaalsContact O-N 3.1Å; F79-L131 HydrophobicContact CD1-CD2 4.01Å; F79-L131 HydrophobicContact CD2-CD2 3.84Å; F79-L131 HydrophobicContact CE1-CD2 3.99Å; F79-L131 HydrophobicContact CE2-CD2 3.83Å; F79-L131 HydrophobicContact CG-CD2 3.93Å; F79-L131 HydrophobicContact CZ-CD2 3.9Å; F79-L134 HydrophobicContact CE2-CD2 3.95Å; F79-L134 HydrophobicContact CZ-CD2 3.8Å
80	S	86.2	Confident	87.3	Confident	52 Å²	52	84 Å²	84	36%	0.364	46%	0.461	S	S	.	.	H	α-helix	trans	-63.5	-44.7	-171.7	68	0	0	0	0	112.3	D78 T82 V83 I84	D78-S80 WeakPolarHBondContact OD1-CB 3.32Å; D78-S80 PolarHBondContact OD1-N 2.88Å; D78-S80 PolarHBondContact OD1-OG 3.31Å; S80-T82 PolarHBondContact O-N 2.99Å; S80-V83 PolarHBondContact O-N 3.48Å; S80-I84 VanDerWaalsContact O-CG1 3.28Å; S80-I84 WeakPolarHBondContact O-CG1 3.47Å; S80-I84 PolarHBondContact O-N 3.08Å
81	T	86.2	Confident	87	Confident	68 Å²	68	83.8 Å²	83.8	42%	0.417	45%	0.45	S	S	.	.	H	α-helix	trans	-59.1	-44.9	177.3	-56.3	0	0	0	0	111.7	F79 V83 I84 Q85	F79-T81 PolarHBondContact O-N 3.14Å; T81-V83 PolarHBondContact O-N 2.91Å; T81-I84 PolarHBondContact O-N 2.94Å; T81-Q85 WeakPolarHBondContact O-CB 3.45Å; T81-Q85 WeakPolarHBondContact O-CG 3.3Å; T81-Q85 PolarHBondContact O-N 3.25Å
82	T	85.5	Confident	87	Confident	64 Å²	64	82.2 Å²	82.2	39%	0.393	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-41.8	179.2	-51.3	0	0	0	0	112	F79 S80 N86	F79-T82 PolarHBondContact O-N 3.34Å; S80-T82 PolarHBondContact O-N 2.99Å; T82-N86 VanDerWaalsContact O-CB 3.32Å; T82-N86 WeakPolarHBondContact O-CB 3.19Å; T82-N86 PolarHBondContact O-N 3.25Å
83	V	87	Confident	87.1	Confident	46 Å²	46	85.3 Å²	85.3	28%	0.279	46%	0.46	S	S	.	.	H	α-helix	trans	-66.9	-41.2	179.6	172.9	0	0	0	0	111.5	F79 S80 T81 V87 Y119	F79-V83 HydrophobicContact CD2-CG2 3.96Å; F79-V83 WeakPolarHBondContact O-CG2 3.28Å; F79-V83 PolarHBondContact O-N 2.87Å; F79-V83 VanDerWaalsContact O-N 3.1Å; S80-V83 PolarHBondContact O-N 3.48Å; T81-V83 PolarHBondContact O-N 2.91Å; V83-V87 WeakPolarHBondContact O-CG2 3.38Å; V83-Y119 HydrophobicContact CB-CE1 4.41Å; V83-Y119 HydrophobicContact CG1-CE1 4.02Å; V83-Y119 PolarHBondContact O-OH 2.88Å; V83-Y119 VanDerWaalsContact O-OH 3.14Å
84	I	88.4	Confident	87.2	Confident	127 Å²	127	84.1 Å²	84.1	65%	0.651	46%	0.458	S	S	*	.	H	α-helix	trans	-67.8	-38.7	179.7	-67	166.7	0	0	0	111.3	S80 T81 V87	S80-I84 VanDerWaalsContact O-CG1 3.28Å; S80-I84 WeakPolarHBondContact O-CG1 3.47Å; S80-I84 PolarHBondContact O-N 3.08Å; T81-I84 PolarHBondContact O-N 2.94Å; I84-V87 WeakPolarHBondContact O-CG2 3.37Å
85	Q	86.8	Confident	87.4	Confident	144 Å²	144	82 Å²	82	67%	0.673	45%	0.445	S	S	*	.	H	α-helix	trans	-74	-36.7	179.4	-72.4	177.1	-12.6	0	0	112.7	T81 V87	T81-Q85 WeakPolarHBondContact O-CB 3.45Å; T81-Q85 WeakPolarHBondContact O-CG 3.3Å; T81-Q85 PolarHBondContact O-N 3.25Å; Q85-V87 VanDerWaalsContact C-N 3.3Å; Q85-V87 PolarHBondContact O-N 2.97Å
86	N	84.8	Confident	87.6	Confident	90 Å²	90	82.9 Å²	82.9	48%	0.481	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	39	-174.9	-68.7	-19.1	0	0	0	113.7	T82 Y119	T82-N86 VanDerWaalsContact O-CB 3.32Å; T82-N86 WeakPolarHBondContact O-CB 3.19Å; T82-N86 PolarHBondContact O-N 3.25Å; N86-Y119 HydrophobicContact CB-CE1 4.28Å; N86-Y119 WeakPolarHBondContact O-CE1 3.39Å
87	V	85.9	Confident	88.1	Confident	101 Å²	101	87.1 Å²	87.1	61%	0.612	47%	0.471	S	S	*	.			trans	-92.1	119.6	173.5	-174.9	0	0	0	0	109.3	V83 I84 Q85 Y119	V83-V87 WeakPolarHBondContact O-CG2 3.38Å; I84-V87 WeakPolarHBondContact O-CG2 3.37Å; Q85-V87 VanDerWaalsContact C-N 3.3Å; Q85-V87 PolarHBondContact O-N 2.97Å; V87-Y119 WeakPolarHBondContact CG2-OH 3.42Å
88	N	85.4	Confident	88.5	Confident	139 Å²	139	93.8 Å²	93.8	74%	0.743	49%	0.491	S	S	*	.			trans	-120.3	-72.4	176	-173.3	-9.4	0	0	0	111.7
89	K	86.7	Confident	88.9	Confident	165 Å²	165	92.8 Å²	92.8	72%	0.717	49%	0.485	S	S	*	.	S	Bend	trans	-115.7	143.9	178.6	-65.3	-175.6	-179.9	179	0	110.5
90	A	87.6	Confident	89.1	Confident	60 Å²	60	96 Å²	96	50%	0.496	50%	0.504	S	S	.	.			trans	-72.3	127.8	174.2	0	0	0	0	0	110.7	K93	A90-K93 HydrophobicContact CB-CG 4.2Å
91	Q	87.6	Confident	89.1	Confident	48 Å²	48	94.7 Å²	94.7	22%	0.224	49%	0.494	C	S	.	.	S	Bend	trans	-78.2	-39.3	175.2	-178.6	-179.9	12.7	0	0	112.2	H113 E114 D117	Q91-H113 VanDerWaalsContact CD-CE1 3.41Å; Q91-H113 WeakPolarHBondContact CG-CE1 3.49Å; Q91-H113 WeakPolarHBondContact CG-NE2 3.39Å; Q91-H113 PolarHBondContact NE2-CE1 2.84Å; Q91-H113 PolarHBondContact NE2-NE2 2.79Å; Q91-E114 PolarHBondContact O-N 3.11Å; Q91-D117 PolarHBondContact NE2-OD1 3.32Å; Q91-D117 PolarHBondContact OE1-OD1 3.44Å
92	V	89.5	Confident	89	Confident	55 Å²	55	94 Å²	94	33%	0.333	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	125.7	176.4	-177.9	0	0	0	0	108.5	V142	V92-V142 HydrophobicContact CG1-CG1 4.26Å
93	K	92.4	Very high	89.1	Confident	65 Å²	65	94 Å²	94	28%	0.283	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	163.3	178	-66.4	-178.1	-171.4	174	0	109.7	A90 Y112 E114	A90-K93 HydrophobicContact CB-CG 4.2Å; K93-Y112 HydrophobicContact CB-CD1 4.06Å; K93-Y112 HydrophobicContact CB-CD2 4.16Å; K93-Y112 HydrophobicContact CB-CE1 3.42Å; K93-Y112 VanDerWaalsContact CB-CE1 3.42Å; K93-Y112 HydrophobicContact CB-CE2 3.54Å; K93-Y112 HydrophobicContact CB-CG 4.4Å; K93-Y112 VanDerWaalsContact CB-OH 3.27Å; K93-Y112 WeakPolarHBondContact CB-OH 3.48Å; K93-Y112 HydrophobicContact CD-CE2 3.8Å; K93-Y112 WeakPolarHBondContact CD-OH 3.39Å; K93-Y112 HydrophobicContact CG-CE2 4.21Å; K93-Y112 PolarHBondContact N-O 3.46Å; K93-Y112 WeakPolarHBondContact O-CD1 3.46Å; K93-Y112 PolarHBondContact O-N 3.46Å; K93-Y112 VanDerWaalsContact O-O 3.13Å; K93-E114 VanDerWaalsContact CD-OE2 3.32Å; K93-E114 WeakPolarHBondContact CD-OE2 3.44Å; K93-E114 VanDerWaalsContact CE-OE2 3.26Å; K93-E114 WeakPolarHBondContact CE-OE2 3.31Å; K93-E114 IonicContact NZ-OE1 3.78Å; K93-E114 PolarHBondContact NZ-OE1 3.09Å; K93-E114 VanDerWaalsContact NZ-OE1 3.13Å; K93-E114 IonicContact NZ-OE2 2.66Å; K93-E114 PolarHBondContact NZ-OE2 3.03Å
94	I	93.6	Very high	89.2	Confident	95 Å²	95	92.9 Å²	92.9	49%	0.487	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.9	-176.8	-62.7	160.9	0	0	0	109.4	F109 V146	I94-F109 HydrophobicContact CG2-CB 3.6Å; I94-F109 HydrophobicContact CG2-CD1 3.62Å; I94-F109 HydrophobicContact CG2-CG 3.9Å; I94-V146 HydrophobicContact CD1-CG2 4.07Å; I94-V146 HydrophobicContact CG1-CG1 4.32Å; I94-V146 HydrophobicContact CG1-CG2 4.13Å
95	R	93.6	Very high	89.4	Confident	142 Å²	142	90.7 Å²	90.7	54%	0.536	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.2	171.5	-171.2	178.7	-63.7	160.7	1.5	109.4	E110 Y112	R95-E110 PolarHBondContact N-O 2.98Å; R95-E110 PolarHBondContact O-N 3.39Å; R95-Y112 HydrophobicContact CB-CD1 4.01Å; R95-Y112 HydrophobicContact CB-CE1 4.11Å
96	A	93.5	Very high	89.7	Confident	76 Å²	76	84 Å²	84	63%	0.628	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.8	171.1	0	0	0	0	0	109.9	F109	A96-F109 HydrophobicContact CB-CD1 4.49Å; A96-F109 HydrophobicContact CB-CE1 4.47Å
97	K	93.5	Very high	90.1	Very high	119 Å²	119	81.7 Å²	81.7	52%	0.517	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	151.3	173.1	178.7	177.3	-175.6	177.4	0	108.7	V108	K97-V108 HydrophobicContact CB-CG2 3.85Å; K97-V108 HydrophobicContact CD-CG2 4.49Å; K97-V108 HydrophobicContact CG-CG2 4.11Å; K97-V108 PolarHBondContact N-O 3.47Å; K97-V108 WeakPolarHBondContact O-CG2 3.49Å; K97-V108 PolarHBondContact O-N 3.12Å; K97-V108 VanDerWaalsContact O-O 3.06Å
98	K	93.2	Very high	90.4	Very high	173 Å²	173	78.4 Å²	78.4	75%	0.752	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.6	177.8	-68	179.4	179.6	179.9	0	108.6	T105	K98-T105 HydrophobicContact CB-CG2 3.86Å; K98-T105 HydrophobicContact CD-CG2 4.09Å; K98-T105 HydrophobicContact CG-CG2 4.04Å
99	D	92.9	Very high	90.9	Very high	80 Å²	80	75.1 Å²	75.1	43%	0.428	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143	171.8	-171	17.1	0	0	0	109.8	T105 L106 V108	D99-T105 CarbonylContact O-C 3.52Å; D99-T105 WeakPolarHBondContact O-CA 3.45Å; D99-L106 PolarHBondContact N-O 2.98Å; D99-L106 PolarHBondContact O-N 2.95Å; D99-V108 HydrophobicContact CB-CG1 3.89Å; D99-V108 HydrophobicContact CB-CG2 4.1Å
100	N	91.3	Very high	91.1	Very high	108 Å²	108	71.6 Å²	71.6	58%	0.578	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	111.9	-173.9	-76.2	-33.4	0	0	0	110.6	T105	N100-T105 WeakPolarHBondContact OD1-CA 3.42Å; N100-T105 WeakPolarHBondContact OD1-CB 3.32Å; N100-T105 WeakPolarHBondContact OD1-CG2 3.38Å; N100-T105 PolarHBondContact OD1-OG1 3.07Å
101	V	86.5	Confident	91.2	Very high	24 Å²	24	73 Å²	73	15%	0.145	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	113.3	-179.8	-178.5	0	0	0	0	109.6	R43 G103 V104 L106	R43-V101 HydrophobicContact CB-CG1 4.16Å; R43-V101 HydrophobicContact CG-CG1 3.7Å; V101-G103 PolarHBondContact O-N 2.98Å; V101-G103 VanDerWaalsContact O-N 3.11Å; V101-V104 PolarHBondContact N-O 3.35Å; V101-V104 PolarHBondContact O-N 3.49Å; V101-L106 HydrophobicContact CB-CD1 4.03Å; V101-L106 HydrophobicContact CG2-CD1 3.68Å; V101-L106 HydrophobicContact CG2-CG 4.47Å
102	A	82.9	Confident	91.3	Very high	53 Å²	53	74.1 Å²	74.1	44%	0.438	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	34	179	0	0	0	0	0	114.6	K36 L40	K36-A102 VanDerWaalsContact CE-O 3.24Å; K36-A102 WeakPolarHBondContact CE-O 3.46Å; L40-A102 HydrophobicContact CD2-CB 4.02Å; L40-A102 HydrophobicContact CG-CB 4.43Å
103	G	87.3	Confident	91.2	Very high	65 Å²	65	77 Å²	77	67%	0.67	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	20.1	-177.5	0	0	0	0	0	114.5	V101	V101-G103 PolarHBondContact O-N 2.98Å; V101-G103 VanDerWaalsContact O-N 3.11Å
104	V	90.8	Very high	90.8	Very high	22 Å²	22	78.6 Å²	78.6	13%	0.133	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.1	164.2	-177.3	0	0	0	0	107.6	L40 V101 L106 A161	L40-V104 HydrophobicContact CD1-CG2 4.04Å; L40-V104 HydrophobicContact CD2-CB 4.36Å; L40-V104 HydrophobicContact CD2-CG2 3.81Å; V101-V104 PolarHBondContact N-O 3.35Å; V101-V104 PolarHBondContact O-N 3.49Å; V104-L106 HydrophobicContact CG1-CD2 3.87Å; V104-A161 HydrophobicContact CG1-CB 3.84Å; V104-A161 HydrophobicContact CG2-CB 3.91Å
105	T	92.7	Very high	89.5	Confident	80 Å²	80	77 Å²	77	49%	0.491	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.3	177.8	-56.6	0	0	0	0	109.5	K98 D99 N100	K98-T105 HydrophobicContact CB-CG2 3.86Å; K98-T105 HydrophobicContact CD-CG2 4.09Å; K98-T105 HydrophobicContact CG-CG2 4.04Å; D99-T105 CarbonylContact O-C 3.52Å; D99-T105 WeakPolarHBondContact O-CA 3.45Å; N100-T105 WeakPolarHBondContact OD1-CA 3.42Å; N100-T105 WeakPolarHBondContact OD1-CB 3.32Å; N100-T105 WeakPolarHBondContact OD1-CG2 3.38Å; N100-T105 PolarHBondContact OD1-OG1 3.07Å
106	L	91.8	Very high	88.6	Confident	4 Å²	4	75.3 Å²	75.3	2%	0.021	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.1	179.9	-53.4	-178.6	0	0	0	110.4	D99 V101 V104 L158	D99-L106 PolarHBondContact N-O 2.98Å; D99-L106 PolarHBondContact O-N 2.95Å; V101-L106 HydrophobicContact CB-CD1 4.03Å; V101-L106 HydrophobicContact CG2-CD1 3.68Å; V101-L106 HydrophobicContact CG2-CG 4.47Å; V104-L106 HydrophobicContact CG1-CD2 3.87Å; L106-L158 HydrophobicContact CD1-CD1 3.79Å; L106-L158 HydrophobicContact CD1-CD2 3.98Å; L106-L158 HydrophobicContact CD1-CG 3.84Å; L106-L158 HydrophobicContact CD2-CD1 4.43Å; L106-L158 HydrophobicContact CD2-CD2 3.69Å; L106-L158 HydrophobicContact CD2-CG 3.57Å; L106-L158 HydrophobicContact CG-CD2 4.38Å; L106-L158 HydrophobicContact CG-CG 4.36Å
107	P	93	Very high	87.6	Confident	41 Å²	41	75.7 Å²	75.7	27%	0.266	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	121.6	169	31.9	-32.6	0	0	0	109.5	T153 S154 T157	P107-T153 HydrophobicContact CG-CG2 3.64Å; P107-S154 PolarHBondContact O-OG 3.34Å; P107-T157 HydrophobicContact CG-CG2 4.32Å
108	V	93.8	Very high	86.5	Confident	32 Å²	32	72.4 Å²	72.4	19%	0.194	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	144.1	173.8	-61.4	0	0	0	0	109.2	K97 D99	K97-V108 HydrophobicContact CB-CG2 3.85Å; K97-V108 HydrophobicContact CD-CG2 4.49Å; K97-V108 HydrophobicContact CG-CG2 4.11Å; K97-V108 PolarHBondContact N-O 3.47Å; K97-V108 WeakPolarHBondContact O-CG2 3.49Å; K97-V108 PolarHBondContact O-N 3.12Å; K97-V108 VanDerWaalsContact O-O 3.06Å; D99-V108 HydrophobicContact CB-CG1 3.89Å; D99-V108 HydrophobicContact CB-CG2 4.1Å
109	F	94.7	Very high	85.6	Confident	70 Å²	70	66.3 Å²	66.3	31%	0.307	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.1	179.8	-59.2	-68.5	0	0	0	110.6	I94 A96 V146 A149 S150 T153	I94-F109 HydrophobicContact CG2-CB 3.6Å; I94-F109 HydrophobicContact CG2-CD1 3.62Å; I94-F109 HydrophobicContact CG2-CG 3.9Å; A96-F109 HydrophobicContact CB-CD1 4.49Å; A96-F109 HydrophobicContact CB-CE1 4.47Å; F109-V146 HydrophobicContact CB-CG1 4Å; F109-A149 HydrophobicContact CD2-CB 4.49Å; F109-S150 WeakPolarHBondContact CA-OG 3.48Å; F109-S150 VanDerWaalsContact CB-OG 3.24Å; F109-S150 WeakPolarHBondContact CB-OG 3.42Å; F109-S150 PolarHBondContact N-OG 2.87Å; F109-S150 PolarHBondContact O-OG 2.94Å; F109-S150 VanDerWaalsContact O-OG 3.12Å; F109-T153 HydrophobicContact CE2-CG2 4.44Å
110	E	91	Very high	84.6	Confident	91 Å²	91	69.4 Å²	69.4	43%	0.425	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.5	174.1	-173.1	172	-156.7	0	0	107.8	R95	R95-E110 PolarHBondContact N-O 2.98Å; R95-E110 PolarHBondContact O-N 3.39Å
111	H	90.5	Very high	83.5	Confident	89 Å²	89	70.8 Å²	70.8	41%	0.412	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	139.8	174	66	-89.2	0	0	0	108.8	V146	H111-V146 HydrophobicContact CB-CG1 4.18Å; H111-V146 HydrophobicContact CB-CG2 4.42Å
112	Y	89.9	Confident	82.6	Confident	72 Å²	72	70.9 Å²	70.9	28%	0.282	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.9	170.1	70.1	-87	0	0	0	110	K93 R95 E114	K93-Y112 HydrophobicContact CB-CD1 4.06Å; K93-Y112 HydrophobicContact CB-CD2 4.16Å; K93-Y112 HydrophobicContact CB-CE1 3.42Å; K93-Y112 VanDerWaalsContact CB-CE1 3.42Å; K93-Y112 HydrophobicContact CB-CE2 3.54Å; K93-Y112 HydrophobicContact CB-CG 4.4Å; K93-Y112 VanDerWaalsContact CB-OH 3.27Å; K93-Y112 WeakPolarHBondContact CB-OH 3.48Å; K93-Y112 HydrophobicContact CD-CE2 3.8Å; K93-Y112 WeakPolarHBondContact CD-OH 3.39Å; K93-Y112 HydrophobicContact CG-CE2 4.21Å; K93-Y112 PolarHBondContact N-O 3.46Å; K93-Y112 WeakPolarHBondContact O-CD1 3.46Å; K93-Y112 PolarHBondContact O-N 3.46Å; K93-Y112 VanDerWaalsContact O-O 3.13Å; R95-Y112 HydrophobicContact CB-CD1 4.01Å; R95-Y112 HydrophobicContact CB-CE1 4.11Å; Y112-E114 HydrophobicContact CD2-CB 4.44Å; Y112-E114 HydrophobicContact CE2-CB 4.27Å
113	H	87.4	Confident	81.9	Confident	117 Å²	117	69.5 Å²	69.5	54%	0.542	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	115.4	179	-161.8	90.2	0	0	0	109	Q91	Q91-H113 VanDerWaalsContact CD-CE1 3.41Å; Q91-H113 WeakPolarHBondContact CG-CE1 3.49Å; Q91-H113 WeakPolarHBondContact CG-NE2 3.39Å; Q91-H113 PolarHBondContact NE2-CE1 2.84Å; Q91-H113 PolarHBondContact NE2-NE2 2.79Å
114	E	82.5	Confident	80.9	Confident	98 Å²	98	72.9 Å²	72.9	46%	0.458	40%	0.396	S	S	.	.			trans	-101.6	98.9	172.9	-160.1	174.2	139.1	0	0	107.3	Q91 K93 Y112 T116	Q91-E114 PolarHBondContact O-N 3.11Å; K93-E114 VanDerWaalsContact CD-OE2 3.32Å; K93-E114 WeakPolarHBondContact CD-OE2 3.44Å; K93-E114 VanDerWaalsContact CE-OE2 3.26Å; K93-E114 WeakPolarHBondContact CE-OE2 3.31Å; K93-E114 IonicContact NZ-OE1 3.78Å; K93-E114 PolarHBondContact NZ-OE1 3.09Å; K93-E114 VanDerWaalsContact NZ-OE1 3.13Å; K93-E114 IonicContact NZ-OE2 2.66Å; K93-E114 PolarHBondContact NZ-OE2 3.03Å; Y112-E114 HydrophobicContact CD2-CB 4.44Å; Y112-E114 HydrophobicContact CE2-CB 4.27Å; E114-T116 PolarHBondContact O-N 3.48Å
115	G	66.5	Low	79.8	Confident	60 Å²	60	76.6 Å²	76.6	62%	0.619	43%	0.429	S	S	*	.			trans	-72.9	91	-157.7	0	0	0	0	0	116.2
116	T	74.4	Confident	78.9	Confident	108 Å²	108	82.4 Å²	82.4	66%	0.663	44%	0.441	S	S	*	.			trans	-141.5	116.3	153.7	-50.6	0	0	0	0	108.9	E114 S118	E114-T116 PolarHBondContact O-N 3.48Å; T116-S118 PolarHBondContact O-N 2.95Å; T116-S118 VanDerWaalsContact O-N 3.1Å
117	D	73.7	Confident	78.3	Confident	83 Å²	83	82.8 Å²	82.8	44%	0.444	45%	0.447	S	S	.	.			trans	-73.5	96.2	173.4	-88.9	-42.1	0	0	0	109.5	Q91 Y119 E120	Q91-D117 PolarHBondContact NE2-OD1 3.32Å; Q91-D117 PolarHBondContact OE1-OD1 3.44Å; D117-Y119 PolarHBondContact O-N 3.4Å; D117-E120 HydrophobicContact CB-CB 4.33Å
118	S	70.3	Confident	77.9	Confident	51 Å²	51	82.4 Å²	82.4	36%	0.357	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.3	178.1	54.3	0	0	0	0	113.6	T116	T116-S118 PolarHBondContact O-N 2.95Å; T116-S118 VanDerWaalsContact O-N 3.1Å
119	Y	74.1	Confident	77.6	Confident	44 Å²	44	86.7 Å²	86.7	17%	0.173	47%	0.468	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116	17.3	-171.4	-59.5	-69.1	0	0	0	113.2	V83 N86 V87 D117 L121 T122 K135	V83-Y119 HydrophobicContact CB-CE1 4.41Å; V83-Y119 HydrophobicContact CG1-CE1 4.02Å; V83-Y119 PolarHBondContact O-OH 2.88Å; V83-Y119 VanDerWaalsContact O-OH 3.14Å; N86-Y119 HydrophobicContact CB-CE1 4.28Å; N86-Y119 WeakPolarHBondContact O-CE1 3.39Å; V87-Y119 WeakPolarHBondContact CG2-OH 3.42Å; D117-Y119 PolarHBondContact O-N 3.4Å; Y119-L121 PolarHBondContact O-N 3.35Å; Y119-T122 HydrophobicContact CD1-CG2 3.82Å; Y119-T122 HydrophobicContact CG-CG2 4.42Å; Y119-T122 PolarHBondContact O-N 3.45Å; Y119-T122 VanDerWaalsContact O-N 3.17Å; Y119-T122 PolarHBondContact O-OG1 2.97Å; Y119-K135 VanDerWaalsContact CB-NZ 3.34Å; Y119-K135 PolarHBondContact O-NZ 2.91Å
120	E	70.9	Confident	77.3	Confident	146 Å²	146	85.8 Å²	85.8	68%	0.682	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-34.8	-177.5	-167.7	171.3	-173.6	0	0	112.3	D117	D117-E120 HydrophobicContact CB-CB 4.33Å
121	L	69	Low	77.2	Confident	136 Å²	136	81.9 Å²	81.9	71%	0.712	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	1	-177.4	-54	174.8	0	0	0	114.5	Y119 G123 L124	Y119-L121 PolarHBondContact O-N 3.35Å; L121-G123 PolarHBondContact O-N 3.48Å; L121-L124 HydrophobicContact CB-CD1 3.96Å; L121-L124 HydrophobicContact CD2-CD1 3.67Å; L121-L124 HydrophobicContact CG-CD1 4.41Å
122	T	68.7	Low	77.1	Confident	26 Å²	26	79.3 Å²	79.3	16%	0.16	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	118.5	179.9	58.7	0	0	0	0	111	Y119 L131	Y119-T122 HydrophobicContact CD1-CG2 3.82Å; Y119-T122 HydrophobicContact CG-CG2 4.42Å; Y119-T122 PolarHBondContact O-N 3.45Å; Y119-T122 VanDerWaalsContact O-N 3.17Å; Y119-T122 PolarHBondContact O-OG1 2.97Å; T122-L131 VanDerWaalsContact O-CD1 3.31Å; T122-L131 WeakPolarHBondContact O-CD1 3.5Å
123	G	66.6	Low	77.1	Confident	25 Å²	25	80.1 Å²	80.1	26%	0.258	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	18.6	175.9	0	0	0	0	0	115.8	L121 A125 R126 G128	L121-G123 PolarHBondContact O-N 3.48Å; G123-A125 PolarHBondContact O-N 3.41Å; G123-R126 CarbonylContact O-C 3.45Å; G123-R126 PolarHBondContact O-N 3.1Å; G123-G128 WeakPolarHBondContact O-CA 3.32Å; G123-G128 PolarHBondContact O-N 3.05Å
124	L	66.9	Low	77.3	Confident	136 Å²	136	75.3 Å²	75.3	71%	0.712	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.9	174.8	-73.3	172.1	0	0	0	113.3	L121	L121-L124 HydrophobicContact CB-CD1 3.96Å; L121-L124 HydrophobicContact CD2-CD1 3.67Å; L121-L124 HydrophobicContact CG-CD1 4.41Å
125	A	68.8	Low	77.7	Confident	100 Å²	100	74.2 Å²	74.2	83%	0.826	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-38.4	-178.7	0	0	0	0	0	113.2	G123	G123-A125 PolarHBondContact O-N 3.41Å
126	R	73.1	Confident	78.9	Confident	201 Å²	201	79 Å²	79	76%	0.758	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.5	130.7	-178.3	-64.7	-172.2	-179.8	176.8	-0.4	110.5	G123	G123-R126 CarbonylContact O-C 3.45Å; G123-R126 PolarHBondContact O-N 3.1Å
127	G	79.6	Confident	79.8	Confident	13 Å²	13	75.1 Å²	75.1	13%	0.134	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	16.7	169.8	0	0	0	0	0	116.7	E129 Q130 L131	G127-E129 VanDerWaalsContact C-N 3.28Å; G127-E129 PolarHBondContact O-N 3.34Å; G127-Q130 PolarHBondContact O-N 3.15Å; G127-Q130 PolarHBondContact O-OE1 2.81Å; G127-L131 PolarHBondContact O-N 2.88Å; G127-L131 VanDerWaalsContact O-N 3.07Å
128	G	84.5	Confident	80.8	Confident	33 Å²	33	74.7 Å²	74.7	34%	0.34	39%	0.385	S	S	.	.	H	α-helix	trans	-58.1	-34.3	179.5	0	0	0	0	0	114.4	G123 L131 A132	G123-G128 WeakPolarHBondContact O-CA 3.32Å; G123-G128 PolarHBondContact O-N 3.05Å; G128-L131 PolarHBondContact O-N 2.96Å; G128-A132 PolarHBondContact O-N 2.72Å
129	E	86.8	Confident	81.8	Confident	121 Å²	121	74.3 Å²	74.3	57%	0.565	39%	0.385	S	S	*	.	H	α-helix	trans	-66.1	-44.1	177.1	-168.5	-169	152.1	0	0	111.7	G127 L131 A132 K133	G127-E129 VanDerWaalsContact C-N 3.28Å; G127-E129 PolarHBondContact O-N 3.34Å; E129-L131 VanDerWaalsContact C-N 3.31Å; E129-L131 PolarHBondContact O-N 3.4Å; E129-A132 PolarHBondContact O-N 2.86Å; E129-K133 WeakPolarHBondContact O-CG 3.42Å; E129-K133 PolarHBondContact O-N 3.45Å; E129-K133 WeakPolarHBondContact OE1-CE 3.24Å; E129-K133 IonicContact OE1-NZ 2.7Å; E129-K133 PolarHBondContact OE1-NZ 2.93Å
130	Q	88.1	Confident	82.6	Confident	52 Å²	52	78.3 Å²	78.3	24%	0.243	40%	0.403	C	S	.	.	H	α-helix	trans	-63.8	-38.4	176.6	-68.6	77	2.1	0	0	110.7	A72 T75 G127 K133 L134	A72-Q130 HydrophobicContact CB-CB 4.11Å; T75-Q130 HydrophobicContact CG2-CG 4.42Å; G127-Q130 PolarHBondContact O-N 3.15Å; G127-Q130 PolarHBondContact O-OE1 2.81Å; Q130-K133 PolarHBondContact O-N 2.92Å; Q130-L134 VanDerWaalsContact O-CB 3.3Å; Q130-L134 WeakPolarHBondContact O-CB 3.33Å; Q130-L134 PolarHBondContact O-N 3.18Å
131	L	88.7	Confident	83.7	Confident	9 Å²	9	71.5 Å²	71.5	5%	0.047	37%	0.372	C	S	.	.	H	α-helix	trans	-67.1	-37.6	174.5	-71.6	170.6	0	0	0	112.5	A72 F79 T122 G127 G128 E129 L134 K135	A72-L131 HydrophobicContact CB-CD2 4.34Å; F79-L131 HydrophobicContact CD1-CD2 4.01Å; F79-L131 HydrophobicContact CD2-CD2 3.84Å; F79-L131 HydrophobicContact CE1-CD2 3.99Å; F79-L131 HydrophobicContact CE2-CD2 3.83Å; F79-L131 HydrophobicContact CG-CD2 3.93Å; F79-L131 HydrophobicContact CZ-CD2 3.9Å; T122-L131 VanDerWaalsContact O-CD1 3.31Å; T122-L131 WeakPolarHBondContact O-CD1 3.5Å; G127-L131 PolarHBondContact O-N 2.88Å; G127-L131 VanDerWaalsContact O-N 3.07Å; G128-L131 PolarHBondContact O-N 2.96Å; E129-L131 VanDerWaalsContact C-N 3.31Å; E129-L131 PolarHBondContact O-N 3.4Å; L131-L134 HydrophobicContact CD2-CD2 4.13Å; L131-L134 WeakPolarHBondContact O-CB 3.13Å; L131-L134 PolarHBondContact O-N 3.34Å; L131-K135 WeakPolarHBondContact O-CG 3.35Å; L131-K135 PolarHBondContact O-N 2.93Å
132	A	88.2	Confident	84.9	Confident	35 Å²	35	67.9 Å²	67.9	29%	0.289	36%	0.355	S	S	.	.	H	α-helix	trans	-65.8	-40.9	174.1	0	0	0	0	0	111.8	G128 E129 K135 R136	G128-A132 PolarHBondContact O-N 2.72Å; E129-A132 PolarHBondContact O-N 2.86Å; A132-K135 PolarHBondContact O-N 3.35Å; A132-R136 WeakPolarHBondContact O-CG 3.41Å; A132-R136 PolarHBondContact O-N 3.47Å; A132-R136 VanDerWaalsContact O-N 3.14Å
133	K	90.5	Very high	86	Confident	89 Å²	89	71.2 Å²	71.2	39%	0.387	37%	0.369	S	S	.	.	H	α-helix	trans	-62.4	-44.8	172.6	-71.6	176.8	-174.2	167.9	0	111.4	E129 Q130 K135 R136 N137	E129-K133 WeakPolarHBondContact O-CG 3.42Å; E129-K133 PolarHBondContact O-N 3.45Å; E129-K133 WeakPolarHBondContact OE1-CE 3.24Å; E129-K133 IonicContact OE1-NZ 2.7Å; E129-K133 PolarHBondContact OE1-NZ 2.93Å; Q130-K133 PolarHBondContact O-N 2.92Å; K133-K135 PolarHBondContact O-N 2.91Å; K133-R136 PolarHBondContact O-N 2.75Å; K133-N137 PolarHBondContact O-N 2.84Å
134	L	91.8	Very high	87.3	Confident	16 Å²	16	71 Å²	71	8%	0.084	36%	0.362	C	S	.	.	H	α-helix	trans	-55.4	-49.7	175.2	-176	69.2	0	0	0	111.6	L69 A72 F79 Q130 L131 R136 N137 Y138	L69-L134 VanDerWaalsContact CA-CD1 3.42Å; L69-L134 HydrophobicContact CB-CD1 3.77Å; L69-L134 HydrophobicContact CG-CD1 4.42Å; L69-L134 VanDerWaalsContact N-CD1 3.34Å; A72-L134 HydrophobicContact CB-CD2 4.09Å; F79-L134 HydrophobicContact CE2-CD2 3.95Å; F79-L134 HydrophobicContact CZ-CD2 3.8Å; Q130-L134 VanDerWaalsContact O-CB 3.3Å; Q130-L134 WeakPolarHBondContact O-CB 3.33Å; Q130-L134 PolarHBondContact O-N 3.18Å; L131-L134 HydrophobicContact CD2-CD2 4.13Å; L131-L134 WeakPolarHBondContact O-CB 3.13Å; L131-L134 PolarHBondContact O-N 3.34Å; L134-R136 VanDerWaalsContact C-N 3.34Å; L134-R136 PolarHBondContact O-N 3.22Å; L134-N137 PolarHBondContact O-N 2.85Å; L134-Y138 HydrophobicContact CD1-CD2 3.58Å; L134-Y138 HydrophobicContact CD1-CE2 3.42Å; L134-Y138 VanDerWaalsContact CD1-CE2 3.42Å; L134-Y138 HydrophobicContact CG-CD2 3.94Å; L134-Y138 HydrophobicContact CG-CE2 4.19Å; L134-Y138 WeakPolarHBondContact O-CD2 3.45Å; L134-Y138 PolarHBondContact O-N 2.97Å
135	K	90.4	Very high	88.6	Confident	74 Å²	74	67.9 Å²	67.9	32%	0.322	35%	0.346	S	S	.	.	H	α-helix	trans	-57.8	-44.8	177.6	-75.6	178.1	-175.4	176.9	0	112.1	Y119 L131 A132 K133 Y138 A139	Y119-K135 VanDerWaalsContact CB-NZ 3.34Å; Y119-K135 PolarHBondContact O-NZ 2.91Å; L131-K135 WeakPolarHBondContact O-CG 3.35Å; L131-K135 PolarHBondContact O-N 2.93Å; A132-K135 PolarHBondContact O-N 3.35Å; K133-K135 PolarHBondContact O-N 2.91Å; K135-Y138 PolarHBondContact O-N 3.43Å; K135-A139 WeakPolarHBondContact O-CB 3.5Å; K135-A139 PolarHBondContact O-N 2.91Å
136	R	91.2	Very high	89.8	Confident	162 Å²	162	63.6 Å²	63.6	61%	0.611	31%	0.309	S	S	*	.	H	α-helix	trans	-63.3	-41.8	178.2	-68.8	173.4	-170.4	149.3	2.8	112	A132 K133 L134 A139 K140	A132-R136 WeakPolarHBondContact O-CG 3.41Å; A132-R136 PolarHBondContact O-N 3.47Å; A132-R136 VanDerWaalsContact O-N 3.14Å; K133-R136 PolarHBondContact O-N 2.75Å; L134-R136 VanDerWaalsContact C-N 3.34Å; L134-R136 PolarHBondContact O-N 3.22Å; R136-A139 PolarHBondContact O-N 3.35Å; R136-K140 WeakPolarHBondContact O-CG 3.2Å; R136-K140 PolarHBondContact O-N 2.95Å; R136-K140 VanDerWaalsContact O-N 3.08Å
137	N	94	Very high	90.7	Very high	25 Å²	25	58.1 Å²	58.1	13%	0.134	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-42	-179.9	-72.5	-3.1	0	0	0	111.7	A65 S68 K133 L134 A141	A65-N137 HydrophobicContact CB-CB 4.28Å; S68-N137 PolarHBondContact OG-ND2 2.99Å; K133-N137 PolarHBondContact O-N 2.84Å; L134-N137 PolarHBondContact O-N 2.85Å; N137-A141 WeakPolarHBondContact O-CB 3.5Å; N137-A141 PolarHBondContact O-N 3.28Å
138	Y	93.7	Very high	91.5	Very high	75 Å²	75	57.9 Å²	57.9	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-70.5	-34.1	174.2	-87	-83.8	0	0	0	113.2	A65 L69 L134 K135 A141 V142	A65-Y138 HydrophobicContact CB-CD2 4.11Å; A65-Y138 HydrophobicContact CB-CE1 4.41Å; A65-Y138 HydrophobicContact CB-CE2 3.92Å; A65-Y138 HydrophobicContact CB-CG 4.43Å; A65-Y138 WeakPolarHBondContact O-CE2 3.31Å; L69-Y138 HydrophobicContact CB-CE2 4.36Å; L69-Y138 HydrophobicContact CD1-CE2 4.36Å; L69-Y138 WeakPolarHBondContact CD1-OH 3.39Å; L134-Y138 HydrophobicContact CD1-CD2 3.58Å; L134-Y138 HydrophobicContact CD1-CE2 3.42Å; L134-Y138 VanDerWaalsContact CD1-CE2 3.42Å; L134-Y138 HydrophobicContact CG-CD2 3.94Å; L134-Y138 HydrophobicContact CG-CE2 4.19Å; L134-Y138 WeakPolarHBondContact O-CD2 3.45Å; L134-Y138 PolarHBondContact O-N 2.97Å; K135-Y138 PolarHBondContact O-N 3.43Å; Y138-A141 PolarHBondContact O-N 3.14Å; Y138-V142 VanDerWaalsContact O-CG2 3.32Å; Y138-V142 WeakPolarHBondContact O-CG2 3.4Å; Y138-V142 PolarHBondContact O-N 2.93Å
139	A	91.6	Very high	91.9	Very high	42 Å²	42	58 Å²	58	35%	0.347	29%	0.285	S	S	.	.	H	α-helix	trans	-60.8	-48.4	174.1	0	0	0	0	0	111.1	K135 R136 A141 V142 E143	K135-A139 WeakPolarHBondContact O-CB 3.5Å; K135-A139 PolarHBondContact O-N 2.91Å; R136-A139 PolarHBondContact O-N 3.35Å; A139-A141 VanDerWaalsContact C-N 3.31Å; A139-A141 PolarHBondContact O-N 3.46Å; A139-V142 PolarHBondContact O-N 3.36Å; A139-E143 WeakPolarHBondContact O-CG 3.35Å; A139-E143 PolarHBondContact O-N 2.77Å
140	K	91.8	Very high	92.3	Very high	129 Å²	129	52.8 Å²	52.8	56%	0.561	26%	0.262	S	S	*	.	H	α-helix	trans	-59.3	-40.9	173.2	-71	176.5	179.9	-179.5	0	112.4	R136 E143 L144	R136-K140 WeakPolarHBondContact O-CG 3.2Å; R136-K140 PolarHBondContact O-N 2.95Å; R136-K140 VanDerWaalsContact O-N 3.08Å; K140-E143 PolarHBondContact O-N 2.61Å; K140-L144 PolarHBondContact O-N 2.84Å; K140-L144 VanDerWaalsContact O-N 3.1Å
141	A	94.4	Very high	92.5	Very high	3 Å²	3	51.3 Å²	51.3	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-63.3	-41.9	177.2	0	0	0	0	0	112.1	V61 M62 N137 Y138 A139 L144 L145	V61-A141 HydrophobicContact CG1-CB 3.95Å; M62-A141 HydrophobicContact SD-CB 3.89Å; N137-A141 WeakPolarHBondContact O-CB 3.5Å; N137-A141 PolarHBondContact O-N 3.28Å; Y138-A141 PolarHBondContact O-N 3.14Å; A139-A141 VanDerWaalsContact C-N 3.31Å; A139-A141 PolarHBondContact O-N 3.46Å; A141-L144 PolarHBondContact O-N 3.31Å; A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 VanDerWaalsContact O-CG 3.27Å; A141-L145 WeakPolarHBondContact O-CG 3.45Å; A141-L145 PolarHBondContact O-N 3.42Å
142	V	93.3	Very high	92.8	Very high	60 Å²	60	55 Å²	55	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-65.9	-42.7	177.1	171	0	0	0	0	111.3	V92 Y138 A139 L144 L145 V146	V92-V142 HydrophobicContact CG1-CG1 4.26Å; Y138-V142 VanDerWaalsContact O-CG2 3.32Å; Y138-V142 WeakPolarHBondContact O-CG2 3.4Å; Y138-V142 PolarHBondContact O-N 2.93Å; A139-V142 PolarHBondContact O-N 3.36Å; V142-L144 VanDerWaalsContact C-N 3.33Å; V142-L144 PolarHBondContact O-N 3.01Å; V142-L145 PolarHBondContact O-N 2.8Å; V142-V146 HydrophobicContact CG1-CG2 4.28Å; V142-V146 WeakPolarHBondContact O-CG2 3.33Å; V142-V146 PolarHBondContact O-N 3.34Å
143	E	92.2	Very high	93.1	Very high	95 Å²	95	55.9 Å²	55.9	44%	0.444	27%	0.274	S	S	.	.	H	α-helix	trans	-56.6	-47	175	-73.4	172.2	-172.3	0	0	111.6	A139 K140 V146 E147	A139-E143 WeakPolarHBondContact O-CG 3.35Å; A139-E143 PolarHBondContact O-N 2.77Å; K140-E143 PolarHBondContact O-N 2.61Å; E143-V146 PolarHBondContact O-N 2.83Å; E143-E147 PolarHBondContact O-N 2.63Å; E143-E147 VanDerWaalsContact O-N 3.09Å
144	L	93.7	Very high	93.2	Very high	21 Å²	21	52 Å²	52	11%	0.11	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-39.9	178.2	-163.4	161.4	0	0	0	111.6	T54 L57 M58 V61 K140 A141 V142 V146 E147 L148	T54-L144 HydrophobicContact CG2-CD2 3.59Å; T54-L144 HydrophobicContact CG2-CG 4.25Å; L57-L144 HydrophobicContact CB-CD1 4.45Å; L57-L144 HydrophobicContact CD2-CD1 3.8Å; L57-L144 HydrophobicContact CG-CD1 3.81Å; M58-L144 HydrophobicContact CB-CD2 3.48Å; M58-L144 VanDerWaalsContact CB-CD2 3.48Å; M58-L144 HydrophobicContact CG-CD2 3.91Å; V61-L144 HydrophobicContact CG2-CD1 4.06Å; K140-L144 PolarHBondContact O-N 2.84Å; K140-L144 VanDerWaalsContact O-N 3.1Å; A141-L144 PolarHBondContact O-N 3.31Å; V142-L144 VanDerWaalsContact C-N 3.33Å; V142-L144 PolarHBondContact O-N 3.01Å; L144-V146 VanDerWaalsContact C-N 3.32Å; L144-V146 PolarHBondContact O-N 2.96Å; L144-E147 PolarHBondContact O-N 2.88Å; L144-L148 WeakPolarHBondContact O-CB 3.27Å; L144-L148 PolarHBondContact O-N 3.39Å
145	L	94.7	Very high	93.3	Very high	71 Å²	71	53.6 Å²	53.6	37%	0.372	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-36.9	174.7	-77	171	0	0	0	112.3	M58 M62 A141 V142 L148 A149	M58-L145 HydrophobicContact CG-CD2 3.92Å; M58-L145 HydrophobicContact SD-CD2 3.77Å; M62-L145 HydrophobicContact SD-CD1 4.49Å; A141-L145 WeakPolarHBondContact O-CB 3.49Å; A141-L145 VanDerWaalsContact O-CG 3.27Å; A141-L145 WeakPolarHBondContact O-CG 3.45Å; A141-L145 PolarHBondContact O-N 3.42Å; V142-L145 PolarHBondContact O-N 2.8Å; L145-L148 PolarHBondContact O-N 3.29Å; L145-A149 VanDerWaalsContact O-CB 3.28Å; L145-A149 WeakPolarHBondContact O-CB 3.45Å; L145-A149 PolarHBondContact O-N 3.28Å
146	V	94.3	Very high	93.4	Very high	10 Å²	10	54.6 Å²	54.6	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-67	-40.5	175.7	178	0	0	0	0	110.7	I94 F109 H111 V142 E143 L144 A149 S150	I94-V146 HydrophobicContact CD1-CG2 4.07Å; I94-V146 HydrophobicContact CG1-CG1 4.32Å; I94-V146 HydrophobicContact CG1-CG2 4.13Å; F109-V146 HydrophobicContact CB-CG1 4Å; H111-V146 HydrophobicContact CB-CG1 4.18Å; H111-V146 HydrophobicContact CB-CG2 4.42Å; V142-V146 HydrophobicContact CG1-CG2 4.28Å; V142-V146 WeakPolarHBondContact O-CG2 3.33Å; V142-V146 PolarHBondContact O-N 3.34Å; E143-V146 PolarHBondContact O-N 2.83Å; L144-V146 VanDerWaalsContact C-N 3.32Å; L144-V146 PolarHBondContact O-N 2.96Å; V146-A149 PolarHBondContact O-N 3.47Å; V146-S150 PolarHBondContact O-N 2.79Å; V146-S150 PolarHBondContact O-OG 3.4Å
147	E	92	Very high	93.5	Very high	85 Å²	85	48.9 Å²	48.9	40%	0.397	26%	0.26	S	S	.	.	H	α-helix	trans	-63.4	-45.9	173.8	-171	179.6	-177.8	0	0	111.1	K50 E143 L144 A149 S150 L151	K50-E147 WeakPolarHBondContact CE-OE1 3.48Å; K50-E147 IonicContact NZ-OE1 3.97Å; K50-E147 PolarHBondContact NZ-OE1 3.42Å; E143-E147 PolarHBondContact O-N 2.63Å; E143-E147 VanDerWaalsContact O-N 3.09Å; L144-E147 PolarHBondContact O-N 2.88Å; E147-A149 PolarHBondContact O-N 3.41Å; E147-S150 WeakPolarHBondContact O-CB 3.5Å; E147-S150 PolarHBondContact O-N 3.19Å; E147-L151 WeakPolarHBondContact O-CG 3.36Å; E147-L151 PolarHBondContact O-N 3.09Å
148	L	94.9	Very high	93.5	Very high	9 Å²	9	47.7 Å²	47.7	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-43.8	177.2	-177.7	61.8	0	0	0	111.8	I51 T54 M58 L144 L145 S150 L151 Q152	I51-L148 HydrophobicContact CG2-CD1 4.34Å; T54-L148 HydrophobicContact CG2-CB 4.09Å; T54-L148 HydrophobicContact CG2-CD1 4.16Å; M58-L148 HydrophobicContact CG-CD2 4.44Å; M58-L148 HydrophobicContact SD-CD2 4.11Å; L144-L148 WeakPolarHBondContact O-CB 3.27Å; L144-L148 PolarHBondContact O-N 3.39Å; L145-L148 PolarHBondContact O-N 3.29Å; L148-S150 VanDerWaalsContact C-N 3.31Å; L148-S150 PolarHBondContact O-N 2.9Å; L148-L151 PolarHBondContact O-N 3.2Å; L148-Q152 HydrophobicContact CD1-CG 4.44Å; L148-Q152 HydrophobicContact CG-CG 4.49Å; L148-Q152 WeakPolarHBondContact O-CG 3.5Å; L148-Q152 PolarHBondContact O-N 3.49Å
149	A	94.7	Very high	93.5	Very high	34 Å²	34	46.3 Å²	46.3	28%	0.281	25%	0.252	S	S	.	.	H	α-helix	trans	-60.7	-41.6	176.2	0	0	0	0	0	111.3	F109 L145 V146 E147 L151 Q152 T153	F109-A149 HydrophobicContact CD2-CB 4.49Å; L145-A149 VanDerWaalsContact O-CB 3.28Å; L145-A149 WeakPolarHBondContact O-CB 3.45Å; L145-A149 PolarHBondContact O-N 3.28Å; V146-A149 PolarHBondContact O-N 3.47Å; E147-A149 PolarHBondContact O-N 3.41Å; A149-L151 VanDerWaalsContact C-N 3.33Å; A149-L151 PolarHBondContact O-N 2.96Å; A149-Q152 PolarHBondContact O-N 2.89Å; A149-T153 PolarHBondContact O-N 2.97Å; A149-T153 PolarHBondContact O-OG1 2.66Å; A149-T153 VanDerWaalsContact O-OG1 3.04Å
150	S	93.6	Very high	93.6	Very high	12 Å²	12	50 Å²	50	8%	0.084	26%	0.262	C	S	.	.	H	α-helix	trans	-58.6	-44.9	175.1	-59.9	0	0	0	0	112.1	F109 V146 E147 L148 S154	F109-S150 WeakPolarHBondContact CA-OG 3.48Å; F109-S150 VanDerWaalsContact CB-OG 3.24Å; F109-S150 WeakPolarHBondContact CB-OG 3.42Å; F109-S150 PolarHBondContact N-OG 2.87Å; F109-S150 PolarHBondContact O-OG 2.94Å; F109-S150 VanDerWaalsContact O-OG 3.12Å; V146-S150 PolarHBondContact O-N 2.79Å; V146-S150 PolarHBondContact O-OG 3.4Å; E147-S150 WeakPolarHBondContact O-CB 3.5Å; E147-S150 PolarHBondContact O-N 3.19Å; L148-S150 VanDerWaalsContact C-N 3.31Å; L148-S150 PolarHBondContact O-N 2.9Å; S150-S154 VanDerWaalsContact O-CB 3.23Å; S150-S154 WeakPolarHBondContact O-CB 3.47Å; S150-S154 PolarHBondContact O-N 3.36Å; S150-S154 PolarHBondContact O-OG 2.7Å
151	L	94	Very high	93.7	Very high	21 Å²	21	44.7 Å²	44.7	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-42.4	177.2	-64.6	173.5	0	0	0	111.5	I47 K50 I51 E147 L148 A149 S154 F155	I47-L151 HydrophobicContact CG2-CB 4.45Å; I47-L151 HydrophobicContact CG2-CD2 4.39Å; K50-L151 HydrophobicContact CB-CD1 4.25Å; K50-L151 HydrophobicContact CD-CD1 3.86Å; K50-L151 HydrophobicContact CD-CD2 3.94Å; K50-L151 HydrophobicContact CG-CD1 3.74Å; I51-L151 HydrophobicContact CD1-CB 4.14Å; I51-L151 HydrophobicContact CG1-CB 3.62Å; I51-L151 HydrophobicContact CG1-CD1 4.31Å; E147-L151 WeakPolarHBondContact O-CG 3.36Å; E147-L151 PolarHBondContact O-N 3.09Å; L148-L151 PolarHBondContact O-N 3.2Å; A149-L151 VanDerWaalsContact C-N 3.33Å; A149-L151 PolarHBondContact O-N 2.96Å; L151-S154 PolarHBondContact O-N 3.25Å; L151-F155 WeakPolarHBondContact O-CB 3.31Å; L151-F155 PolarHBondContact O-N 2.93Å
152	Q	94.4	Very high	93.7	Very high	88 Å²	88	45.2 Å²	45.2	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-65.4	-46.2	179.6	-74.3	178.2	-13.1	0	0	112.5	L148 A149 S154 F155 V156	L148-Q152 HydrophobicContact CD1-CG 4.44Å; L148-Q152 HydrophobicContact CG-CG 4.49Å; L148-Q152 WeakPolarHBondContact O-CG 3.5Å; L148-Q152 PolarHBondContact O-N 3.49Å; A149-Q152 PolarHBondContact O-N 2.89Å; Q152-S154 VanDerWaalsContact C-N 3.35Å; Q152-F155 WeakPolarHBondContact O-CB 3.25Å; Q152-F155 PolarHBondContact O-N 3.39Å; Q152-V156 WeakPolarHBondContact O-CG2 3.39Å; Q152-V156 PolarHBondContact O-N 3.16Å
153	T	94.1	Very high	93.7	Very high	52 Å²	52	47.9 Å²	47.9	32%	0.319	25%	0.25	S	S	.	.	H	α-helix	trans	-66	-40.2	177.6	-50.1	0	0	0	0	111.2	P107 F109 A149 F155 T157	P107-T153 HydrophobicContact CG-CG2 3.64Å; F109-T153 HydrophobicContact CE2-CG2 4.44Å; A149-T153 PolarHBondContact O-N 2.97Å; A149-T153 PolarHBondContact O-OG1 2.66Å; A149-T153 VanDerWaalsContact O-OG1 3.04Å; T153-F155 VanDerWaalsContact C-N 3.29Å; T153-F155 PolarHBondContact O-N 2.92Å; T153-T157 WeakPolarHBondContact O-CG2 3.23Å; T153-T157 PolarHBondContact O-N 3.17Å; T153-T157 PolarHBondContact O-OG1 3.01Å
154	S	92.1	Very high	93.9	Very high	7 Å²	7	47.8 Å²	47.8	5%	0.049	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-36.6	172.4	-64.8	0	0	0	0	112.1	P107 S150 L151 Q152 T157 L158	P107-S154 PolarHBondContact O-OG 3.34Å; S150-S154 VanDerWaalsContact O-CB 3.23Å; S150-S154 WeakPolarHBondContact O-CB 3.47Å; S150-S154 PolarHBondContact O-N 3.36Å; S150-S154 PolarHBondContact O-OG 2.7Å; L151-S154 PolarHBondContact O-N 3.25Å; Q152-S154 VanDerWaalsContact C-N 3.35Å; S154-T157 WeakPolarHBondContact CA-OG1 3.35Å; S154-T157 PolarHBondContact O-OG1 3.13Å; S154-L158 VanDerWaalsContact O-CB 3.28Å; S154-L158 WeakPolarHBondContact O-CB 3.5Å; S154-L158 VanDerWaalsContact O-CG 3.24Å; S154-L158 WeakPolarHBondContact O-CG 3.43Å; S154-L158 PolarHBondContact O-N 3.09Å
155	F	93.8	Very high	93.9	Very high	51 Å²	51	47.4 Å²	47.4	22%	0.224	25%	0.251	C	S	.	.	H	α-helix	trans	-67.1	-46.2	-180	179.1	-94.1	0	0	0	112.5	F44 I47 L48 I51 L151 Q152 T153 L158 D159	F44-F155 HydrophobicContact CD1-CE2 4.41Å; F44-F155 AromaticContact CD2-CD2 3.89Å; F44-F155 HydrophobicContact CD2-CD2 3.89Å; F44-F155 AromaticContact CD2-CE2 3.78Å; F44-F155 HydrophobicContact CD2-CE2 3.78Å; F44-F155 HydrophobicContact CD2-CZ 4.5Å; F44-F155 AromaticContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CZ 4.11Å; F44-F155 HydrophobicContact CE2-CD1 4.36Å; F44-F155 AromaticContact CE2-CD2 3.48Å; F44-F155 HydrophobicContact CE2-CD2 3.48Å; F44-F155 VanDerWaalsContact CE2-CD2 3.48Å; F44-F155 HydrophobicContact CE2-CE1 4.05Å; F44-F155 AromaticContact CE2-CE2 3.1Å; F44-F155 HydrophobicContact CE2-CE2 3.1Å; F44-F155 HydrophobicContact CE2-CG 4.11Å; F44-F155 AromaticContact CE2-CZ 3.43Å; F44-F155 HydrophobicContact CE2-CZ 3.43Å; F44-F155 VanDerWaalsContact CE2-CZ 3.43Å; F44-F155 HydrophobicContact CG-CE2 4.39Å; F44-F155 HydrophobicContact CZ-CD2 4.04Å; F44-F155 HydrophobicContact CZ-CE1 4.09Å; F44-F155 AromaticContact CZ-CE2 3.16Å; F44-F155 HydrophobicContact CZ-CE2 3.16Å; F44-F155 AromaticContact CZ-CZ 3.2Å; F44-F155 HydrophobicContact CZ-CZ 3.2Å; I47-F155 HydrophobicContact CG2-CB 4.14Å; I47-F155 HydrophobicContact CG2-CD2 4.22Å; L48-F155 HydrophobicContact CB-CE2 4.08Å; L48-F155 HydrophobicContact CD1-CE2 3.89Å; L48-F155 HydrophobicContact CD1-CZ 4.1Å; L48-F155 HydrophobicContact CG-CE2 4.49Å; I51-F155 HydrophobicContact CD1-CB 3.72Å; I51-F155 HydrophobicContact CD1-CD2 3.95Å; I51-F155 HydrophobicContact CD1-CG 3.89Å; L151-F155 WeakPolarHBondContact O-CB 3.31Å; L151-F155 PolarHBondContact O-N 2.93Å; Q152-F155 WeakPolarHBondContact O-CB 3.25Å; Q152-F155 PolarHBondContact O-N 3.39Å; T153-F155 VanDerWaalsContact C-N 3.29Å; T153-F155 PolarHBondContact O-N 2.92Å; F155-L158 PolarHBondContact O-N 2.89Å; F155-D159 PolarHBondContact O-N 3.42Å
156	V	93.9	Very high	93.9	Very high	94 Å²	94	46.8 Å²	46.8	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-64.5	-43.7	178.9	176.6	0	0	0	0	111.1	Q152 D159 E160	Q152-V156 WeakPolarHBondContact O-CG2 3.39Å; Q152-V156 PolarHBondContact O-N 3.16Å; V156-D159 PolarHBondContact O-N 2.82Å; V156-E160 PolarHBondContact O-N 3.48Å; V156-E160 VanDerWaalsContact O-N 3.16Å
157	T	92.8	Very high	94	Very high	42 Å²	42	54.8 Å²	54.8	26%	0.258	28%	0.277	S	S	.	.	H	α-helix	trans	-66.7	-37.4	178.1	51.4	0	0	0	0	112.5	P107 T153 S154 A161	P107-T157 HydrophobicContact CG-CG2 4.32Å; T153-T157 WeakPolarHBondContact O-CG2 3.23Å; T153-T157 PolarHBondContact O-N 3.17Å; T153-T157 PolarHBondContact O-OG1 3.01Å; S154-T157 WeakPolarHBondContact CA-OG1 3.35Å; S154-T157 PolarHBondContact O-OG1 3.13Å; T157-A161 WeakPolarHBondContact O-CB 3.25Å; T157-A161 PolarHBondContact O-N 3.43Å; T157-A161 VanDerWaalsContact O-N 3.09Å
158	L	93	Very high	94.1	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.1	-42.1	172.9	-79.7	173.2	0	0	0	112.9	L40 F44 I47 L106 S154 F155 E160 A161 I162	L40-L158 HydrophobicContact CD2-CD2 3.81Å; F44-L158 HydrophobicContact CD2-CB 4.25Å; I47-L158 HydrophobicContact CD1-CD1 3.27Å; L106-L158 HydrophobicContact CD1-CD1 3.79Å; L106-L158 HydrophobicContact CD1-CD2 3.98Å; L106-L158 HydrophobicContact CD1-CG 3.84Å; L106-L158 HydrophobicContact CD2-CD1 4.43Å; L106-L158 HydrophobicContact CD2-CD2 3.69Å; L106-L158 HydrophobicContact CD2-CG 3.57Å; L106-L158 HydrophobicContact CG-CD2 4.38Å; L106-L158 HydrophobicContact CG-CG 4.36Å; S154-L158 VanDerWaalsContact O-CB 3.28Å; S154-L158 WeakPolarHBondContact O-CB 3.5Å; S154-L158 VanDerWaalsContact O-CG 3.24Å; S154-L158 WeakPolarHBondContact O-CG 3.43Å; S154-L158 PolarHBondContact O-N 3.09Å; F155-L158 PolarHBondContact O-N 2.89Å; L158-E160 VanDerWaalsContact C-N 3.34Å; L158-E160 PolarHBondContact O-N 3.45Å; L158-A161 PolarHBondContact O-N 3.05Å; L158-I162 WeakPolarHBondContact O-CB 3.4Å; L158-I162 VanDerWaalsContact O-CG1 3.25Å; L158-I162 WeakPolarHBondContact O-CG1 3.24Å; L158-I162 PolarHBondContact O-N 3.23Å
159	D	93.9	Very high	94.2	Very high	47 Å²	47	58.5 Å²	58.5	25%	0.251	29%	0.287	S	S	.	.	H	α-helix	trans	-59	-46.2	177.7	179.2	56.4	0	0	0	111.3	F44 F155 V156 A161 I162 K163	F44-D159 HydrophobicContact CE2-CB 3.86Å; F44-D159 HydrophobicContact CZ-CB 4.45Å; F155-D159 PolarHBondContact O-N 3.42Å; V156-D159 PolarHBondContact O-N 2.82Å; D159-A161 PolarHBondContact O-N 2.94Å; D159-I162 PolarHBondContact O-N 2.86Å; D159-K163 WeakPolarHBondContact O-CG 3.28Å; D159-K163 PolarHBondContact O-N 3.04Å; D159-K163 IonicContact OD1-NZ 3.88Å; D159-K163 WeakPolarHBondContact OD2-CE 3.43Å; D159-K163 IonicContact OD2-NZ 3.72Å; D159-K163 PolarHBondContact OD2-NZ 3.45Å
160	E	94	Very high	94.3	Very high	120 Å²	120	60.9 Å²	60.9	56%	0.561	30%	0.296	S	S	*	.	H	α-helix	trans	-62.3	-44.7	176.8	-171.7	172.9	-168.5	0	0	111.7	V156 L158 I162 K163 I164	V156-E160 PolarHBondContact O-N 3.48Å; V156-E160 VanDerWaalsContact O-N 3.16Å; L158-E160 VanDerWaalsContact C-N 3.34Å; L158-E160 PolarHBondContact O-N 3.45Å; E160-I162 VanDerWaalsContact C-N 3.33Å; E160-I162 PolarHBondContact O-N 2.83Å; E160-K163 PolarHBondContact O-N 3.04Å; E160-I164 HydrophobicContact CG-CD1 4.01Å; E160-I164 VanDerWaalsContact O-CG1 3.31Å; E160-I164 WeakPolarHBondContact O-CG1 3.33Å; E160-I164 PolarHBondContact O-N 2.99Å
161	A	93.3	Very high	94.4	Very high	16 Å²	16	62.2 Å²	62.2	13%	0.132	31%	0.307	C	S	.	.	H	α-helix	trans	-62.3	-37.7	177	0	0	0	0	0	112.8	V104 T157 L158 D159 T165	V104-A161 HydrophobicContact CG1-CB 3.84Å; V104-A161 HydrophobicContact CG2-CB 3.91Å; T157-A161 WeakPolarHBondContact O-CB 3.25Å; T157-A161 PolarHBondContact O-N 3.43Å; T157-A161 VanDerWaalsContact O-N 3.09Å; L158-A161 PolarHBondContact O-N 3.05Å; D159-A161 PolarHBondContact O-N 2.94Å; A161-T165 WeakPolarHBondContact O-CB 3.41Å; A161-T165 PolarHBondContact O-N 3.24Å; A161-T165 PolarHBondContact O-OG1 3.18Å
162	I	94.3	Very high	94.5	Very high	14 Å²	14	62 Å²	62	7%	0.072	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-47.2	174.8	-70.9	165.6	0	0	0	110.2	L40 F44 L158 D159 E160 I164 T165 N166	L40-I162 HydrophobicContact CB-CD1 4.08Å; L40-I162 HydrophobicContact CB-CG1 3.63Å; L40-I162 HydrophobicContact CD1-CG1 4.3Å; F44-I162 HydrophobicContact CB-CD1 3.68Å; F44-I162 HydrophobicContact CD2-CD1 4.03Å; F44-I162 HydrophobicContact CG-CD1 3.87Å; L158-I162 WeakPolarHBondContact O-CB 3.4Å; L158-I162 VanDerWaalsContact O-CG1 3.25Å; L158-I162 WeakPolarHBondContact O-CG1 3.24Å; L158-I162 PolarHBondContact O-N 3.23Å; D159-I162 PolarHBondContact O-N 2.86Å; E160-I162 VanDerWaalsContact C-N 3.33Å; E160-I162 PolarHBondContact O-N 2.83Å; I162-I164 VanDerWaalsContact C-N 3.34Å; I162-I164 PolarHBondContact O-N 3.12Å; I162-T165 PolarHBondContact O-N 2.87Å; I162-N166 WeakPolarHBondContact CG2-ND2 3.47Å; I162-N166 WeakPolarHBondContact O-CB 3.49Å; I162-N166 PolarHBondContact O-N 3.06Å
163	K	95.2	Very high	94.5	Very high	116 Å²	116	61.2 Å²	61.2	50%	0.504	30%	0.302	S	S	.	.	H	α-helix	trans	-58.3	-44.9	177.8	-76.6	170.7	177	164.6	0	111.8	D159 E160 R167	D159-K163 WeakPolarHBondContact O-CG 3.28Å; D159-K163 PolarHBondContact O-N 3.04Å; D159-K163 IonicContact OD1-NZ 3.88Å; D159-K163 WeakPolarHBondContact OD2-CE 3.43Å; D159-K163 IonicContact OD2-NZ 3.72Å; D159-K163 PolarHBondContact OD2-NZ 3.45Å; E160-K163 PolarHBondContact O-N 3.04Å; K163-R167 VanDerWaalsContact O-CB 3.25Å; K163-R167 WeakPolarHBondContact O-CB 3.43Å; K163-R167 PolarHBondContact O-N 3.05Å
164	I	95.1	Very high	94.5	Very high	93 Å²	93	65.1 Å²	65.1	48%	0.477	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-44.3	176.8	-66.4	167.4	0	0	0	110.7	E160 I162 R167 R168	E160-I164 HydrophobicContact CG-CD1 4.01Å; E160-I164 VanDerWaalsContact O-CG1 3.31Å; E160-I164 WeakPolarHBondContact O-CG1 3.33Å; E160-I164 PolarHBondContact O-N 2.99Å; I162-I164 VanDerWaalsContact C-N 3.34Å; I162-I164 PolarHBondContact O-N 3.12Å; I164-R167 PolarHBondContact O-N 2.86Å; I164-R168 WeakPolarHBondContact O-CB 3.41Å; I164-R168 PolarHBondContact O-N 2.95Å
165	T	94.7	Very high	94.6	Very high	14 Å²	14	68.7 Å²	68.7	9%	0.086	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-46.3	-179.8	-56.7	0	0	0	0	111.3	L33 A161 I162 R168 V169	L33-T165 HydrophobicContact CB-CG2 4.49Å; L33-T165 HydrophobicContact CD2-CG2 4.43Å; A161-T165 WeakPolarHBondContact O-CB 3.41Å; A161-T165 PolarHBondContact O-N 3.24Å; A161-T165 PolarHBondContact O-OG1 3.18Å; I162-T165 PolarHBondContact O-N 2.87Å; T165-R168 WeakPolarHBondContact O-CB 3.43Å; T165-R168 PolarHBondContact O-N 2.89Å; T165-V169 WeakPolarHBondContact O-CG2 3.26Å; T165-V169 PolarHBondContact O-N 3.43Å
166	N	94.3	Very high	94.5	Very high	58 Å²	58	69 Å²	69	31%	0.31	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-41.8	176.8	-76.3	-21.5	0	0	0	112	S37 I162 R168 V169 N170	S37-N166 WeakPolarHBondContact CB-OD1 3.44Å; S37-N166 PolarHBondContact OG-OD1 3.31Å; I162-N166 WeakPolarHBondContact CG2-ND2 3.47Å; I162-N166 WeakPolarHBondContact O-CB 3.49Å; I162-N166 PolarHBondContact O-N 3.06Å; N166-R168 VanDerWaalsContact C-N 3.26Å; N166-R168 PolarHBondContact O-N 2.66Å; N166-V169 PolarHBondContact O-N 3.42Å; N166-N170 WeakPolarHBondContact O-CB 3.12Å; N166-N170 VanDerWaalsContact O-CG 3.24Å; N166-N170 PolarHBondContact O-N 2.8Å; N166-N170 PolarHBondContact O-OD1 3.22Å
167	R	95.8	Very high	94.5	Very high	177 Å²	177	65.3 Å²	65.3	67%	0.668	32%	0.318	S	S	*	.	H	α-helix	trans	-58.8	-40.6	173.8	-170.2	-176.3	-59.8	163.1	2	111.4	K163 I164 N170 A171	K163-R167 VanDerWaalsContact O-CB 3.25Å; K163-R167 WeakPolarHBondContact O-CB 3.43Å; K163-R167 PolarHBondContact O-N 3.05Å; I164-R167 PolarHBondContact O-N 2.86Å; R167-N170 PolarHBondContact O-N 3.38Å; R167-A171 WeakPolarHBondContact O-CB 3.27Å; R167-A171 PolarHBondContact O-N 3.06Å
168	R	95.4	Very high	94.6	Very high	164 Å²	164	64.7 Å²	64.7	62%	0.619	32%	0.315	S	S	*	.	H	α-helix	trans	-68.1	-39.9	177.2	-168.7	174.7	-178.8	170.5	0.8	112.4	L33 I164 T165 N166 A171 I172	L33-R168 HydrophobicContact CD1-CB 4.42Å; L33-R168 HydrophobicContact CD1-CG 3.8Å; I164-R168 WeakPolarHBondContact O-CB 3.41Å; I164-R168 PolarHBondContact O-N 2.95Å; T165-R168 WeakPolarHBondContact O-CB 3.43Å; T165-R168 PolarHBondContact O-N 2.89Å; N166-R168 VanDerWaalsContact C-N 3.26Å; N166-R168 PolarHBondContact O-N 2.66Å; R168-A171 PolarHBondContact O-N 2.83Å; R168-I172 HydrophobicContact CG-CD1 4.39Å; R168-I172 VanDerWaalsContact O-CG1 3.31Å; R168-I172 WeakPolarHBondContact O-CG1 3.43Å; R168-I172 PolarHBondContact O-N 3.45Å
169	V	96.4	Very high	94.6	Very high	8 Å²	8	69.2 Å²	69.2	5%	0.048	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-49.3	173.4	172.7	0	0	0	0	110.2	R30 L33 T165 N166 A171 I172 E173	R30-V169 HydrophobicContact CG-CG1 4.18Å; L33-V169 HydrophobicContact CB-CG2 3.58Å; T165-V169 WeakPolarHBondContact O-CG2 3.26Å; T165-V169 PolarHBondContact O-N 3.43Å; N166-V169 PolarHBondContact O-N 3.42Å; V169-A171 VanDerWaalsContact C-N 3.34Å; V169-A171 PolarHBondContact O-N 3.46Å; V169-I172 PolarHBondContact O-N 3.38Å; V169-I172 VanDerWaalsContact O-N 3.09Å; V169-E173 WeakPolarHBondContact O-CB 3.32Å; V169-E173 PolarHBondContact O-N 3.32Å
170	N	95.7	Very high	94.6	Very high	85 Å²	85	67 Å²	67	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-63.4	-38.5	179.5	-65.9	-2.4	0	0	0	112.3	N166 R167 I172 E173 H174	N166-N170 WeakPolarHBondContact O-CB 3.12Å; N166-N170 VanDerWaalsContact O-CG 3.24Å; N166-N170 PolarHBondContact O-N 2.8Å; N166-N170 PolarHBondContact O-OD1 3.22Å; R167-N170 PolarHBondContact O-N 3.38Å; N170-I172 VanDerWaalsContact C-N 3.32Å; N170-I172 PolarHBondContact O-N 3.08Å; N170-E173 PolarHBondContact O-N 3.44Å; N170-H174 PolarHBondContact O-N 3.28Å
171	A	96.1	Very high	94.7	Very high	40 Å²	40	65.6 Å²	65.6	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-38.3	174.5	0	0	0	0	0	111.8	R167 R168 V169 V175 I176	R167-A171 WeakPolarHBondContact O-CB 3.27Å; R167-A171 PolarHBondContact O-N 3.06Å; R168-A171 PolarHBondContact O-N 2.83Å; V169-A171 VanDerWaalsContact C-N 3.34Å; V169-A171 PolarHBondContact O-N 3.46Å; A171-V175 WeakPolarHBondContact O-CA 3.42Å; A171-V175 VanDerWaalsContact O-CB 3.27Å; A171-V175 WeakPolarHBondContact O-CB 3.36Å; A171-V175 PolarHBondContact O-N 3.09Å; A171-V175 VanDerWaalsContact O-N 3.1Å; A171-I176 PolarHBondContact O-N 2.86Å
172	I	95.6	Very high	94.7	Very high	16 Å²	16	69.1 Å²	69.1	8%	0.082	32%	0.324	C	S	.	.	I	π-helix	trans	-66.3	-45.2	175.7	-69	165.5	0	0	0	110.5	A26 R30 L33 R168 V169 N170 I176 I177	A26-I172 HydrophobicContact CB-CG2 4.39Å; R30-I172 HydrophobicContact CB-CG2 3.92Å; R30-I172 HydrophobicContact CG-CG2 4.41Å; L33-I172 HydrophobicContact CD1-CD1 3.7Å; R168-I172 HydrophobicContact CG-CD1 4.39Å; R168-I172 VanDerWaalsContact O-CG1 3.31Å; R168-I172 WeakPolarHBondContact O-CG1 3.43Å; R168-I172 PolarHBondContact O-N 3.45Å; V169-I172 PolarHBondContact O-N 3.38Å; V169-I172 VanDerWaalsContact O-N 3.09Å; N170-I172 VanDerWaalsContact C-N 3.32Å; N170-I172 PolarHBondContact O-N 3.08Å; I172-I176 HydrophobicContact CG1-CD1 3.94Å; I172-I176 PolarHBondContact O-N 3.09Å; I172-I177 HydrophobicContact CG2-CD1 3.87Å; I172-I177 HydrophobicContact CG2-CG1 4.07Å; I172-I177 WeakPolarHBondContact O-CB 3.34Å; I172-I177 VanDerWaalsContact O-CG1 3.31Å; I172-I177 WeakPolarHBondContact O-CG1 3.18Å; I172-I177 PolarHBondContact O-N 3.44Å
173	E	95	Very high	94.6	Very high	71 Å²	71	68.5 Å²	68.5	33%	0.332	32%	0.32	S	S	.	.	I	π-helix	trans	-70.5	-45.7	-175.3	-177.4	154	-140.5	0	0	113.9	R30 V169 N170 P178	R30-E173 IonicContact NH1-OE1 2.76Å; R30-E173 PolarHBondContact NH1-OE1 2.92Å; V169-E173 WeakPolarHBondContact O-CB 3.32Å; V169-E173 PolarHBondContact O-N 3.32Å; N170-E173 PolarHBondContact O-N 3.44Å; E173-P178 WeakPolarHBondContact O-CD 3.44Å; E173-P178 WeakPolarHBondContact O-CG 3.47Å
174	H	94.2	Very high	94.5	Very high	135 Å²	135	64.3 Å²	64.3	63%	0.625	30%	0.303	S	S	*	.	I	π-helix	trans	-100.4	-18.8	-172.6	-63.2	-60.3	0	0	0	114.3	N170	N170-H174 PolarHBondContact O-N 3.28Å
175	V	93.4	Very high	94.4	Very high	81 Å²	81	62.4 Å²	62.4	49%	0.491	30%	0.301	S	S	.	.	I	π-helix	trans	-113.4	-54.2	-177.4	-174.4	0	0	0	0	111.6	A171 R179	A171-V175 WeakPolarHBondContact O-CA 3.42Å; A171-V175 VanDerWaalsContact O-CB 3.27Å; A171-V175 WeakPolarHBondContact O-CB 3.36Å; A171-V175 PolarHBondContact O-N 3.09Å; A171-V175 VanDerWaalsContact O-N 3.1Å; V175-R179 WeakPolarHBondContact O-CB 3.48Å; V175-R179 PolarHBondContact O-N 3.03Å
176	I	93.2	Very high	94.3	Very high	57 Å²	57	64.9 Å²	64.9	29%	0.292	31%	0.309	S	S	.	.	I	π-helix	trans	-77.3	-51	-169.8	-60.9	170.4	0	0	0	111.8	A26 A171 I172 R179 I180	A26-I176 HydrophobicContact CB-CG2 4.46Å; A171-I176 PolarHBondContact O-N 2.86Å; I172-I176 HydrophobicContact CG1-CD1 3.94Å; I172-I176 PolarHBondContact O-N 3.09Å; I176-R179 PolarHBondContact O-N 3.41Å; I176-I180 HydrophobicContact CG2-CD1 3.68Å; I176-I180 HydrophobicContact CG2-CG1 4.42Å; I176-I180 WeakPolarHBondContact O-CG1 3.46Å; I176-I180 PolarHBondContact O-N 3.26Å
177	I	94.4	Very high	94.2	Very high	18 Å²	18	62.1 Å²	62.1	9%	0.092	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-52.3	-179.8	-72.8	170.3	0	0	0	110.4	L23 A26 Q27 I172 R179 I180 E181	L23-I177 HydrophobicContact CD1-CG2 4.18Å; A26-I177 HydrophobicContact CB-CG1 4.09Å; Q27-I177 HydrophobicContact CG-CD1 4.36Å; I172-I177 HydrophobicContact CG2-CD1 3.87Å; I172-I177 HydrophobicContact CG2-CG1 4.07Å; I172-I177 WeakPolarHBondContact O-CB 3.34Å; I172-I177 VanDerWaalsContact O-CG1 3.31Å; I172-I177 WeakPolarHBondContact O-CG1 3.18Å; I172-I177 PolarHBondContact O-N 3.44Å; I177-R179 VanDerWaalsContact C-N 3.28Å; I177-R179 PolarHBondContact O-N 3.46Å; I177-I180 PolarHBondContact O-N 2.99Å; I177-I180 VanDerWaalsContact O-N 3.08Å; I177-E181 HydrophobicContact CG2-CG 4.31Å; I177-E181 WeakPolarHBondContact CG2-OE1 3.42Å; I177-E181 WeakPolarHBondContact O-CG 3.21Å; I177-E181 PolarHBondContact O-N 3.25Å
178	P	94.7	Very high	94.2	Very high	29 Å²	29	56.4 Å²	56.4	19%	0.188	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-34.9	179.1	-27.8	37.8	0	0	0	113.3	E173 E181 R182	E173-P178 WeakPolarHBondContact O-CD 3.44Å; E173-P178 WeakPolarHBondContact O-CG 3.47Å; P178-E181 PolarHBondContact O-N 2.91Å; P178-R182 WeakPolarHBondContact O-CB 3.23Å; P178-R182 WeakPolarHBondContact O-CG 3.24Å; P178-R182 PolarHBondContact O-N 3.21Å
179	R	93	Very high	94.1	Very high	94 Å²	94	52.7 Å²	52.7	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-66.9	-39.3	176.2	-177.5	170.4	64.2	175	1.3	112.1	I7 V175 I176 I177 T183	I7-R179 HydrophobicContact CG1-CG 4.07Å; V175-R179 WeakPolarHBondContact O-CB 3.48Å; V175-R179 PolarHBondContact O-N 3.03Å; I176-R179 PolarHBondContact O-N 3.41Å; I177-R179 VanDerWaalsContact C-N 3.28Å; I177-R179 PolarHBondContact O-N 3.46Å; R179-T183 WeakPolarHBondContact O-CB 3.38Å; R179-T183 PolarHBondContact O-N 2.84Å; R179-T183 VanDerWaalsContact O-N 3.14Å; R179-T183 PolarHBondContact O-OG1 3.38Å
180	I	94.1	Very high	93.9	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-43.8	175.7	-65.5	164.6	0	0	0	110.3	I7 R22 L23 A26 I176 I177 T183 L184	I7-I180 HydrophobicContact CD1-CG1 4.1Å; R22-I180 HydrophobicContact CB-CD1 4.49Å; R22-I180 HydrophobicContact CG-CD1 3.79Å; L23-I180 HydrophobicContact CB-CG2 3.85Å; L23-I180 HydrophobicContact CD1-CB 4.42Å; L23-I180 HydrophobicContact CD1-CG2 4.13Å; A26-I180 HydrophobicContact CB-CD1 4.21Å; I176-I180 HydrophobicContact CG2-CD1 3.68Å; I176-I180 HydrophobicContact CG2-CG1 4.42Å; I176-I180 WeakPolarHBondContact O-CG1 3.46Å; I176-I180 PolarHBondContact O-N 3.26Å; I177-I180 PolarHBondContact O-N 2.99Å; I177-I180 VanDerWaalsContact O-N 3.08Å; I180-T183 WeakPolarHBondContact O-CB 3.22Å; I180-T183 PolarHBondContact O-N 2.71Å; I180-T183 VanDerWaalsContact O-N 3.16Å; I180-L184 WeakPolarHBondContact O-CB 3.45Å; I180-L184 PolarHBondContact O-N 2.99Å
181	E	94.4	Very high	93.8	Very high	91 Å²	91	52.4 Å²	52.4	43%	0.425	27%	0.269	S	S	.	.	H	α-helix	trans	-61.7	-44.7	178.6	-72.3	173.8	170	0	0	112.1	L23 I177 P178 T183 L184 A185	L23-E181 HydrophobicContact CD1-CG 4.03Å; L23-E181 HydrophobicContact CD2-CG 4.43Å; I177-E181 HydrophobicContact CG2-CG 4.31Å; I177-E181 WeakPolarHBondContact CG2-OE1 3.42Å; I177-E181 WeakPolarHBondContact O-CG 3.21Å; I177-E181 PolarHBondContact O-N 3.25Å; P178-E181 PolarHBondContact O-N 2.91Å; E181-T183 VanDerWaalsContact C-N 3.3Å; E181-T183 PolarHBondContact O-N 2.89Å; E181-L184 PolarHBondContact O-N 3.04Å; E181-A185 WeakPolarHBondContact O-CB 3.45Å; E181-A185 PolarHBondContact O-N 3.25Å
182	R	93.1	Very high	93.7	Very high	90 Å²	90	54.3 Å²	54.3	34%	0.34	27%	0.273	S	S	.	.	H	α-helix	trans	-61.1	-37.4	173.2	-74.7	-172.7	-66.2	-101.7	5.4	112.9	D5 R6 P178 Y186	D5-R182 PolarHBondContact O-NE 3.47Å; D5-R182 PolarHBondContact O-NH2 3.32Å; R6-R182 HydrophobicContact CG-CB 4.18Å; P178-R182 WeakPolarHBondContact O-CB 3.23Å; P178-R182 WeakPolarHBondContact O-CG 3.24Å; P178-R182 PolarHBondContact O-N 3.21Å; R182-Y186 WeakPolarHBondContact O-CB 3.28Å; R182-Y186 PolarHBondContact O-N 3.35Å; R182-Y186 VanDerWaalsContact O-N 3.09Å
183	T	92.6	Very high	93.7	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-69	-40.4	176.4	-53.4	0	0	0	0	110.8	I7 I9 M19 R179 I180 E181 Y186 I187	I7-T183 HydrophobicContact CB-CG2 4.14Å; I7-T183 PolarHBondContact N-OG1 3.1Å; I9-T183 HydrophobicContact CG2-CG2 3.77Å; M19-T183 HydrophobicContact CG-CG2 4.3Å; M19-T183 HydrophobicContact SD-CG2 4.2Å; R179-T183 WeakPolarHBondContact O-CB 3.38Å; R179-T183 PolarHBondContact O-N 2.84Å; R179-T183 VanDerWaalsContact O-N 3.14Å; R179-T183 PolarHBondContact O-OG1 3.38Å; I180-T183 WeakPolarHBondContact O-CB 3.22Å; I180-T183 PolarHBondContact O-N 2.71Å; I180-T183 VanDerWaalsContact O-N 3.16Å; E181-T183 VanDerWaalsContact C-N 3.3Å; E181-T183 PolarHBondContact O-N 2.89Å; T183-Y186 WeakPolarHBondContact O-CB 3.28Å; T183-Y186 PolarHBondContact O-N 3.02Å; T183-I187 HydrophobicContact CG2-CD1 4.1Å; T183-I187 VanDerWaalsContact O-CG1 3.3Å; T183-I187 WeakPolarHBondContact O-CG1 3.29Å; T183-I187 PolarHBondContact O-N 3.04Å
184	L	93.1	Very high	93.6	Very high	29 Å²	29	58 Å²	58	15%	0.152	29%	0.286	C	S	.	.	H	α-helix	trans	-67.2	-41.4	178.5	-173.7	143.1	0	0	0	111.5	K20 I180 E181 I187 I188	K20-L184 HydrophobicContact CG-CD1 3.58Å; I180-L184 WeakPolarHBondContact O-CB 3.45Å; I180-L184 PolarHBondContact O-N 2.99Å; E181-L184 PolarHBondContact O-N 3.04Å; L184-I187 PolarHBondContact O-N 3.35Å; L184-I188 HydrophobicContact CD2-CD1 3.53Å; L184-I188 HydrophobicContact CD2-CG1 4.48Å; L184-I188 HydrophobicContact CG-CD1 4.38Å; L184-I188 VanDerWaalsContact O-CG1 3.31Å; L184-I188 WeakPolarHBondContact O-CG1 3.11Å; L184-I188 PolarHBondContact O-N 3.08Å
185	A	93.3	Very high	93.5	Very high	52 Å²	52	55.6 Å²	55.6	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-44.9	172.3	0	0	0	0	0	111.5	E181 I187 I188 T189	E181-A185 WeakPolarHBondContact O-CB 3.45Å; E181-A185 PolarHBondContact O-N 3.25Å; A185-I187 PolarHBondContact O-N 3.15Å; A185-I188 PolarHBondContact O-N 3.1Å; A185-T189 PolarHBondContact O-N 3.43Å; A185-T189 PolarHBondContact O-OG1 3.4Å; A185-T189 VanDerWaalsContact O-OG1 3.11Å
186	Y	93.2	Very high	93.6	Very high	66 Å²	66	58.6 Å²	58.6	26%	0.259	28%	0.278	S	S	.	.	H	α-helix	trans	-59.4	-46.8	175.3	172.1	-115.4	0	0	0	112.7	R6 P11 R182 T183 I188 T189 E190	R6-Y186 VanDerWaalsContact NH1-CG 3.33Å; P11-Y186 HydrophobicContact CG-CD1 4.35Å; P11-Y186 HydrophobicContact CG-CE1 3.58Å; R182-Y186 WeakPolarHBondContact O-CB 3.28Å; R182-Y186 PolarHBondContact O-N 3.35Å; R182-Y186 VanDerWaalsContact O-N 3.09Å; T183-Y186 WeakPolarHBondContact O-CB 3.28Å; T183-Y186 PolarHBondContact O-N 3.02Å; Y186-I188 VanDerWaalsContact C-N 3.3Å; Y186-I188 PolarHBondContact O-N 3.42Å; Y186-T189 PolarHBondContact O-N 3.01Å; Y186-E190 HydrophobicContact CD2-CG 3.81Å; Y186-E190 HydrophobicContact CE1-CG 4.27Å; Y186-E190 HydrophobicContact CE2-CG 3.34Å; Y186-E190 WeakPolarHBondContact CE2-OE1 3.33Å; Y186-E190 HydrophobicContact CG-CG 4.45Å; Y186-E190 WeakPolarHBondContact O-CB 3.42Å; Y186-E190 VanDerWaalsContact O-CG 3.28Å; Y186-E190 WeakPolarHBondContact O-CG 3.47Å; Y186-E190 PolarHBondContact O-N 3.25Å
187	I	92.8	Very high	93.7	Very high	0 Å²	0	61 Å²	61	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.4	-40.4	178.4	-67.1	165.1	0	0	0	111	I9 A15 Q16 M19 T183 L184 A185 L191	I9-I187 HydrophobicContact CG2-CD1 4.02Å; A15-I187 HydrophobicContact CB-CD1 4.15Å; Q16-I187 HydrophobicContact CB-CG2 3.83Å; Q16-I187 HydrophobicContact CG-CG2 4.25Å; M19-I187 HydrophobicContact CB-CD1 4.44Å; M19-I187 HydrophobicContact CG-CD1 3.74Å; T183-I187 HydrophobicContact CG2-CD1 4.1Å; T183-I187 VanDerWaalsContact O-CG1 3.3Å; T183-I187 WeakPolarHBondContact O-CG1 3.29Å; T183-I187 PolarHBondContact O-N 3.04Å; L184-I187 PolarHBondContact O-N 3.35Å; A185-I187 PolarHBondContact O-N 3.15Å; I187-L191 HydrophobicContact CG2-CD1 3.79Å; I187-L191 HydrophobicContact CG2-CG 4.26Å; I187-L191 WeakPolarHBondContact O-CB 3.46Å; I187-L191 VanDerWaalsContact O-CG 3.22Å; I187-L191 WeakPolarHBondContact O-CG 3.42Å; I187-L191 PolarHBondContact O-N 2.82Å
188	I	93.9	Very high	93.6	Very high	57 Å²	57	65.1 Å²	65.1	29%	0.292	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-50.9	178	-68.8	169.2	0	0	0	110.2	L184 A185 Y186 E190 L191 D192	L184-I188 HydrophobicContact CD2-CD1 3.53Å; L184-I188 HydrophobicContact CD2-CG1 4.48Å; L184-I188 HydrophobicContact CG-CD1 4.38Å; L184-I188 VanDerWaalsContact O-CG1 3.31Å; L184-I188 WeakPolarHBondContact O-CG1 3.11Å; L184-I188 PolarHBondContact O-N 3.08Å; A185-I188 PolarHBondContact O-N 3.1Å; Y186-I188 VanDerWaalsContact C-N 3.3Å; Y186-I188 PolarHBondContact O-N 3.42Å; I188-E190 VanDerWaalsContact C-N 3.3Å; I188-E190 PolarHBondContact O-N 3.44Å; I188-L191 PolarHBondContact O-N 3.22Å; I188-D192 WeakPolarHBondContact O-CB 3.38Å; I188-D192 PolarHBondContact O-N 2.9Å
189	T	94.1	Very high	93.6	Very high	87 Å²	87	70.6 Å²	70.6	53%	0.534	33%	0.328	S	S	.	.	H	α-helix	trans	-58.4	-40.8	179.4	-55.4	0	0	0	0	112.6	A185 Y186 D192 E193	A185-T189 PolarHBondContact O-N 3.43Å; A185-T189 PolarHBondContact O-OG1 3.4Å; A185-T189 VanDerWaalsContact O-OG1 3.11Å; Y186-T189 PolarHBondContact O-N 3.01Å; T189-D192 PolarHBondContact O-N 3.18Å; T189-E193 PolarHBondContact O-N 3.22Å
190	E	92.9	Very high	93.7	Very high	67 Å²	67	72.8 Å²	72.8	31%	0.313	34%	0.337	S	S	.	.	H	α-helix	trans	-71.1	-35.6	178.5	-70.8	-77.5	154.3	0	0	113.1	P11 Y186 I188 R194	P11-E190 HydrophobicContact CB-CB 3.58Å; P11-E190 HydrophobicContact CB-CG 4.17Å; P11-E190 HydrophobicContact CG-CB 3.75Å; P11-E190 HydrophobicContact CG-CG 3.75Å; Y186-E190 HydrophobicContact CD2-CG 3.81Å; Y186-E190 HydrophobicContact CE1-CG 4.27Å; Y186-E190 HydrophobicContact CE2-CG 3.34Å; Y186-E190 WeakPolarHBondContact CE2-OE1 3.33Å; Y186-E190 HydrophobicContact CG-CG 4.45Å; Y186-E190 WeakPolarHBondContact O-CB 3.42Å; Y186-E190 VanDerWaalsContact O-CG 3.28Å; Y186-E190 WeakPolarHBondContact O-CG 3.47Å; Y186-E190 PolarHBondContact O-N 3.25Å; I188-E190 VanDerWaalsContact C-N 3.3Å; I188-E190 PolarHBondContact O-N 3.44Å; E190-R194 WeakPolarHBondContact O-CG 3.28Å; E190-R194 PolarHBondContact O-N 2.87Å; E190-R194 VanDerWaalsContact O-N 3.11Å
191	L	93.3	Very high	93.7	Very high	20 Å²	20	79.6 Å²	79.6	11%	0.105	36%	0.362	C	S	.	.	H	α-helix	trans	-67.7	-43.2	173.8	-73.3	174	0	0	0	110.8	R13 I187 I188 E193 R194 E195	R13-L191 HydrophobicContact CG-CD1 4.13Å; R13-L191 HydrophobicContact CG-CD2 4.21Å; I187-L191 HydrophobicContact CG2-CD1 3.79Å; I187-L191 HydrophobicContact CG2-CG 4.26Å; I187-L191 WeakPolarHBondContact O-CB 3.46Å; I187-L191 VanDerWaalsContact O-CG 3.22Å; I187-L191 WeakPolarHBondContact O-CG 3.42Å; I187-L191 PolarHBondContact O-N 2.82Å; I188-L191 PolarHBondContact O-N 3.22Å; L191-E193 VanDerWaalsContact C-N 3.3Å; L191-E193 PolarHBondContact O-N 2.82Å; L191-R194 PolarHBondContact O-N 2.88Å; L191-E195 WeakPolarHBondContact O-CG 3.32Å; L191-E195 PolarHBondContact O-N 2.99Å
192	D	94.8	Very high	93.8	Very high	79 Å²	79	80.2 Å²	80.2	42%	0.422	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-37.5	177	-65.6	-15	0	0	0	111.5	I188 T189 E195 R196	I188-D192 WeakPolarHBondContact O-CB 3.38Å; I188-D192 PolarHBondContact O-N 2.9Å; T189-D192 PolarHBondContact O-N 3.18Å; D192-E195 PolarHBondContact O-N 3.14Å; D192-R196 WeakPolarHBondContact O-CB 3.07Å; D192-R196 PolarHBondContact O-N 2.87Å
193	E	94.1	Very high	93.9	Very high	74 Å²	74	81.9 Å²	81.9	35%	0.346	38%	0.378	S	S	.	.	H	α-helix	trans	-67.5	-42.9	176.2	-159.3	62.5	-131.7	0	0	111.8	T189 L191 E195 R196 E197	T189-E193 PolarHBondContact O-N 3.22Å; L191-E193 VanDerWaalsContact C-N 3.3Å; L191-E193 PolarHBondContact O-N 2.82Å; E193-E195 PolarHBondContact O-N 3.24Å; E193-R196 WeakPolarHBondContact O-CB 3.25Å; E193-R196 PolarHBondContact O-N 3.47Å; E193-R196 IonicContact OE1-CZ 3.92Å; E193-R196 IonicContact OE1-NH1 2.61Å; E193-R196 PolarHBondContact OE1-NH1 3.49Å; E193-R196 IonicContact OE2-CZ 3.75Å; E193-R196 IonicContact OE2-NH1 2.66Å; E193-R196 PolarHBondContact OE2-NH1 3.22Å; E193-E197 WeakPolarHBondContact O-CG 3.27Å; E193-E197 PolarHBondContact O-N 2.98Å
194	R	93.2	Very high	93.9	Very high	91 Å²	91	85.7 Å²	85.7	34%	0.343	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-41	174.6	-72.4	-173.8	-171.9	-168.5	7.7	112.5	E190 L191 R196 E197 E198	E190-R194 WeakPolarHBondContact O-CG 3.28Å; E190-R194 PolarHBondContact O-N 2.87Å; E190-R194 VanDerWaalsContact O-N 3.11Å; L191-R194 PolarHBondContact O-N 2.88Å; R194-R196 VanDerWaalsContact C-N 3.29Å; R194-R196 PolarHBondContact O-N 3.46Å; R194-E197 PolarHBondContact O-N 3.44Å; R194-E198 WeakPolarHBondContact O-CB 3.41Å; R194-E198 WeakPolarHBondContact O-CG 3.34Å; R194-E198 PolarHBondContact O-N 3.34Å
195	E	93.2	Very high	94	Very high	84 Å²	84	88.5 Å²	88.5	39%	0.393	41%	0.409	S	S	.	.	H	α-helix	trans	-63.5	-37.4	174.9	-73.2	-177.4	-175.7	0	0	111	R13 L191 D192 E193 E198 F199	R13-E195 IonicContact CZ-OE1 3.25Å; R13-E195 IonicContact NE-OE1 3.64Å; R13-E195 IonicContact NH2-OE1 2.81Å; R13-E195 PolarHBondContact NH2-OE1 2.9Å; L191-E195 WeakPolarHBondContact O-CG 3.32Å; L191-E195 PolarHBondContact O-N 2.99Å; D192-E195 PolarHBondContact O-N 3.14Å; E193-E195 PolarHBondContact O-N 3.24Å; E195-E198 PolarHBondContact O-N 3.45Å; E195-F199 VanDerWaalsContact O-CB 3.27Å; E195-F199 WeakPolarHBondContact O-CB 3.2Å; E195-F199 PolarHBondContact O-N 3.36Å
196	R	94.3	Very high	93.9	Very high	145 Å²	145	92.7 Å²	92.7	55%	0.547	42%	0.419	S	S	.	.	H	α-helix	trans	-65.4	-43.5	174	-169	-177.1	-62.9	141.2	5.5	112.4	D192 E193 R194 F199 Y200	D192-R196 WeakPolarHBondContact O-CB 3.07Å; D192-R196 PolarHBondContact O-N 2.87Å; E193-R196 WeakPolarHBondContact O-CB 3.25Å; E193-R196 PolarHBondContact O-N 3.47Å; E193-R196 IonicContact OE1-CZ 3.92Å; E193-R196 IonicContact OE1-NH1 2.61Å; E193-R196 PolarHBondContact OE1-NH1 3.49Å; E193-R196 IonicContact OE2-CZ 3.75Å; E193-R196 IonicContact OE2-NH1 2.66Å; E193-R196 PolarHBondContact OE2-NH1 3.22Å; R194-R196 VanDerWaalsContact C-N 3.29Å; R194-R196 PolarHBondContact O-N 3.46Å; R196-F199 PolarHBondContact O-N 3.03Å; R196-Y200 PolarHBondContact O-N 3.16Å
197	E	94.6	Very high	94	Very high	107 Å²	107	93.7 Å²	93.7	50%	0.5	43%	0.427	S	S	.	.	H	α-helix	trans	-63.3	-43.2	175.8	-72.3	178.2	-179.1	0	0	112.1	E193 R194 Y200 R201	E193-E197 WeakPolarHBondContact O-CG 3.27Å; E193-E197 PolarHBondContact O-N 2.98Å; R194-E197 PolarHBondContact O-N 3.44Å; E197-Y200 PolarHBondContact O-N 3.48Å; E197-R201 WeakPolarHBondContact O-CG 3.32Å; E197-R201 PolarHBondContact O-N 3.18Å
198	E	93.5	Very high	94	Very high	105 Å²	105	100.6 Å²	100.6	49%	0.491	46%	0.456	S	S	.	.	H	α-helix	trans	-62.2	-45.4	173.8	-76.9	179.7	-174.7	0	0	111.9	R194 E195 Y200 R201 L202	R194-E198 WeakPolarHBondContact O-CB 3.41Å; R194-E198 WeakPolarHBondContact O-CG 3.34Å; R194-E198 PolarHBondContact O-N 3.34Å; E195-E198 PolarHBondContact O-N 3.45Å; E198-Y200 VanDerWaalsContact C-N 3.35Å; E198-Y200 PolarHBondContact O-N 3.38Å; E198-R201 PolarHBondContact O-N 3.25Å; E198-L202 WeakPolarHBondContact O-CG 3.48Å; E198-L202 PolarHBondContact O-N 3.14Å
199	F	94.8	Very high	94	Very high	143 Å²	143	104.7 Å²	104.7	63%	0.627	47%	0.472	S	S	*	.	H	α-helix	trans	-60.1	-43.6	176.3	-176.5	-97.5	0	0	0	112	E195 R196 L202 K203	E195-F199 VanDerWaalsContact O-CB 3.27Å; E195-F199 WeakPolarHBondContact O-CB 3.2Å; E195-F199 PolarHBondContact O-N 3.36Å; R196-F199 PolarHBondContact O-N 3.03Å; F199-L202 PolarHBondContact O-N 3.41Å; F199-K203 WeakPolarHBondContact O-CB 3.46Å; F199-K203 PolarHBondContact O-N 3.49Å
200	Y	95.1	Very high	93.9	Very high	141 Å²	141	107 Å²	107	55%	0.553	48%	0.475	S	S	*	.	H	α-helix	trans	-62.6	-43.3	176	-176.8	-94.5	0	0	0	112.1	R196 E197 E198 K203 K204	R196-Y200 PolarHBondContact O-N 3.16Å; E197-Y200 PolarHBondContact O-N 3.48Å; E198-Y200 VanDerWaalsContact C-N 3.35Å; E198-Y200 PolarHBondContact O-N 3.38Å; Y200-K203 PolarHBondContact O-N 2.92Å; Y200-K204 HydrophobicContact CD1-CG 4.27Å; Y200-K204 HydrophobicContact CE1-CG 3.82Å; Y200-K204 PolarHBondContact O-N 3.18Å; Y200-K204 VanDerWaalsContact OH-CE 3.25Å; Y200-K204 WeakPolarHBondContact OH-CE 3.4Å
201	R	94.2	Very high	93.8	Very high	143 Å²	143	107.4 Å²	107.4	54%	0.54	48%	0.478	S	S	.	.	H	α-helix	trans	-60.8	-45.7	175.6	-74.9	-175.5	-70.5	-175.5	0.1	111.7	E197 E198 K204 I205	E197-R201 WeakPolarHBondContact O-CG 3.32Å; E197-R201 PolarHBondContact O-N 3.18Å; E198-R201 PolarHBondContact O-N 3.25Å; R201-K204 PolarHBondContact O-N 2.74Å; R201-I205 VanDerWaalsContact O-CG1 3.32Å; R201-I205 WeakPolarHBondContact O-CG1 3.39Å; R201-I205 PolarHBondContact O-N 2.86Å
202	L	94.8	Very high	93.7	Very high	104 Å²	104	112 Å²	112	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-62.8	-43.2	176.8	-71.3	174.4	0	0	0	112.1	E198 F199 K204 I205 Q206	E198-L202 WeakPolarHBondContact O-CG 3.48Å; E198-L202 PolarHBondContact O-N 3.14Å; F199-L202 PolarHBondContact O-N 3.41Å; L202-K204 VanDerWaalsContact C-N 3.33Å; L202-K204 PolarHBondContact O-N 3.44Å; L202-I205 PolarHBondContact O-N 2.93Å; L202-Q206 WeakPolarHBondContact O-CG 3.4Å; L202-Q206 PolarHBondContact O-N 3.39Å
203	K	95.5	Very high	93.4	Very high	126 Å²	126	114.3 Å²	114.3	55%	0.548	51%	0.509	S	S	.	.	H	α-helix	trans	-57.9	-44.7	175.1	-175.1	178.2	-179.3	178.3	0	111.5	F199 Y200 Q206 E207	F199-K203 WeakPolarHBondContact O-CB 3.46Å; F199-K203 PolarHBondContact O-N 3.49Å; Y200-K203 PolarHBondContact O-N 2.92Å; K203-Q206 PolarHBondContact O-N 3.35Å; K203-E207 WeakPolarHBondContact O-CB 3.24Å; K203-E207 PolarHBondContact O-N 3.05Å
204	K	94.2	Very high	93.2	Very high	79 Å²	79	114.5 Å²	114.5	34%	0.343	51%	0.509	S	S	.	.	H	α-helix	trans	-66.8	-35.9	177.1	-75.5	-72.4	167.4	-158.5	0	113.1	Y200 R201 L202 E207 K208	Y200-K204 HydrophobicContact CD1-CG 4.27Å; Y200-K204 HydrophobicContact CE1-CG 3.82Å; Y200-K204 PolarHBondContact O-N 3.18Å; Y200-K204 VanDerWaalsContact OH-CE 3.25Å; Y200-K204 WeakPolarHBondContact OH-CE 3.4Å; R201-K204 PolarHBondContact O-N 2.74Å; L202-K204 VanDerWaalsContact C-N 3.33Å; L202-K204 PolarHBondContact O-N 3.44Å; K204-E207 WeakPolarHBondContact CD-OE2 3.36Å; K204-E207 IonicContact NZ-OE1 2.84Å; K204-E207 IonicContact NZ-OE2 2.66Å; K204-E207 PolarHBondContact NZ-OE2 3.04Å; K204-K208 WeakPolarHBondContact O-CG 3.42Å; K204-K208 PolarHBondContact O-N 3.42Å
205	I	93.7	Very high	93	Very high	89 Å²	89	116.9 Å²	116.9	46%	0.456	52%	0.522	S	S	.	.	H	α-helix	trans	-66.3	-43	174.2	-68.4	165.3	0	0	0	110.7	R201 L202 K208 K209	R201-I205 VanDerWaalsContact O-CG1 3.32Å; R201-I205 WeakPolarHBondContact O-CG1 3.39Å; R201-I205 PolarHBondContact O-N 2.86Å; L202-I205 PolarHBondContact O-N 2.93Å; I205-K208 PolarHBondContact O-N 3.17Å; I205-K209 WeakPolarHBondContact O-CG 3.44Å; I205-K209 PolarHBondContact O-N 3.04Å
206	Q	92.7	Very high	92.5	Very high	139 Å²	139	116 Å²	116	65%	0.65	53%	0.526	S	S	*	.	H	α-helix	trans	-63.2	-42.6	175.4	-73.8	-179.2	-8.2	0	0	112	L202 K203 K209 K210	L202-Q206 WeakPolarHBondContact O-CG 3.4Å; L202-Q206 PolarHBondContact O-N 3.39Å; K203-Q206 PolarHBondContact O-N 3.35Å; Q206-K209 PolarHBondContact O-N 3.49Å; Q206-K210 WeakPolarHBondContact O-CB 3.46Å; Q206-K210 PolarHBondContact O-N 2.7Å
207	E	93.7	Very high	91.9	Very high	88 Å²	88	113.5 Å²	113.5	41%	0.411	52%	0.52	S	S	.	.	H	α-helix	trans	-59.7	-46	174.7	-172.3	175	-163	0	0	111.3	K203 K204 K209 K210 I211	K203-E207 WeakPolarHBondContact O-CB 3.24Å; K203-E207 PolarHBondContact O-N 3.05Å; K204-E207 WeakPolarHBondContact CD-OE2 3.36Å; K204-E207 IonicContact NZ-OE1 2.84Å; K204-E207 IonicContact NZ-OE2 2.66Å; K204-E207 PolarHBondContact NZ-OE2 3.04Å; E207-K209 PolarHBondContact O-N 3.29Å; E207-K210 PolarHBondContact O-N 2.82Å; E207-I211 HydrophobicContact CG-CD1 4.22Å; E207-I211 VanDerWaalsContact O-CG1 3.3Å; E207-I211 WeakPolarHBondContact O-CG1 3.23Å; E207-I211 PolarHBondContact O-N 3.44Å
208	K	93.7	Very high	91.4	Very high	144 Å²	144	114.4 Å²	114.4	63%	0.626	52%	0.522	S	S	*	.	H	α-helix	trans	-61.7	-43	174.3	-74.5	-178.6	179.8	-173.1	0	112.6	K204 I205 K210 I211 L212	K204-K208 WeakPolarHBondContact O-CG 3.42Å; K204-K208 PolarHBondContact O-N 3.42Å; I205-K208 PolarHBondContact O-N 3.17Å; K208-K210 VanDerWaalsContact C-N 3.33Å; K208-I211 PolarHBondContact O-N 2.93Å; K208-L212 WeakPolarHBondContact O-CB 3.34Å; K208-L212 WeakPolarHBondContact O-CD1 3.42Å; K208-L212 WeakPolarHBondContact O-CG 3.42Å; K208-L212 PolarHBondContact O-N 2.99Å
209	K	92.8	Very high	90.7	Very high	144 Å²	144	112.8 Å²	112.8	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-39.4	175.8	-77.8	-173.3	176.3	-171.5	0	111.9	I205 Q206 E207 L212 K213	I205-K209 WeakPolarHBondContact O-CG 3.44Å; I205-K209 PolarHBondContact O-N 3.04Å; Q206-K209 PolarHBondContact O-N 3.49Å; E207-K209 PolarHBondContact O-N 3.29Å; K209-L212 PolarHBondContact O-N 3.22Å; K209-K213 WeakPolarHBondContact O-CB 3.47Å; K209-K213 PolarHBondContact O-N 2.93Å
210	K	92.3	Very high	89.9	Confident	135 Å²	135	109.9 Å²	109.9	59%	0.587	51%	0.508	S	S	*	.	H	α-helix	trans	-64.1	-47	175.4	-169.9	-175.2	179.9	-161.2	0	111.3	Q206 E207 K208 L212 K213 E214	Q206-K210 WeakPolarHBondContact O-CB 3.46Å; Q206-K210 PolarHBondContact O-N 2.7Å; E207-K210 PolarHBondContact O-N 2.82Å; K208-K210 VanDerWaalsContact C-N 3.33Å; K210-L212 VanDerWaalsContact C-N 3.33Å; K210-L212 PolarHBondContact O-N 3.18Å; K210-K213 PolarHBondContact O-N 3.2Å; K210-E214 WeakPolarHBondContact CE-OE1 3.35Å; K210-E214 IonicContact NZ-OE1 3.6Å; K210-E214 WeakPolarHBondContact O-CG 3.42Å; K210-E214 PolarHBondContact O-N 3.23Å
211	I	91.3	Very high	89	Confident	75 Å²	75	109 Å²	109	39%	0.385	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-41.6	176.2	-66.3	163.5	0	0	0	111.3	E207 K208 K215	E207-I211 HydrophobicContact CG-CD1 4.22Å; E207-I211 VanDerWaalsContact O-CG1 3.3Å; E207-I211 WeakPolarHBondContact O-CG1 3.23Å; E207-I211 PolarHBondContact O-N 3.44Å; K208-I211 PolarHBondContact O-N 2.93Å; I211-K215 HydrophobicContact CG2-CD 4.19Å; I211-K215 WeakPolarHBondContact O-CB 3.45Å; I211-K215 VanDerWaalsContact O-CG 3.3Å; I211-K215 WeakPolarHBondContact O-CG 3.3Å; I211-K215 PolarHBondContact O-N 2.96Å
212	L	90.5	Very high	88.1	Confident	117 Å²	117	108.5 Å²	108.5	61%	0.613	51%	0.513	S	S	*	.	H	α-helix	trans	-62.6	-42.8	175.4	-82.1	154.9	0	0	0	111.6	K208 K209 K210 K215 S216	K208-L212 WeakPolarHBondContact O-CB 3.34Å; K208-L212 WeakPolarHBondContact O-CD1 3.42Å; K208-L212 WeakPolarHBondContact O-CG 3.42Å; K208-L212 PolarHBondContact O-N 2.99Å; K209-L212 PolarHBondContact O-N 3.22Å; K210-L212 VanDerWaalsContact C-N 3.33Å; K210-L212 PolarHBondContact O-N 3.18Å; L212-K215 PolarHBondContact O-N 3.09Å; L212-S216 PolarHBondContact O-N 3.24Å; L212-S216 PolarHBondContact O-OG 3.3Å
213	K	89.2	Confident	86.9	Confident	128 Å²	128	109.9 Å²	109.9	56%	0.557	51%	0.51	S	S	*	.	H	α-helix	trans	-64.3	-46.3	177.2	-167.9	-179.6	178.5	-167.1	0	112	K209 K210 K215 S216 E217	K209-K213 WeakPolarHBondContact O-CB 3.47Å; K209-K213 PolarHBondContact O-N 2.93Å; K210-K213 PolarHBondContact O-N 3.2Å; K213-K215 VanDerWaalsContact C-N 3.31Å; K213-K215 PolarHBondContact O-N 3.47Å; K213-S216 WeakPolarHBondContact CA-OG 3.28Å; K213-S216 PolarHBondContact O-N 3.37Å; K213-S216 PolarHBondContact O-OG 3.4Å; K213-E217 WeakPolarHBondContact CE-OE1 3.31Å; K213-E217 IonicContact NZ-OE1 3.95Å; K213-E217 WeakPolarHBondContact O-CB 3.28Å; K213-E217 WeakPolarHBondContact O-CG 3.15Å; K213-E217 PolarHBondContact O-N 3.07Å
214	E	89.7	Confident	85.5	Confident	77 Å²	77	110.3 Å²	110.3	36%	0.36	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-36.5	175.4	-72	174.1	-170.9	0	0	112	K210 K218	K210-E214 WeakPolarHBondContact CE-OE1 3.35Å; K210-E214 IonicContact NZ-OE1 3.6Å; K210-E214 WeakPolarHBondContact O-CG 3.42Å; K210-E214 PolarHBondContact O-N 3.23Å; E214-K218 WeakPolarHBondContact O-CB 3.47Å; E214-K218 VanDerWaalsContact O-CG 3.27Å; E214-K218 WeakPolarHBondContact O-CG 3.46Å; E214-K218 PolarHBondContact O-N 3.38Å
215	K	88.5	Confident	84.3	Confident	141 Å²	141	110.9 Å²	110.9	61%	0.613	53%	0.528	S	S	*	.	H	α-helix	trans	-68.2	-41.6	174.1	-78.4	178.2	175.4	-172.7	0	112.2	I211 L212 K213 K218 D219	I211-K215 HydrophobicContact CG2-CD 4.19Å; I211-K215 WeakPolarHBondContact O-CB 3.45Å; I211-K215 VanDerWaalsContact O-CG 3.3Å; I211-K215 WeakPolarHBondContact O-CG 3.3Å; I211-K215 PolarHBondContact O-N 2.96Å; L212-K215 PolarHBondContact O-N 3.09Å; K213-K215 VanDerWaalsContact C-N 3.31Å; K213-K215 PolarHBondContact O-N 3.47Å; K215-K218 PolarHBondContact O-N 3Å; K215-D219 WeakPolarHBondContact O-CB 3.38Å; K215-D219 PolarHBondContact O-N 3.26Å
216	S	83	Confident	82.9	Confident	67 Å²	67	110 Å²	110	47%	0.469	53%	0.534	S	S	.	.	H	α-helix	trans	-67.7	-36.2	176	56.2	0	0	0	0	112.4	L212 K213 L220	L212-S216 PolarHBondContact O-N 3.24Å; L212-S216 PolarHBondContact O-OG 3.3Å; K213-S216 WeakPolarHBondContact CA-OG 3.28Å; K213-S216 PolarHBondContact O-N 3.37Å; K213-S216 PolarHBondContact O-OG 3.4Å; S216-L220 VanDerWaalsContact O-CB 3.23Å; S216-L220 WeakPolarHBondContact O-CB 3.13Å; S216-L220 PolarHBondContact O-N 3.33Å
217	E	83.1	Confident	81.2	Confident	91 Å²	91	106.5 Å²	106.5	43%	0.425	54%	0.536	S	S	.	.	H	α-helix	trans	-66.1	-43.5	174.7	-74.8	170.6	179.2	0	0	110.7	K213 L220 E221	K213-E217 WeakPolarHBondContact CE-OE1 3.31Å; K213-E217 IonicContact NZ-OE1 3.95Å; K213-E217 WeakPolarHBondContact O-CB 3.28Å; K213-E217 WeakPolarHBondContact O-CG 3.15Å; K213-E217 PolarHBondContact O-N 3.07Å; E217-L220 PolarHBondContact O-N 3.38Å; E217-E221 WeakPolarHBondContact O-CB 3.49Å; E217-E221 WeakPolarHBondContact O-CG 3.39Å; E217-E221 PolarHBondContact O-N 2.84Å
218	K	82.7	Confident	79.4	Confident	126 Å²	126	110 Å²	110	55%	0.548	55%	0.552	S	S	.	*	H	α-helix	trans	-64.8	-40.4	174.5	-73.6	175.4	-177.2	-178.6	0	113.5	E214 K215 L220 E221 Q222	E214-K218 WeakPolarHBondContact O-CB 3.47Å; E214-K218 VanDerWaalsContact O-CG 3.27Å; E214-K218 WeakPolarHBondContact O-CG 3.46Å; E214-K218 PolarHBondContact O-N 3.38Å; K215-K218 PolarHBondContact O-N 3Å; K218-L220 VanDerWaalsContact C-N 3.33Å; K218-E221 PolarHBondContact O-N 3.44Å; K218-Q222 WeakPolarHBondContact O-CB 3.39Å; K218-Q222 VanDerWaalsContact O-CG 3.26Å; K218-Q222 WeakPolarHBondContact O-CG 3.47Å; K218-Q222 PolarHBondContact O-N 2.9Å
219	D	80	Confident	77.3	Confident	71 Å²	71	105.4 Å²	105.4	38%	0.38	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-40	174.8	-173	46.6	0	0	0	110.5	K215 Q222 R223	K215-D219 WeakPolarHBondContact O-CB 3.38Å; K215-D219 PolarHBondContact O-N 3.26Å; D219-Q222 PolarHBondContact O-N 3.49Å; D219-R223 WeakPolarHBondContact O-CB 3.41Å; D219-R223 VanDerWaalsContact O-CG 3.26Å; D219-R223 WeakPolarHBondContact O-CG 3.32Å; D219-R223 PolarHBondContact O-N 2.98Å; D219-R223 IonicContact OD1-NE 3.37Å; D219-R223 IonicContact OD2-CZ 3.96Å; D219-R223 IonicContact OD2-NE 3.54Å; D219-R223 PolarHBondContact OD2-NE 3.33Å; D219-R223 IonicContact OD2-NH2 3.87Å; D219-R223 PolarHBondContact OD2-NH2 3.17Å
220	L	76.2	Confident	75.3	Confident	82 Å²	82	106.6 Å²	106.6	43%	0.429	55%	0.548	S	S	.	.	H	α-helix	trans	-67.7	-39.4	176.5	-166.1	144.7	0	0	0	112	S216 E217 K218 R224	S216-L220 VanDerWaalsContact O-CB 3.23Å; S216-L220 WeakPolarHBondContact O-CB 3.13Å; S216-L220 PolarHBondContact O-N 3.33Å; E217-L220 PolarHBondContact O-N 3.38Å; K218-L220 VanDerWaalsContact C-N 3.33Å; L220-R224 HydrophobicContact CD2-CG 4.31Å; L220-R224 WeakPolarHBondContact O-CB 3.37Å; L220-R224 VanDerWaalsContact O-CG 3.31Å; L220-R224 WeakPolarHBondContact O-CG 3.45Å; L220-R224 PolarHBondContact O-N 3.3Å
221	E	76.4	Confident	73.5	Confident	123 Å²	123	106.4 Å²	106.4	58%	0.575	55%	0.549	S	S	*	.	H	α-helix	trans	-64.8	-41.1	171.9	-76.9	176.6	177.2	0	0	112.2	E217 K218 R224 A225	E217-E221 WeakPolarHBondContact O-CB 3.49Å; E217-E221 WeakPolarHBondContact O-CG 3.39Å; E217-E221 PolarHBondContact O-N 2.84Å; K218-E221 PolarHBondContact O-N 3.44Å; E221-R224 PolarHBondContact O-N 3.32Å; E221-A225 WeakPolarHBondContact O-CB 3.32Å; E221-A225 PolarHBondContact O-N 3.1Å
222	Q	76.2	Confident	71.7	Confident	133 Å²	133	108.2 Å²	108.2	62%	0.621	57%	0.566	S	S	*	*	H	α-helix	trans	-65.8	-42.2	176	-77	178.2	1.2	0	0	111.8	K218 D219 A225 A226	K218-Q222 WeakPolarHBondContact O-CB 3.39Å; K218-Q222 VanDerWaalsContact O-CG 3.26Å; K218-Q222 WeakPolarHBondContact O-CG 3.47Å; K218-Q222 PolarHBondContact O-N 2.9Å; D219-Q222 PolarHBondContact O-N 3.49Å; Q222-A225 PolarHBondContact O-N 3.43Å; Q222-A226 VanDerWaalsContact O-CB 3.3Å; Q222-A226 WeakPolarHBondContact O-CB 3.33Å; Q222-A226 PolarHBondContact O-N 2.6Å
223	R	68.6	Low	69.6	Low	132 Å²	132	106 Å²	106	50%	0.498	56%	0.564	S	S	.	*	H	α-helix	trans	-68.1	-34.3	174.8	-67.4	178.1	-174.4	-156	-1.4	112.3	D219 A226 G227 E228 V229	D219-R223 WeakPolarHBondContact O-CB 3.41Å; D219-R223 VanDerWaalsContact O-CG 3.26Å; D219-R223 WeakPolarHBondContact O-CG 3.32Å; D219-R223 PolarHBondContact O-N 2.98Å; D219-R223 IonicContact OD1-NE 3.37Å; D219-R223 IonicContact OD2-CZ 3.96Å; D219-R223 IonicContact OD2-NE 3.54Å; D219-R223 PolarHBondContact OD2-NE 3.33Å; D219-R223 IonicContact OD2-NH2 3.87Å; D219-R223 PolarHBondContact OD2-NH2 3.17Å; R223-A226 PolarHBondContact O-N 3.2Å; R223-G227 PolarHBondContact O-N 3.33Å; R223-E228 PolarHBondContact O-N 2.94Å; R223-E228 VanDerWaalsContact O-N 3.1Å; R223-V229 HydrophobicContact CB-CG2 3.33Å
224	R	66.4	Low	67.7	Low	136 Å²	136	106.1 Å²	106.1	51%	0.513	57%	0.571	S	S	.	*	H	α-helix	trans	-63.6	-43.9	170.3	-81.3	-179.1	178.7	-177.4	-2.5	111.5	L220 E221 G227 V229 E231	L220-R224 HydrophobicContact CD2-CG 4.31Å; L220-R224 WeakPolarHBondContact O-CB 3.37Å; L220-R224 VanDerWaalsContact O-CG 3.31Å; L220-R224 WeakPolarHBondContact O-CG 3.45Å; L220-R224 PolarHBondContact O-N 3.3Å; E221-R224 PolarHBondContact O-N 3.32Å; R224-G227 PolarHBondContact O-N 3.47Å; R224-V229 HydrophobicContact CG-CB 3.99Å; R224-V229 HydrophobicContact CG-CG1 4.29Å; R224-V229 HydrophobicContact CG-CG2 4.25Å; R224-E231 IonicContact CZ-OE1 2.74Å; R224-E231 IonicContact NH2-OE1 3.05Å
225	A	68.6	Low	65.9	Low	91 Å²	91	110.6 Å²	110.6	75%	0.752	60%	0.597	S	S	*	*	H	α-helix	trans	-69.9	-30.8	177.7	0	0	0	0	0	113.2	E221 Q222 G227	E221-A225 WeakPolarHBondContact O-CB 3.32Å; E221-A225 PolarHBondContact O-N 3.1Å; Q222-A225 PolarHBondContact O-N 3.43Å; A225-G227 PolarHBondContact O-N 2.94Å
226	A	65.3	Low	64.3	Low	70 Å²	70	112.4 Å²	112.4	58%	0.579	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-2.4	173.9	0	0	0	0	0	113.5	Q222 R223 E228	Q222-A226 VanDerWaalsContact O-CB 3.3Å; Q222-A226 WeakPolarHBondContact O-CB 3.33Å; Q222-A226 PolarHBondContact O-N 2.6Å; R223-A226 PolarHBondContact O-N 3.2Å; A226-E228 VanDerWaalsContact C-N 3.31Å; A226-E228 PolarHBondContact O-N 3.08Å
227	G	56.5	Low	63	Low	66 Å²	66	112.9 Å²	112.9	68%	0.68	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.1	14.3	176.1	0	0	0	0	0	115.3	R223 R224 A225	R223-G227 PolarHBondContact O-N 3.33Å; R224-G227 PolarHBondContact O-N 3.47Å; A225-G227 PolarHBondContact O-N 2.94Å
228	E	56.1	Low	61.4	Low	161 Å²	161	116.6 Å²	116.6	75%	0.752	64%	0.637	S	S	*	*			trans	-96.7	-2.8	-177.9	-72.2	-174.8	162.6	0	0	113.8	R223 A226	R223-E228 PolarHBondContact O-N 2.94Å; R223-E228 VanDerWaalsContact O-N 3.1Å; A226-E228 VanDerWaalsContact C-N 3.31Å; A226-E228 PolarHBondContact O-N 3.08Å
229	V	49.6	Very low	59.7	Low	48 Å²	48	119.5 Å²	119.5	29%	0.291	65%	0.653	S	S	.	*			trans	-102.7	97.2	177.2	-173.2	0	0	0	0	109.6	R223 R224 E231	R223-V229 HydrophobicContact CB-CG2 3.33Å; R224-V229 HydrophobicContact CG-CB 3.99Å; R224-V229 HydrophobicContact CG-CG1 4.29Å; R224-V229 HydrophobicContact CG-CG2 4.25Å; V229-E231 PolarHBondContact O-N 3.4Å; V229-E231 VanDerWaalsContact O-N 3.14Å
230	L	50	Low	58.3	Low	168 Å²	168	125.3 Å²	125.3	88%	0.88	68%	0.675	S	S	*	*			trans	-58.1	109.7	154.3	-85.5	145.1	0	0	0	107.3
231	E	56.1	Low	57.3	Low	132 Å²	132	128.7 Å²	128.7	62%	0.617	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-54.9	126.5	166.8	-67.8	-165	144.2	0	0	107.6	R224 V229 A233	R224-E231 IonicContact CZ-OE1 2.74Å; R224-E231 IonicContact NH2-OE1 3.05Å; V229-E231 PolarHBondContact O-N 3.4Å; V229-E231 VanDerWaalsContact O-N 3.14Å; E231-A233 PolarHBondContact O-N 3.49Å
232	P	52.4	Low	56.3	Low	112 Å²	112	131.6 Å²	131.6	73%	0.727	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-60.1	119.7	174.1	24.7	-31.2	0	0	0	107.3	N234	P232-N234 PolarHBondContact O-N 3.03Å
233	A	47.8	Very low	55.4	Low	71 Å²	71	132.7 Å²	132.7	59%	0.587	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-49.4	118.5	177.9	0	0	0	0	0	109.1	E231 L235	E231-A233 PolarHBondContact O-N 3.49Å; A233-L235 VanDerWaalsContact C-N 3.34Å; A233-L235 PolarHBondContact O-N 3.04Å
234	N	47.6	Very low	54.9	Low	130 Å²	130	133.1 Å²	133.1	70%	0.695	73%	0.728	S	S	*	*			trans	-66.4	98.6	170.4	-82.8	-31.4	0	0	0	107.1	P232 L236 A237	P232-N234 PolarHBondContact O-N 3.03Å; N234-L236 PolarHBondContact O-N 3.18Å; N234-A237 HydrophobicContact CB-CB 4.37Å; N234-A237 PolarHBondContact O-N 2.86Å; N234-A237 VanDerWaalsContact O-N 3.11Å
235	L	53.5	Low	54.3	Low	172 Å²	172	134.7 Å²	134.7	90%	0.901	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	0.1	174.4	-97.6	105.4	0	0	0	114.9	A233	A233-L235 VanDerWaalsContact C-N 3.34Å; A233-L235 PolarHBondContact O-N 3.04Å
236	L	53.9	Low	53.6	Low	178 Å²	178	138.5 Å²	138.5	93%	0.932	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	0.4	-177.8	-95.6	148	0	0	0	113.8	N234	N234-L236 PolarHBondContact O-N 3.18Å
237	A	56.8	Low	52.6	Low	78 Å²	78	148.1 Å²	148.1	65%	0.645	78%	0.779	S	S	*	*	S	Bend	trans	-115.1	-6.9	-175.5	0	0	0	0	0	115.1	N234	N234-A237 HydrophobicContact CB-CB 4.37Å; N234-A237 PolarHBondContact O-N 2.86Å; N234-A237 VanDerWaalsContact O-N 3.11Å
238	E	48.8	Very low	52.4	Low	168 Å²	168	152.3 Å²	152.3	79%	0.785	78%	0.784	S	S	*	*			trans	-98.5	5.8	-174.8	-73.4	-173.2	163.4	0	0	115.2	K240	E238-K240 PolarHBondContact O-N 3.32Å
239	E	47.4	Very low	52.2	Low	187 Å²	187	151.8 Å²	151.8	87%	0.874	79%	0.786	S	S	*	*			trans	-89.7	79.9	169.4	-72.7	-177.6	171.9	0	0	110.4
240	K	50.9	Low	52.4	Low	193 Å²	193	157.6 Å²	157.6	84%	0.839	81%	0.813	S	S	*	*			trans	-122.7	94.9	153.8	-80.5	-173.4	177.7	-179.5	0	107.1	E238 E242	E238-K240 PolarHBondContact O-N 3.32Å; K240-E242 PolarHBondContact O-N 2.88Å
241	D	53.9	Low	52.5	Low	153 Å²	153	156.9 Å²	156.9	82%	0.818	81%	0.809	S	S	*	*			trans	-46.7	133.4	173.4	-75.6	-39.6	0	0	0	110.9	D243	D241-D243 PolarHBondContact O-N 3.34Å
242	E	55.5	Low	52.3	Low	185 Å²	185	158.5 Å²	158.5	86%	0.864	82%	0.822	S	S	*	*			trans	-67.3	116.9	168.1	-72.3	-176.3	155.6	0	0	108.6	K240 L244	K240-E242 PolarHBondContact O-N 2.88Å; E242-L244 PolarHBondContact O-N 2.94Å
243	D	58.8	Low	52.3	Low	155 Å²	155	161.6 Å²	161.6	83%	0.829	83%	0.828	S	S	*	*			trans	-61	102.9	169.4	-77.8	-31.3	0	0	0	109.2	D241 L245	D241-D243 PolarHBondContact O-N 3.34Å; D243-L245 PolarHBondContact O-N 3.13Å
244	L	56.6	Low	52.6	Low	141 Å²	141	168.1 Å²	168.1	74%	0.738	85%	0.845	S	S	*	*			trans	-64.7	99.2	168	-76.6	159.4	0	0	0	109.4	E242 F246	E242-L244 PolarHBondContact O-N 2.94Å; L244-F246 HydrophobicContact CB-CD2 4.27Å; L244-F246 HydrophobicContact CB-CE2 3.89Å; L244-F246 HydrophobicContact CD1-CE2 4.33Å; L244-F246 HydrophobicContact CD2-CE2 4.47Å; L244-F246 HydrophobicContact CG-CE2 4.48Å; L244-F246 PolarHBondContact O-N 3.23Å
245	L	54.6	Low	53	Low	169 Å²	169	171 Å²	171	89%	0.885	86%	0.857	S	S	*	*			trans	-83.4	102.3	160	-79.6	162.8	0	0	0	108.5	D243	D243-L245 PolarHBondContact O-N 3.13Å
246	F	54.4	Low	52.9	Low	171 Å²	171	170.9 Å²	170.9	75%	0.75	85%	0.853	S	S	*	*			trans	-74.8	147.9	158.9	-68.2	-87.9	0	0	0	109	L244	L244-F246 HydrophobicContact CB-CD2 4.27Å; L244-F246 HydrophobicContact CB-CE2 3.89Å; L244-F246 HydrophobicContact CD1-CE2 4.33Å; L244-F246 HydrophobicContact CD2-CE2 4.47Å; L244-F246 HydrophobicContact CG-CE2 4.48Å; L244-F246 PolarHBondContact O-N 3.23Å
247	E	43.9	Very low	52.9	Low	273 Å²	273	170.3 Å²	170.3	100%	1.276	85%	0.846	S	S	*	*			trans	-45	0	176.6	-68.6	-177.7	156.8	0	0	114.8

Retrieved 247 of 247 residues in 96.3 ms (Link to these results)

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