A0A087YLJ9_POEFO Loading...

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 protons. 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. May play a role in cilium biogenesis through regulation of the transport and the localization of proteins to the cilium.

AlphaFold DB , UniProt , Accession A0A087YLJ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 248 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	44.2	Very low	74.5	Confident	244 Å²	244	105.8 Å²	105.8	100%	1.202	54%	0.541	S	S	*	.				0	116.6	0	-72.2	-71.5	-154	0	0	108	G3	M1-G3 PolarHBondContact O-N 3.23Å
2	S	46.8	Very low	76.1	Confident	81 Å²	81	100.5 Å²	100.5	57%	0.566	52%	0.52	S	S	*	.			trans	-62	123.6	-161.1	-174.2	0	0	0	0	113.6	K4 E5	S2-K4 PolarHBondContact O-N 3.34Å; S2-E5 PolarHBondContact O-N 3.13Å
3	G	57.1	Low	77.3	Confident	58 Å²	58	105.5 Å²	105.5	60%	0.598	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	5.9	175.9	0	0	0	0	0	115.6	M1	M1-G3 PolarHBondContact O-N 3.23Å
4	K	68.6	Low	78.5	Confident	176 Å²	176	108.2 Å²	108.2	77%	0.765	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-7.9	-178.6	-64.9	-175.7	178.8	179	0	114.4	S2	S2-K4 PolarHBondContact O-N 3.34Å
5	E	79.1	Confident	79.4	Confident	108 Å²	108	101.7 Å²	101.7	51%	0.505	51%	0.511	S	S	.	.	S	Bend	trans	-85.7	-14.2	-173.5	-71.9	-146.5	130	0	0	114.9	S2 R179 R182	S2-E5 PolarHBondContact O-N 3.13Å; E5-R179 WeakPolarHBondContact O-CG 3.32Å; E5-R182 VanDerWaalsContact CB-NH1 3.34Å; E5-R182 IonicContact OE1-NH1 2.73Å; E5-R182 PolarHBondContact OE1-NH1 2.87Å; E5-R182 IonicContact OE2-NH1 3.41Å; E5-R182 PolarHBondContact OE2-NH1 2.73Å
6	R	81.4	Confident	80.3	Confident	122 Å²	122	97.8 Å²	97.8	46%	0.46	49%	0.49	S	S	.	.	S	Bend	trans	-130.2	165	-176.9	-66	-178.1	-67.7	-175.4	1.8	109.6	R182	R6-R182 HydrophobicContact CG-CB 4.24Å
7	I	87	Confident	81.1	Confident	40 Å²	40	97.6 Å²	97.6	21%	0.205	50%	0.496	C	S	.	.			trans	-88.9	128.9	170.7	-52.8	177.7	0	0	0	107	I9 M19 R179 I180 T183	I7-I9 HydrophobicContact CB-CG2 4.16Å; I7-I9 HydrophobicContact CG2-CG2 3.55Å; I7-I9 PolarHBondContact O-N 2.99Å; I7-M19 HydrophobicContact CD1-SD 4.17Å; I7-R179 HydrophobicContact CG1-CG 4.14Å; I7-I180 HydrophobicContact CD1-CG1 4.09Å; I7-T183 HydrophobicContact CB-CG2 4.16Å; I7-T183 PolarHBondContact N-OG1 3.21Å
8	D	85.9	Confident	81.9	Confident	146 Å²	146	96.3 Å²	96.3	78%	0.781	49%	0.489	S	S	*	.			trans	-71.9	91.2	179.2	-61.2	-36.9	0	0	0	110
9	I	87.6	Confident	82.5	Confident	40 Å²	40	91.5 Å²	91.5	21%	0.205	47%	0.465	C	S	.	.			trans	-134.5	143	176.1	88.5	177.2	0	0	0	109.7	I7 A15 M19 T183 I187	I7-I9 HydrophobicContact CB-CG2 4.16Å; I7-I9 HydrophobicContact CG2-CG2 3.55Å; I7-I9 PolarHBondContact O-N 2.99Å; I9-A15 HydrophobicContact CD1-CB 3.71Å; I9-A15 HydrophobicContact CG1-CB 4.33Å; I9-M19 HydrophobicContact CD1-CE 3.69Å; I9-M19 HydrophobicContact CD1-CG 3.54Å; I9-M19 HydrophobicContact CD1-SD 3.99Å; I9-M19 HydrophobicContact CG2-CE 4.38Å; I9-T183 HydrophobicContact CD1-CG2 4.3Å; I9-T183 HydrophobicContact CG1-CG2 4.3Å; I9-I187 HydrophobicContact CD1-CD1 3.52Å; I9-I187 HydrophobicContact CD1-CG1 4.35Å; I9-I187 HydrophobicContact CG1-CD1 4.12Å; I9-I187 HydrophobicContact CG1-CG1 4.45Å
10	F	90.3	Very high	83.1	Confident	145 Å²	145	92.3 Å²	92.3	64%	0.636	47%	0.465	S	S	*	.			trans	-71.4	134.4	174.6	-171.2	-98.8	0	0	0	110.9	S12 A15	F10-S12 PolarHBondContact O-N 3.38Å; F10-A15 WeakPolarHBondContact O-CB 3.47Å
11	P	91.9	Very high	83.7	Confident	4 Å²	4	91 Å²	91	3%	0.026	47%	0.468	C	S	.	.			trans	-70.3	114.2	-178.6	27.1	-33.2	0	0	0	111.2	I187 E190 R194	P11-I187 HydrophobicContact CB-CG2 4.44Å; P11-E190 HydrophobicContact CB-CB 3.6Å; P11-E190 HydrophobicContact CB-CG 4.16Å; P11-E190 HydrophobicContact CG-CB 3.78Å; P11-E190 HydrophobicContact CG-CG 4.01Å; P11-R194 PolarHBondContact O-NH1 3.34Å
12	S	93.8	Very high	86.1	Confident	42 Å²	42	85.7 Å²	85.7	29%	0.294	44%	0.435	S	S	.	.			trans	-147.5	157.4	173.8	76	0	0	0	0	110.8	F10 M14 A15 Q16	F10-S12 PolarHBondContact O-N 3.38Å; S12-M14 PolarHBondContact O-N 3.4Å; S12-A15 WeakPolarHBondContact O-CB 3.49Å; S12-A15 PolarHBondContact O-N 2.85Å; S12-A15 WeakPolarHBondContact OG-CB 3.39Å; S12-A15 PolarHBondContact OG-N 3.48Å; S12-Q16 PolarHBondContact O-N 3.48Å
13	R	91.3	Very high	88.4	Confident	166 Å²	166	83.1 Å²	83.1	63%	0.626	42%	0.415	S	S	*	.	H	α-helix	trans	-58.3	-35.7	175.2	-73.2	-172.2	175.7	-175.2	-0.1	112	Q16 T17 L191 E195	R13-Q16 WeakPolarHBondContact O-CB 3.21Å; R13-Q16 PolarHBondContact O-N 2.88Å; R13-T17 PolarHBondContact O-N 3.49Å; R13-T17 PolarHBondContact O-OG1 3.24Å; R13-L191 HydrophobicContact CG-CD1 4.11Å; R13-L191 HydrophobicContact CG-CD2 4.33Å; R13-E195 IonicContact CZ-OE1 3.7Å; R13-E195 IonicContact NE-OE1 3.62Å; R13-E195 IonicContact NH2-OE1 2.68Å; R13-E195 PolarHBondContact NH2-OE1 3.43Å
14	M	93.8	Very high	90.3	Very high	143 Å²	143	87.4 Å²	87.4	70%	0.704	42%	0.417	S	S	*	.	H	α-helix	trans	-63.9	-45	174	-173.3	179.5	-177.7	0	0	111.5	S12 Q16 T17 I18	S12-M14 PolarHBondContact O-N 3.4Å; M14-Q16 VanDerWaalsContact C-N 3.3Å; M14-Q16 PolarHBondContact O-N 2.77Å; M14-T17 PolarHBondContact O-N 3.14Å; M14-I18 HydrophobicContact CE-CD1 4.48Å; M14-I18 HydrophobicContact CG-CD1 4.19Å; M14-I18 WeakPolarHBondContact O-CG1 3.25Å; M14-I18 PolarHBondContact O-N 3.3Å; M14-I18 VanDerWaalsContact O-N 3.07Å
15	A	92.5	Very high	91.5	Very high	11 Å²	11	80.9 Å²	80.9	9%	0.091	40%	0.399	C	S	.	.	H	α-helix	trans	-62.3	-37.4	177.7	0	0	0	0	0	112	I9 F10 S12 I18 M19	I9-A15 HydrophobicContact CD1-CB 3.71Å; I9-A15 HydrophobicContact CG1-CB 4.33Å; F10-A15 WeakPolarHBondContact O-CB 3.47Å; S12-A15 WeakPolarHBondContact O-CB 3.49Å; S12-A15 PolarHBondContact O-N 2.85Å; S12-A15 WeakPolarHBondContact OG-CB 3.39Å; S12-A15 PolarHBondContact OG-N 3.48Å; A15-I18 PolarHBondContact O-N 2.89Å; A15-M19 WeakPolarHBondContact O-CG 3.47Å; A15-M19 PolarHBondContact O-N 3.38Å
16	Q	93.3	Very high	92.3	Very high	38 Å²	38	76.5 Å²	76.5	18%	0.178	38%	0.382	C	S	.	.	H	α-helix	trans	-59.7	-46.2	173.7	-165	-168.4	18.6	0	0	111.8	S12 R13 M14 I18 M19 K20 L184 I187	S12-Q16 PolarHBondContact O-N 3.48Å; R13-Q16 WeakPolarHBondContact O-CB 3.21Å; R13-Q16 PolarHBondContact O-N 2.88Å; M14-Q16 VanDerWaalsContact C-N 3.3Å; M14-Q16 PolarHBondContact O-N 2.77Å; Q16-I18 PolarHBondContact O-N 2.87Å; Q16-M19 PolarHBondContact O-N 3.35Å; Q16-K20 HydrophobicContact CG-CD 4.45Å; Q16-K20 WeakPolarHBondContact O-CB 3.48Å; Q16-K20 WeakPolarHBondContact O-CG 3.42Å; Q16-K20 PolarHBondContact O-N 3.34Å; Q16-L184 HydrophobicContact CG-CD2 4.43Å; Q16-I187 HydrophobicContact CB-CG2 3.91Å; Q16-I187 HydrophobicContact CG-CG2 4.33Å
17	T	95.1	Very high	92.9	Very high	95 Å²	95	75.5 Å²	75.5	58%	0.583	38%	0.382	S	S	*	.	H	α-helix	trans	-61.7	-43.1	177.3	-57.7	0	0	0	0	111.5	R13 M14 K20 A21	R13-T17 PolarHBondContact O-N 3.49Å; R13-T17 PolarHBondContact O-OG1 3.24Å; M14-T17 PolarHBondContact O-N 3.14Å; T17-K20 PolarHBondContact O-N 3.26Å; T17-A21 WeakPolarHBondContact O-CB 3.19Å; T17-A21 PolarHBondContact O-N 2.88Å
18	I	94.8	Very high	93.3	Very high	74 Å²	74	77.1 Å²	77.1	38%	0.379	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-43.9	176.9	-62.4	166.7	0	0	0	110.7	M14 A15 Q16 A21 R22	M14-I18 HydrophobicContact CE-CD1 4.48Å; M14-I18 HydrophobicContact CG-CD1 4.19Å; M14-I18 WeakPolarHBondContact O-CG1 3.25Å; M14-I18 PolarHBondContact O-N 3.3Å; M14-I18 VanDerWaalsContact O-N 3.07Å; A15-I18 PolarHBondContact O-N 2.89Å; Q16-I18 PolarHBondContact O-N 2.87Å; I18-A21 PolarHBondContact O-N 3.47Å; I18-R22 WeakPolarHBondContact O-CG 3.41Å; I18-R22 PolarHBondContact O-N 2.99Å
19	M	93.8	Very high	93.8	Very high	5 Å²	5	71.1 Å²	71.1	3%	0.025	37%	0.367	C	S	.	.	H	α-helix	trans	-67.6	-39.1	178.7	-70.2	-50.9	113.3	0	0	112.5	I7 I9 A15 Q16 R22 L23 L184 I187	I7-M19 HydrophobicContact CD1-SD 4.17Å; I9-M19 HydrophobicContact CD1-CE 3.69Å; I9-M19 HydrophobicContact CD1-CG 3.54Å; I9-M19 HydrophobicContact CD1-SD 3.99Å; I9-M19 HydrophobicContact CG2-CE 4.38Å; A15-M19 WeakPolarHBondContact O-CG 3.47Å; A15-M19 PolarHBondContact O-N 3.38Å; Q16-M19 PolarHBondContact O-N 3.35Å; M19-R22 PolarHBondContact O-N 3.04Å; M19-L23 WeakPolarHBondContact O-CB 3.38Å; M19-L23 PolarHBondContact O-N 2.85Å; M19-L184 HydrophobicContact CB-CG 4.5Å; M19-I187 HydrophobicContact CB-CD1 4.37Å; M19-I187 HydrophobicContact CG-CD1 3.78Å
20	K	94.6	Very high	94.1	Very high	107 Å²	107	73.3 Å²	73.3	47%	0.465	37%	0.373	S	S	.	.	H	α-helix	trans	-60.7	-43.8	172.7	-77.1	177.3	177	175.5	0	111.7	Q16 T17 L23 K24 L184	Q16-K20 HydrophobicContact CG-CD 4.45Å; Q16-K20 WeakPolarHBondContact O-CB 3.48Å; Q16-K20 WeakPolarHBondContact O-CG 3.42Å; Q16-K20 PolarHBondContact O-N 3.34Å; T17-K20 PolarHBondContact O-N 3.26Å; K20-L23 PolarHBondContact O-N 2.87Å; K20-K24 PolarHBondContact O-N 3.41Å; K20-L184 HydrophobicContact CG-CD1 3.88Å
21	A	95.8	Very high	94.3	Very high	65 Å²	65	69.3 Å²	69.3	54%	0.537	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-43.1	175.6	0	0	0	0	0	111.9	T17 I18 K24 G25	T17-A21 WeakPolarHBondContact O-CB 3.19Å; T17-A21 PolarHBondContact O-N 2.88Å; I18-A21 PolarHBondContact O-N 3.47Å; A21-K24 PolarHBondContact O-N 2.9Å; A21-G25 PolarHBondContact O-N 2.76Å
22	R	94	Very high	94.4	Very high	134 Å²	134	74.5 Å²	74.5	51%	0.506	39%	0.39	S	S	.	.	H	α-helix	trans	-62.4	-40.8	174.5	-77.6	-175.6	179.8	-174.3	0.7	112.5	I18 M19 G25 A26 I180	I18-R22 WeakPolarHBondContact O-CG 3.41Å; I18-R22 PolarHBondContact O-N 2.99Å; M19-R22 PolarHBondContact O-N 3.04Å; R22-G25 PolarHBondContact O-N 2.87Å; R22-A26 WeakPolarHBondContact O-CB 3.49Å; R22-A26 PolarHBondContact O-N 3.38Å; R22-I180 HydrophobicContact CB-CD1 4.29Å
23	L	95	Very high	94.5	Very high	26 Å²	26	74.3 Å²	74.3	14%	0.136	39%	0.385	C	S	.	.	H	α-helix	trans	-61.2	-49	177	-174.8	67.2	0	0	0	110.8	M19 K20 G25 A26 Q27 I177 I180 L184	M19-L23 WeakPolarHBondContact O-CB 3.38Å; M19-L23 PolarHBondContact O-N 2.85Å; K20-L23 PolarHBondContact O-N 2.87Å; L23-G25 VanDerWaalsContact C-N 3.32Å; L23-G25 PolarHBondContact O-N 2.86Å; L23-A26 PolarHBondContact O-N 3.32Å; L23-Q27 WeakPolarHBondContact O-CG 3.42Å; L23-Q27 PolarHBondContact O-N 3.35Å; L23-I177 HydrophobicContact CD1-CG2 4.19Å; L23-I180 HydrophobicContact CB-CG2 3.87Å; L23-I180 HydrophobicContact CD1-CB 4.28Å; L23-I180 HydrophobicContact CD1-CG2 3.99Å; L23-I180 HydrophobicContact CG-CG2 4.48Å; L23-L184 HydrophobicContact CD2-CD1 4.2Å
24	K	96.1	Very high	94.6	Very high	148 Å²	148	70.8 Å²	70.8	64%	0.643	37%	0.374	S	S	*	.	H	α-helix	trans	-59.8	-43.5	176.5	-171.2	175.7	-178.9	178.5	0	111.3	K20 A21 Q27 T28	K20-K24 PolarHBondContact O-N 3.41Å; A21-K24 PolarHBondContact O-N 2.9Å; K24-Q27 PolarHBondContact O-N 3.4Å; K24-T28 WeakPolarHBondContact O-CG2 3.45Å; K24-T28 PolarHBondContact O-N 2.8Å; K24-T28 PolarHBondContact O-OG1 2.99Å; K24-T28 VanDerWaalsContact O-OG1 3.13Å
25	G	95.6	Very high	94.6	Very high	39 Å²	39	70.6 Å²	70.6	40%	0.402	37%	0.37	S	S	.	.	H	α-helix	trans	-62.4	-38.7	175.2	0	0	0	0	0	113.7	A21 R22 L23 T28 G29	A21-G25 PolarHBondContact O-N 2.76Å; R22-G25 PolarHBondContact O-N 2.87Å; L23-G25 VanDerWaalsContact C-N 3.32Å; L23-G25 PolarHBondContact O-N 2.86Å; G25-T28 WeakPolarHBondContact CA-OG1 3.32Å; G25-T28 PolarHBondContact O-OG1 3.49Å; G25-T28 VanDerWaalsContact O-OG1 3.05Å; G25-G29 PolarHBondContact O-N 3Å
26	A	95.1	Very high	94.6	Very high	17 Å²	17	73.4 Å²	73.4	14%	0.14	38%	0.38	C	S	.	.	H	α-helix	trans	-67.8	-40.8	175.7	0	0	0	0	0	111.8	R22 L23 R30 I172 I177 I180	R22-A26 WeakPolarHBondContact O-CB 3.49Å; R22-A26 PolarHBondContact O-N 3.38Å; L23-A26 PolarHBondContact O-N 3.32Å; A26-R30 WeakPolarHBondContact O-CB 3.38Å; A26-R30 PolarHBondContact O-N 2.94Å; A26-I172 HydrophobicContact CB-CG2 4.33Å; A26-I177 HydrophobicContact CB-CG1 4.13Å; A26-I180 HydrophobicContact CB-CD1 4.31Å
27	Q	94.4	Very high	94.6	Very high	100 Å²	100	71.7 Å²	71.7	47%	0.467	37%	0.372	S	S	.	.	H	α-helix	trans	-65.3	-45.8	176.5	-71.9	172.8	-14.2	0	0	112.2	L23 K24 R30 S31 I177	L23-Q27 WeakPolarHBondContact O-CG 3.42Å; L23-Q27 PolarHBondContact O-N 3.35Å; K24-Q27 PolarHBondContact O-N 3.4Å; Q27-R30 PolarHBondContact O-N 2.9Å; Q27-S31 PolarHBondContact O-N 2.93Å; Q27-S31 VanDerWaalsContact O-N 3.13Å; Q27-I177 HydrophobicContact CG-CD1 4.36Å
28	T	95.3	Very high	94.5	Very high	74 Å²	74	70.8 Å²	70.8	45%	0.454	36%	0.364	S	S	.	.	H	α-helix	trans	-65.8	-42.8	176	55.6	0	0	0	0	111.3	K24 G25 R30 S31 L32	K24-T28 WeakPolarHBondContact O-CG2 3.45Å; K24-T28 PolarHBondContact O-N 2.8Å; K24-T28 PolarHBondContact O-OG1 2.99Å; K24-T28 VanDerWaalsContact O-OG1 3.13Å; G25-T28 WeakPolarHBondContact CA-OG1 3.32Å; G25-T28 PolarHBondContact O-OG1 3.49Å; G25-T28 VanDerWaalsContact O-OG1 3.05Å; T28-R30 VanDerWaalsContact C-N 3.34Å; T28-R30 PolarHBondContact O-N 3.17Å; T28-S31 PolarHBondContact O-N 3.41Å; T28-L32 WeakPolarHBondContact O-CG 3.45Å; T28-L32 PolarHBondContact O-N 3.27Å
29	G	94.9	Very high	94.4	Very high	21 Å²	21	69.5 Å²	69.5	22%	0.216	36%	0.364	C	S	.	.	H	α-helix	trans	-58.3	-42.3	174.9	0	0	0	0	0	112.9	G25 L32 L33	G25-G29 PolarHBondContact O-N 3Å; G29-L32 PolarHBondContact O-N 3.29Å; G29-L33 WeakPolarHBondContact O-CB 3.23Å; G29-L33 WeakPolarHBondContact O-CG 3.25Å; G29-L33 PolarHBondContact O-N 2.89Å
30	R	94.9	Very high	94.3	Very high	86 Å²	86	69.2 Å²	69.2	33%	0.325	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-49.8	173.7	179.9	-173.4	162.9	177.2	-2.7	111.5	A26 Q27 T28 L32 L33 K34 V169 I172 E173	A26-R30 WeakPolarHBondContact O-CB 3.38Å; A26-R30 PolarHBondContact O-N 2.94Å; Q27-R30 PolarHBondContact O-N 2.9Å; T28-R30 VanDerWaalsContact C-N 3.34Å; T28-R30 PolarHBondContact O-N 3.17Å; R30-L32 PolarHBondContact O-N 3.08Å; R30-L33 PolarHBondContact O-N 3.41Å; R30-K34 VanDerWaalsContact O-CB 3.31Å; R30-K34 WeakPolarHBondContact O-CB 3.46Å; R30-K34 PolarHBondContact O-N 3.04Å; R30-V169 HydrophobicContact CG-CG1 4.28Å; R30-I172 HydrophobicContact CB-CG2 3.93Å; R30-E173 IonicContact CZ-OE1 2.89Å; R30-E173 IonicContact CZ-OE2 3.14Å; R30-E173 IonicContact NE-OE2 3.65Å; R30-E173 PolarHBondContact NE-OE2 3.44Å; R30-E173 IonicContact NH1-OE1 3.53Å; R30-E173 PolarHBondContact NH1-OE1 3.05Å; R30-E173 IonicContact NH1-OE2 3.66Å; R30-E173 IonicContact NH2-OE1 2.76Å; R30-E173 PolarHBondContact NH2-OE1 3.45Å; R30-E173 IonicContact NH2-OE2 3.83Å; R30-E173 PolarHBondContact NH2-OE2 3.34Å
31	S	94.7	Very high	94.2	Very high	60 Å²	60	65.5 Å²	65.5	42%	0.42	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-43.7	-179.4	-177.8	0	0	0	0	112	Q27 T28 K34 K35	Q27-S31 PolarHBondContact O-N 2.93Å; Q27-S31 VanDerWaalsContact O-N 3.13Å; T28-S31 PolarHBondContact O-N 3.41Å; S31-K34 PolarHBondContact O-N 3.22Å; S31-K35 WeakPolarHBondContact O-CG 3.42Å; S31-K35 PolarHBondContact O-N 3.39Å
32	L	94.7	Very high	94	Very high	114 Å²	114	68.4 Å²	68.4	60%	0.597	35%	0.354	S	S	*	.	H	α-helix	trans	-64.8	-46.1	178	-70.2	170.9	0	0	0	112.4	T28 G29 R30 K34 K35 K36	T28-L32 WeakPolarHBondContact O-CG 3.45Å; T28-L32 PolarHBondContact O-N 3.27Å; G29-L32 PolarHBondContact O-N 3.29Å; R30-L32 PolarHBondContact O-N 3.08Å; L32-K34 VanDerWaalsContact C-N 3.29Å; L32-K34 PolarHBondContact O-N 3.35Å; L32-K35 PolarHBondContact O-N 2.95Å; L32-K36 PolarHBondContact O-N 3.47Å
33	L	94.6	Very high	93.9	Very high	38 Å²	38	68.5 Å²	68.5	20%	0.199	35%	0.354	C	S	.	.	H	α-helix	trans	-65.7	-34.6	177.8	-72.1	174.8	0	0	0	112.1	G29 R30 K36 S37 T165 R168 V169 I172	G29-L33 WeakPolarHBondContact O-CB 3.23Å; G29-L33 WeakPolarHBondContact O-CG 3.25Å; G29-L33 PolarHBondContact O-N 2.89Å; R30-L33 PolarHBondContact O-N 3.41Å; L33-K36 PolarHBondContact O-N 3Å; L33-S37 WeakPolarHBondContact O-CB 3.32Å; L33-S37 PolarHBondContact O-N 2.99Å; L33-T165 HydrophobicContact CB-CG2 4.5Å; L33-T165 HydrophobicContact CD2-CG2 4.45Å; L33-R168 HydrophobicContact CD1-CG 4.02Å; L33-V169 HydrophobicContact CB-CG2 3.6Å; L33-I172 HydrophobicContact CD1-CD1 3.72Å
34	K	94.3	Very high	93.8	Very high	91 Å²	91	69.1 Å²	69.1	40%	0.396	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-47.9	175.1	-175.9	53.6	176.4	148.8	0	111.3	R30 S31 L32 K36 S37 D38	R30-K34 VanDerWaalsContact O-CB 3.31Å; R30-K34 WeakPolarHBondContact O-CB 3.46Å; R30-K34 PolarHBondContact O-N 3.04Å; S31-K34 PolarHBondContact O-N 3.22Å; L32-K34 VanDerWaalsContact C-N 3.29Å; L32-K34 PolarHBondContact O-N 3.35Å; K34-K36 VanDerWaalsContact C-N 3.32Å; K34-K36 PolarHBondContact O-N 3.13Å; K34-S37 WeakPolarHBondContact O-CB 3.29Å; K34-S37 PolarHBondContact O-N 3.37Å; K34-S37 VanDerWaalsContact O-N 3.12Å; K34-D38 WeakPolarHBondContact CE-OD1 3.49Å; K34-D38 IonicContact NZ-OD1 3.41Å; K34-D38 PolarHBondContact NZ-OD1 2.92Å; K34-D38 IonicContact NZ-OD2 2.71Å; K34-D38 VanDerWaalsContact O-CG 3.26Å; K34-D38 PolarHBondContact O-N 2.92Å
35	K	94	Very high	93.7	Very high	140 Å²	140	70.1 Å²	70.1	61%	0.609	36%	0.356	S	S	*	.	H	α-helix	trans	-57.8	-42.2	173.9	-70.5	178.7	-177.6	-175.4	0	112.4	S31 L32 D38 A39	S31-K35 WeakPolarHBondContact O-CG 3.42Å; S31-K35 PolarHBondContact O-N 3.39Å; L32-K35 PolarHBondContact O-N 2.95Å; K35-D38 PolarHBondContact O-N 2.92Å; K35-A39 PolarHBondContact O-N 3.41Å; K35-A39 VanDerWaalsContact O-N 3.08Å
36	K	92.8	Very high	93.6	Very high	70 Å²	70	72.3 Å²	72.3	30%	0.304	36%	0.356	S	S	.	.	H	α-helix	trans	-60.6	-46.6	174.2	178.7	173.6	175.1	163.6	0	111.7	L32 L33 K34 D38 A39 L40 A102	L32-K36 PolarHBondContact O-N 3.47Å; L33-K36 PolarHBondContact O-N 3Å; K34-K36 VanDerWaalsContact C-N 3.32Å; K34-K36 PolarHBondContact O-N 3.13Å; K36-D38 VanDerWaalsContact C-N 3.33Å; K36-D38 PolarHBondContact O-N 3.35Å; K36-A39 PolarHBondContact O-N 3.47Å; K36-L40 HydrophobicContact CG-CD1 4.12Å; K36-L40 WeakPolarHBondContact O-CG 3.41Å; K36-L40 PolarHBondContact O-N 3.45Å; K36-A102 WeakPolarHBondContact CE-O 3.45Å; K36-A102 PolarHBondContact NZ-O 3.23Å
37	S	91.9	Very high	93.5	Very high	1 Å²	1	72.8 Å²	72.8	1%	0.007	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-41.5	178	-172.5	0	0	0	0	112.3	L33 K34 L40 S41 N166	L33-S37 WeakPolarHBondContact O-CB 3.32Å; L33-S37 PolarHBondContact O-N 2.99Å; K34-S37 WeakPolarHBondContact O-CB 3.29Å; K34-S37 PolarHBondContact O-N 3.37Å; K34-S37 VanDerWaalsContact O-N 3.12Å; S37-L40 PolarHBondContact O-N 3.49Å; S37-S41 WeakPolarHBondContact O-CB 3.33Å; S37-S41 PolarHBondContact O-N 3.46Å; S37-S41 PolarHBondContact O-OG 3.43Å; S37-N166 PolarHBondContact OG-OD1 2.86Å
38	D	92.7	Very high	93.5	Very high	76 Å²	76	71.3 Å²	71.3	41%	0.406	35%	0.351	S	S	.	.	H	α-helix	trans	-67.8	-40.3	-179.8	-62.7	-25.4	0	0	0	111.2	K34 K35 K36 S41 M42	K34-D38 WeakPolarHBondContact CE-OD1 3.49Å; K34-D38 IonicContact NZ-OD1 3.41Å; K34-D38 PolarHBondContact NZ-OD1 2.92Å; K34-D38 IonicContact NZ-OD2 2.71Å; K34-D38 VanDerWaalsContact O-CG 3.26Å; K34-D38 PolarHBondContact O-N 2.92Å; K35-D38 PolarHBondContact O-N 2.92Å; K36-D38 VanDerWaalsContact C-N 3.33Å; K36-D38 PolarHBondContact O-N 3.35Å; D38-S41 PolarHBondContact O-N 3.31Å; D38-M42 PolarHBondContact O-N 3.11Å
39	A	92.7	Very high	93.5	Very high	47 Å²	47	76.2 Å²	76.2	39%	0.388	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-43.9	173.5	0	0	0	0	0	112.5	K35 K36 S41 M42 R43	K35-A39 PolarHBondContact O-N 3.41Å; K35-A39 VanDerWaalsContact O-N 3.08Å; K36-A39 PolarHBondContact O-N 3.47Å; A39-S41 VanDerWaalsContact C-N 3.35Å; A39-M42 PolarHBondContact O-N 3.09Å; A39-R43 PolarHBondContact O-N 3.24Å; A39-R43 VanDerWaalsContact O-N 3.15Å
40	L	92.4	Very high	93.5	Very high	0 Å²	0	80.7 Å²	80.7	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-62.6	-42.5	174.6	-71.2	173.4	0	0	0	111.2	K36 S37 M42 R43 F44 A102 V104 L158 I162	K36-L40 HydrophobicContact CG-CD1 4.12Å; K36-L40 WeakPolarHBondContact O-CG 3.41Å; K36-L40 PolarHBondContact O-N 3.45Å; S37-L40 PolarHBondContact O-N 3.49Å; L40-M42 VanDerWaalsContact C-N 3.32Å; L40-M42 PolarHBondContact O-N 2.88Å; L40-R43 PolarHBondContact O-N 2.97Å; L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 PolarHBondContact O-N 3.49Å; L40-A102 HydrophobicContact CD2-CB 4Å; L40-A102 HydrophobicContact CG-CB 4.4Å; L40-V104 HydrophobicContact CD1-CG2 4.09Å; L40-V104 HydrophobicContact CD2-CG2 4.01Å; L40-L158 HydrophobicContact CD2-CD1 4.42Å; L40-L158 HydrophobicContact CD2-CG 4.5Å; L40-I162 HydrophobicContact CB-CD1 4.09Å; L40-I162 HydrophobicContact CB-CG1 3.68Å; L40-I162 HydrophobicContact CD1-CG1 4.39Å
41	S	91.9	Very high	93.5	Very high	29 Å²	29	77.5 Å²	77.5	20%	0.203	36%	0.364	C	S	.	.	H	α-helix	trans	-64.3	-35.7	178.5	-61.1	0	0	0	0	112.3	S37 D38 A39 F44 R45	S37-S41 WeakPolarHBondContact O-CB 3.33Å; S37-S41 PolarHBondContact O-N 3.46Å; S37-S41 PolarHBondContact O-OG 3.43Å; D38-S41 PolarHBondContact O-N 3.31Å; A39-S41 VanDerWaalsContact C-N 3.35Å; S41-F44 WeakPolarHBondContact O-CB 3.49Å; S41-R45 WeakPolarHBondContact O-CG 3.35Å; S41-R45 PolarHBondContact O-N 2.93Å; S41-R45 VanDerWaalsContact O-N 3.13Å
42	M	92.8	Very high	93.5	Very high	125 Å²	125	79.5 Å²	79.5	62%	0.616	37%	0.368	S	S	*	.	H	α-helix	trans	-63.8	-47.8	173.5	-173.1	179.9	-173.5	0	0	111.2	D38 A39 L40 R45 Q46	D38-M42 PolarHBondContact O-N 3.11Å; A39-M42 PolarHBondContact O-N 3.09Å; L40-M42 VanDerWaalsContact C-N 3.32Å; L40-M42 PolarHBondContact O-N 2.88Å; M42-R45 PolarHBondContact O-N 3.27Å; M42-Q46 WeakPolarHBondContact O-CG 3.45Å; M42-Q46 PolarHBondContact O-N 3.19Å; M42-Q46 VanDerWaalsContact O-N 3.15Å
43	R	90.5	Very high	93.5	Very high	136 Å²	136	79.4 Å²	79.4	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-63.3	-40.2	176	-72.5	-63.3	-165.1	178.3	7.2	112.4	A39 L40 R45 Q46 I47 V101	A39-R43 PolarHBondContact O-N 3.24Å; A39-R43 VanDerWaalsContact O-N 3.15Å; L40-R43 PolarHBondContact O-N 2.97Å; R43-R45 VanDerWaalsContact C-N 3.33Å; R43-R45 PolarHBondContact O-N 3.13Å; R43-Q46 VanDerWaalsContact CD-OE1 3.3Å; R43-Q46 WeakPolarHBondContact O-CB 3.43Å; R43-Q46 PolarHBondContact O-N 3.47Å; R43-Q46 VanDerWaalsContact O-N 3.16Å; R43-I47 WeakPolarHBondContact O-CG1 3.11Å; R43-I47 PolarHBondContact O-N 3.48Å; R43-V101 HydrophobicContact CB-CG1 4.3Å; R43-V101 HydrophobicContact CG-CG1 3.83Å
44	F	93.4	Very high	93.5	Very high	39 Å²	39	78.1 Å²	78.1	17%	0.171	36%	0.358	C	S	.	.	H	α-helix	trans	-55.1	-47.6	174.9	-175	-107.5	0	0	0	112	L40 S41 Q46 I47 L48 F155 L158 D159 I162	L40-F44 WeakPolarHBondContact O-CB 3.47Å; L40-F44 PolarHBondContact O-N 3.49Å; S41-F44 WeakPolarHBondContact O-CB 3.49Å; F44-Q46 PolarHBondContact O-N 3.42Å; F44-I47 PolarHBondContact O-N 2.89Å; F44-L48 WeakPolarHBondContact O-CB 3.46Å; F44-L48 PolarHBondContact O-N 3.01Å; F44-F155 HydrophobicContact CD1-CE2 4.41Å; F44-F155 AromaticContact CD2-CD2 3.84Å; F44-F155 HydrophobicContact CD2-CD2 3.84Å; F44-F155 AromaticContact CD2-CE2 3.73Å; F44-F155 HydrophobicContact CD2-CE2 3.73Å; F44-F155 HydrophobicContact CD2-CZ 4.45Å; F44-F155 AromaticContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CZ 4.05Å; F44-F155 HydrophobicContact CE2-CD1 4.28Å; F44-F155 AromaticContact CE2-CD2 3.42Å; F44-F155 HydrophobicContact CE2-CD2 3.42Å; F44-F155 VanDerWaalsContact CE2-CD2 3.42Å; F44-F155 AromaticContact CE2-CE1 3.98Å; F44-F155 HydrophobicContact CE2-CE1 3.98Å; F44-F155 AromaticContact CE2-CE2 3.06Å; F44-F155 HydrophobicContact CE2-CE2 3.06Å; F44-F155 HydrophobicContact CE2-CG 4.03Å; F44-F155 AromaticContact CE2-CZ 3.38Å; F44-F155 HydrophobicContact CE2-CZ 3.38Å; F44-F155 HydrophobicContact CG-CE2 4.38Å; F44-F155 HydrophobicContact CZ-CD2 4.02Å; F44-F155 AromaticContact CZ-CE1 3.99Å; F44-F155 HydrophobicContact CZ-CE1 3.99Å; F44-F155 AromaticContact CZ-CE2 3.16Å; F44-F155 HydrophobicContact CZ-CE2 3.16Å; F44-F155 AromaticContact CZ-CZ 3.14Å; F44-F155 HydrophobicContact CZ-CZ 3.14Å; F44-L158 HydrophobicContact CB-CD2 3.49Å; F44-L158 VanDerWaalsContact CB-CD2 3.49Å; F44-L158 HydrophobicContact CD2-CD2 3.58Å; F44-L158 HydrophobicContact CG-CD2 3.98Å; F44-D159 HydrophobicContact CE2-CB 3.8Å; F44-D159 HydrophobicContact CZ-CB 4.3Å; F44-I162 HydrophobicContact CB-CD1 3.78Å; F44-I162 HydrophobicContact CD2-CD1 4.26Å; F44-I162 HydrophobicContact CG-CD1 4.02Å
45	R	93.6	Very high	93.5	Very high	170 Å²	170	79.8 Å²	79.8	64%	0.642	37%	0.366	S	S	*	.	H	α-helix	trans	-65.7	-36.6	177.8	-69.8	176.3	-173.6	177.2	2.3	112.5	S41 M42 R43 L48 R49	S41-R45 WeakPolarHBondContact O-CG 3.35Å; S41-R45 PolarHBondContact O-N 2.93Å; S41-R45 VanDerWaalsContact O-N 3.13Å; M42-R45 PolarHBondContact O-N 3.27Å; R43-R45 VanDerWaalsContact C-N 3.33Å; R43-R45 PolarHBondContact O-N 3.13Å; R45-L48 PolarHBondContact O-N 2.85Å; R45-R49 WeakPolarHBondContact O-CG 3.42Å; R45-R49 PolarHBondContact O-N 2.83Å; R45-R49 VanDerWaalsContact O-N 3.12Å
46	Q	93.4	Very high	93.5	Very high	84 Å²	84	77.1 Å²	77.1	39%	0.393	36%	0.361	S	S	.	.	H	α-helix	trans	-63.6	-46.6	174.8	-70.5	174.6	-5.5	0	0	111.3	M42 R43 F44 L48 R49 K50	M42-Q46 WeakPolarHBondContact O-CG 3.45Å; M42-Q46 PolarHBondContact O-N 3.19Å; M42-Q46 VanDerWaalsContact O-N 3.15Å; R43-Q46 VanDerWaalsContact CD-OE1 3.3Å; R43-Q46 WeakPolarHBondContact O-CB 3.43Å; R43-Q46 PolarHBondContact O-N 3.47Å; R43-Q46 VanDerWaalsContact O-N 3.16Å; F44-Q46 PolarHBondContact O-N 3.42Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.03Å; Q46-R49 PolarHBondContact O-N 3.14Å; Q46-K50 PolarHBondContact O-N 2.96Å; Q46-K50 VanDerWaalsContact O-N 3.09Å
47	I	93.1	Very high	93.6	Very high	28 Å²	28	79.3 Å²	79.3	14%	0.144	37%	0.371	C	S	.	.	H	α-helix	trans	-63.1	-41.7	177	-67.1	170.2	0	0	0	110.4	R43 F44 R49 K50 I51 L151 F155 L158	R43-I47 WeakPolarHBondContact O-CG1 3.11Å; R43-I47 PolarHBondContact O-N 3.48Å; F44-I47 PolarHBondContact O-N 2.89Å; I47-R49 PolarHBondContact O-N 3.06Å; I47-K50 PolarHBondContact O-N 3.29Å; I47-I51 HydrophobicContact CG2-CD1 3.75Å; I47-I51 HydrophobicContact CG2-CG1 4.17Å; I47-I51 WeakPolarHBondContact O-CG1 3.48Å; I47-I51 PolarHBondContact O-N 3.02Å; I47-L151 HydrophobicContact CG2-CD2 4.41Å; I47-F155 HydrophobicContact CG2-CB 4.19Å; I47-F155 HydrophobicContact CG2-CD2 4.22Å; I47-L158 HydrophobicContact CD1-CD1 4.31Å
48	L	94.1	Very high	93.7	Very high	69 Å²	69	81 Å²	81	36%	0.361	38%	0.379	S	S	.	.	H	α-helix	trans	-58.2	-46.6	177.9	-178.1	61.8	0	0	0	112.2	F44 R45 Q46 K50 I51 I52 F155	F44-L48 WeakPolarHBondContact O-CB 3.46Å; F44-L48 PolarHBondContact O-N 3.01Å; R45-L48 PolarHBondContact O-N 2.85Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.03Å; L48-K50 VanDerWaalsContact C-N 3.35Å; L48-I51 PolarHBondContact O-N 3.13Å; L48-I52 HydrophobicContact CD1-CD1 4.47Å; L48-I52 HydrophobicContact CG-CD1 4.33Å; L48-I52 WeakPolarHBondContact O-CG1 3.37Å; L48-I52 PolarHBondContact O-N 3.29Å; L48-I52 VanDerWaalsContact O-N 3.11Å; L48-F155 HydrophobicContact CB-CE2 4.07Å; L48-F155 HydrophobicContact CD1-CE2 3.86Å; L48-F155 HydrophobicContact CD1-CZ 4.06Å; L48-F155 HydrophobicContact CG-CE2 4.47Å
49	R	95.6	Very high	93.7	Very high	176 Å²	176	79 Å²	79	66%	0.664	38%	0.377	S	S	*	.	H	α-helix	trans	-60	-47.1	175.8	-70.4	178.4	-173.7	-178.4	0.1	111	R45 Q46 I47 I51 I52 E53	R45-R49 WeakPolarHBondContact O-CG 3.42Å; R45-R49 PolarHBondContact O-N 2.83Å; R45-R49 VanDerWaalsContact O-N 3.12Å; Q46-R49 PolarHBondContact O-N 3.14Å; I47-R49 PolarHBondContact O-N 3.06Å; R49-I51 VanDerWaalsContact C-N 3.32Å; R49-I51 PolarHBondContact O-N 3.46Å; R49-I52 PolarHBondContact O-N 3Å; R49-I52 VanDerWaalsContact O-N 3.16Å; R49-E53 WeakPolarHBondContact O-CG 3.34Å; R49-E53 PolarHBondContact O-N 3.39Å
50	K	94.6	Very high	93.8	Very high	115 Å²	115	82.1 Å²	82.1	50%	0.5	38%	0.383	S	S	.	.	H	α-helix	trans	-61.1	-39.4	178.3	-164.1	173.9	-178.7	-179	0	112.3	Q46 I47 L48 E53 T54 L151	Q46-K50 PolarHBondContact O-N 2.96Å; Q46-K50 VanDerWaalsContact O-N 3.09Å; I47-K50 PolarHBondContact O-N 3.29Å; L48-K50 VanDerWaalsContact C-N 3.35Å; K50-E53 PolarHBondContact O-N 3.46Å; K50-T54 WeakPolarHBondContact O-CB 3.31Å; K50-T54 PolarHBondContact O-N 3.46Å; K50-T54 PolarHBondContact O-OG1 3.26Å; K50-L151 HydrophobicContact CB-CD1 4.42Å; K50-L151 HydrophobicContact CD-CD1 4.08Å; K50-L151 HydrophobicContact CD-CD2 4.12Å; K50-L151 HydrophobicContact CG-CD1 3.89Å
51	I	95.4	Very high	93.9	Very high	20 Å²	20	83.5 Å²	83.5	10%	0.103	39%	0.392	C	S	.	.	H	α-helix	trans	-61.2	-45.5	175.4	-74.2	172	0	0	0	110.8	I47 L48 R49 K55 L148 L151 F155	I47-I51 HydrophobicContact CG2-CD1 3.75Å; I47-I51 HydrophobicContact CG2-CG1 4.17Å; I47-I51 WeakPolarHBondContact O-CG1 3.48Å; I47-I51 PolarHBondContact O-N 3.02Å; L48-I51 PolarHBondContact O-N 3.13Å; R49-I51 VanDerWaalsContact C-N 3.32Å; R49-I51 PolarHBondContact O-N 3.46Å; I51-K55 WeakPolarHBondContact O-CB 3.49Å; I51-K55 PolarHBondContact O-N 3.21Å; I51-L148 HydrophobicContact CG2-CD1 4.3Å; I51-L151 HydrophobicContact CD1-CB 4.16Å; I51-L151 HydrophobicContact CG1-CB 3.66Å; I51-L151 HydrophobicContact CG1-CD1 4.34Å; I51-F155 HydrophobicContact CD1-CB 3.75Å; I51-F155 HydrophobicContact CD1-CD2 3.99Å; I51-F155 HydrophobicContact CD1-CG 3.94Å
52	I	95.1	Very high	94	Very high	102 Å²	102	85.7 Å²	85.7	52%	0.523	40%	0.399	S	S	.	.	H	α-helix	trans	-63.1	-47.6	-179.9	-65.5	165.8	0	0	0	109.9	L48 R49 K55 T56	L48-I52 HydrophobicContact CD1-CD1 4.47Å; L48-I52 HydrophobicContact CG-CD1 4.33Å; L48-I52 WeakPolarHBondContact O-CG1 3.37Å; L48-I52 PolarHBondContact O-N 3.29Å; L48-I52 VanDerWaalsContact O-N 3.11Å; R49-I52 PolarHBondContact O-N 3Å; R49-I52 VanDerWaalsContact O-N 3.16Å; I52-K55 PolarHBondContact O-N 2.96Å; I52-T56 PolarHBondContact O-N 3.47Å; I52-T56 PolarHBondContact O-OG1 3.03Å; I52-T56 VanDerWaalsContact O-OG1 3.08Å
53	E	94.8	Very high	94.1	Very high	111 Å²	111	88.3 Å²	88.3	52%	0.519	40%	0.402	S	S	.	.	H	α-helix	trans	-59.7	-50.1	177.6	-70.3	171.4	-160	0	0	112.2	R49 K50 K55 T56 K57	R49-E53 WeakPolarHBondContact O-CG 3.34Å; R49-E53 PolarHBondContact O-N 3.39Å; K50-E53 PolarHBondContact O-N 3.46Å; E53-K55 VanDerWaalsContact C-N 3.32Å; E53-K55 PolarHBondContact O-N 3.3Å; E53-T56 PolarHBondContact O-N 2.91Å; E53-K57 WeakPolarHBondContact O-CG 3.28Å; E53-K57 PolarHBondContact O-N 2.93Å
54	T	94.4	Very high	94.3	Very high	11 Å²	11	86.2 Å²	86.2	7%	0.067	40%	0.398	C	S	.	.	H	α-helix	trans	-65.6	-35.5	179.4	-59.6	0	0	0	0	111.6	K50 K57 M58 L148	K50-T54 WeakPolarHBondContact O-CB 3.31Å; K50-T54 PolarHBondContact O-N 3.46Å; K50-T54 PolarHBondContact O-OG1 3.26Å; T54-K57 PolarHBondContact O-N 3.35Å; T54-M58 VanDerWaalsContact O-CB 3.26Å; T54-M58 WeakPolarHBondContact O-CB 3.43Å; T54-M58 PolarHBondContact O-N 2.95Å; T54-L148 HydrophobicContact CG2-CB 4.15Å; T54-L148 HydrophobicContact CG2-CD1 4.08Å
55	K	94.5	Very high	94.3	Very high	127 Å²	127	84.3 Å²	84.3	55%	0.552	39%	0.39	S	S	*	.	H	α-helix	trans	-66.2	-39.5	177.2	-172.8	175.2	-176.5	179.6	0	112	I51 I52 E53 M58 G59 L148	I51-K55 WeakPolarHBondContact O-CB 3.49Å; I51-K55 PolarHBondContact O-N 3.21Å; I52-K55 PolarHBondContact O-N 2.96Å; E53-K55 VanDerWaalsContact C-N 3.32Å; E53-K55 PolarHBondContact O-N 3.3Å; K55-M58 HydrophobicContact CG-CE 4.48Å; K55-G59 PolarHBondContact O-N 3.01Å; K55-G59 VanDerWaalsContact O-N 3.12Å; K55-L148 HydrophobicContact CB-CD1 4.5Å
56	T	94.9	Very high	94.3	Very high	84 Å²	84	78.7 Å²	78.7	52%	0.515	38%	0.38	S	S	.	.	H	α-helix	trans	-65.2	-48.3	174.4	-54.7	0	0	0	0	110.9	I52 E53 M58 G59 E60	I52-T56 PolarHBondContact O-N 3.47Å; I52-T56 PolarHBondContact O-OG1 3.03Å; I52-T56 VanDerWaalsContact O-OG1 3.08Å; E53-T56 PolarHBondContact O-N 2.91Å; T56-M58 VanDerWaalsContact C-N 3.32Å; T56-M58 PolarHBondContact O-N 3Å; T56-G59 PolarHBondContact O-N 2.71Å; T56-E60 PolarHBondContact O-N 2.71Å
57	K	94.3	Very high	94.4	Very high	115 Å²	115	80.9 Å²	80.9	50%	0.5	39%	0.389	S	S	.	.	H	α-helix	trans	-58.2	-42.2	176	-71.3	175.2	-179.3	177.1	0	112.3	E53 T54 G59 E60 V61	E53-K57 WeakPolarHBondContact O-CG 3.28Å; E53-K57 PolarHBondContact O-N 2.93Å; T54-K57 PolarHBondContact O-N 3.35Å; K57-G59 VanDerWaalsContact C-N 3.29Å; K57-G59 PolarHBondContact O-N 2.96Å; K57-E60 PolarHBondContact O-N 3.06Å; K57-V61 WeakPolarHBondContact O-CG2 3.29Å; K57-V61 PolarHBondContact O-N 3.29Å
58	M	93.4	Very high	94.3	Very high	38 Å²	38	80 Å²	80	19%	0.187	39%	0.385	C	S	.	.	H	α-helix	trans	-60	-39.9	175.5	-178.6	-168.3	76.5	0	0	111.6	T54 K55 T56 E60 V61 M62 L145 L148	T54-M58 VanDerWaalsContact O-CB 3.26Å; T54-M58 WeakPolarHBondContact O-CB 3.43Å; T54-M58 PolarHBondContact O-N 2.95Å; K55-M58 HydrophobicContact CG-CE 4.48Å; T56-M58 VanDerWaalsContact C-N 3.32Å; T56-M58 PolarHBondContact O-N 3Å; M58-E60 VanDerWaalsContact C-N 3.29Å; M58-E60 PolarHBondContact O-N 3.05Å; M58-V61 PolarHBondContact O-N 3.2Å; M58-M62 HydrophobicContact CG-CG 4.1Å; M58-M62 VanDerWaalsContact O-CB 3.26Å; M58-M62 WeakPolarHBondContact O-CB 3.47Å; M58-M62 VanDerWaalsContact O-CG 3.24Å; M58-M62 WeakPolarHBondContact O-CG 3.24Å; M58-M62 PolarHBondContact O-N 3.2Å; M58-L145 HydrophobicContact CG-CD2 4.32Å; M58-L145 HydrophobicContact SD-CD2 3.32Å; M58-L145 WeakPolarHBondContact SD-CD2 3.41Å; M58-L145 HydrophobicContact SD-CG 4.13Å; M58-L148 HydrophobicContact CE-CD2 3.91Å; M58-L148 HydrophobicContact SD-CD2 3.38Å; M58-L148 WeakPolarHBondContact SD-CD2 3.39Å
59	G	93.8	Very high	94.2	Very high	34 Å²	34	80 Å²	80	35%	0.351	39%	0.385	S	S	.	.	H	α-helix	trans	-60.9	-37.4	176.1	0	0	0	0	0	113.1	K55 T56 K57 R63	K55-G59 PolarHBondContact O-N 3.01Å; K55-G59 VanDerWaalsContact O-N 3.12Å; T56-G59 PolarHBondContact O-N 2.71Å; K57-G59 VanDerWaalsContact C-N 3.29Å; K57-G59 PolarHBondContact O-N 2.96Å; G59-R63 WeakPolarHBondContact O-CB 3.41Å; G59-R63 PolarHBondContact O-N 3.14Å
60	E	94.2	Very high	94	Very high	112 Å²	112	74.2 Å²	74.2	52%	0.523	38%	0.375	S	S	.	.	H	α-helix	trans	-70.3	-49.2	175.4	-65.6	174.1	174.9	0	0	111.6	T56 K57 M58 M62 R63 E64	T56-E60 PolarHBondContact O-N 2.71Å; K57-E60 PolarHBondContact O-N 3.06Å; M58-E60 VanDerWaalsContact C-N 3.29Å; M58-E60 PolarHBondContact O-N 3.05Å; E60-M62 VanDerWaalsContact C-N 3.35Å; E60-M62 PolarHBondContact O-N 3.27Å; E60-R63 WeakPolarHBondContact O-CB 3.49Å; E60-R63 PolarHBondContact O-N 3.15Å; E60-R63 VanDerWaalsContact O-N 3.13Å; E60-E64 PolarHBondContact O-N 3.25Å
61	V	95	Very high	93.8	Very high	29 Å²	29	72.3 Å²	72.3	18%	0.176	37%	0.368	C	S	.	.	H	α-helix	trans	-64.3	-38.7	-179.6	175.3	0	0	0	0	111.8	K57 M58 R63 E64 A65 A141 L144	K57-V61 WeakPolarHBondContact O-CG2 3.29Å; K57-V61 PolarHBondContact O-N 3.29Å; M58-V61 PolarHBondContact O-N 3.2Å; V61-R63 VanDerWaalsContact C-N 3.33Å; V61-E64 PolarHBondContact O-N 3.13Å; V61-A65 WeakPolarHBondContact O-CB 3.39Å; V61-A65 PolarHBondContact O-N 3.24Å; V61-A141 HydrophobicContact CG1-CB 3.96Å; V61-L144 HydrophobicContact CB-CD1 4.14Å; V61-L144 HydrophobicContact CG1-CD1 4.19Å; V61-L144 HydrophobicContact CG2-CD1 3.73Å
62	M	94	Very high	93.5	Very high	75 Å²	75	71.4 Å²	71.4	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-67.9	-33.4	175.2	-73.4	-68.4	-80.1	0	0	112.1	M58 E60 A66 A141 L145	M58-M62 HydrophobicContact CG-CG 4.1Å; M58-M62 VanDerWaalsContact O-CB 3.26Å; M58-M62 WeakPolarHBondContact O-CB 3.47Å; M58-M62 VanDerWaalsContact O-CG 3.24Å; M58-M62 WeakPolarHBondContact O-CG 3.24Å; M58-M62 PolarHBondContact O-N 3.2Å; E60-M62 VanDerWaalsContact C-N 3.35Å; E60-M62 PolarHBondContact O-N 3.27Å; M62-A66 VanDerWaalsContact O-CB 3.28Å; M62-A66 WeakPolarHBondContact O-CB 3.47Å; M62-A66 PolarHBondContact O-N 3.07Å; M62-A141 HydrophobicContact SD-CB 3.78Å; M62-L145 HydrophobicContact SD-CD1 4.45Å
63	R	94.8	Very high	93.3	Very high	180 Å²	180	72 Å²	72	68%	0.679	36%	0.362	S	S	*	.	H	α-helix	trans	-66.7	-44.3	174	-170.6	-170.8	-56.7	147	4.6	111	G59 E60 V61 A66 F67	G59-R63 WeakPolarHBondContact O-CB 3.41Å; G59-R63 PolarHBondContact O-N 3.14Å; E60-R63 WeakPolarHBondContact O-CB 3.49Å; E60-R63 PolarHBondContact O-N 3.15Å; E60-R63 VanDerWaalsContact O-N 3.13Å; V61-R63 VanDerWaalsContact C-N 3.33Å; R63-A66 PolarHBondContact O-N 2.86Å; R63-F67 WeakPolarHBondContact O-CB 3.45Å; R63-F67 PolarHBondContact O-N 3.3Å
64	E	93.9	Very high	93	Very high	91 Å²	91	75.6 Å²	75.6	43%	0.425	38%	0.376	S	S	.	.	H	α-helix	trans	-60.8	-47	174.5	-172.2	-173.5	159.7	0	0	111	E60 V61 A66 F67 S68 R140	E60-E64 PolarHBondContact O-N 3.25Å; V61-E64 PolarHBondContact O-N 3.13Å; E64-A66 PolarHBondContact O-N 2.9Å; E64-F67 PolarHBondContact O-N 2.91Å; E64-S68 PolarHBondContact O-N 3.07Å; E64-S68 PolarHBondContact O-OG 3.21Å; E64-R140 IonicContact OE1-NH2 3.06Å
65	A	93.8	Very high	92.8	Very high	0 Å²	0	78 Å²	78	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-61.7	-42.2	177.6	0	0	0	0	0	112.6	V61 F67 S68 L69 N137 Y138	V61-A65 WeakPolarHBondContact O-CB 3.39Å; V61-A65 PolarHBondContact O-N 3.24Å; A65-F67 VanDerWaalsContact C-N 3.33Å; A65-F67 PolarHBondContact O-N 3.33Å; A65-S68 PolarHBondContact O-N 3.49Å; A65-L69 PolarHBondContact O-N 3.4Å; A65-N137 HydrophobicContact CB-CB 4.21Å; A65-Y138 HydrophobicContact CB-CD2 4.02Å; A65-Y138 HydrophobicContact CB-CE1 4.4Å; A65-Y138 HydrophobicContact CB-CE2 3.85Å; A65-Y138 HydrophobicContact CB-CG 4.37Å; A65-Y138 WeakPolarHBondContact O-CE2 3.44Å
66	A	93.8	Very high	92.2	Very high	52 Å²	52	73.4 Å²	73.4	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-65.2	-36.7	175.9	0	0	0	0	0	112.3	M62 R63 E64 L69 A70	M62-A66 VanDerWaalsContact O-CB 3.28Å; M62-A66 WeakPolarHBondContact O-CB 3.47Å; M62-A66 PolarHBondContact O-N 3.07Å; R63-A66 PolarHBondContact O-N 2.86Å; E64-A66 PolarHBondContact O-N 2.9Å; A66-L69 WeakPolarHBondContact O-CB 3.39Å; A66-L69 PolarHBondContact O-N 2.99Å; A66-A70 PolarHBondContact O-N 3.12Å
67	F	94.3	Very high	91.8	Very high	130 Å²	130	71 Å²	71	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-66.4	-45.3	174.4	-174.3	-103.7	0	0	0	111.6	R63 E64 A65 L69 A70 E71	R63-F67 WeakPolarHBondContact O-CB 3.45Å; R63-F67 PolarHBondContact O-N 3.3Å; E64-F67 PolarHBondContact O-N 2.91Å; A65-F67 VanDerWaalsContact C-N 3.33Å; A65-F67 PolarHBondContact O-N 3.33Å; F67-L69 PolarHBondContact O-N 3.39Å; F67-A70 WeakPolarHBondContact O-CB 3.33Å; F67-A70 PolarHBondContact O-N 3.07Å; F67-E71 HydrophobicContact CD1-CG 4.32Å; F67-E71 HydrophobicContact CE1-CG 4.02Å; F67-E71 WeakPolarHBondContact CE1-OE1 3.4Å; F67-E71 HydrophobicContact CZ-CG 4.42Å; F67-E71 PolarHBondContact O-N 2.98Å
68	S	92.4	Very high	91.3	Very high	10 Å²	10	70.2 Å²	70.2	7%	0.07	37%	0.37	C	S	.	.	H	α-helix	trans	-60.1	-30.3	173.8	-59.2	0	0	0	0	112.8	E64 A65 E71 A72 N137	E64-S68 PolarHBondContact O-N 3.07Å; E64-S68 PolarHBondContact O-OG 3.21Å; A65-S68 PolarHBondContact O-N 3.49Å; S68-E71 PolarHBondContact O-N 2.9Å; S68-A72 WeakPolarHBondContact O-CB 3.42Å; S68-A72 PolarHBondContact O-N 2.94Å; S68-N137 PolarHBondContact OG-ND2 3.2Å
69	L	91.4	Very high	90.9	Very high	68 Å²	68	70.3 Å²	70.3	36%	0.356	37%	0.369	S	S	.	.	H	α-helix	trans	-65	-42.6	173.5	-169.8	153.7	0	0	0	111	A65 A66 F67 A72 K73 L134 Y138	A65-L69 PolarHBondContact O-N 3.4Å; A66-L69 WeakPolarHBondContact O-CB 3.39Å; A66-L69 PolarHBondContact O-N 2.99Å; F67-L69 PolarHBondContact O-N 3.39Å; L69-A72 PolarHBondContact O-N 3.26Å; L69-K73 WeakPolarHBondContact O-CB 3.25Å; L69-K73 PolarHBondContact O-N 2.92Å; L69-L134 VanDerWaalsContact CA-CD1 3.41Å; L69-L134 HydrophobicContact CB-CD1 3.73Å; L69-L134 HydrophobicContact CG-CD1 4.38Å; L69-L134 VanDerWaalsContact N-CD1 3.34Å; L69-Y138 HydrophobicContact CB-CE2 4.35Å; L69-Y138 HydrophobicContact CD1-CE2 4.26Å; L69-Y138 WeakPolarHBondContact CD1-OH 3.32Å
70	A	92.2	Very high	90.4	Very high	55 Å²	55	71 Å²	71	46%	0.455	37%	0.369	S	S	.	.	H	α-helix	trans	-63.1	-42.4	176.4	0	0	0	0	0	111.7	A66 F67 K73 F74	A66-A70 PolarHBondContact O-N 3.12Å; F67-A70 WeakPolarHBondContact O-CB 3.33Å; F67-A70 PolarHBondContact O-N 3.07Å; A70-K73 PolarHBondContact O-N 3.2Å; A70-F74 WeakPolarHBondContact O-CB 3.47Å; A70-F74 PolarHBondContact O-N 2.87Å
71	E	90.1	Very high	90	Very high	75 Å²	75	69.2 Å²	69.2	35%	0.35	37%	0.365	S	S	.	.	H	α-helix	trans	-62.3	-44.6	174.9	-66.3	-177.1	147.3	0	0	112.3	F67 S68 K73 F74 T75	F67-E71 HydrophobicContact CD1-CG 4.32Å; F67-E71 HydrophobicContact CE1-CG 4.02Å; F67-E71 WeakPolarHBondContact CE1-OE1 3.4Å; F67-E71 HydrophobicContact CZ-CG 4.42Å; F67-E71 PolarHBondContact O-N 2.98Å; S68-E71 PolarHBondContact O-N 2.9Å; E71-K73 VanDerWaalsContact C-N 3.33Å; E71-K73 PolarHBondContact O-N 2.9Å; E71-F74 PolarHBondContact O-N 2.92Å; E71-T75 WeakPolarHBondContact O-CG2 3.41Å; E71-T75 PolarHBondContact O-N 3.3Å; E71-T75 VanDerWaalsContact O-N 3.09Å; E71-T75 PolarHBondContact O-OG1 2.97Å
72	A	89.4	Confident	89.5	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-62.1	-42.1	176	0	0	0	0	0	111.1	S68 L69 T75 A76 F79 Q130 L134	S68-A72 WeakPolarHBondContact O-CB 3.42Å; S68-A72 PolarHBondContact O-N 2.94Å; L69-A72 PolarHBondContact O-N 3.26Å; A72-T75 PolarHBondContact O-N 3.37Å; A72-T75 PolarHBondContact O-OG1 3.41Å; A72-A76 VanDerWaalsContact O-CB 3.32Å; A72-A76 WeakPolarHBondContact O-CB 3.41Å; A72-A76 PolarHBondContact O-N 3.41Å; A72-F79 HydrophobicContact CB-CE1 3.89Å; A72-F79 HydrophobicContact CB-CZ 3.89Å; A72-Q130 HydrophobicContact CB-CB 4.36Å; A72-L134 HydrophobicContact CB-CD2 4.06Å
73	K	89.7	Confident	89.1	Confident	116 Å²	116	69.5 Å²	69.5	50%	0.504	37%	0.371	S	S	.	.	H	α-helix	trans	-67.8	-36.8	179.4	-169.5	173.4	-175.8	175.3	0	112.3	L69 A70 E71 G77 F79	L69-K73 WeakPolarHBondContact O-CB 3.25Å; L69-K73 PolarHBondContact O-N 2.92Å; A70-K73 PolarHBondContact O-N 3.2Å; E71-K73 VanDerWaalsContact C-N 3.33Å; E71-K73 PolarHBondContact O-N 2.9Å; K73-G77 CarbonylContact O-C 3.58Å; K73-G77 VanDerWaalsContact O-CA 3.29Å; K73-G77 WeakPolarHBondContact O-CA 3.13Å; K73-G77 PolarHBondContact O-N 2.85Å; K73-G77 VanDerWaalsContact O-N 3.11Å; K73-F79 HydrophobicContact CB-CE1 4.36Å
74	F	89.7	Confident	88.8	Confident	186 Å²	186	67 Å²	67	82%	0.816	37%	0.37	S	S	*	.	H	α-helix	trans	-64.9	-39.7	175.4	-178.2	-101.8	0	0	0	112.2	A70 E71	A70-F74 WeakPolarHBondContact O-CB 3.47Å; A70-F74 PolarHBondContact O-N 2.87Å; E71-F74 PolarHBondContact O-N 2.92Å
75	T	88.3	Confident	88.4	Confident	60 Å²	60	70 Å²	70	37%	0.368	38%	0.384	S	S	.	.	H	α-helix	trans	-86.7	-44.3	-174.7	51.6	0	0	0	0	114.1	E71 A72 Q130	E71-T75 WeakPolarHBondContact O-CG2 3.41Å; E71-T75 PolarHBondContact O-N 3.3Å; E71-T75 VanDerWaalsContact O-N 3.09Å; E71-T75 PolarHBondContact O-OG1 2.97Å; A72-T75 PolarHBondContact O-N 3.37Å; A72-T75 PolarHBondContact O-OG1 3.41Å; T75-Q130 HydrophobicContact CG2-CG 4.24Å
76	A	83.9	Confident	88	Confident	32 Å²	32	74.7 Å²	74.7	26%	0.264	41%	0.409	S	S	.	.	H	α-helix	trans	-92.1	-10	-176.4	0	0	0	0	0	113.4	A72 F79	A72-A76 VanDerWaalsContact O-CB 3.32Å; A72-A76 WeakPolarHBondContact O-CB 3.41Å; A72-A76 PolarHBondContact O-N 3.41Å; A76-F79 HydrophobicContact CB-CD1 3.99Å; A76-F79 HydrophobicContact CB-CE1 4.49Å
77	G	84.5	Confident	87.6	Confident	33 Å²	33	77 Å²	77	34%	0.34	42%	0.417	S	S	.	.			trans	76.8	-151.4	-172.2	0	0	0	0	0	112	K73 F79	K73-G77 CarbonylContact O-C 3.58Å; K73-G77 VanDerWaalsContact O-CA 3.29Å; K73-G77 WeakPolarHBondContact O-CA 3.13Å; K73-G77 PolarHBondContact O-N 2.85Å; K73-G77 VanDerWaalsContact O-N 3.11Å; G77-F79 WeakPolarHBondContact O-CD1 3.42Å; G77-F79 PolarHBondContact O-N 2.88Å
78	D	84.8	Confident	87.1	Confident	99 Å²	99	77.8 Å²	77.8	53%	0.529	43%	0.428	S	S	.	.			trans	-86.5	96.5	-179.3	-164.4	10.6	0	0	0	111.9	S80	D78-S80 WeakPolarHBondContact OD1-CB 3.5Å; D78-S80 PolarHBondContact OD1-N 3.02Å; D78-S80 PolarHBondContact OD1-OG 3.44Å
79	F	84.3	Confident	86.7	Confident	40 Å²	40	85.4 Å²	85.4	18%	0.175	46%	0.46	C	S	.	.			trans	-98.3	1.4	174.2	59.9	-92.5	0	0	0	113	A72 K73 A76 G77 T81 T82 V83 L131 L134	A72-F79 HydrophobicContact CB-CE1 3.89Å; A72-F79 HydrophobicContact CB-CZ 3.89Å; K73-F79 HydrophobicContact CB-CE1 4.36Å; A76-F79 HydrophobicContact CB-CD1 3.99Å; A76-F79 HydrophobicContact CB-CE1 4.49Å; G77-F79 WeakPolarHBondContact O-CD1 3.42Å; G77-F79 PolarHBondContact O-N 2.88Å; F79-T81 PolarHBondContact O-N 3.44Å; F79-T82 PolarHBondContact O-N 2.94Å; F79-V83 HydrophobicContact CD2-CG2 3.98Å; F79-V83 WeakPolarHBondContact O-CG2 3.43Å; F79-V83 PolarHBondContact O-N 2.84Å; F79-V83 VanDerWaalsContact O-N 3.12Å; F79-L131 HydrophobicContact CD1-CD1 4.46Å; F79-L131 HydrophobicContact CD2-CD1 3.89Å; F79-L131 HydrophobicContact CE1-CD1 4.27Å; F79-L131 HydrophobicContact CE2-CD1 3.68Å; F79-L131 HydrophobicContact CG-CD1 4.28Å; F79-L131 HydrophobicContact CZ-CD1 3.89Å; F79-L134 HydrophobicContact CE2-CD2 4.07Å; F79-L134 HydrophobicContact CZ-CD2 3.92Å
80	S	85	Confident	86.4	Confident	49 Å²	49	85.2 Å²	85.2	34%	0.343	47%	0.468	S	S	.	.	H	α-helix	trans	-64	-44.2	-172.2	64.9	0	0	0	0	112.6	D78 V83 I84	D78-S80 WeakPolarHBondContact OD1-CB 3.5Å; D78-S80 PolarHBondContact OD1-N 3.02Å; D78-S80 PolarHBondContact OD1-OG 3.44Å; S80-V83 PolarHBondContact O-N 3.17Å; S80-I84 WeakPolarHBondContact O-CB 3.47Å; S80-I84 WeakPolarHBondContact O-CD1 3.35Å; S80-I84 WeakPolarHBondContact O-CG1 3.34Å; S80-I84 PolarHBondContact O-N 3.34Å
81	T	85.8	Confident	86.1	Confident	74 Å²	74	85.1 Å²	85.1	45%	0.454	46%	0.458	S	S	.	.	H	α-helix	trans	-61.7	-45.7	178.2	50.1	0	0	0	0	111.7	F79 V83 I84 Q85	F79-T81 PolarHBondContact O-N 3.44Å; T81-V83 VanDerWaalsContact C-N 3.34Å; T81-V83 PolarHBondContact O-N 3.19Å; T81-I84 PolarHBondContact O-N 3.42Å; T81-Q85 WeakPolarHBondContact O-CB 3.47Å; T81-Q85 VanDerWaalsContact O-CG 3.31Å; T81-Q85 WeakPolarHBondContact O-CG 3.45Å; T81-Q85 PolarHBondContact O-N 3.41Å
82	T	84.3	Confident	86	Confident	61 Å²	61	84.3 Å²	84.3	37%	0.374	46%	0.458	S	S	.	.	H	α-helix	trans	-60.5	-42	177.6	-52.1	0	0	0	0	112.1	F79 N86	F79-T82 PolarHBondContact O-N 2.94Å; T82-N86 VanDerWaalsContact O-CB 3.29Å; T82-N86 WeakPolarHBondContact O-CB 3.36Å; T82-N86 PolarHBondContact O-N 2.92Å; T82-N86 VanDerWaalsContact O-N 3.15Å; T82-N86 PolarHBondContact O-ND2 3.34Å
83	V	85.9	Confident	86.1	Confident	49 Å²	49	88.7 Å²	88.7	30%	0.297	48%	0.477	S	S	.	.	H	α-helix	trans	-68.5	-43.1	178.1	174.2	0	0	0	0	111	F79 S80 T81 N86 V87 Y119	F79-V83 HydrophobicContact CD2-CG2 3.98Å; F79-V83 WeakPolarHBondContact O-CG2 3.43Å; F79-V83 PolarHBondContact O-N 2.84Å; F79-V83 VanDerWaalsContact O-N 3.12Å; S80-V83 PolarHBondContact O-N 3.17Å; T81-V83 VanDerWaalsContact C-N 3.34Å; T81-V83 PolarHBondContact O-N 3.19Å; V83-N86 PolarHBondContact O-N 3.38Å; V83-V87 WeakPolarHBondContact O-CG2 3.4Å; V83-Y119 HydrophobicContact CG1-CE1 4.34Å
84	I	87.8	Confident	86.3	Confident	127 Å²	127	86.7 Å²	86.7	65%	0.651	48%	0.475	S	S	*	.	H	α-helix	trans	-67.3	-38.1	-179	-67	164.4	0	0	0	111.5	S80 T81	S80-I84 WeakPolarHBondContact O-CB 3.47Å; S80-I84 WeakPolarHBondContact O-CD1 3.35Å; S80-I84 WeakPolarHBondContact O-CG1 3.34Å; S80-I84 PolarHBondContact O-N 3.34Å; T81-I84 PolarHBondContact O-N 3.42Å
85	Q	86.3	Confident	86.4	Confident	154 Å²	154	84.1 Å²	84.1	72%	0.72	46%	0.46	S	S	*	.	H	α-helix	trans	-74.2	-32.6	179.8	-73.1	179.2	-20.3	0	0	112.9	T81 V87	T81-Q85 WeakPolarHBondContact O-CB 3.47Å; T81-Q85 VanDerWaalsContact O-CG 3.31Å; T81-Q85 WeakPolarHBondContact O-CG 3.45Å; T81-Q85 PolarHBondContact O-N 3.41Å; Q85-V87 VanDerWaalsContact C-N 3.33Å; Q85-V87 PolarHBondContact O-N 3.04Å
86	N	84.1	Confident	86.6	Confident	99 Å²	99	85.3 Å²	85.3	53%	0.529	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	33.7	-175.8	-70.1	-31.2	0	0	0	114.1	T82 V83 Y119	T82-N86 VanDerWaalsContact O-CB 3.29Å; T82-N86 WeakPolarHBondContact O-CB 3.36Å; T82-N86 PolarHBondContact O-N 2.92Å; T82-N86 VanDerWaalsContact O-N 3.15Å; T82-N86 PolarHBondContact O-ND2 3.34Å; V83-N86 PolarHBondContact O-N 3.38Å; N86-Y119 HydrophobicContact CB-CE1 4.26Å; N86-Y119 PolarHBondContact O-OH 3.46Å
87	V	85.5	Confident	87	Confident	99 Å²	99	89 Å²	89	60%	0.6	49%	0.485	S	S	*	.			trans	-89.3	117.5	174.5	-175.4	0	0	0	0	110	V83 Q85	V83-V87 WeakPolarHBondContact O-CG2 3.4Å; Q85-V87 VanDerWaalsContact C-N 3.33Å; Q85-V87 PolarHBondContact O-N 3.04Å
88	N	83.7	Confident	87.4	Confident	147 Å²	147	96 Å²	96	79%	0.786	51%	0.506	S	S	*	.			trans	-120.8	-69.8	176	-171.4	-9.3	0	0	0	112.1
89	K	84.8	Confident	87.8	Confident	171 Å²	171	95.3 Å²	95.3	74%	0.743	50%	0.503	S	S	*	.	S	Bend	trans	-116.1	142.7	179.7	-65.2	-175.7	-179.1	179	0	110.8
90	A	85.3	Confident	88	Confident	63 Å²	63	98.3 Å²	98.3	52%	0.521	52%	0.521	S	S	.	.			trans	-73.3	126.4	174.7	0	0	0	0	0	110.7
91	Q	85.9	Confident	88.1	Confident	53 Å²	53	97.1 Å²	97.1	25%	0.248	51%	0.511	C	S	.	.	S	Bend	trans	-76.5	-34.7	174.3	-170.3	-174.9	7.5	0	0	112	Q113 E114	Q91-Q113 HydrophobicContact CG-CG 4.14Å; Q91-Q113 VanDerWaalsContact NE2-NE2 3.11Å; Q91-Q113 WeakPolarHBondContact O-CA 3.44Å; Q91-E114 PolarHBondContact O-N 2.92Å
92	V	88.3	Confident	88	Confident	59 Å²	59	96.1 Å²	96.1	36%	0.358	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.9	178.3	-177.5	0	0	0	0	108.9	V142	V92-V142 HydrophobicContact CG1-CG1 4.29Å
93	K	90.9	Very high	88	Confident	91 Å²	91	95.8 Å²	95.8	40%	0.396	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	161.3	176.4	-64.2	-176.7	-173	171	0	110	Y112 E114	K93-Y112 PolarHBondContact N-O 3.25Å; K93-Y112 PolarHBondContact O-N 3.35Å; K93-E114 WeakPolarHBondContact CD-OE2 3.25Å; K93-E114 WeakPolarHBondContact CE-OE2 3.45Å; K93-E114 IonicContact NZ-OE1 2.86Å; K93-E114 IonicContact NZ-OE2 3.76Å; K93-E114 PolarHBondContact NZ-OE2 2.91Å
94	V	92.9	Very high	88.2	Confident	75 Å²	75	94.5 Å²	94.5	46%	0.455	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.1	179.2	-178.3	0	0	0	0	109.1	F109 V146	V94-F109 HydrophobicContact CG1-CB 3.62Å; V94-F109 HydrophobicContact CG1-CD1 3.74Å; V94-F109 HydrophobicContact CG1-CG 3.94Å; V94-V146 HydrophobicContact CG1-CG1 4.18Å; V94-V146 HydrophobicContact CG2-CG1 4.24Å; V94-V146 HydrophobicContact CG2-CG2 3.8Å
95	R	92.9	Very high	88.4	Confident	132 Å²	132	93.1 Å²	93.1	50%	0.498	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.9	173.1	-72.5	-174.3	-73.9	177.2	-2	110	F109 E110	R95-F109 WeakPolarHBondContact O-CA 3.28Å; R95-E110 PolarHBondContact N-O 2.93Å; R95-E110 PolarHBondContact O-N 2.79Å
96	A	92.5	Very high	88.6	Confident	85 Å²	85	86 Å²	86	70%	0.702	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.2	174.2	0	0	0	0	0	110.1	F109	A96-F109 HydrophobicContact CB-CD1 4.48Å; A96-F109 HydrophobicContact CB-CE1 4.4Å
97	K	92.6	Very high	89	Confident	109 Å²	109	83.2 Å²	83.2	47%	0.474	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153.2	173.3	-172.9	172.6	-177.6	-178.5	0	109.2	V108 E110	K97-V108 PolarHBondContact N-O 2.64Å; K97-V108 PolarHBondContact O-N 3.06Å; K97-E110 HydrophobicContact CD-CG 4.35Å; K97-E110 WeakPolarHBondContact CD-OE1 3.4Å; K97-E110 WeakPolarHBondContact CE-OE1 3.48Å; K97-E110 IonicContact NZ-OE1 3.07Å; K97-E110 PolarHBondContact NZ-OE1 3.16Å
98	K	92.8	Very high	89.3	Confident	179 Å²	179	80.2 Å²	80.2	78%	0.778	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.4	174.6	-63.8	179.3	-179.5	178.2	0	108.5
99	D	91.8	Very high	89.9	Confident	85 Å²	85	76.3 Å²	76.3	46%	0.455	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	146.7	170.2	-170.8	18.4	0	0	0	109.5	T105 L106 V108	D99-T105 CarbonylContact O-C 3.5Å; D99-T105 WeakPolarHBondContact O-CA 3.46Å; D99-L106 PolarHBondContact N-O 3.41Å; D99-L106 PolarHBondContact O-N 2.97Å; D99-V108 HydrophobicContact CB-CG2 3.59Å
100	N	90	Very high	90.1	Very high	103 Å²	103	71.7 Å²	71.7	55%	0.551	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	114.7	-176.9	-175.4	5.8	0	0	0	110.7	G103 V104	N100-G103 VanDerWaalsContact OD1-CA 3.23Å; N100-G103 WeakPolarHBondContact OD1-CA 3.37Å; N100-G103 PolarHBondContact OD1-N 2.66Å; N100-G103 VanDerWaalsContact OD1-N 3.12Å; N100-V104 PolarHBondContact OD1-N 3.4Å; N100-V104 PolarHBondContact OD1-O 2.97Å
101	V	86.1	Confident	90.3	Very high	25 Å²	25	73.2 Å²	73.2	15%	0.152	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	111.8	178.5	-178.3	0	0	0	0	109.1	R43 G103 V104 L106	R43-V101 HydrophobicContact CB-CG1 4.3Å; R43-V101 HydrophobicContact CG-CG1 3.83Å; V101-G103 PolarHBondContact O-N 3.49Å; V101-G103 VanDerWaalsContact O-N 3.11Å; V101-V104 PolarHBondContact N-O 3.18Å; V101-V104 PolarHBondContact O-N 2.93Å; V101-L106 HydrophobicContact CB-CD1 4.03Å; V101-L106 HydrophobicContact CG2-CD1 3.63Å; V101-L106 HydrophobicContact CG2-CG 4.48Å
102	A	82.8	Confident	90.4	Very high	53 Å²	53	75.2 Å²	75.2	44%	0.438	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	33.7	178	0	0	0	0	0	114.3	K36 L40	K36-A102 WeakPolarHBondContact CE-O 3.45Å; K36-A102 PolarHBondContact NZ-O 3.23Å; L40-A102 HydrophobicContact CD2-CB 4Å; L40-A102 HydrophobicContact CG-CB 4.4Å
103	G	85.4	Confident	90.2	Very high	53 Å²	53	77.9 Å²	77.9	55%	0.546	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	23.7	-179.1	0	0	0	0	0	114	N100 V101	N100-G103 VanDerWaalsContact OD1-CA 3.23Å; N100-G103 WeakPolarHBondContact OD1-CA 3.37Å; N100-G103 PolarHBondContact OD1-N 2.66Å; N100-G103 VanDerWaalsContact OD1-N 3.12Å; V101-G103 PolarHBondContact O-N 3.49Å; V101-G103 VanDerWaalsContact O-N 3.11Å
104	V	90	Very high	89.6	Confident	23 Å²	23	77.9 Å²	77.9	14%	0.139	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.5	166.8	-178.2	0	0	0	0	107.4	L40 N100 V101 L106 A161	L40-V104 HydrophobicContact CD1-CG2 4.09Å; L40-V104 HydrophobicContact CD2-CG2 4.01Å; N100-V104 PolarHBondContact OD1-N 3.4Å; N100-V104 PolarHBondContact OD1-O 2.97Å; V101-V104 PolarHBondContact N-O 3.18Å; V101-V104 PolarHBondContact O-N 2.93Å; V104-L106 HydrophobicContact CG1-CD2 4.05Å; V104-L106 PolarHBondContact O-N 3.35Å; V104-A161 HydrophobicContact CG1-CB 3.88Å; V104-A161 HydrophobicContact CG2-CB 3.96Å
105	T	91.7	Very high	88.6	Confident	98 Å²	98	77.4 Å²	77.4	60%	0.601	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	113.7	177.6	52.3	0	0	0	0	110.1	D99	D99-T105 CarbonylContact O-C 3.5Å; D99-T105 WeakPolarHBondContact O-CA 3.46Å
106	L	90.8	Very high	87.4	Confident	5 Å²	5	74.1 Å²	74.1	3%	0.026	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.3	177.5	-55.8	177.6	0	0	0	109.8	D99 V101 V104 L158	D99-L106 PolarHBondContact N-O 3.41Å; D99-L106 PolarHBondContact O-N 2.97Å; V101-L106 HydrophobicContact CB-CD1 4.03Å; V101-L106 HydrophobicContact CG2-CD1 3.63Å; V101-L106 HydrophobicContact CG2-CG 4.48Å; V104-L106 HydrophobicContact CG1-CD2 4.05Å; V104-L106 PolarHBondContact O-N 3.35Å; L106-L158 HydrophobicContact CD1-CD1 3.96Å; L106-L158 HydrophobicContact CD2-CB 4Å; L106-L158 HydrophobicContact CD2-CD1 4.23Å
107	P	91.9	Very high	86.3	Confident	40 Å²	40	73 Å²	73	26%	0.26	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	124.2	169.7	31.4	-32.6	0	0	0	109.8	T153 S154 T157	P107-T153 HydrophobicContact CG-CG2 3.7Å; P107-S154 PolarHBondContact O-OG 2.84Å; P107-T157 HydrophobicContact CG-CG2 4.33Å
108	V	93.3	Very high	85.2	Confident	35 Å²	35	71.3 Å²	71.3	21%	0.212	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.2	177.3	178.6	0	0	0	0	108.2	K97 D99 S150	K97-V108 PolarHBondContact N-O 2.64Å; K97-V108 PolarHBondContact O-N 3.06Å; D99-V108 HydrophobicContact CB-CG2 3.59Å; V108-S150 WeakPolarHBondContact CA-OG 3.43Å; V108-S150 VanDerWaalsContact CG1-OG 3.28Å; V108-S150 WeakPolarHBondContact CG1-OG 3.48Å
109	F	94.3	Very high	84.2	Confident	65 Å²	65	65.1 Å²	65.1	29%	0.285	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	131.8	176	-62.1	-61.5	0	0	0	110.9	V94 R95 A96 V146 S150 T153	V94-F109 HydrophobicContact CG1-CB 3.62Å; V94-F109 HydrophobicContact CG1-CD1 3.74Å; V94-F109 HydrophobicContact CG1-CG 3.94Å; R95-F109 WeakPolarHBondContact O-CA 3.28Å; A96-F109 HydrophobicContact CB-CD1 4.48Å; A96-F109 HydrophobicContact CB-CE1 4.4Å; F109-V146 HydrophobicContact CB-CG1 3.94Å; F109-S150 PolarHBondContact N-OG 2.97Å; F109-T153 HydrophobicContact CE2-CG2 4.36Å
110	E	89.8	Confident	83.2	Confident	75 Å²	75	68 Å²	68	35%	0.35	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.9	171.4	-72.3	-176.6	169.8	0	0	109.3	R95 K97	R95-E110 PolarHBondContact N-O 2.93Å; R95-E110 PolarHBondContact O-N 2.79Å; K97-E110 HydrophobicContact CD-CG 4.35Å; K97-E110 WeakPolarHBondContact CD-OE1 3.4Å; K97-E110 WeakPolarHBondContact CE-OE1 3.48Å; K97-E110 IonicContact NZ-OE1 3.07Å; K97-E110 PolarHBondContact NZ-OE1 3.16Å
111	H	90	Very high	82.3	Confident	94 Å²	94	69.8 Å²	69.8	44%	0.435	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	140.6	173.5	84.6	-97.3	0	0	0	109.4	E143 V146	H111-E143 IonicContact CE1-OE1 3.08Å; H111-E143 PolarHBondContact CE1-OE1 2.99Å; H111-E143 IonicContact ND1-OE1 3.66Å; H111-E143 IonicContact NE2-OE1 2.79Å; H111-V146 HydrophobicContact CB-CG1 4.38Å
112	Y	88.2	Confident	81.6	Confident	95 Å²	95	70 Å²	70	37%	0.373	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	128.6	174.5	179.7	-111	0	0	0	109.8	K93 E114	K93-Y112 PolarHBondContact N-O 3.25Å; K93-Y112 PolarHBondContact O-N 3.35Å; Y112-E114 HydrophobicContact CD1-CB 4.08Å; Y112-E114 HydrophobicContact CE1-CB 3.64Å; Y112-E114 HydrophobicContact CE1-CG 3.82Å
113	Q	84.4	Confident	81	Confident	115 Å²	115	68.9 Å²	68.9	54%	0.537	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.5	176.3	-162.7	172.5	14.5	0	0	109.1	Q91	Q91-Q113 HydrophobicContact CG-CG 4.14Å; Q91-Q113 VanDerWaalsContact NE2-NE2 3.11Å; Q91-Q113 WeakPolarHBondContact O-CA 3.44Å
114	E	77.4	Confident	80.3	Confident	92 Å²	92	72.5 Å²	72.5	43%	0.43	41%	0.408	S	S	.	.			trans	-123.8	108.3	-178.5	-160.6	-178.1	159	0	0	109.1	Q91 K93 Y112	Q91-E114 PolarHBondContact O-N 2.92Å; K93-E114 WeakPolarHBondContact CD-OE2 3.25Å; K93-E114 WeakPolarHBondContact CE-OE2 3.45Å; K93-E114 IonicContact NZ-OE1 2.86Å; K93-E114 IonicContact NZ-OE2 3.76Å; K93-E114 PolarHBondContact NZ-OE2 2.91Å; Y112-E114 HydrophobicContact CD1-CB 4.08Å; Y112-E114 HydrophobicContact CE1-CB 3.64Å; Y112-E114 HydrophobicContact CE1-CG 3.82Å
115	G	72.1	Confident	79.4	Confident	64 Å²	64	76.3 Å²	76.3	66%	0.66	44%	0.442	S	S	*	.	S	Bend	trans	109.7	176	171.6	0	0	0	0	0	116.3
116	G	67.4	Low	78.6	Confident	64 Å²	64	81.2 Å²	81.2	66%	0.66	45%	0.449	S	S	*	.	S	Bend	trans	-83.5	166.6	175.3	0	0	0	0	0	113.4	S118	G116-S118 PolarHBondContact O-N 3.42Å; G116-S118 VanDerWaalsContact O-N 3.15Å
117	D	70	Confident	78.2	Confident	62 Å²	62	82.1 Å²	82.1	33%	0.332	46%	0.46	S	S	.	.			trans	-66.7	110.6	-177.5	-171.4	-5.2	0	0	0	110.7	Y119 E120 K135	D117-Y119 PolarHBondContact O-N 2.9Å; D117-Y119 PolarHBondContact OD1-N 3.4Å; D117-E120 HydrophobicContact CB-CB 4.3Å; D117-K135 IonicContact OD1-NZ 3.1Å; D117-K135 PolarHBondContact OD1-NZ 3.04Å; D117-K135 IonicContact OD2-NZ 2.64Å; D117-K135 PolarHBondContact OD2-NZ 3.37Å
118	S	68	Low	77.8	Confident	73 Å²	73	81.7 Å²	81.7	51%	0.51	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-17.2	-178.5	-29.3	0	0	0	0	112.7	G116	G116-S118 PolarHBondContact O-N 3.42Å; G116-S118 VanDerWaalsContact O-N 3.15Å
119	Y	72.8	Confident	77.5	Confident	48 Å²	48	84.7 Å²	84.7	19%	0.188	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	21.7	-171.5	-61.6	-77.2	0	0	0	111.7	V83 N86 D117 L121 T122 K135	V83-Y119 HydrophobicContact CG1-CE1 4.34Å; N86-Y119 HydrophobicContact CB-CE1 4.26Å; N86-Y119 PolarHBondContact O-OH 3.46Å; D117-Y119 PolarHBondContact O-N 2.9Å; D117-Y119 PolarHBondContact OD1-N 3.4Å; Y119-L121 PolarHBondContact O-N 2.98Å; Y119-T122 HydrophobicContact CD1-CG2 3.91Å; Y119-T122 HydrophobicContact CG-CG2 4.48Å; Y119-T122 PolarHBondContact O-N 2.9Å; Y119-T122 PolarHBondContact O-OG1 3.05Å; Y119-K135 VanDerWaalsContact CB-NZ 3.3Å; Y119-K135 PolarHBondContact O-NZ 2.94Å
120	E	70.8	Confident	77.2	Confident	146 Å²	146	83.9 Å²	83.9	68%	0.682	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-33.4	-177.3	-167	169.2	-172.3	0	0	112.4	D117	D117-E120 HydrophobicContact CB-CB 4.3Å
121	L	71.2	Confident	77.1	Confident	141 Å²	141	80.8 Å²	80.8	74%	0.738	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-2.6	177.6	-73.9	101.2	0	0	0	115	Y119 L124	Y119-L121 PolarHBondContact O-N 2.98Å; L121-L124 HydrophobicContact CB-CD1 3.71Å; L121-L124 HydrophobicContact CD2-CD1 3.72Å; L121-L124 HydrophobicContact CG-CD1 3.72Å; L121-L124 WeakPolarHBondContact O-CG 3.46Å
122	T	72.2	Confident	76.9	Confident	30 Å²	30	78.1 Å²	78.1	18%	0.184	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	130	179.4	58.6	0	0	0	0	110.8	Y119 L131	Y119-T122 HydrophobicContact CD1-CG2 3.91Å; Y119-T122 HydrophobicContact CG-CG2 4.48Å; Y119-T122 PolarHBondContact O-N 2.9Å; Y119-T122 PolarHBondContact O-OG1 3.05Å; T122-L131 VanDerWaalsContact O-CD2 3.3Å; T122-L131 WeakPolarHBondContact O-CD2 3.3Å; T122-L131 WeakPolarHBondContact OG1-CD2 3.36Å
123	G	68.6	Low	77	Confident	28 Å²	28	79.1 Å²	79.1	29%	0.289	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	11.6	-179.7	0	0	0	0	0	115.6	A125 R126 G128	G123-A125 PolarHBondContact O-N 3.13Å; G123-R126 CarbonylContact O-C 3.32Å; G123-R126 VanDerWaalsContact O-C 3.32Å; G123-R126 PolarHBondContact O-N 2.95Å; G123-R126 VanDerWaalsContact O-O 3.09Å; G123-G128 WeakPolarHBondContact O-CA 3.36Å; G123-G128 PolarHBondContact O-N 3.35Å
124	L	71.9	Confident	77.3	Confident	130 Å²	130	74.3 Å²	74.3	68%	0.681	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-33.2	175.4	-80.8	170.3	0	0	0	113.3	L121	L121-L124 HydrophobicContact CB-CD1 3.71Å; L121-L124 HydrophobicContact CD2-CD1 3.72Å; L121-L124 HydrophobicContact CG-CD1 3.72Å; L121-L124 WeakPolarHBondContact O-CG 3.46Å
125	A	70.3	Confident	77.9	Confident	102 Å²	102	72.8 Å²	72.8	84%	0.843	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-40.3	179.9	0	0	0	0	0	112.8	G123	G123-A125 PolarHBondContact O-N 3.13Å
126	R	76.3	Confident	78.7	Confident	202 Å²	202	76.5 Å²	76.5	76%	0.762	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-155.7	136.3	179	-67.6	-171	177.3	176.6	-1.4	110.6	G123	G123-R126 CarbonylContact O-C 3.32Å; G123-R126 VanDerWaalsContact O-C 3.32Å; G123-R126 PolarHBondContact O-N 2.95Å; G123-R126 VanDerWaalsContact O-O 3.09Å
127	G	80.4	Confident	80	Confident	24 Å²	24	74.2 Å²	74.2	25%	0.247	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	12.2	168.2	0	0	0	0	0	116.9	E129 Q130 L131	G127-E129 VanDerWaalsContact C-N 3.31Å; G127-E129 PolarHBondContact O-N 3.13Å; G127-Q130 PolarHBondContact O-N 3.46Å; G127-L131 PolarHBondContact O-N 2.91Å
128	G	84.5	Confident	81	Confident	31 Å²	31	75.1 Å²	75.1	32%	0.32	39%	0.388	S	S	.	.	H	α-helix	trans	-55.3	-36.8	-178.7	0	0	0	0	0	115.3	G123 L131 S132	G123-G128 WeakPolarHBondContact O-CA 3.36Å; G123-G128 PolarHBondContact O-N 3.35Å; G128-L131 PolarHBondContact O-N 2.67Å; G128-S132 PolarHBondContact O-N 3.21Å
129	E	86.5	Confident	82.1	Confident	98 Å²	98	74.2 Å²	74.2	46%	0.458	39%	0.385	S	S	.	.	H	α-helix	trans	-64.1	-41.4	175.6	174.3	59.2	-167.8	0	0	111.9	G127 L131 S132 R133	G127-E129 VanDerWaalsContact C-N 3.31Å; G127-E129 PolarHBondContact O-N 3.13Å; E129-L131 VanDerWaalsContact C-N 3.31Å; E129-L131 PolarHBondContact O-N 3.42Å; E129-S132 PolarHBondContact O-N 3.24Å; E129-R133 WeakPolarHBondContact O-CG 3.29Å; E129-R133 PolarHBondContact O-N 3.23Å; E129-R133 IonicContact OE1-CZ 2.66Å; E129-R133 IonicContact OE1-NE 3.46Å; E129-R133 PolarHBondContact OE1-NE 2.95Å; E129-R133 IonicContact OE1-NH2 3.81Å; E129-R133 PolarHBondContact OE1-NH2 2.76Å; E129-R133 VanDerWaalsContact OE1-NH2 3.07Å
130	Q	88.1	Confident	83	Confident	48 Å²	48	77.5 Å²	77.5	22%	0.224	40%	0.397	C	S	.	.	H	α-helix	trans	-68.6	-34.6	176.8	-60.5	-59.3	-6.2	0	0	111.5	A72 T75 G127 R133 L134	A72-Q130 HydrophobicContact CB-CB 4.36Å; T75-Q130 HydrophobicContact CG2-CG 4.24Å; G127-Q130 PolarHBondContact O-N 3.46Å; Q130-R133 PolarHBondContact O-N 3.47Å; Q130-L134 WeakPolarHBondContact O-CB 3.42Å; Q130-L134 PolarHBondContact O-N 3.35Å
131	L	87.3	Confident	84.1	Confident	10 Å²	10	70.7 Å²	70.7	5%	0.052	37%	0.366	C	S	.	.	H	α-helix	trans	-68.7	-36.6	175	-156.5	71.3	0	0	0	112.2	F79 T122 G127 G128 E129 L134 K135	F79-L131 HydrophobicContact CD1-CD1 4.46Å; F79-L131 HydrophobicContact CD2-CD1 3.89Å; F79-L131 HydrophobicContact CE1-CD1 4.27Å; F79-L131 HydrophobicContact CE2-CD1 3.68Å; F79-L131 HydrophobicContact CG-CD1 4.28Å; F79-L131 HydrophobicContact CZ-CD1 3.89Å; T122-L131 VanDerWaalsContact O-CD2 3.3Å; T122-L131 WeakPolarHBondContact O-CD2 3.3Å; T122-L131 WeakPolarHBondContact OG1-CD2 3.36Å; G127-L131 PolarHBondContact O-N 2.91Å; G128-L131 PolarHBondContact O-N 2.67Å; E129-L131 VanDerWaalsContact C-N 3.31Å; E129-L131 PolarHBondContact O-N 3.42Å; L131-L134 HydrophobicContact CD1-CD2 3.98Å; L131-L134 WeakPolarHBondContact O-CB 3.29Å; L131-L134 PolarHBondContact O-N 3.15Å; L131-K135 WeakPolarHBondContact O-CG 3.4Å; L131-K135 PolarHBondContact O-N 2.92Å
132	S	87.6	Confident	85.1	Confident	38 Å²	38	66.8 Å²	66.8	27%	0.266	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-43.3	173.5	-171.5	0	0	0	0	111.8	G128 E129 K135 R136	G128-S132 PolarHBondContact O-N 3.21Å; E129-S132 PolarHBondContact O-N 3.24Å; S132-K135 PolarHBondContact O-N 2.91Å; S132-R136 WeakPolarHBondContact O-CG 3.42Å; S132-R136 PolarHBondContact O-N 3.44Å; S132-R136 PolarHBondContact OG-NH2 3.45Å
133	R	89.6	Confident	86	Confident	116 Å²	116	69.1 Å²	69.1	44%	0.438	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-44.8	173	-69.9	175.5	-173.3	-162.5	0.8	111.9	E129 Q130 K135 R136 N137	E129-R133 WeakPolarHBondContact O-CG 3.29Å; E129-R133 PolarHBondContact O-N 3.23Å; E129-R133 IonicContact OE1-CZ 2.66Å; E129-R133 IonicContact OE1-NE 3.46Å; E129-R133 PolarHBondContact OE1-NE 2.95Å; E129-R133 IonicContact OE1-NH2 3.81Å; E129-R133 PolarHBondContact OE1-NH2 2.76Å; E129-R133 VanDerWaalsContact OE1-NH2 3.07Å; Q130-R133 PolarHBondContact O-N 3.47Å; R133-K135 PolarHBondContact O-N 3.36Å; R133-R136 PolarHBondContact O-N 3.38Å; R133-N137 VanDerWaalsContact O-CG 3.28Å; R133-N137 PolarHBondContact O-N 3.39Å; R133-N137 PolarHBondContact O-OD1 3.42Å
134	L	90.8	Very high	87.2	Confident	14 Å²	14	69.8 Å²	69.8	7%	0.073	35%	0.353	C	S	.	.	H	α-helix	trans	-54.8	-50.8	174.3	-177.9	69.1	0	0	0	111.4	L69 A72 F79 Q130 L131 R136 N137 Y138	L69-L134 VanDerWaalsContact CA-CD1 3.41Å; L69-L134 HydrophobicContact CB-CD1 3.73Å; L69-L134 HydrophobicContact CG-CD1 4.38Å; L69-L134 VanDerWaalsContact N-CD1 3.34Å; A72-L134 HydrophobicContact CB-CD2 4.06Å; F79-L134 HydrophobicContact CE2-CD2 4.07Å; F79-L134 HydrophobicContact CZ-CD2 3.92Å; Q130-L134 WeakPolarHBondContact O-CB 3.42Å; Q130-L134 PolarHBondContact O-N 3.35Å; L131-L134 HydrophobicContact CD1-CD2 3.98Å; L131-L134 WeakPolarHBondContact O-CB 3.29Å; L131-L134 PolarHBondContact O-N 3.15Å; L134-R136 PolarHBondContact O-N 3.13Å; L134-N137 PolarHBondContact O-N 3.12Å; L134-Y138 HydrophobicContact CD1-CD2 3.56Å; L134-Y138 HydrophobicContact CD1-CE2 3.4Å; L134-Y138 VanDerWaalsContact CD1-CE2 3.4Å; L134-Y138 HydrophobicContact CG-CD2 3.96Å; L134-Y138 HydrophobicContact CG-CE2 4.2Å; L134-Y138 WeakPolarHBondContact O-CD2 3.33Å; L134-Y138 PolarHBondContact O-N 2.91Å
135	K	89.1	Confident	88.3	Confident	59 Å²	59	66.9 Å²	66.9	26%	0.257	34%	0.338	S	S	.	.	H	α-helix	trans	-57.5	-46	178	-73.6	179.9	-171.8	-175.9	0	111.9	D117 Y119 L131 S132 R133 N137 Y138 A139	D117-K135 IonicContact OD1-NZ 3.1Å; D117-K135 PolarHBondContact OD1-NZ 3.04Å; D117-K135 IonicContact OD2-NZ 2.64Å; D117-K135 PolarHBondContact OD2-NZ 3.37Å; Y119-K135 VanDerWaalsContact CB-NZ 3.3Å; Y119-K135 PolarHBondContact O-NZ 2.94Å; L131-K135 WeakPolarHBondContact O-CG 3.4Å; L131-K135 PolarHBondContact O-N 2.92Å; S132-K135 PolarHBondContact O-N 2.91Å; R133-K135 PolarHBondContact O-N 3.36Å; K135-N137 VanDerWaalsContact C-N 3.33Å; K135-N137 PolarHBondContact O-N 2.99Å; K135-Y138 PolarHBondContact O-N 3.02Å; K135-A139 VanDerWaalsContact O-CB 3.22Å; K135-A139 WeakPolarHBondContact O-CB 3.47Å; K135-A139 PolarHBondContact O-N 3.06Å
136	R	90	Very high	89.4	Confident	142 Å²	142	62.9 Å²	62.9	54%	0.536	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-39.7	177.9	-68	175.9	-165.5	147.9	4.4	111.8	S132 R133 L134 A139 R140	S132-R136 WeakPolarHBondContact O-CG 3.42Å; S132-R136 PolarHBondContact O-N 3.44Å; S132-R136 PolarHBondContact OG-NH2 3.45Å; R133-R136 PolarHBondContact O-N 3.38Å; L134-R136 PolarHBondContact O-N 3.13Å; R136-A139 PolarHBondContact O-N 3.37Å; R136-R140 WeakPolarHBondContact O-CG 3.36Å; R136-R140 PolarHBondContact O-N 2.93Å; R136-R140 VanDerWaalsContact O-N 3.08Å
137	N	93.4	Very high	90.1	Very high	16 Å²	16	57.6 Å²	57.6	9%	0.086	29%	0.287	C	S	.	.	H	α-helix	trans	-68.7	-43.9	179.8	-69.4	0.9	0	0	0	111.5	A65 S68 R133 L134 K135 R140 A141	A65-N137 HydrophobicContact CB-CB 4.21Å; S68-N137 PolarHBondContact OG-ND2 3.2Å; R133-N137 VanDerWaalsContact O-CG 3.28Å; R133-N137 PolarHBondContact O-N 3.39Å; R133-N137 PolarHBondContact O-OD1 3.42Å; L134-N137 PolarHBondContact O-N 3.12Å; K135-N137 VanDerWaalsContact C-N 3.33Å; K135-N137 PolarHBondContact O-N 2.99Å; N137-R140 PolarHBondContact O-N 2.98Å; N137-R140 PolarHBondContact OD1-NH2 3.44Å; N137-A141 WeakPolarHBondContact O-CB 3.45Å; N137-A141 PolarHBondContact O-N 2.78Å
138	Y	92.1	Very high	90.8	Very high	81 Å²	81	56.7 Å²	56.7	32%	0.318	28%	0.277	S	S	.	.	H	α-helix	trans	-69.8	-34.2	174.7	-87.1	-85	0	0	0	113.1	A65 L69 L134 K135 A141 V142	A65-Y138 HydrophobicContact CB-CD2 4.02Å; A65-Y138 HydrophobicContact CB-CE1 4.4Å; A65-Y138 HydrophobicContact CB-CE2 3.85Å; A65-Y138 HydrophobicContact CB-CG 4.37Å; A65-Y138 WeakPolarHBondContact O-CE2 3.44Å; L69-Y138 HydrophobicContact CB-CE2 4.35Å; L69-Y138 HydrophobicContact CD1-CE2 4.26Å; L69-Y138 WeakPolarHBondContact CD1-OH 3.32Å; L134-Y138 HydrophobicContact CD1-CD2 3.56Å; L134-Y138 HydrophobicContact CD1-CE2 3.4Å; L134-Y138 VanDerWaalsContact CD1-CE2 3.4Å; L134-Y138 HydrophobicContact CG-CD2 3.96Å; L134-Y138 HydrophobicContact CG-CE2 4.2Å; L134-Y138 WeakPolarHBondContact O-CD2 3.33Å; L134-Y138 PolarHBondContact O-N 2.91Å; K135-Y138 PolarHBondContact O-N 3.02Å; Y138-A141 WeakPolarHBondContact O-CB 3.39Å; Y138-A141 PolarHBondContact O-N 3.3Å; Y138-V142 VanDerWaalsContact O-CG2 3.31Å; Y138-V142 WeakPolarHBondContact O-CG2 3.32Å; Y138-V142 PolarHBondContact O-N 2.84Å
139	A	90.6	Very high	91.3	Very high	54 Å²	54	57 Å²	57	45%	0.446	28%	0.275	S	S	.	.	H	α-helix	trans	-61.3	-47.2	174	0	0	0	0	0	111.2	K135 R136 A141 V142 E143	K135-A139 VanDerWaalsContact O-CB 3.22Å; K135-A139 WeakPolarHBondContact O-CB 3.47Å; K135-A139 PolarHBondContact O-N 3.06Å; R136-A139 PolarHBondContact O-N 3.37Å; A139-A141 VanDerWaalsContact C-N 3.31Å; A139-A141 PolarHBondContact O-N 3.42Å; A139-V142 PolarHBondContact O-N 2.81Å; A139-E143 PolarHBondContact O-N 2.99Å
140	R	91.4	Very high	91.6	Very high	118 Å²	118	52.9 Å²	52.9	45%	0.445	26%	0.258	S	S	.	.	H	α-helix	trans	-60.2	-39.8	173.5	-71.7	-172.3	-73.1	153.1	-3.1	112.1	E64 R136 N137 E143 L144	E64-R140 IonicContact OE1-NH2 3.06Å; R136-R140 WeakPolarHBondContact O-CG 3.36Å; R136-R140 PolarHBondContact O-N 2.93Å; R136-R140 VanDerWaalsContact O-N 3.08Å; N137-R140 PolarHBondContact O-N 2.98Å; N137-R140 PolarHBondContact OD1-NH2 3.44Å; R140-E143 PolarHBondContact O-N 3.37Å; R140-L144 PolarHBondContact O-N 3.08Å; R140-L144 VanDerWaalsContact O-N 3.15Å
141	A	93.9	Very high	91.9	Very high	2 Å²	2	51.8 Å²	51.8	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-65.1	-42.4	177	0	0	0	0	0	112.6	V61 M62 N137 Y138 A139 L144 L145	V61-A141 HydrophobicContact CG1-CB 3.96Å; M62-A141 HydrophobicContact SD-CB 3.78Å; N137-A141 WeakPolarHBondContact O-CB 3.45Å; N137-A141 PolarHBondContact O-N 2.78Å; Y138-A141 WeakPolarHBondContact O-CB 3.39Å; Y138-A141 PolarHBondContact O-N 3.3Å; A139-A141 VanDerWaalsContact C-N 3.31Å; A139-A141 PolarHBondContact O-N 3.42Å; A141-L144 PolarHBondContact O-N 2.99Å; A141-L145 WeakPolarHBondContact O-CB 3.41Å; A141-L145 WeakPolarHBondContact O-CG 3.48Å; A141-L145 PolarHBondContact O-N 3.32Å
142	V	92.5	Very high	92.2	Very high	59 Å²	59	55.6 Å²	55.6	36%	0.358	27%	0.271	S	S	.	.	H	α-helix	trans	-65.8	-40.8	177.4	170.9	0	0	0	0	111.1	V92 Y138 A139 L144 L145 V146	V92-V142 HydrophobicContact CG1-CG1 4.29Å; Y138-V142 VanDerWaalsContact O-CG2 3.31Å; Y138-V142 WeakPolarHBondContact O-CG2 3.32Å; Y138-V142 PolarHBondContact O-N 2.84Å; A139-V142 PolarHBondContact O-N 2.81Å; V142-L144 PolarHBondContact O-N 3.23Å; V142-L145 WeakPolarHBondContact O-CB 3.38Å; V142-L145 PolarHBondContact O-N 3.41Å; V142-V146 HydrophobicContact CG1-CG2 4.47Å; V142-V146 WeakPolarHBondContact O-CG2 3.31Å; V142-V146 PolarHBondContact O-N 3.37Å
143	E	91.8	Very high	92.5	Very high	80 Å²	80	56.2 Å²	56.2	37%	0.374	27%	0.273	S	S	.	.	H	α-helix	trans	-58	-49.2	175.1	-171.9	176.6	-171.5	0	0	111.4	H111 A139 R140 L145 V146 E147	H111-E143 IonicContact CE1-OE1 3.08Å; H111-E143 PolarHBondContact CE1-OE1 2.99Å; H111-E143 IonicContact ND1-OE1 3.66Å; H111-E143 IonicContact NE2-OE1 2.79Å; A139-E143 PolarHBondContact O-N 2.99Å; R140-E143 PolarHBondContact O-N 3.37Å; E143-L145 VanDerWaalsContact C-N 3.33Å; E143-L145 PolarHBondContact O-N 3.46Å; E143-V146 PolarHBondContact O-N 3.41Å; E143-E147 PolarHBondContact O-N 3.35Å
144	L	93.6	Very high	92.6	Very high	42 Å²	42	51.1 Å²	51.1	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-35.3	175.5	-77.2	171.9	0	0	0	113.2	V61 R140 A141 V142 E147 L148	V61-L144 HydrophobicContact CB-CD1 4.14Å; V61-L144 HydrophobicContact CG1-CD1 4.19Å; V61-L144 HydrophobicContact CG2-CD1 3.73Å; R140-L144 PolarHBondContact O-N 3.08Å; R140-L144 VanDerWaalsContact O-N 3.15Å; A141-L144 PolarHBondContact O-N 2.99Å; V142-L144 PolarHBondContact O-N 3.23Å; L144-E147 PolarHBondContact O-N 3.13Å; L144-L148 WeakPolarHBondContact O-CB 3.46Å; L144-L148 PolarHBondContact O-N 2.95Å
145	L	93.6	Very high	92.7	Very high	69 Å²	69	52.8 Å²	52.8	36%	0.361	26%	0.262	S	S	.	.	H	α-helix	trans	-65.2	-40.5	175.3	-82.6	166.3	0	0	0	111.8	M58 M62 A141 V142 E143 L148 A149	M58-L145 HydrophobicContact CG-CD2 4.32Å; M58-L145 HydrophobicContact SD-CD2 3.32Å; M58-L145 WeakPolarHBondContact SD-CD2 3.41Å; M58-L145 HydrophobicContact SD-CG 4.13Å; M62-L145 HydrophobicContact SD-CD1 4.45Å; A141-L145 WeakPolarHBondContact O-CB 3.41Å; A141-L145 WeakPolarHBondContact O-CG 3.48Å; A141-L145 PolarHBondContact O-N 3.32Å; V142-L145 WeakPolarHBondContact O-CB 3.38Å; V142-L145 PolarHBondContact O-N 3.41Å; E143-L145 VanDerWaalsContact C-N 3.33Å; E143-L145 PolarHBondContact O-N 3.46Å; L145-L148 PolarHBondContact O-N 2.77Å; L145-A149 VanDerWaalsContact O-CB 3.31Å; L145-A149 WeakPolarHBondContact O-CB 3.45Å; L145-A149 PolarHBondContact O-N 3.5Å
146	V	94	Very high	92.9	Very high	17 Å²	17	54.4 Å²	54.4	10%	0.103	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-43.1	176	173.8	0	0	0	0	110.5	V94 F109 H111 V142 E143 A149 S150	V94-V146 HydrophobicContact CG1-CG1 4.18Å; V94-V146 HydrophobicContact CG2-CG1 4.24Å; V94-V146 HydrophobicContact CG2-CG2 3.8Å; F109-V146 HydrophobicContact CB-CG1 3.94Å; H111-V146 HydrophobicContact CB-CG1 4.38Å; V142-V146 HydrophobicContact CG1-CG2 4.47Å; V142-V146 WeakPolarHBondContact O-CG2 3.31Å; V142-V146 PolarHBondContact O-N 3.37Å; E143-V146 PolarHBondContact O-N 3.41Å; V146-A149 PolarHBondContact O-N 3.15Å; V146-S150 WeakPolarHBondContact O-CB 3.36Å; V146-S150 PolarHBondContact O-N 2.79Å
147	E	91.9	Very high	93	Very high	91 Å²	91	49.8 Å²	49.8	43%	0.425	26%	0.264	S	S	.	.	H	α-helix	trans	-60.8	-45	173.9	-69.8	-170	167.5	0	0	112.2	E143 L144 S150 L151	E143-E147 PolarHBondContact O-N 3.35Å; L144-E147 PolarHBondContact O-N 3.13Å; E147-S150 WeakPolarHBondContact O-CB 3.41Å; E147-S150 PolarHBondContact O-N 2.75Å; E147-L151 WeakPolarHBondContact O-CG 3.18Å; E147-L151 PolarHBondContact O-N 3.39Å
148	L	94.5	Very high	93	Very high	6 Å²	6	49 Å²	49	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-63.8	-43.5	178.4	-175.9	65.5	0	0	0	111.5	I51 T54 K55 M58 L144 L145 S150 L151 Q152	I51-L148 HydrophobicContact CG2-CD1 4.3Å; T54-L148 HydrophobicContact CG2-CB 4.15Å; T54-L148 HydrophobicContact CG2-CD1 4.08Å; K55-L148 HydrophobicContact CB-CD1 4.5Å; M58-L148 HydrophobicContact CE-CD2 3.91Å; M58-L148 HydrophobicContact SD-CD2 3.38Å; M58-L148 WeakPolarHBondContact SD-CD2 3.39Å; L144-L148 WeakPolarHBondContact O-CB 3.46Å; L144-L148 PolarHBondContact O-N 2.95Å; L145-L148 PolarHBondContact O-N 2.77Å; L148-S150 VanDerWaalsContact C-N 3.28Å; L148-S150 PolarHBondContact O-N 3.41Å; L148-L151 PolarHBondContact O-N 3.19Å; L148-Q152 HydrophobicContact CG-CG 4.44Å; L148-Q152 WeakPolarHBondContact O-CB 3.42Å; L148-Q152 WeakPolarHBondContact O-CG 3.49Å; L148-Q152 PolarHBondContact O-N 3.12Å
149	A	94.2	Very high	93.1	Very high	36 Å²	36	47.3 Å²	47.3	30%	0.298	26%	0.256	S	S	.	.	H	α-helix	trans	-61.9	-37.8	176.8	0	0	0	0	0	111.8	L145 V146 Q152 T153	L145-A149 VanDerWaalsContact O-CB 3.31Å; L145-A149 WeakPolarHBondContact O-CB 3.45Å; L145-A149 PolarHBondContact O-N 3.5Å; V146-A149 PolarHBondContact O-N 3.15Å; A149-Q152 PolarHBondContact O-N 2.92Å; A149-T153 WeakPolarHBondContact O-CB 3.43Å; A149-T153 PolarHBondContact O-N 3.41Å; A149-T153 PolarHBondContact O-OG1 3Å
150	S	93.6	Very high	93.2	Very high	12 Å²	12	50.3 Å²	50.3	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-60.8	-48	174	-170.9	0	0	0	0	111.5	V108 F109 V146 E147 L148 S154	V108-S150 WeakPolarHBondContact CA-OG 3.43Å; V108-S150 VanDerWaalsContact CG1-OG 3.28Å; V108-S150 WeakPolarHBondContact CG1-OG 3.48Å; F109-S150 PolarHBondContact N-OG 2.97Å; V146-S150 WeakPolarHBondContact O-CB 3.36Å; V146-S150 PolarHBondContact O-N 2.79Å; E147-S150 WeakPolarHBondContact O-CB 3.41Å; E147-S150 PolarHBondContact O-N 2.75Å; L148-S150 VanDerWaalsContact C-N 3.28Å; L148-S150 PolarHBondContact O-N 3.41Å; S150-S154 VanDerWaalsContact O-CB 3.27Å; S150-S154 WeakPolarHBondContact O-CB 3.38Å; S150-S154 PolarHBondContact O-N 3.5Å; S150-S154 PolarHBondContact O-OG 3.46Å
151	L	93.8	Very high	93.3	Very high	26 Å²	26	45.5 Å²	45.5	14%	0.136	25%	0.247	C	C	.	.	H	α-helix	trans	-63.7	-42.5	176.2	-66	173.2	0	0	0	112.2	I47 K50 I51 E147 L148 F155	I47-L151 HydrophobicContact CG2-CD2 4.41Å; K50-L151 HydrophobicContact CB-CD1 4.42Å; K50-L151 HydrophobicContact CD-CD1 4.08Å; K50-L151 HydrophobicContact CD-CD2 4.12Å; K50-L151 HydrophobicContact CG-CD1 3.89Å; I51-L151 HydrophobicContact CD1-CB 4.16Å; I51-L151 HydrophobicContact CG1-CB 3.66Å; I51-L151 HydrophobicContact CG1-CD1 4.34Å; E147-L151 WeakPolarHBondContact O-CG 3.18Å; E147-L151 PolarHBondContact O-N 3.39Å; L148-L151 PolarHBondContact O-N 3.19Å; L151-F155 WeakPolarHBondContact O-CB 3.44Å; L151-F155 PolarHBondContact O-N 2.97Å
152	Q	93.9	Very high	93.3	Very high	89 Å²	89	46 Å²	46	42%	0.416	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-44.4	179.4	-75	177.3	-9.9	0	0	112.4	L148 A149 F155 V156	L148-Q152 HydrophobicContact CG-CG 4.44Å; L148-Q152 WeakPolarHBondContact O-CB 3.42Å; L148-Q152 WeakPolarHBondContact O-CG 3.49Å; L148-Q152 PolarHBondContact O-N 3.12Å; A149-Q152 PolarHBondContact O-N 2.92Å; Q152-F155 WeakPolarHBondContact O-CB 3.49Å; Q152-F155 PolarHBondContact O-N 3.18Å; Q152-V156 WeakPolarHBondContact O-CG2 3.39Å; Q152-V156 PolarHBondContact O-N 3.11Å
153	T	93.3	Very high	93.4	Very high	52 Å²	52	48.6 Å²	48.6	32%	0.319	26%	0.255	S	S	.	.	H	α-helix	trans	-67.6	-41.8	179.4	-50.3	0	0	0	0	110.8	P107 F109 A149 F155 V156 T157	P107-T153 HydrophobicContact CG-CG2 3.7Å; F109-T153 HydrophobicContact CE2-CG2 4.36Å; A149-T153 WeakPolarHBondContact O-CB 3.43Å; A149-T153 PolarHBondContact O-N 3.41Å; A149-T153 PolarHBondContact O-OG1 3Å; T153-F155 VanDerWaalsContact C-N 3.28Å; T153-F155 PolarHBondContact O-N 2.87Å; T153-V156 PolarHBondContact O-N 2.85Å; T153-T157 WeakPolarHBondContact O-CG2 3.2Å; T153-T157 PolarHBondContact O-N 2.97Å; T153-T157 PolarHBondContact O-OG1 2.81Å
154	S	92.1	Very high	93.5	Very high	8 Å²	8	48.6 Å²	48.6	6%	0.056	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-36.5	171.6	-67.5	0	0	0	0	112.1	P107 S150 T157 L158	P107-S154 PolarHBondContact O-OG 2.84Å; S150-S154 VanDerWaalsContact O-CB 3.27Å; S150-S154 WeakPolarHBondContact O-CB 3.38Å; S150-S154 PolarHBondContact O-N 3.5Å; S150-S154 PolarHBondContact O-OG 3.46Å; S154-T157 WeakPolarHBondContact CA-OG1 3.34Å; S154-T157 PolarHBondContact O-OG1 3.19Å; S154-L158 WeakPolarHBondContact O-CB 3.11Å; S154-L158 PolarHBondContact O-N 3.42Å
155	F	93.8	Very high	93.5	Very high	49 Å²	49	47.3 Å²	47.3	22%	0.215	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-46.1	179.6	178.6	-92.6	0	0	0	112.6	F44 I47 L48 I51 L151 Q152 T153 L158 D159	F44-F155 HydrophobicContact CD1-CE2 4.41Å; F44-F155 AromaticContact CD2-CD2 3.84Å; F44-F155 HydrophobicContact CD2-CD2 3.84Å; F44-F155 AromaticContact CD2-CE2 3.73Å; F44-F155 HydrophobicContact CD2-CE2 3.73Å; F44-F155 HydrophobicContact CD2-CZ 4.45Å; F44-F155 AromaticContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CE2 3.85Å; F44-F155 HydrophobicContact CE1-CZ 4.05Å; F44-F155 HydrophobicContact CE2-CD1 4.28Å; F44-F155 AromaticContact CE2-CD2 3.42Å; F44-F155 HydrophobicContact CE2-CD2 3.42Å; F44-F155 VanDerWaalsContact CE2-CD2 3.42Å; F44-F155 AromaticContact CE2-CE1 3.98Å; F44-F155 HydrophobicContact CE2-CE1 3.98Å; F44-F155 AromaticContact CE2-CE2 3.06Å; F44-F155 HydrophobicContact CE2-CE2 3.06Å; F44-F155 HydrophobicContact CE2-CG 4.03Å; F44-F155 AromaticContact CE2-CZ 3.38Å; F44-F155 HydrophobicContact CE2-CZ 3.38Å; F44-F155 HydrophobicContact CG-CE2 4.38Å; F44-F155 HydrophobicContact CZ-CD2 4.02Å; F44-F155 AromaticContact CZ-CE1 3.99Å; F44-F155 HydrophobicContact CZ-CE1 3.99Å; F44-F155 AromaticContact CZ-CE2 3.16Å; F44-F155 HydrophobicContact CZ-CE2 3.16Å; F44-F155 AromaticContact CZ-CZ 3.14Å; F44-F155 HydrophobicContact CZ-CZ 3.14Å; I47-F155 HydrophobicContact CG2-CB 4.19Å; I47-F155 HydrophobicContact CG2-CD2 4.22Å; L48-F155 HydrophobicContact CB-CE2 4.07Å; L48-F155 HydrophobicContact CD1-CE2 3.86Å; L48-F155 HydrophobicContact CD1-CZ 4.06Å; L48-F155 HydrophobicContact CG-CE2 4.47Å; I51-F155 HydrophobicContact CD1-CB 3.75Å; I51-F155 HydrophobicContact CD1-CD2 3.99Å; I51-F155 HydrophobicContact CD1-CG 3.94Å; L151-F155 WeakPolarHBondContact O-CB 3.44Å; L151-F155 PolarHBondContact O-N 2.97Å; Q152-F155 WeakPolarHBondContact O-CB 3.49Å; Q152-F155 PolarHBondContact O-N 3.18Å; T153-F155 VanDerWaalsContact C-N 3.28Å; T153-F155 PolarHBondContact O-N 2.87Å; F155-L158 PolarHBondContact O-N 2.92Å; F155-D159 WeakPolarHBondContact O-CB 3.36Å; F155-D159 PolarHBondContact O-N 3.4Å
156	V	93.4	Very high	93.5	Very high	94 Å²	94	46.5 Å²	46.5	57%	0.57	25%	0.247	S	C	*	.	H	α-helix	trans	-64.6	-46.1	179.3	175.5	0	0	0	0	111	Q152 T153 L158 D159 E160	Q152-V156 WeakPolarHBondContact O-CG2 3.39Å; Q152-V156 PolarHBondContact O-N 3.11Å; T153-V156 PolarHBondContact O-N 2.85Å; V156-L158 VanDerWaalsContact C-N 3.33Å; V156-L158 PolarHBondContact O-N 3.16Å; V156-D159 PolarHBondContact O-N 3.15Å; V156-E160 PolarHBondContact O-N 3.39Å; V156-E160 VanDerWaalsContact O-N 3.15Å
157	T	92.1	Very high	93.5	Very high	45 Å²	45	53.5 Å²	53.5	28%	0.276	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-38.3	178.5	50.7	0	0	0	0	112.2	P107 T153 S154 A161	P107-T157 HydrophobicContact CG-CG2 4.33Å; T153-T157 WeakPolarHBondContact O-CG2 3.2Å; T153-T157 PolarHBondContact O-N 2.97Å; T153-T157 PolarHBondContact O-OG1 2.81Å; S154-T157 WeakPolarHBondContact CA-OG1 3.34Å; S154-T157 PolarHBondContact O-OG1 3.19Å; T157-A161 PolarHBondContact O-N 3.12Å; T157-A161 VanDerWaalsContact O-N 3.13Å
158	L	92.6	Very high	93.7	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-72	-37.3	178.1	-164.8	146.3	0	0	0	112.5	L40 F44 I47 L106 S154 F155 V156 A161 I162	L40-L158 HydrophobicContact CD2-CD1 4.42Å; L40-L158 HydrophobicContact CD2-CG 4.5Å; F44-L158 HydrophobicContact CB-CD2 3.49Å; F44-L158 VanDerWaalsContact CB-CD2 3.49Å; F44-L158 HydrophobicContact CD2-CD2 3.58Å; F44-L158 HydrophobicContact CG-CD2 3.98Å; I47-L158 HydrophobicContact CD1-CD1 4.31Å; L106-L158 HydrophobicContact CD1-CD1 3.96Å; L106-L158 HydrophobicContact CD2-CB 4Å; L106-L158 HydrophobicContact CD2-CD1 4.23Å; S154-L158 WeakPolarHBondContact O-CB 3.11Å; S154-L158 PolarHBondContact O-N 3.42Å; F155-L158 PolarHBondContact O-N 2.92Å; V156-L158 VanDerWaalsContact C-N 3.33Å; V156-L158 PolarHBondContact O-N 3.16Å; L158-A161 PolarHBondContact O-N 3.32Å; L158-I162 HydrophobicContact CD2-CD1 3.44Å; L158-I162 VanDerWaalsContact CD2-CD1 3.44Å; L158-I162 HydrophobicContact CD2-CG1 4.09Å; L158-I162 WeakPolarHBondContact O-CG1 3.13Å; L158-I162 PolarHBondContact O-N 3.46Å
159	D	93.6	Very high	93.7	Very high	44 Å²	44	57 Å²	57	24%	0.235	28%	0.281	C	S	.	.	H	α-helix	trans	-59.5	-46.5	173.4	178.9	55.9	0	0	0	111.6	F44 F155 V156 A161 I162 K163	F44-D159 HydrophobicContact CE2-CB 3.8Å; F44-D159 HydrophobicContact CZ-CB 4.3Å; F155-D159 WeakPolarHBondContact O-CB 3.36Å; F155-D159 PolarHBondContact O-N 3.4Å; V156-D159 PolarHBondContact O-N 3.15Å; D159-A161 VanDerWaalsContact C-N 3.34Å; D159-A161 PolarHBondContact O-N 3.37Å; D159-I162 PolarHBondContact O-N 3.11Å; D159-K163 WeakPolarHBondContact O-CG 3.4Å; D159-K163 PolarHBondContact O-N 3.16Å; D159-K163 IonicContact OD1-NZ 3.03Å; D159-K163 WeakPolarHBondContact OD2-CE 3.37Å; D159-K163 IonicContact OD2-NZ 2.85Å; D159-K163 PolarHBondContact OD2-NZ 3.48Å
160	E	93.5	Very high	93.7	Very high	118 Å²	118	59.2 Å²	59.2	55%	0.551	29%	0.288	S	S	*	.	H	α-helix	trans	-62.1	-43.6	177.8	-172.4	173.4	-169.5	0	0	111.5	V156 I162 K163 I164	V156-E160 PolarHBondContact O-N 3.39Å; V156-E160 VanDerWaalsContact O-N 3.15Å; E160-I162 VanDerWaalsContact C-N 3.34Å; E160-I162 PolarHBondContact O-N 2.88Å; E160-K163 PolarHBondContact O-N 3.34Å; E160-I164 HydrophobicContact CG-CD1 4Å; E160-I164 WeakPolarHBondContact O-CG1 3.4Å; E160-I164 PolarHBondContact O-N 3.15Å
161	A	92.8	Very high	93.8	Very high	17 Å²	17	60.7 Å²	60.7	14%	0.14	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-39.9	176.1	0	0	0	0	0	112.5	V104 T157 L158 D159 T165	V104-A161 HydrophobicContact CG1-CB 3.88Å; V104-A161 HydrophobicContact CG2-CB 3.96Å; T157-A161 PolarHBondContact O-N 3.12Å; T157-A161 VanDerWaalsContact O-N 3.13Å; L158-A161 PolarHBondContact O-N 3.32Å; D159-A161 VanDerWaalsContact C-N 3.34Å; D159-A161 PolarHBondContact O-N 3.37Å; A161-T165 WeakPolarHBondContact O-CB 3.48Å; A161-T165 PolarHBondContact O-N 2.76Å; A161-T165 PolarHBondContact O-OG1 3.49Å
162	I	94.1	Very high	93.9	Very high	13 Å²	13	60.3 Å²	60.3	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-48.1	174	-71.6	171.9	0	0	0	110.4	L40 F44 L158 D159 E160 I164 T165 N166	L40-I162 HydrophobicContact CB-CD1 4.09Å; L40-I162 HydrophobicContact CB-CG1 3.68Å; L40-I162 HydrophobicContact CD1-CG1 4.39Å; F44-I162 HydrophobicContact CB-CD1 3.78Å; F44-I162 HydrophobicContact CD2-CD1 4.26Å; F44-I162 HydrophobicContact CG-CD1 4.02Å; L158-I162 HydrophobicContact CD2-CD1 3.44Å; L158-I162 VanDerWaalsContact CD2-CD1 3.44Å; L158-I162 HydrophobicContact CD2-CG1 4.09Å; L158-I162 WeakPolarHBondContact O-CG1 3.13Å; L158-I162 PolarHBondContact O-N 3.46Å; D159-I162 PolarHBondContact O-N 3.11Å; E160-I162 VanDerWaalsContact C-N 3.34Å; E160-I162 PolarHBondContact O-N 2.88Å; I162-I164 VanDerWaalsContact C-N 3.34Å; I162-I164 PolarHBondContact O-N 2.81Å; I162-T165 PolarHBondContact O-N 3.03Å; I162-T165 VanDerWaalsContact O-N 3.16Å; I162-N166 WeakPolarHBondContact CG2-ND2 3.23Å; I162-N166 WeakPolarHBondContact O-CB 3.33Å; I162-N166 PolarHBondContact O-N 3.4Å
163	K	94.6	Very high	93.9	Very high	112 Å²	112	58.7 Å²	58.7	49%	0.487	29%	0.291	S	S	.	.	H	α-helix	trans	-59.4	-42.9	179.2	-75.6	170.7	176.6	165	0	111.9	D159 E160 R167	D159-K163 WeakPolarHBondContact O-CG 3.4Å; D159-K163 PolarHBondContact O-N 3.16Å; D159-K163 IonicContact OD1-NZ 3.03Å; D159-K163 WeakPolarHBondContact OD2-CE 3.37Å; D159-K163 IonicContact OD2-NZ 2.85Å; D159-K163 PolarHBondContact OD2-NZ 3.48Å; E160-K163 PolarHBondContact O-N 3.34Å; K163-R167 WeakPolarHBondContact O-CB 3.32Å; K163-R167 VanDerWaalsContact O-CG 3.3Å; K163-R167 WeakPolarHBondContact O-CG 3.27Å; K163-R167 PolarHBondContact O-N 3.09Å; K163-R167 PolarHBondContact O-NE 2.9Å
164	I	94.2	Very high	93.9	Very high	80 Å²	80	62.3 Å²	62.3	41%	0.41	30%	0.304	S	S	.	.	H	α-helix	trans	-63.3	-45.2	175.6	-67.4	165.2	0	0	0	110.5	E160 I162 R167 R168	E160-I164 HydrophobicContact CG-CD1 4Å; E160-I164 WeakPolarHBondContact O-CG1 3.4Å; E160-I164 PolarHBondContact O-N 3.15Å; I162-I164 VanDerWaalsContact C-N 3.34Å; I162-I164 PolarHBondContact O-N 2.81Å; I164-R167 PolarHBondContact O-N 3.23Å; I164-R168 WeakPolarHBondContact O-CB 3.33Å; I164-R168 PolarHBondContact O-N 2.96Å
165	T	93.5	Very high	93.9	Very high	15 Å²	15	65.9 Å²	65.9	9%	0.092	33%	0.326	C	S	.	.	H	α-helix	trans	-64.3	-46.1	-179.2	-54.6	0	0	0	0	111.4	L33 A161 I162 R168 V169	L33-T165 HydrophobicContact CB-CG2 4.5Å; L33-T165 HydrophobicContact CD2-CG2 4.45Å; A161-T165 WeakPolarHBondContact O-CB 3.48Å; A161-T165 PolarHBondContact O-N 2.76Å; A161-T165 PolarHBondContact O-OG1 3.49Å; I162-T165 PolarHBondContact O-N 3.03Å; I162-T165 VanDerWaalsContact O-N 3.16Å; T165-R168 WeakPolarHBondContact O-CB 3.41Å; T165-R168 PolarHBondContact O-N 3.04Å; T165-V169 WeakPolarHBondContact O-CG2 3.36Å; T165-V169 PolarHBondContact O-N 2.87Å
166	N	93.2	Very high	93.8	Very high	52 Å²	52	66.4 Å²	66.4	28%	0.278	33%	0.33	S	S	.	.	H	α-helix	trans	-63	-43.4	176.5	-76.7	-26	0	0	0	112.3	S37 I162 R168 V169 N170	S37-N166 PolarHBondContact OG-OD1 2.86Å; I162-N166 WeakPolarHBondContact CG2-ND2 3.23Å; I162-N166 WeakPolarHBondContact O-CB 3.33Å; I162-N166 PolarHBondContact O-N 3.4Å; N166-R168 VanDerWaalsContact C-N 3.26Å; N166-R168 PolarHBondContact O-N 3.29Å; N166-V169 PolarHBondContact O-N 2.82Å; N166-N170 VanDerWaalsContact O-CG 3.26Å; N166-N170 PolarHBondContact O-N 3.43Å; N166-N170 PolarHBondContact O-OD1 3.04Å
167	R	95.2	Very high	93.9	Very high	164 Å²	164	63.3 Å²	63.3	62%	0.619	31%	0.31	S	S	*	.	H	α-helix	trans	-58	-40.9	173.3	-79.2	-172.9	-67.2	166	-4.6	111.7	K163 I164 N170 A171	K163-R167 WeakPolarHBondContact O-CB 3.32Å; K163-R167 VanDerWaalsContact O-CG 3.3Å; K163-R167 WeakPolarHBondContact O-CG 3.27Å; K163-R167 PolarHBondContact O-N 3.09Å; K163-R167 PolarHBondContact O-NE 2.9Å; I164-R167 PolarHBondContact O-N 3.23Å; R167-N170 PolarHBondContact O-N 3.42Å; R167-A171 WeakPolarHBondContact O-CB 3.48Å; R167-A171 PolarHBondContact O-N 3.36Å
168	R	95.2	Very high	94	Very high	164 Å²	164	63.2 Å²	63.2	62%	0.619	31%	0.31	S	S	*	.	H	α-helix	trans	-67.3	-40.8	178.4	-164.5	172.7	-173.6	167.5	1.5	112.3	L33 I164 T165 N166 A171 I172	L33-R168 HydrophobicContact CD1-CG 4.02Å; I164-R168 WeakPolarHBondContact O-CB 3.33Å; I164-R168 PolarHBondContact O-N 2.96Å; T165-R168 WeakPolarHBondContact O-CB 3.41Å; T165-R168 PolarHBondContact O-N 3.04Å; N166-R168 VanDerWaalsContact C-N 3.26Å; N166-R168 PolarHBondContact O-N 3.29Å; R168-A171 PolarHBondContact O-N 3.05Å; R168-I172 HydrophobicContact CG-CD1 4.38Å; R168-I172 VanDerWaalsContact O-CG1 3.29Å; R168-I172 WeakPolarHBondContact O-CG1 3.39Å; R168-I172 PolarHBondContact O-N 3.05Å
169	V	95.9	Very high	94	Very high	6 Å²	6	67.8 Å²	67.8	4%	0.036	33%	0.328	C	S	.	.	H	α-helix	trans	-60.1	-48.4	173.3	172.3	0	0	0	0	110.3	R30 L33 T165 N166 A171 I172 E173	R30-V169 HydrophobicContact CG-CG1 4.28Å; L33-V169 HydrophobicContact CB-CG2 3.6Å; T165-V169 WeakPolarHBondContact O-CG2 3.36Å; T165-V169 PolarHBondContact O-N 2.87Å; N166-V169 PolarHBondContact O-N 2.82Å; V169-A171 PolarHBondContact O-N 3.12Å; V169-I172 PolarHBondContact O-N 3.38Å; V169-E173 WeakPolarHBondContact O-CB 3.42Å; V169-E173 PolarHBondContact O-N 3.25Å
170	N	94.3	Very high	94	Very high	84 Å²	84	66.1 Å²	66.1	45%	0.449	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-38.9	179.8	-67.4	-1.6	0	0	0	112.2	N166 R167 I172 E173 H174	N166-N170 VanDerWaalsContact O-CG 3.26Å; N166-N170 PolarHBondContact O-N 3.43Å; N166-N170 PolarHBondContact O-OD1 3.04Å; R167-N170 PolarHBondContact O-N 3.42Å; N170-I172 VanDerWaalsContact C-N 3.34Å; N170-E173 PolarHBondContact O-N 3.35Å; N170-H174 PolarHBondContact O-N 2.84Å
171	A	95.7	Very high	94	Very high	42 Å²	42	64.5 Å²	64.5	35%	0.347	31%	0.314	S	S	.	.	H	α-helix	trans	-63.6	-40.2	174.8	0	0	0	0	0	111.7	R167 R168 V169 V175 I176	R167-A171 WeakPolarHBondContact O-CB 3.48Å; R167-A171 PolarHBondContact O-N 3.36Å; R168-A171 PolarHBondContact O-N 3.05Å; V169-A171 PolarHBondContact O-N 3.12Å; A171-V175 WeakPolarHBondContact O-CA 3.45Å; A171-V175 VanDerWaalsContact O-CB 3.28Å; A171-V175 WeakPolarHBondContact O-CB 3.44Å; A171-V175 PolarHBondContact O-N 2.87Å; A171-V175 VanDerWaalsContact O-N 3.07Å; A171-I176 PolarHBondContact O-N 3.39Å
172	I	94.8	Very high	94	Very high	18 Å²	18	68.1 Å²	68.1	9%	0.092	32%	0.324	C	S	.	.	I	π-helix	trans	-65.4	-45.8	175.7	-68	164.2	0	0	0	110.4	A26 R30 L33 R168 V169 N170 I176 I177	A26-I172 HydrophobicContact CB-CG2 4.33Å; R30-I172 HydrophobicContact CB-CG2 3.93Å; L33-I172 HydrophobicContact CD1-CD1 3.72Å; R168-I172 HydrophobicContact CG-CD1 4.38Å; R168-I172 VanDerWaalsContact O-CG1 3.29Å; R168-I172 WeakPolarHBondContact O-CG1 3.39Å; R168-I172 PolarHBondContact O-N 3.05Å; V169-I172 PolarHBondContact O-N 3.38Å; N170-I172 VanDerWaalsContact C-N 3.34Å; I172-I176 HydrophobicContact CG1-CD1 3.98Å; I172-I177 HydrophobicContact CG2-CD1 3.94Å; I172-I177 HydrophobicContact CG2-CG1 4.11Å; I172-I177 WeakPolarHBondContact O-CB 3.45Å; I172-I177 VanDerWaalsContact O-CG1 3.29Å; I172-I177 WeakPolarHBondContact O-CG1 3.11Å; I172-I177 PolarHBondContact O-N 3.02Å
173	E	93.5	Very high	93.9	Very high	56 Å²	56	67.5 Å²	67.5	26%	0.262	32%	0.321	S	S	.	.	I	π-helix	trans	-67.4	-48.7	-176.3	176.1	162.3	-158.3	0	0	113.8	R30 V169 N170 P178	R30-E173 IonicContact CZ-OE1 2.89Å; R30-E173 IonicContact CZ-OE2 3.14Å; R30-E173 IonicContact NE-OE2 3.65Å; R30-E173 PolarHBondContact NE-OE2 3.44Å; R30-E173 IonicContact NH1-OE1 3.53Å; R30-E173 PolarHBondContact NH1-OE1 3.05Å; R30-E173 IonicContact NH1-OE2 3.66Å; R30-E173 IonicContact NH2-OE1 2.76Å; R30-E173 PolarHBondContact NH2-OE1 3.45Å; R30-E173 IonicContact NH2-OE2 3.83Å; R30-E173 PolarHBondContact NH2-OE2 3.34Å; V169-E173 WeakPolarHBondContact O-CB 3.42Å; V169-E173 PolarHBondContact O-N 3.25Å; N170-E173 PolarHBondContact O-N 3.35Å; E173-P178 VanDerWaalsContact O-CD 3.25Å; E173-P178 WeakPolarHBondContact O-CD 3.28Å
174	H	92.9	Very high	93.8	Very high	127 Å²	127	62.9 Å²	62.9	59%	0.588	30%	0.301	S	S	*	.	I	π-helix	trans	-100.3	-17.6	-170.3	-63	-64.4	0	0	0	114.1	N170	N170-H174 PolarHBondContact O-N 2.84Å
175	V	92.6	Very high	93.8	Very high	83 Å²	83	62.8 Å²	62.8	50%	0.503	30%	0.304	S	S	.	.	I	π-helix	trans	-113.7	-54.9	-178.1	-174.5	0	0	0	0	111.4	A171 R179	A171-V175 WeakPolarHBondContact O-CA 3.45Å; A171-V175 VanDerWaalsContact O-CB 3.28Å; A171-V175 WeakPolarHBondContact O-CB 3.44Å; A171-V175 PolarHBondContact O-N 2.87Å; A171-V175 VanDerWaalsContact O-N 3.07Å; V175-R179 WeakPolarHBondContact O-CB 3.38Å; V175-R179 PolarHBondContact O-N 3.08Å
176	I	92.8	Very high	93.8	Very high	60 Å²	60	65.2 Å²	65.2	31%	0.308	31%	0.312	S	S	.	.	I	π-helix	trans	-75.7	-50.7	-170.4	-59.5	173.8	0	0	0	111.6	A171 I172 R179 I180	A171-I176 PolarHBondContact O-N 3.39Å; I172-I176 HydrophobicContact CG1-CD1 3.98Å; I176-R179 PolarHBondContact O-N 3.38Å; I176-I180 HydrophobicContact CG2-CD1 3.74Å; I176-I180 HydrophobicContact CG2-CG1 4.35Å; I176-I180 WeakPolarHBondContact O-CG1 3.31Å; I176-I180 PolarHBondContact O-N 3.43Å
177	I	94	Very high	93.8	Very high	29 Å²	29	62.7 Å²	62.7	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-51.6	-179.6	-72.4	170	0	0	0	110.7	L23 A26 Q27 I172 R179 I180 D181	L23-I177 HydrophobicContact CD1-CG2 4.19Å; A26-I177 HydrophobicContact CB-CG1 4.13Å; Q27-I177 HydrophobicContact CG-CD1 4.36Å; I172-I177 HydrophobicContact CG2-CD1 3.94Å; I172-I177 HydrophobicContact CG2-CG1 4.11Å; I172-I177 WeakPolarHBondContact O-CB 3.45Å; I172-I177 VanDerWaalsContact O-CG1 3.29Å; I172-I177 WeakPolarHBondContact O-CG1 3.11Å; I172-I177 PolarHBondContact O-N 3.02Å; I177-R179 VanDerWaalsContact C-N 3.27Å; I177-R179 PolarHBondContact O-N 2.91Å; I177-I180 PolarHBondContact O-N 3.49Å; I177-D181 WeakPolarHBondContact O-CB 3.47Å; I177-D181 PolarHBondContact O-N 3.34Å
178	P	94.4	Very high	93.7	Very high	44 Å²	44	57.8 Å²	57.8	29%	0.286	28%	0.284	S	S	.	.	H	α-helix	trans	-64.6	-29	179	-25.3	37.1	0	0	0	113.7	E173 R182	E173-P178 VanDerWaalsContact O-CD 3.25Å; E173-P178 WeakPolarHBondContact O-CD 3.28Å; P178-R182 WeakPolarHBondContact O-CB 3.44Å; P178-R182 WeakPolarHBondContact O-CG 3.39Å; P178-R182 PolarHBondContact O-N 2.91Å; P178-R182 VanDerWaalsContact O-N 3.07Å; P178-R182 PolarHBondContact O-NE 2.61Å; P178-R182 VanDerWaalsContact O-NE 3.13Å
179	R	92.7	Very high	93.7	Very high	96 Å²	96	53.5 Å²	53.5	36%	0.362	28%	0.277	S	S	.	.	H	α-helix	trans	-71.4	-41.4	175.4	-177.7	166.7	73.9	172.9	6.1	111.9	E5 I7 V175 I176 I177 D181 T183	E5-R179 WeakPolarHBondContact O-CG 3.32Å; I7-R179 HydrophobicContact CG1-CG 4.14Å; V175-R179 WeakPolarHBondContact O-CB 3.38Å; V175-R179 PolarHBondContact O-N 3.08Å; I176-R179 PolarHBondContact O-N 3.38Å; I177-R179 VanDerWaalsContact C-N 3.27Å; I177-R179 PolarHBondContact O-N 2.91Å; R179-D181 VanDerWaalsContact C-N 3.35Å; R179-T183 WeakPolarHBondContact O-CB 3.4Å; R179-T183 PolarHBondContact O-N 3.49Å; R179-T183 VanDerWaalsContact O-N 3.15Å; R179-T183 PolarHBondContact O-OG1 3.49Å
180	I	93.6	Very high	93.5	Very high	8 Å²	8	56.5 Å²	56.5	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-44	174.7	-66	169.4	0	0	0	109.6	I7 R22 L23 A26 I176 I177 T183 L184	I7-I180 HydrophobicContact CD1-CG1 4.09Å; R22-I180 HydrophobicContact CB-CD1 4.29Å; L23-I180 HydrophobicContact CB-CG2 3.87Å; L23-I180 HydrophobicContact CD1-CB 4.28Å; L23-I180 HydrophobicContact CD1-CG2 3.99Å; L23-I180 HydrophobicContact CG-CG2 4.48Å; A26-I180 HydrophobicContact CB-CD1 4.31Å; I176-I180 HydrophobicContact CG2-CD1 3.74Å; I176-I180 HydrophobicContact CG2-CG1 4.35Å; I176-I180 WeakPolarHBondContact O-CG1 3.31Å; I176-I180 PolarHBondContact O-N 3.43Å; I177-I180 PolarHBondContact O-N 3.49Å; I180-T183 WeakPolarHBondContact O-CB 3.32Å; I180-T183 PolarHBondContact O-N 3Å; I180-T183 VanDerWaalsContact O-N 3.14Å; I180-L184 WeakPolarHBondContact O-CB 3.35Å; I180-L184 PolarHBondContact O-N 2.99Å
181	D	93.4	Very high	93.5	Very high	85 Å²	85	53.4 Å²	53.4	46%	0.455	27%	0.273	S	S	.	.	H	α-helix	trans	-61.5	-49	-178.6	-160.3	42.7	0	0	0	111.9	I177 R179 T183 L184 T185	I177-D181 WeakPolarHBondContact O-CB 3.47Å; I177-D181 PolarHBondContact O-N 3.34Å; R179-D181 VanDerWaalsContact C-N 3.35Å; D181-T183 VanDerWaalsContact C-N 3.26Å; D181-T183 PolarHBondContact O-N 2.94Å; D181-L184 WeakPolarHBondContact O-CA 3.42Å; D181-L184 WeakPolarHBondContact O-CB 3.38Å; D181-L184 PolarHBondContact O-N 3.28Å; D181-T185 PolarHBondContact O-N 2.87Å; D181-T185 PolarHBondContact O-OG1 2.86Å; D181-T185 VanDerWaalsContact O-OG1 3.12Å
182	R	92.9	Very high	93.4	Very high	93 Å²	93	55.6 Å²	55.6	35%	0.351	28%	0.279	S	S	.	.	H	α-helix	trans	-57.5	-36.5	172.8	-76.4	-178.7	-78	178.6	-7.2	113.5	E5 R6 P178 Y186	E5-R182 VanDerWaalsContact CB-NH1 3.34Å; E5-R182 IonicContact OE1-NH1 2.73Å; E5-R182 PolarHBondContact OE1-NH1 2.87Å; E5-R182 IonicContact OE2-NH1 3.41Å; E5-R182 PolarHBondContact OE2-NH1 2.73Å; R6-R182 HydrophobicContact CG-CB 4.24Å; P178-R182 WeakPolarHBondContact O-CB 3.44Å; P178-R182 WeakPolarHBondContact O-CG 3.39Å; P178-R182 PolarHBondContact O-N 2.91Å; P178-R182 VanDerWaalsContact O-N 3.07Å; P178-R182 PolarHBondContact O-NE 2.61Å; P178-R182 VanDerWaalsContact O-NE 3.13Å; R182-Y186 PolarHBondContact O-N 2.89Å; R182-Y186 VanDerWaalsContact O-N 3.13Å
183	T	92.3	Very high	93.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.6	-37.9	176.1	-51.5	0	0	0	0	110.7	I7 I9 R179 I180 D181 Y186 I187	I7-T183 HydrophobicContact CB-CG2 4.16Å; I7-T183 PolarHBondContact N-OG1 3.21Å; I9-T183 HydrophobicContact CD1-CG2 4.3Å; I9-T183 HydrophobicContact CG1-CG2 4.3Å; R179-T183 WeakPolarHBondContact O-CB 3.4Å; R179-T183 PolarHBondContact O-N 3.49Å; R179-T183 VanDerWaalsContact O-N 3.15Å; R179-T183 PolarHBondContact O-OG1 3.49Å; I180-T183 WeakPolarHBondContact O-CB 3.32Å; I180-T183 PolarHBondContact O-N 3Å; I180-T183 VanDerWaalsContact O-N 3.14Å; D181-T183 VanDerWaalsContact C-N 3.26Å; D181-T183 PolarHBondContact O-N 2.94Å; T183-Y186 WeakPolarHBondContact O-CB 3.39Å; T183-Y186 PolarHBondContact O-N 3.44Å; T183-I187 HydrophobicContact CG2-CD1 4.17Å; T183-I187 WeakPolarHBondContact O-CD1 3.34Å; T183-I187 VanDerWaalsContact O-CG1 3.25Å; T183-I187 WeakPolarHBondContact O-CG1 3.31Å; T183-I187 PolarHBondContact O-N 3.23Å
184	L	93.2	Very high	93.3	Very high	14 Å²	14	60.3 Å²	60.3	7%	0.073	30%	0.297	C	S	.	.	H	α-helix	trans	-66.9	-43.8	178.4	-144.9	164.2	0	0	0	110.9	Q16 M19 K20 L23 I180 D181 Y186 I187 I188	Q16-L184 HydrophobicContact CG-CD2 4.43Å; M19-L184 HydrophobicContact CB-CG 4.5Å; K20-L184 HydrophobicContact CG-CD1 3.88Å; L23-L184 HydrophobicContact CD2-CD1 4.2Å; I180-L184 WeakPolarHBondContact O-CB 3.35Å; I180-L184 PolarHBondContact O-N 2.99Å; D181-L184 WeakPolarHBondContact O-CA 3.42Å; D181-L184 WeakPolarHBondContact O-CB 3.38Å; D181-L184 PolarHBondContact O-N 3.28Å; L184-Y186 VanDerWaalsContact C-N 3.33Å; L184-Y186 PolarHBondContact O-N 3.06Å; L184-I187 PolarHBondContact O-N 3.32Å; L184-I188 HydrophobicContact CD2-CD1 3.4Å; L184-I188 VanDerWaalsContact CD2-CD1 3.4Å; L184-I188 HydrophobicContact CD2-CG1 4.01Å; L184-I188 WeakPolarHBondContact O-CG1 3.26Å; L184-I188 PolarHBondContact O-N 3.21Å
185	T	93.5	Very high	93.3	Very high	78 Å²	78	58.3 Å²	58.3	48%	0.479	29%	0.288	S	S	.	.	H	α-helix	trans	-57.4	-46.2	172.3	-48.8	0	0	0	0	111.2	D181 I187 I188 T189	D181-T185 PolarHBondContact O-N 2.87Å; D181-T185 PolarHBondContact O-OG1 2.86Å; D181-T185 VanDerWaalsContact O-OG1 3.12Å; T185-I187 PolarHBondContact O-N 3.5Å; T185-I188 PolarHBondContact O-N 2.93Å; T185-T189 WeakPolarHBondContact O-CG2 3.35Å; T185-T189 PolarHBondContact O-N 3.43Å; T185-T189 PolarHBondContact O-OG1 3.45Å; T185-T189 VanDerWaalsContact O-OG1 3.14Å
186	Y	93.4	Very high	93.4	Very high	66 Å²	66	62.3 Å²	62.3	26%	0.259	29%	0.294	S	S	.	.	H	α-helix	trans	-58.9	-45.8	177.1	169.4	-111.7	0	0	0	112.8	R182 T183 L184 I188 T189 E190	R182-Y186 PolarHBondContact O-N 2.89Å; R182-Y186 VanDerWaalsContact O-N 3.13Å; T183-Y186 WeakPolarHBondContact O-CB 3.39Å; T183-Y186 PolarHBondContact O-N 3.44Å; L184-Y186 VanDerWaalsContact C-N 3.33Å; L184-Y186 PolarHBondContact O-N 3.06Å; Y186-I188 VanDerWaalsContact C-N 3.33Å; Y186-I188 PolarHBondContact O-N 3.22Å; Y186-T189 WeakPolarHBondContact CA-OG1 3.21Å; Y186-T189 PolarHBondContact O-N 3.4Å; Y186-T189 PolarHBondContact O-OG1 3.42Å; Y186-E190 HydrophobicContact CD2-CG 3.9Å; Y186-E190 HydrophobicContact CE1-CG 4.35Å; Y186-E190 HydrophobicContact CE2-CG 3.37Å; Y186-E190 VanDerWaalsContact CE2-OE1 3.28Å; Y186-E190 WeakPolarHBondContact CE2-OE1 3.35Å; Y186-E190 WeakPolarHBondContact O-CB 3.5Å; Y186-E190 VanDerWaalsContact O-CG 3.31Å; Y186-E190 WeakPolarHBondContact O-CG 3.5Å; Y186-E190 PolarHBondContact O-N 3.15Å
187	I	93	Very high	93.4	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.3	-41.7	178.5	-63.5	157.4	0	0	0	110.9	I9 P11 Q16 M19 T183 L184 T185 E190 L191	I9-I187 HydrophobicContact CD1-CD1 3.52Å; I9-I187 HydrophobicContact CD1-CG1 4.35Å; I9-I187 HydrophobicContact CG1-CD1 4.12Å; I9-I187 HydrophobicContact CG1-CG1 4.45Å; P11-I187 HydrophobicContact CB-CG2 4.44Å; Q16-I187 HydrophobicContact CB-CG2 3.91Å; Q16-I187 HydrophobicContact CG-CG2 4.33Å; M19-I187 HydrophobicContact CB-CD1 4.37Å; M19-I187 HydrophobicContact CG-CD1 3.78Å; T183-I187 HydrophobicContact CG2-CD1 4.17Å; T183-I187 WeakPolarHBondContact O-CD1 3.34Å; T183-I187 VanDerWaalsContact O-CG1 3.25Å; T183-I187 WeakPolarHBondContact O-CG1 3.31Å; T183-I187 PolarHBondContact O-N 3.23Å; L184-I187 PolarHBondContact O-N 3.32Å; T185-I187 PolarHBondContact O-N 3.5Å; I187-E190 PolarHBondContact O-N 3.13Å; I187-L191 HydrophobicContact CG2-CD1 3.77Å; I187-L191 HydrophobicContact CG2-CG 4.22Å; I187-L191 WeakPolarHBondContact O-CB 3.46Å; I187-L191 VanDerWaalsContact O-CG 3.24Å; I187-L191 WeakPolarHBondContact O-CG 3.35Å; I187-L191 PolarHBondContact O-N 2.86Å
188	I	93.6	Very high	93.3	Very high	60 Å²	60	68.3 Å²	68.3	31%	0.308	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-49.6	178.3	-69	166.9	0	0	0	109.9	L184 T185 Y186 E190 L191 D192	L184-I188 HydrophobicContact CD2-CD1 3.4Å; L184-I188 VanDerWaalsContact CD2-CD1 3.4Å; L184-I188 HydrophobicContact CD2-CG1 4.01Å; L184-I188 WeakPolarHBondContact O-CG1 3.26Å; L184-I188 PolarHBondContact O-N 3.21Å; T185-I188 PolarHBondContact O-N 2.93Å; Y186-I188 VanDerWaalsContact C-N 3.33Å; Y186-I188 PolarHBondContact O-N 3.22Å; I188-E190 VanDerWaalsContact C-N 3.3Å; I188-E190 PolarHBondContact O-N 3.19Å; I188-L191 PolarHBondContact O-N 2.89Å; I188-D192 WeakPolarHBondContact O-CB 3.41Å; I188-D192 PolarHBondContact O-N 2.97Å
189	T	94.4	Very high	93.3	Very high	75 Å²	75	73.1 Å²	73.1	46%	0.46	34%	0.337	S	S	.	.	H	α-helix	trans	-60.7	-37.9	-179.6	50.6	0	0	0	0	112.9	T185 Y186 E193	T185-T189 WeakPolarHBondContact O-CG2 3.35Å; T185-T189 PolarHBondContact O-N 3.43Å; T185-T189 PolarHBondContact O-OG1 3.45Å; T185-T189 VanDerWaalsContact O-OG1 3.14Å; Y186-T189 WeakPolarHBondContact CA-OG1 3.21Å; Y186-T189 PolarHBondContact O-N 3.4Å; Y186-T189 PolarHBondContact O-OG1 3.42Å; T189-E193 PolarHBondContact O-N 2.92Å; T189-E193 VanDerWaalsContact O-N 3.13Å
190	E	93.5	Very high	93.4	Very high	69 Å²	69	75.5 Å²	75.5	32%	0.322	35%	0.347	S	S	.	.	H	α-helix	trans	-73.2	-36.2	177.8	-73	-75.8	162.7	0	0	112.9	P11 Y186 I187 I188 R194	P11-E190 HydrophobicContact CB-CB 3.6Å; P11-E190 HydrophobicContact CB-CG 4.16Å; P11-E190 HydrophobicContact CG-CB 3.78Å; P11-E190 HydrophobicContact CG-CG 4.01Å; Y186-E190 HydrophobicContact CD2-CG 3.9Å; Y186-E190 HydrophobicContact CE1-CG 4.35Å; Y186-E190 HydrophobicContact CE2-CG 3.37Å; Y186-E190 VanDerWaalsContact CE2-OE1 3.28Å; Y186-E190 WeakPolarHBondContact CE2-OE1 3.35Å; Y186-E190 WeakPolarHBondContact O-CB 3.5Å; Y186-E190 VanDerWaalsContact O-CG 3.31Å; Y186-E190 WeakPolarHBondContact O-CG 3.5Å; Y186-E190 PolarHBondContact O-N 3.15Å; I187-E190 PolarHBondContact O-N 3.13Å; I188-E190 VanDerWaalsContact C-N 3.3Å; I188-E190 PolarHBondContact O-N 3.19Å; E190-R194 WeakPolarHBondContact O-CG 3Å; E190-R194 PolarHBondContact O-N 3.42Å; E190-R194 VanDerWaalsContact O-N 3.11Å
191	L	93.3	Very high	93.4	Very high	19 Å²	19	82 Å²	82	10%	0.099	37%	0.371	C	S	.	.	H	α-helix	trans	-67.4	-43.3	174.8	-73.6	175.2	0	0	0	111	R13 I187 I188 E193 R194 E195	R13-L191 HydrophobicContact CG-CD1 4.11Å; R13-L191 HydrophobicContact CG-CD2 4.33Å; I187-L191 HydrophobicContact CG2-CD1 3.77Å; I187-L191 HydrophobicContact CG2-CG 4.22Å; I187-L191 WeakPolarHBondContact O-CB 3.46Å; I187-L191 VanDerWaalsContact O-CG 3.24Å; I187-L191 WeakPolarHBondContact O-CG 3.35Å; I187-L191 PolarHBondContact O-N 2.86Å; I188-L191 PolarHBondContact O-N 2.89Å; L191-E193 VanDerWaalsContact C-N 3.3Å; L191-E193 PolarHBondContact O-N 3.41Å; L191-R194 PolarHBondContact O-N 2.96Å; L191-E195 WeakPolarHBondContact O-CG 3.31Å; L191-E195 PolarHBondContact O-N 2.68Å
192	D	94.2	Very high	93.4	Very high	87 Å²	87	83.3 Å²	83.3	47%	0.465	38%	0.377	S	S	.	.	H	α-helix	trans	-62.6	-37.5	177.8	-67.1	-12.3	0	0	0	111.5	I188 E195 R196	I188-D192 WeakPolarHBondContact O-CB 3.41Å; I188-D192 PolarHBondContact O-N 2.97Å; D192-E195 PolarHBondContact O-N 3.15Å; D192-R196 WeakPolarHBondContact O-CB 3.42Å; D192-R196 PolarHBondContact O-N 3.39Å
193	E	93.6	Very high	93.5	Very high	84 Å²	84	84.9 Å²	84.9	39%	0.393	39%	0.387	S	S	.	.	H	α-helix	trans	-69.3	-40.9	176.3	-164.4	59.8	-143.8	0	0	111.8	T189 L191 E195 R196 E197	T189-E193 PolarHBondContact O-N 2.92Å; T189-E193 VanDerWaalsContact O-N 3.13Å; L191-E193 VanDerWaalsContact C-N 3.3Å; L191-E193 PolarHBondContact O-N 3.41Å; E193-E195 PolarHBondContact O-N 3.49Å; E193-R196 WeakPolarHBondContact O-CB 3.5Å; E193-R196 PolarHBondContact O-N 3.42Å; E193-R196 IonicContact OE2-NH1 3.84Å; E193-E197 WeakPolarHBondContact O-CG 3.48Å; E193-E197 PolarHBondContact O-N 3.41Å
194	R	92.3	Very high	93.6	Very high	90 Å²	90	88.8 Å²	88.8	34%	0.34	40%	0.404	S	S	.	.	H	α-helix	trans	-62.1	-41.9	173	-76.4	-169.4	179.1	150	9.2	112.7	P11 E190 L191 R196 E197 E198	P11-R194 PolarHBondContact O-NH1 3.34Å; E190-R194 WeakPolarHBondContact O-CG 3Å; E190-R194 PolarHBondContact O-N 3.42Å; E190-R194 VanDerWaalsContact O-N 3.11Å; L191-R194 PolarHBondContact O-N 2.96Å; R194-R196 VanDerWaalsContact C-N 3.28Å; R194-R196 PolarHBondContact O-N 2.98Å; R194-E197 PolarHBondContact O-N 3.17Å; R194-E198 PolarHBondContact O-N 2.8Å
195	E	92.3	Very high	93.6	Very high	85 Å²	85	92.5 Å²	92.5	40%	0.397	42%	0.422	S	S	.	.	H	α-helix	trans	-63.7	-37.1	175.8	-72.9	-177.6	-174.6	0	0	111	R13 L191 D192 E193 E198 F199	R13-E195 IonicContact CZ-OE1 3.7Å; R13-E195 IonicContact NE-OE1 3.62Å; R13-E195 IonicContact NH2-OE1 2.68Å; R13-E195 PolarHBondContact NH2-OE1 3.43Å; L191-E195 WeakPolarHBondContact O-CG 3.31Å; L191-E195 PolarHBondContact O-N 2.68Å; D192-E195 PolarHBondContact O-N 3.15Å; E193-E195 PolarHBondContact O-N 3.49Å; E195-E198 PolarHBondContact O-N 3.27Å; E195-F199 VanDerWaalsContact O-CB 3.29Å; E195-F199 WeakPolarHBondContact O-CB 3.48Å; E195-F199 PolarHBondContact O-N 3.27Å
196	R	94.4	Very high	93.5	Very high	166 Å²	166	95.3 Å²	95.3	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-64.8	-43.1	173.8	-175.4	-178.6	-70.2	-178.2	-2.5	112.5	D192 E193 R194 F199 Y200	D192-R196 WeakPolarHBondContact O-CB 3.42Å; D192-R196 PolarHBondContact O-N 3.39Å; E193-R196 WeakPolarHBondContact O-CB 3.5Å; E193-R196 PolarHBondContact O-N 3.42Å; E193-R196 IonicContact OE2-NH1 3.84Å; R194-R196 VanDerWaalsContact C-N 3.28Å; R194-R196 PolarHBondContact O-N 2.98Å; R196-F199 PolarHBondContact O-N 3.3Å; R196-Y200 PolarHBondContact O-N 3.3Å
197	E	94.2	Very high	93.5	Very high	106 Å²	106	96.3 Å²	96.3	50%	0.495	44%	0.437	S	S	.	.	H	α-helix	trans	-63.5	-42.9	175.8	-72.9	179.9	178.1	0	0	112.3	E193 R194 Y200 R201	E193-E197 WeakPolarHBondContact O-CG 3.48Å; E193-E197 PolarHBondContact O-N 3.41Å; R194-E197 PolarHBondContact O-N 3.17Å; E197-Y200 PolarHBondContact O-N 3.12Å; E197-R201 PolarHBondContact O-N 2.87Å
198	E	91.9	Very high	93.5	Very high	109 Å²	109	102.9 Å²	102.9	51%	0.509	47%	0.466	S	S	.	.	H	α-helix	trans	-63.5	-43.8	174.2	-77.7	-178.6	178.5	0	0	111.8	R194 E195 Y200 R201 L202	R194-E198 PolarHBondContact O-N 2.8Å; E195-E198 PolarHBondContact O-N 3.27Å; E198-Y200 VanDerWaalsContact C-N 3.34Å; E198-Y200 PolarHBondContact O-N 3.14Å; E198-R201 PolarHBondContact O-N 3.11Å; E198-L202 WeakPolarHBondContact O-CG 3.24Å; E198-L202 PolarHBondContact O-N 3.38Å
199	F	94.4	Very high	93.3	Very high	146 Å²	146	106 Å²	106	64%	0.64	48%	0.477	S	S	*	.	H	α-helix	trans	-59.9	-43.6	176.1	-176.5	-97.9	0	0	0	112	E195 R196 L202 K203	E195-F199 VanDerWaalsContact O-CB 3.29Å; E195-F199 WeakPolarHBondContact O-CB 3.48Å; E195-F199 PolarHBondContact O-N 3.27Å; R196-F199 PolarHBondContact O-N 3.3Å; F199-L202 PolarHBondContact O-N 3.5Å; F199-K203 WeakPolarHBondContact O-CB 3.26Å; F199-K203 PolarHBondContact O-N 3.28Å
200	Y	94.4	Very high	93.2	Very high	145 Å²	145	108.6 Å²	108.6	57%	0.569	48%	0.482	S	S	*	.	H	α-helix	trans	-63.5	-42	176.4	-173.8	-94.2	0	0	0	112.2	R196 E197 E198 K203 K204	R196-Y200 PolarHBondContact O-N 3.3Å; E197-Y200 PolarHBondContact O-N 3.12Å; E198-Y200 VanDerWaalsContact C-N 3.34Å; E198-Y200 PolarHBondContact O-N 3.14Å; Y200-K203 PolarHBondContact O-N 3.38Å; Y200-K204 HydrophobicContact CD1-CG 4.32Å; Y200-K204 HydrophobicContact CE1-CG 3.81Å; Y200-K204 PolarHBondContact O-N 2.93Å; Y200-K204 WeakPolarHBondContact OH-CE 3.47Å
201	R	93.5	Very high	93	Very high	144 Å²	144	110 Å²	110	54%	0.543	49%	0.488	S	S	.	.	H	α-helix	trans	-60.2	-48.1	175.2	-80.3	-173.9	-76.9	175	-2.8	111.8	E197 E198 K203 K204 I205	E197-R201 PolarHBondContact O-N 2.87Å; E198-R201 PolarHBondContact O-N 3.11Å; R201-K203 PolarHBondContact O-N 3.47Å; R201-K204 PolarHBondContact O-N 3.31Å; R201-I205 WeakPolarHBondContact O-CG1 3.28Å; R201-I205 PolarHBondContact O-N 2.89Å
202	L	93.8	Very high	92.8	Very high	113 Å²	113	114.3 Å²	114.3	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-61.3	-43.5	177.3	-71.6	172.6	0	0	0	111.8	E198 F199 K204 I205 Q206	E198-L202 WeakPolarHBondContact O-CG 3.24Å; E198-L202 PolarHBondContact O-N 3.38Å; F199-L202 PolarHBondContact O-N 3.5Å; L202-K204 VanDerWaalsContact C-N 3.34Å; L202-K204 PolarHBondContact O-N 2.81Å; L202-I205 PolarHBondContact O-N 3.01Å; L202-Q206 PolarHBondContact O-N 3.19Å
203	K	94.9	Very high	92.4	Very high	127 Å²	127	117.3 Å²	117.3	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-57.9	-45	175.9	-175	177.6	-179.8	178.9	0	111.7	F199 Y200 R201 Q206 E207	F199-K203 WeakPolarHBondContact O-CB 3.26Å; F199-K203 PolarHBondContact O-N 3.28Å; Y200-K203 PolarHBondContact O-N 3.38Å; R201-K203 PolarHBondContact O-N 3.47Å; K203-Q206 PolarHBondContact O-N 3.42Å; K203-E207 WeakPolarHBondContact O-CB 3.39Å; K203-E207 PolarHBondContact O-N 3.42Å
204	K	93.4	Very high	92.1	Very high	82 Å²	82	117.5 Å²	117.5	36%	0.357	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-37.3	177.5	-81.9	-72.2	170.6	-156.7	0	113.1	Y200 R201 L202 E207 K208	Y200-K204 HydrophobicContact CD1-CG 4.32Å; Y200-K204 HydrophobicContact CE1-CG 3.81Å; Y200-K204 PolarHBondContact O-N 2.93Å; Y200-K204 WeakPolarHBondContact OH-CE 3.47Å; R201-K204 PolarHBondContact O-N 3.31Å; L202-K204 VanDerWaalsContact C-N 3.34Å; L202-K204 PolarHBondContact O-N 2.81Å; K204-E207 WeakPolarHBondContact CD-OE2 3.37Å; K204-E207 IonicContact NZ-OE2 2.76Å; K204-E207 PolarHBondContact NZ-OE2 3.45Å; K204-E207 PolarHBondContact O-N 3.24Å; K204-K208 WeakPolarHBondContact O-CG 3.29Å; K204-K208 PolarHBondContact O-N 2.92Å
205	I	93.3	Very high	91.7	Very high	91 Å²	91	119.5 Å²	119.5	47%	0.467	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-43.4	174.7	-68.4	165.4	0	0	0	110.5	R201 L202 K208 K209	R201-I205 WeakPolarHBondContact O-CG1 3.28Å; R201-I205 PolarHBondContact O-N 2.89Å; L202-I205 PolarHBondContact O-N 3.01Å; I205-K208 PolarHBondContact O-N 3.48Å; I205-K209 WeakPolarHBondContact O-CB 3.37Å; I205-K209 PolarHBondContact O-N 3Å
206	Q	92.1	Very high	91.1	Very high	138 Å²	138	118.5 Å²	118.5	65%	0.645	53%	0.528	S	S	*	.	H	α-helix	trans	-65.6	-40.9	178.4	-166.4	171.6	9.3	0	0	111.9	L202 K203 K209 K210	L202-Q206 PolarHBondContact O-N 3.19Å; K203-Q206 PolarHBondContact O-N 3.42Å; Q206-K209 PolarHBondContact O-N 3.23Å; Q206-K210 WeakPolarHBondContact O-CB 3.33Å; Q206-K210 PolarHBondContact O-N 3Å
207	E	93.3	Very high	90.4	Very high	86 Å²	86	116.5 Å²	116.5	40%	0.402	53%	0.526	S	S	.	.	H	α-helix	trans	-59.8	-46.3	173.8	-167.6	175.5	-159	0	0	111.2	K203 K204 K210 Q211	K203-E207 WeakPolarHBondContact O-CB 3.39Å; K203-E207 PolarHBondContact O-N 3.42Å; K204-E207 WeakPolarHBondContact CD-OE2 3.37Å; K204-E207 IonicContact NZ-OE2 2.76Å; K204-E207 PolarHBondContact NZ-OE2 3.45Å; K204-E207 PolarHBondContact O-N 3.24Å; E207-K210 PolarHBondContact O-N 3.17Å; E207-Q211 WeakPolarHBondContact O-CG 3.41Å; E207-Q211 PolarHBondContact O-N 2.82Å
208	K	92.3	Very high	89.7	Confident	138 Å²	138	117.3 Å²	117.3	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-43.6	174.2	-75	-176.1	179.8	-174.7	0	112.8	K204 I205 K210 Q211 L212	K204-K208 WeakPolarHBondContact O-CG 3.29Å; K204-K208 PolarHBondContact O-N 2.92Å; I205-K208 PolarHBondContact O-N 3.48Å; K208-K210 VanDerWaalsContact C-N 3.27Å; K208-K210 PolarHBondContact O-N 3.08Å; K208-Q211 PolarHBondContact O-N 3.46Å; K208-L212 WeakPolarHBondContact O-CB 3.38Å; K208-L212 PolarHBondContact O-N 3.06Å
209	K	90.9	Very high	89	Confident	126 Å²	126	118.6 Å²	118.6	55%	0.548	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-34.2	176.3	-82.6	-170.1	173.8	-172.9	0	112.1	I205 Q206 R213	I205-K209 WeakPolarHBondContact O-CB 3.37Å; I205-K209 PolarHBondContact O-N 3Å; Q206-K209 PolarHBondContact O-N 3.23Å; K209-R213 WeakPolarHBondContact O-CB 3.38Å; K209-R213 WeakPolarHBondContact O-CG 3.22Å; K209-R213 PolarHBondContact O-N 2.89Å; K209-R213 VanDerWaalsContact O-N 3.08Å
210	K	92.3	Very high	88	Confident	130 Å²	130	116.6 Å²	116.6	57%	0.565	53%	0.534	S	S	*	.	H	α-helix	trans	-69.7	-47.1	175.9	-166.4	-172.7	-179.8	-151.5	0	110.9	Q206 E207 K208 L212 R213 E214	Q206-K210 WeakPolarHBondContact O-CB 3.33Å; Q206-K210 PolarHBondContact O-N 3Å; E207-K210 PolarHBondContact O-N 3.17Å; K208-K210 VanDerWaalsContact C-N 3.27Å; K208-K210 PolarHBondContact O-N 3.08Å; K210-L212 VanDerWaalsContact C-N 3.32Å; K210-L212 PolarHBondContact O-N 2.93Å; K210-R213 PolarHBondContact O-N 2.67Å; K210-R213 VanDerWaalsContact O-N 3.17Å; K210-E214 WeakPolarHBondContact CE-OE1 3.38Å; K210-E214 IonicContact NZ-OE1 2.78Å; K210-E214 PolarHBondContact NZ-OE1 2.94Å; K210-E214 WeakPolarHBondContact O-CG 3.33Å; K210-E214 PolarHBondContact O-N 3.05Å
211	Q	89.1	Confident	86.9	Confident	97 Å²	97	112.4 Å²	112.4	45%	0.453	53%	0.529	S	S	.	.	H	α-helix	trans	-60.7	-39.8	175.9	-71.1	175.2	-0.9	0	0	112.6	E207 K208 K215	E207-Q211 WeakPolarHBondContact O-CG 3.41Å; E207-Q211 PolarHBondContact O-N 2.82Å; K208-Q211 PolarHBondContact O-N 3.46Å; Q211-K215 WeakPolarHBondContact O-CB 3.39Å; Q211-K215 VanDerWaalsContact O-CG 3.32Å; Q211-K215 WeakPolarHBondContact O-CG 3.38Å; Q211-K215 PolarHBondContact O-N 3.37Å
212	L	87.4	Confident	85.9	Confident	110 Å²	110	108.4 Å²	108.4	58%	0.576	53%	0.527	S	S	*	.	H	α-helix	trans	-63.2	-45.2	174.1	-87.3	156.2	0	0	0	111.4	K208 K210 K215 T216	K208-L212 WeakPolarHBondContact O-CB 3.38Å; K208-L212 PolarHBondContact O-N 3.06Å; K210-L212 VanDerWaalsContact C-N 3.32Å; K210-L212 PolarHBondContact O-N 2.93Å; L212-K215 PolarHBondContact O-N 3.15Å; L212-T216 WeakPolarHBondContact O-CG2 3.46Å; L212-T216 PolarHBondContact O-N 2.86Å; L212-T216 PolarHBondContact O-OG1 2.76Å
213	R	85.7	Confident	84.5	Confident	151 Å²	151	112.4 Å²	112.4	57%	0.57	53%	0.534	S	S	*	.	H	α-helix	trans	-60.2	-47.2	175.8	-84.1	-172.9	-96.1	-167.5	-7	112.7	K209 K210 K215 T216 E217	K209-R213 WeakPolarHBondContact O-CB 3.38Å; K209-R213 WeakPolarHBondContact O-CG 3.22Å; K209-R213 PolarHBondContact O-N 2.89Å; K209-R213 VanDerWaalsContact O-N 3.08Å; K210-R213 PolarHBondContact O-N 2.67Å; K210-R213 VanDerWaalsContact O-N 3.17Å; R213-K215 VanDerWaalsContact C-N 3.3Å; R213-K215 PolarHBondContact O-N 3.39Å; R213-T216 WeakPolarHBondContact CA-OG1 3.44Å; R213-T216 PolarHBondContact O-N 2.89Å; R213-T216 PolarHBondContact O-OG1 3.09Å; R213-E217 WeakPolarHBondContact O-CB 3.37Å; R213-E217 WeakPolarHBondContact O-CG 3.44Å; R213-E217 PolarHBondContact O-N 3.05Å
214	E	87.4	Confident	82.9	Confident	87 Å²	87	112.6 Å²	112.6	41%	0.407	54%	0.54	S	S	.	.	H	α-helix	trans	-59.8	-40.2	176.4	-71.8	169.8	-175.9	0	0	111.2	K210 L218	K210-E214 WeakPolarHBondContact CE-OE1 3.38Å; K210-E214 IonicContact NZ-OE1 2.78Å; K210-E214 PolarHBondContact NZ-OE1 2.94Å; K210-E214 WeakPolarHBondContact O-CG 3.33Å; K210-E214 PolarHBondContact O-N 3.05Å; E214-L218 WeakPolarHBondContact O-CB 3.14Å; E214-L218 WeakPolarHBondContact O-CD1 3.29Å; E214-L218 VanDerWaalsContact O-CG 3.23Å; E214-L218 WeakPolarHBondContact O-CG 3.1Å; E214-L218 PolarHBondContact O-N 3.49Å
215	K	85.3	Confident	81.4	Confident	133 Å²	133	112.6 Å²	112.6	58%	0.578	56%	0.555	S	S	*	*	H	α-helix	trans	-66.5	-44.1	174.7	-75.6	-179.9	179.8	-171.8	0	113	Q211 L212 R213 E217 L218 E219	Q211-K215 WeakPolarHBondContact O-CB 3.39Å; Q211-K215 VanDerWaalsContact O-CG 3.32Å; Q211-K215 WeakPolarHBondContact O-CG 3.38Å; Q211-K215 PolarHBondContact O-N 3.37Å; L212-K215 PolarHBondContact O-N 3.15Å; R213-K215 VanDerWaalsContact C-N 3.3Å; R213-K215 PolarHBondContact O-N 3.39Å; K215-E217 VanDerWaalsContact C-N 3.33Å; K215-L218 PolarHBondContact O-N 2.86Å; K215-E219 WeakPolarHBondContact O-CG 3.35Å; K215-E219 PolarHBondContact O-N 3.19Å
216	T	79.3	Confident	79.9	Confident	63 Å²	63	112.3 Å²	112.3	39%	0.387	57%	0.567	S	S	.	*	H	α-helix	trans	-65.6	-37.6	177.8	50.7	0	0	0	0	111.7	L212 R213 E219 I220	L212-T216 WeakPolarHBondContact O-CG2 3.46Å; L212-T216 PolarHBondContact O-N 2.86Å; L212-T216 PolarHBondContact O-OG1 2.76Å; R213-T216 WeakPolarHBondContact CA-OG1 3.44Å; R213-T216 PolarHBondContact O-N 2.89Å; R213-T216 PolarHBondContact O-OG1 3.09Å; T216-E219 PolarHBondContact O-N 3.36Å; T216-I220 WeakPolarHBondContact O-CB 3.39Å; T216-I220 WeakPolarHBondContact O-CD1 3.45Å; T216-I220 WeakPolarHBondContact O-CG1 3.35Å; T216-I220 PolarHBondContact O-N 3.32Å
217	E	79.9	Confident	78.1	Confident	125 Å²	125	110.9 Å²	110.9	58%	0.584	56%	0.563	S	S	*	*	H	α-helix	trans	-65.1	-40.3	174.9	-75.2	173.3	-171.9	0	0	111.4	R213 K215 I220 A221	R213-E217 WeakPolarHBondContact O-CB 3.37Å; R213-E217 WeakPolarHBondContact O-CG 3.44Å; R213-E217 PolarHBondContact O-N 3.05Å; K215-E217 VanDerWaalsContact C-N 3.33Å; E217-I220 PolarHBondContact O-N 2.88Å; E217-A221 VanDerWaalsContact O-CB 3.25Å; E217-A221 WeakPolarHBondContact O-CB 3.34Å; E217-A221 PolarHBondContact O-N 3.42Å
218	L	79.8	Confident	76	Confident	123 Å²	123	108.9 Å²	108.9	64%	0.644	57%	0.566	S	S	*	*	H	α-helix	trans	-65.3	-40.7	173.4	-72.8	167.8	0	0	0	112.4	E214 K215 A221 A222	E214-L218 WeakPolarHBondContact O-CB 3.14Å; E214-L218 WeakPolarHBondContact O-CD1 3.29Å; E214-L218 VanDerWaalsContact O-CG 3.23Å; E214-L218 WeakPolarHBondContact O-CG 3.1Å; E214-L218 PolarHBondContact O-N 3.49Å; K215-L218 PolarHBondContact O-N 2.86Å; L218-A221 PolarHBondContact O-N 2.93Å; L218-A222 VanDerWaalsContact O-CB 3.25Å; L218-A222 WeakPolarHBondContact O-CB 3.41Å; L218-A222 PolarHBondContact O-N 3.45Å
219	E	76.3	Confident	73.9	Confident	136 Å²	136	109.1 Å²	109.1	64%	0.636	58%	0.581	S	S	*	*	H	α-helix	trans	-66	-42.1	175.7	-78	178.3	-179.7	0	0	111.8	K215 T216 A222 R223	K215-E219 WeakPolarHBondContact O-CG 3.35Å; K215-E219 PolarHBondContact O-N 3.19Å; T216-E219 PolarHBondContact O-N 3.36Å; E219-A222 PolarHBondContact O-N 3.45Å; E219-R223 WeakPolarHBondContact O-CB 3.32Å; E219-R223 PolarHBondContact O-N 3.38Å
220	I	73.8	Confident	71.7	Confident	104 Å²	104	109.1 Å²	109.1	53%	0.533	59%	0.586	S	S	.	*	H	α-helix	trans	-63.9	-45.6	175.1	-69.2	164.3	0	0	0	110.2	T216 E217 A222 R223 L224	T216-I220 WeakPolarHBondContact O-CB 3.39Å; T216-I220 WeakPolarHBondContact O-CD1 3.45Å; T216-I220 WeakPolarHBondContact O-CG1 3.35Å; T216-I220 PolarHBondContact O-N 3.32Å; E217-I220 PolarHBondContact O-N 2.88Å; I220-A222 VanDerWaalsContact C-N 3.35Å; I220-A222 PolarHBondContact O-N 2.95Å; I220-R223 WeakPolarHBondContact O-CB 3.37Å; I220-R223 PolarHBondContact O-N 2.67Å; I220-L224 HydrophobicContact CG2-CD1 4.4Å; I220-L224 WeakPolarHBondContact O-CB 3.3Å; I220-L224 PolarHBondContact O-N 3.06Å
221	A	72	Confident	69.4	Low	57 Å²	57	107 Å²	107	47%	0.471	59%	0.593	S	S	.	*	H	α-helix	trans	-63.1	-39.3	176.4	0	0	0	0	0	112.3	E217 L218 L224 A225	E217-A221 VanDerWaalsContact O-CB 3.25Å; E217-A221 WeakPolarHBondContact O-CB 3.34Å; E217-A221 PolarHBondContact O-N 3.42Å; L218-A221 PolarHBondContact O-N 2.93Å; A221-L224 PolarHBondContact O-N 3.25Å; A221-A225 WeakPolarHBondContact O-CB 3.47Å; A221-A225 PolarHBondContact O-N 3.31Å
222	A	71.4	Confident	67.4	Low	60 Å²	60	111.5 Å²	111.5	50%	0.496	61%	0.614	S	S	.	*	H	α-helix	trans	-66.5	-37.9	174.4	0	0	0	0	0	112	L218 E219 I220 A225 A226	L218-A222 VanDerWaalsContact O-CB 3.25Å; L218-A222 WeakPolarHBondContact O-CB 3.41Å; L218-A222 PolarHBondContact O-N 3.45Å; E219-A222 PolarHBondContact O-N 3.45Å; I220-A222 VanDerWaalsContact C-N 3.35Å; I220-A222 PolarHBondContact O-N 2.95Å; A222-A225 PolarHBondContact O-N 3.25Å; A222-A226 WeakPolarHBondContact O-CB 3.38Å; A222-A226 PolarHBondContact O-N 3.03Å
223	R	64.9	Low	65.4	Low	196 Å²	196	111.7 Å²	111.7	74%	0.74	62%	0.622	S	S	*	*	H	α-helix	trans	-65	-41.6	172.8	-128.6	178.5	179.6	173.3	-0.8	111.5	E219 I220 A225 A226 L227	E219-R223 WeakPolarHBondContact O-CB 3.32Å; E219-R223 PolarHBondContact O-N 3.38Å; I220-R223 WeakPolarHBondContact O-CB 3.37Å; I220-R223 PolarHBondContact O-N 2.67Å; R223-A225 VanDerWaalsContact C-N 3.33Å; R223-A226 PolarHBondContact O-N 3.23Å; R223-L227 WeakPolarHBondContact O-CD1 3.46Å; R223-L227 PolarHBondContact O-N 3.27Å; R223-L227 VanDerWaalsContact O-N 3.13Å
224	L	61.2	Low	63.2	Low	131 Å²	131	108.9 Å²	108.9	69%	0.686	63%	0.63	S	S	*	*	H	α-helix	trans	-67	-31.7	175.8	-125.6	112.4	0	0	0	112.6	I220 A221	I220-L224 HydrophobicContact CG2-CD1 4.4Å; I220-L224 WeakPolarHBondContact O-CB 3.3Å; I220-L224 PolarHBondContact O-N 3.06Å; A221-L224 PolarHBondContact O-N 3.25Å
225	A	63.1	Low	61.1	Low	82 Å²	82	112.2 Å²	112.2	68%	0.678	65%	0.651	S	S	*	*	H	α-helix	trans	-78.4	-27.1	175.4	0	0	0	0	0	113	A221 A222 R223	A221-A225 WeakPolarHBondContact O-CB 3.47Å; A221-A225 PolarHBondContact O-N 3.31Å; A222-A225 PolarHBondContact O-N 3.25Å; R223-A225 VanDerWaalsContact C-N 3.33Å
226	A	60.5	Low	59.1	Low	86 Å²	86	113.5 Å²	113.5	71%	0.711	66%	0.661	S	S	*	*	H	α-helix	trans	-78.1	-28.3	175.9	0	0	0	0	0	112.9	A222 R223 G228	A222-A226 WeakPolarHBondContact O-CB 3.38Å; A222-A226 PolarHBondContact O-N 3.03Å; R223-A226 PolarHBondContact O-N 3.23Å; A226-G228 PolarHBondContact O-N 3.06Å
227	L	54.2	Low	57.5	Low	107 Å²	107	118.2 Å²	118.2	56%	0.56	68%	0.683	S	S	*	*	S	Bend	trans	-82.8	97.2	162.4	-78.5	90.9	0	0	0	108.4	R223 I230	R223-L227 WeakPolarHBondContact O-CD1 3.46Å; R223-L227 PolarHBondContact O-N 3.27Å; R223-L227 VanDerWaalsContact O-N 3.13Å; L227-I230 HydrophobicContact CD2-CD1 3.75Å
228	G	48.7	Very low	55.9	Low	45 Å²	45	117.3 Å²	117.3	46%	0.464	69%	0.686	S	S	.	*			trans	-54.6	170.4	170.4	0	0	0	0	0	112.7	A226 I230	A226-G228 PolarHBondContact O-N 3.06Å; G228-I230 PolarHBondContact O-N 2.9Å
229	P	48.5	Very low	53.8	Low	142 Å²	142	120.7 Å²	120.7	92%	0.922	70%	0.699	S	S	*	*			trans	-59.9	97.1	-163.5	27.4	-34.8	0	0	0	111.4	A231	P229-A231 PolarHBondContact O-N 3.28Å
230	I	46	Very low	52.3	Low	126 Å²	126	122.8 Å²	122.8	65%	0.646	71%	0.709	S	S	*	*			trans	-82.4	116.6	167.3	-64.4	168.8	0	0	0	105	L227 G228	L227-I230 HydrophobicContact CD2-CD1 3.75Å; G228-I230 PolarHBondContact O-N 2.9Å
231	A	42.8	Very low	50.5	Low	85 Å²	85	123.7 Å²	123.7	70%	0.702	72%	0.719	S	S	*	*			trans	-45.8	139	171.8	0	0	0	0	0	110.5	P229 P233	P229-A231 PolarHBondContact O-N 3.28Å; A231-P233 VanDerWaalsContact O-CD 3.29Å; A231-P233 WeakPolarHBondContact O-CD 3.38Å
232	E	46.4	Very low	49.1	Very low	193 Å²	193	129 Å²	129	90%	0.902	74%	0.739	S	S	*	*			trans	-39.2	121	174.3	-64.4	178.2	156.9	0	0	111.8
233	P	45.5	Very low	47.7	Very low	114 Å²	114	134.2 Å²	134.2	74%	0.74	75%	0.754	S	S	*	*			trans	-91	137.3	151.3	28.1	-15.4	0	0	0	108.9	A231	A231-P233 VanDerWaalsContact O-CD 3.29Å; A231-P233 WeakPolarHBondContact O-CD 3.38Å
234	A	41.2	Very low	46.9	Very low	91 Å²	91	131.9 Å²	131.9	75%	0.752	76%	0.756	S	S	*	*			trans	-49.9	149.6	-170	0	0	0	0	0	115.9	M236	A234-M236 PolarHBondContact O-N 3.06Å; A234-M236 VanDerWaalsContact O-N 3.13Å
235	N	42.8	Very low	46.2	Very low	157 Å²	157	132.8 Å²	132.8	84%	0.84	76%	0.76	S	S	*	*			trans	-40.2	113.6	162.9	-87.7	-25	0	0	0	112
236	M	42.1	Very low	44.9	Very low	161 Å²	161	136.2 Å²	136.2	79%	0.793	77%	0.767	S	S	*	*			trans	-112.4	93.8	157	-69.4	-145.2	-64.3	0	0	108.4	A234 T238	A234-M236 PolarHBondContact O-N 3.06Å; A234-M236 VanDerWaalsContact O-N 3.13Å; M236-T238 PolarHBondContact O-N 3.25Å
237	L	46.8	Very low	44	Very low	162 Å²	162	141.6 Å²	141.6	85%	0.848	77%	0.774	S	S	*	*			trans	-72.8	25.2	178.6	-129.6	142.5	0	0	0	112.6
238	T	45.5	Very low	43.2	Very low	105 Å²	105	149 Å²	149	64%	0.644	81%	0.806	S	S	*	*			trans	-155.4	96	-170.8	51.8	0	0	0	0	109.7	M236	M236-T238 PolarHBondContact O-N 3.25Å
239	E	35.7	Very low	42.9	Very low	194 Å²	194	154.2 Å²	154.2	91%	0.907	82%	0.823	S	S	*	*			trans	-165.4	112.8	132.6	-105.7	168.2	-159.3	0	0	108.9
240	E	44.5	Very low	42.6	Very low	181 Å²	181	154.8 Å²	154.8	85%	0.846	82%	0.818	S	S	*	*			trans	-55.7	136.7	171.6	-62.3	169	141.3	0	0	110.2
241	T	36.8	Very low	42.4	Very low	123 Å²	123	156.4 Å²	156.4	76%	0.755	83%	0.828	S	S	*	*				169.6	114.8	113.5	34.3	0	0	0	0	109.2	E243	T241-E243 PolarHBondContact O-N 3.02Å
242	D	41.6	Very low	42.4	Very low	168 Å²	168	160.6 Å²	160.6	90%	0.898	84%	0.835	S	S	*	*			trans	-64.1	111.8	157.4	-86.3	-34.1	0	0	0	107.1	D244	D242-D244 PolarHBondContact O-N 3.34Å
243	E	43.4	Very low	42.1	Very low	170 Å²	170	158.6 Å²	158.6	79%	0.794	83%	0.831	S	S	*	*			trans	-80.4	97.7	163.1	-85	-168.8	158.5	0	0	109	T241 L245	T241-E243 PolarHBondContact O-N 3.02Å; E243-L245 PolarHBondContact O-N 3.32Å; E243-L245 VanDerWaalsContact O-N 3.09Å
244	D	47.9	Very low	41.9	Very low	146 Å²	146	161.6 Å²	161.6	78%	0.781	84%	0.837	S	S	*	*			trans	-60.4	102.8	162.2	-103.1	-20.4	0	0	0	109.3	D242 L246	D242-D244 PolarHBondContact O-N 3.34Å; D244-L246 VanDerWaalsContact C-N 3.26Å; D244-L246 PolarHBondContact O-N 3.07Å
245	L	45.1	Very low	42	Very low	150 Å²	150	166.6 Å²	166.6	79%	0.785	84%	0.843	S	S	*	*			trans	-81.1	78.7	165.5	-79.2	162.3	0	0	0	109.7	E243 F247	E243-L245 PolarHBondContact O-N 3.32Å; E243-L245 VanDerWaalsContact O-N 3.09Å; L245-F247 PolarHBondContact O-N 2.86Å
246	L	36.6	Very low	41.9	Very low	155 Å²	155	167.4 Å²	167.4	81%	0.812	84%	0.843	S	S	*	*			trans	-66.1	117.1	152.5	-91.3	154.4	0	0	0	108.2	D244	D244-L246 VanDerWaalsContact C-N 3.26Å; D244-L246 PolarHBondContact O-N 3.07Å
247	F	41.7	Very low	41.9	Very low	198 Å²	198	167.9 Å²	167.9	87%	0.868	85%	0.847	S	S	*	*			trans	-63.7	135.3	168.8	-77.3	-92	0	0	0	110.9	L245	L245-F247 PolarHBondContact O-N 2.86Å
248	E	37	Very low	41.4	Very low	263 Å²	263	168.5 Å²	168.5	100%	1.229	85%	0.847	S	S	*	*			trans	-71.9	0	135.3	-80	-170.4	157.6	0	0	110

Retrieved 248 of 248 residues in 180.8 ms (Link to these results)

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