A0A3Q0KFX1_SCHMA Loading...

AAA domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KFX1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 632 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	31.3	Very low	39.6	Very low	247 Å²	247	143.3 Å²	143.3	100%	1.217	72%	0.721	S	S	*	*				0	103.7	0	-61.8	163.7	102.5	0	0	106.3
2	K	33.9	Very low	41.1	Very low	206 Å²	206	146.7 Å²	146.7	90%	0.896	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-97.3	136.6	165.1	-86.8	-174	170.7	-176.2	0	106.4
3	E	35.3	Very low	42.4	Very low	182 Å²	182	144.1 Å²	144.1	85%	0.85	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-60.8	139.4	-165.4	-68.8	128.4	145.9	0	0	112	V5	E3-V5 PolarHBondContact O-N 3.2Å
4	S	35.8	Very low	43.3	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-58.2	119.8	171	47.6	0	0	0	0	109.1	G6	S4-G6 PolarHBondContact O-N 3.03Å
5	V	37.6	Very low	44.9	Very low	117 Å²	117	135.6 Å²	135.6	71%	0.709	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-54.8	124.5	176.7	177.6	0	0	0	0	109.6	E3 F7	E3-V5 PolarHBondContact O-N 3.2Å; V5-F7 PolarHBondContact O-N 3.14Å; V5-F7 VanDerWaalsContact O-N 3.14Å
6	G	33.4	Very low	46.2	Very low	52 Å²	52	131.9 Å²	131.9	54%	0.536	65%	0.648	S	S	.	*			trans	71.6	15.5	137.5	0	0	0	0	0	120.5	S4 Q8	S4-G6 PolarHBondContact O-N 3.03Å; G6-Q8 PolarHBondContact O-N 3.39Å
7	F	35.7	Very low	47.1	Very low	196 Å²	196	125.1 Å²	125.1	86%	0.86	61%	0.614	S	S	*	*			trans	-71.2	66.5	162.6	-72.3	-71.1	0	0	0	110.8	V5	V5-F7 PolarHBondContact O-N 3.14Å; V5-F7 VanDerWaalsContact O-N 3.14Å
8	Q	42	Very low	48.1	Very low	151 Å²	151	119.1 Å²	119.1	71%	0.706	59%	0.588	S	S	*	*			trans	-107	86.6	178.1	-82.7	-155.9	-18.7	0	0	112.7	G6	G6-Q8 PolarHBondContact O-N 3.39Å
9	Y	42.3	Very low	49.2	Very low	182 Å²	182	116.3 Å²	116.3	71%	0.714	58%	0.578	S	S	*	*			trans	62.5	91.3	150.2	-59	-83	0	0	0	116	D11	Y9-D11 PolarHBondContact O-N 2.88Å
10	I	47.8	Very low	49.9	Very low	72 Å²	72	114.5 Å²	114.5	37%	0.369	57%	0.568	S	S	.	*	S	Bend	trans	-45.2	115.2	130.8	-60.8	173.8	0	0	0	106.3	R12 L15 L497 L501	I10-R12 PolarHBondContact O-N 2.89Å; I10-L15 HydrophobicContact CG2-CB 3.96Å; I10-L497 HydrophobicContact CG2-CD1 4.06Å; I10-L501 HydrophobicContact CD1-CD2 4.15Å; I10-L501 HydrophobicContact CG1-CD2 4.03Å
11	D	60.3	Low	50.7	Low	71 Å²	71	109.3 Å²	109.3	38%	0.38	54%	0.543	S	S	.	.			trans	-50.4	112.8	-176.3	-175	5.1	0	0	0	109	Y9 D13 R14 L15	Y9-D11 PolarHBondContact O-N 2.88Å; D11-D13 PolarHBondContact O-N 3.41Å; D11-D13 VanDerWaalsContact O-N 3.07Å; D11-R14 HydrophobicContact CB-CB 4.34Å; D11-R14 HydrophobicContact CB-CG 3.74Å; D11-R14 WeakPolarHBondContact O-CA 3.11Å; D11-R14 WeakPolarHBondContact O-CB 3.44Å; D11-R14 PolarHBondContact O-N 3.12Å; D11-R14 IonicContact OD2-CZ 3.39Å; D11-R14 IonicContact OD2-NE 3.13Å; D11-R14 PolarHBondContact OD2-NE 3.02Å; D11-R14 IonicContact OD2-NH2 3.51Å; D11-L15 PolarHBondContact O-N 2.89Å; D11-L15 VanDerWaalsContact O-N 3.15Å
12	R	58.3	Low	52.3	Low	184 Å²	184	99.5 Å²	99.5	69%	0.694	50%	0.501	S	S	*	.	H	α-helix	trans	-57.9	-35.1	-161.4	-175.7	-175.8	-178.8	-175.9	0.7	111.3	I10 R14 L15 L16	I10-R12 PolarHBondContact O-N 2.89Å; R12-R14 VanDerWaalsContact C-N 3.34Å; R12-L15 PolarHBondContact O-N 3.18Å; R12-L16 HydrophobicContact CG-CD1 4.06Å; R12-L16 HydrophobicContact CG-CG 4.5Å; R12-L16 WeakPolarHBondContact O-CB 3.34Å; R12-L16 VanDerWaalsContact O-CG 3.24Å; R12-L16 WeakPolarHBondContact O-CG 3.48Å; R12-L16 PolarHBondContact O-N 2.89Å
13	D	57.8	Low	53.9	Low	113 Å²	113	96 Å²	96	60%	0.604	49%	0.486	S	S	*	.	H	α-helix	trans	-70.3	-31.3	-179.5	-62.5	-16.1	0	0	0	111.4	D11 L17	D11-D13 PolarHBondContact O-N 3.41Å; D11-D13 VanDerWaalsContact O-N 3.07Å; D13-L17 WeakPolarHBondContact O-CB 3.43Å; D13-L17 PolarHBondContact O-N 3.1Å
14	R	55.2	Low	55.2	Low	79 Å²	79	90.4 Å²	90.4	30%	0.298	46%	0.457	S	S	.	.	H	α-helix	trans	-73.2	-41.2	174	-52.5	-172.1	-165.1	-166.8	1.8	112.4	D11 R12 L17 A18 W473 D500	D11-R14 HydrophobicContact CB-CB 4.34Å; D11-R14 HydrophobicContact CB-CG 3.74Å; D11-R14 WeakPolarHBondContact O-CA 3.11Å; D11-R14 WeakPolarHBondContact O-CB 3.44Å; D11-R14 PolarHBondContact O-N 3.12Å; D11-R14 IonicContact OD2-CZ 3.39Å; D11-R14 IonicContact OD2-NE 3.13Å; D11-R14 PolarHBondContact OD2-NE 3.02Å; D11-R14 IonicContact OD2-NH2 3.51Å; R12-R14 VanDerWaalsContact C-N 3.34Å; R14-L17 PolarHBondContact O-N 3.17Å; R14-A18 PolarHBondContact O-N 2.85Å; R14-W473 HydrophobicContact CB-CH2 3.75Å; R14-W473 HydrophobicContact CB-CZ2 4.25Å; R14-W473 HydrophobicContact CG-CH2 3.46Å; R14-W473 VanDerWaalsContact CG-CH2 3.46Å; R14-W473 HydrophobicContact CG-CZ2 3.79Å; R14-W473 HydrophobicContact CG-CZ3 4.13Å; R14-D500 IonicContact NH1-OD2 2.77Å; R14-D500 PolarHBondContact NH1-OD2 2.93Å
15	L	66.4	Low	56.3	Low	82 Å²	82	87.8 Å²	87.8	43%	0.429	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-42.4	174.1	-175.5	64.2	0	0	0	110.8	I10 D11 R12 L17 A18 V19	I10-L15 HydrophobicContact CG2-CB 3.96Å; D11-L15 PolarHBondContact O-N 2.89Å; D11-L15 VanDerWaalsContact O-N 3.15Å; R12-L15 PolarHBondContact O-N 3.18Å; L15-L17 VanDerWaalsContact C-N 3.3Å; L15-L17 PolarHBondContact O-N 3.36Å; L15-A18 PolarHBondContact O-N 3.09Å; L15-V19 WeakPolarHBondContact O-CB 3.47Å; L15-V19 VanDerWaalsContact O-CG2 3.32Å; L15-V19 WeakPolarHBondContact O-CG2 3.44Å; L15-V19 PolarHBondContact O-N 3.05Å
16	L	66.6	Low	57.4	Low	77 Å²	77	86.3 Å²	86.3	40%	0.403	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-41.5	172.1	-78.2	169.2	0	0	0	111.5	R12 V19 Q20	R12-L16 HydrophobicContact CG-CD1 4.06Å; R12-L16 HydrophobicContact CG-CG 4.5Å; R12-L16 WeakPolarHBondContact O-CB 3.34Å; R12-L16 VanDerWaalsContact O-CG 3.24Å; R12-L16 WeakPolarHBondContact O-CG 3.48Å; R12-L16 PolarHBondContact O-N 2.89Å; L16-V19 PolarHBondContact O-N 2.78Å; L16-Q20 WeakPolarHBondContact O-CB 3.4Å; L16-Q20 VanDerWaalsContact O-CG 3.24Å; L16-Q20 WeakPolarHBondContact O-CG 3.38Å; L16-Q20 PolarHBondContact O-N 3.23Å
17	L	61	Low	58.5	Low	15 Å²	15	91.7 Å²	91.7	8%	0.079	43%	0.43	C	S	.	.	H	α-helix	trans	-63.7	-50.1	174.7	178.2	66.9	0	0	0	111.9	D13 R14 L15 V19 Q20 V21 W473 L476 L485	D13-L17 WeakPolarHBondContact O-CB 3.43Å; D13-L17 PolarHBondContact O-N 3.1Å; R14-L17 PolarHBondContact O-N 3.17Å; L15-L17 VanDerWaalsContact C-N 3.3Å; L15-L17 PolarHBondContact O-N 3.36Å; L17-V19 PolarHBondContact O-N 3.27Å; L17-Q20 CarbonylContact O-C 3.52Å; L17-Q20 WeakPolarHBondContact O-CA 3.4Å; L17-Q20 WeakPolarHBondContact O-CB 3.17Å; L17-Q20 PolarHBondContact O-N 3.39Å; L17-V21 HydrophobicContact CD1-CG2 3.84Å; L17-V21 HydrophobicContact CG-CG2 4.14Å; L17-V21 WeakPolarHBondContact O-CG2 3.38Å; L17-V21 PolarHBondContact O-N 3.24Å; L17-W473 HydrophobicContact CD2-CE3 4.4Å; L17-W473 HydrophobicContact CD2-CH2 3.67Å; L17-W473 HydrophobicContact CD2-CZ3 3.45Å; L17-W473 VanDerWaalsContact CD2-CZ3 3.45Å; L17-L476 HydrophobicContact CD1-CD2 3.89Å; L17-L476 HydrophobicContact CD2-CB 4.41Å; L17-L476 HydrophobicContact CD2-CD1 3.57Å; L17-L476 HydrophobicContact CD2-CD2 4.19Å; L17-L476 HydrophobicContact CD2-CG 4.28Å; L17-L485 HydrophobicContact CD1-CD2 4.19Å
18	A	65.3	Low	59.3	Low	18 Å²	18	86.3 Å²	86.3	15%	0.149	42%	0.416	C	S	.	.	H	α-helix	trans	-55.9	-41.2	178.5	0	0	0	0	0	111.3	R14 L15 A22 V493	R14-A18 PolarHBondContact O-N 2.85Å; L15-A18 PolarHBondContact O-N 3.09Å; A18-A22 VanDerWaalsContact O-CB 3.23Å; A18-A22 WeakPolarHBondContact O-CB 3.23Å; A18-A22 PolarHBondContact O-N 2.83Å; A18-V493 HydrophobicContact CB-CG1 4.39Å
19	V	68.3	Low	59.3	Low	65 Å²	65	83.3 Å²	83.3	39%	0.394	40%	0.404	S	S	.	.	H	α-helix	trans	-66.5	-35.9	172.5	171.8	0	0	0	0	112.5	L15 L16 L17 K23	L15-V19 WeakPolarHBondContact O-CB 3.47Å; L15-V19 VanDerWaalsContact O-CG2 3.32Å; L15-V19 WeakPolarHBondContact O-CG2 3.44Å; L15-V19 PolarHBondContact O-N 3.05Å; L16-V19 PolarHBondContact O-N 2.78Å; L17-V19 PolarHBondContact O-N 3.27Å; V19-K23 HydrophobicContact CG1-CD 4.25Å; V19-K23 VanDerWaalsContact O-CB 3.3Å; V19-K23 WeakPolarHBondContact O-CB 3.21Å; V19-K23 VanDerWaalsContact O-CG 3.26Å; V19-K23 WeakPolarHBondContact O-CG 3.36Å; V19-K23 PolarHBondContact O-N 3.33Å
20	Q	63	Low	59.4	Low	80 Å²	80	78.3 Å²	78.3	37%	0.374	40%	0.396	S	S	.	.	H	α-helix	trans	-71	-43.4	177.1	-78	174.2	19.8	0	0	112.8	L16 L17 K23 R24 F482	L16-Q20 WeakPolarHBondContact O-CB 3.4Å; L16-Q20 VanDerWaalsContact O-CG 3.24Å; L16-Q20 WeakPolarHBondContact O-CG 3.38Å; L16-Q20 PolarHBondContact O-N 3.23Å; L17-Q20 CarbonylContact O-C 3.52Å; L17-Q20 WeakPolarHBondContact O-CA 3.4Å; L17-Q20 WeakPolarHBondContact O-CB 3.17Å; L17-Q20 PolarHBondContact O-N 3.39Å; Q20-K23 PolarHBondContact O-N 3.05Å; Q20-R24 PolarHBondContact O-N 3.41Å; Q20-F482 HydrophobicContact CG-CZ 4.47Å
21	V	66.5	Low	59.2	Low	7 Å²	7	79.5 Å²	79.5	4%	0.042	41%	0.411	C	S	.	.	H	α-helix	trans	-66	-43.4	175	-171.7	0	0	0	0	109.7	L17 K23 R24 D25 L485 V490	L17-V21 HydrophobicContact CD1-CG2 3.84Å; L17-V21 HydrophobicContact CG-CG2 4.14Å; L17-V21 WeakPolarHBondContact O-CG2 3.38Å; L17-V21 PolarHBondContact O-N 3.24Å; V21-K23 VanDerWaalsContact C-N 3.32Å; V21-K23 PolarHBondContact O-N 3.05Å; V21-R24 WeakPolarHBondContact O-CB 3.36Å; V21-R24 PolarHBondContact O-N 2.91Å; V21-R24 VanDerWaalsContact O-N 3.1Å; V21-D25 PolarHBondContact O-N 3.37Å; V21-L485 HydrophobicContact CG2-CD2 4.12Å; V21-V490 HydrophobicContact CB-CG2 4.19Å; V21-V490 HydrophobicContact CG1-CG2 3.48Å; V21-V490 VanDerWaalsContact CG1-CG2 3.48Å
22	A	65.8	Low	58	Low	40 Å²	40	80.1 Å²	80.1	33%	0.331	42%	0.421	S	S	.	.	H	α-helix	trans	-58.7	-41.3	172.2	0	0	0	0	0	112.4	A18 D25 V26	A18-A22 VanDerWaalsContact O-CB 3.23Å; A18-A22 WeakPolarHBondContact O-CB 3.23Å; A18-A22 PolarHBondContact O-N 2.83Å; A22-D25 PolarHBondContact O-N 3.38Å; A22-V26 WeakPolarHBondContact O-CB 3.41Å; A22-V26 VanDerWaalsContact O-CG2 3.24Å; A22-V26 WeakPolarHBondContact O-CG2 3.32Å; A22-V26 PolarHBondContact O-N 3.35Å
23	K	67	Low	56.8	Low	134 Å²	134	79.7 Å²	79.7	58%	0.583	43%	0.426	S	S	*	.	H	α-helix	trans	-66.4	-33.2	174	-81.6	-179.1	177.5	-170.9	0	113.5	V19 Q20 V21 R27	V19-K23 HydrophobicContact CG1-CD 4.25Å; V19-K23 VanDerWaalsContact O-CB 3.3Å; V19-K23 WeakPolarHBondContact O-CB 3.21Å; V19-K23 VanDerWaalsContact O-CG 3.26Å; V19-K23 WeakPolarHBondContact O-CG 3.36Å; V19-K23 PolarHBondContact O-N 3.33Å; Q20-K23 PolarHBondContact O-N 3.05Å; V21-K23 VanDerWaalsContact C-N 3.32Å; V21-K23 PolarHBondContact O-N 3.05Å; K23-R27 VanDerWaalsContact O-CB 3.27Å; K23-R27 WeakPolarHBondContact O-CB 3.44Å; K23-R27 PolarHBondContact O-N 2.97Å; K23-R27 VanDerWaalsContact O-N 3.07Å
24	R	62.2	Low	55.6	Low	64 Å²	64	81.7 Å²	81.7	24%	0.242	44%	0.435	C	S	.	.	H	α-helix	trans	-64.5	-52.6	173	-173.1	-159.8	76.7	134.6	4	109.6	Q20 V21 R27 C28 D487	Q20-R24 PolarHBondContact O-N 3.41Å; V21-R24 WeakPolarHBondContact O-CB 3.36Å; V21-R24 PolarHBondContact O-N 2.91Å; V21-R24 VanDerWaalsContact O-N 3.1Å; R24-R27 CarbonylContact O-C 3.56Å; R24-R27 WeakPolarHBondContact O-CA 3.18Å; R24-R27 WeakPolarHBondContact O-CB 3.35Å; R24-R27 PolarHBondContact O-N 3.01Å; R24-C28 PolarHBondContact O-N 3.33Å; R24-C28 PolarHBondContact O-SG 2.87Å; R24-C28 VanDerWaalsContact O-SG 3.34Å; R24-D487 IonicContact CZ-OD1 2.88Å; R24-D487 IonicContact NH1-OD1 2.69Å; R24-D487 PolarHBondContact NH1-OD1 2.94Å; R24-D487 IonicContact NH2-OD1 3.19Å; R24-D487 PolarHBondContact NH2-OD1 3.14Å; R24-D487 VanDerWaalsContact NH2-OD1 3.13Å
25	D	59.4	Low	54.5	Low	44 Å²	44	87.2 Å²	87.2	24%	0.235	47%	0.465	C	S	.	.	H	α-helix	trans	-66.6	-41.4	-175.7	-71.2	14.3	0	0	0	111.3	V21 A22 R27 C28 L29 V490	V21-D25 PolarHBondContact O-N 3.37Å; A22-D25 PolarHBondContact O-N 3.38Å; D25-R27 VanDerWaalsContact C-N 3.3Å; D25-R27 PolarHBondContact O-N 3.37Å; D25-C28 WeakPolarHBondContact O-CB 3.34Å; D25-C28 PolarHBondContact O-N 3.35Å; D25-L29 WeakPolarHBondContact O-CG 3.31Å; D25-L29 PolarHBondContact O-N 3.04Å; D25-V490 WeakPolarHBondContact OD2-CG2 3.49Å
26	V	60.3	Low	52.7	Low	87 Å²	87	89.9 Å²	89.9	53%	0.527	48%	0.479	S	S	.	.	H	α-helix	trans	-60.6	-37	170.5	169.9	0	0	0	0	111.8	A22 L29 S30	A22-V26 WeakPolarHBondContact O-CB 3.41Å; A22-V26 VanDerWaalsContact O-CG2 3.24Å; A22-V26 WeakPolarHBondContact O-CG2 3.32Å; A22-V26 PolarHBondContact O-N 3.35Å; V26-L29 PolarHBondContact O-N 2.76Å; V26-S30 WeakPolarHBondContact O-CB 3.36Å; V26-S30 PolarHBondContact O-N 3.16Å; V26-S30 PolarHBondContact O-OG 3.37Å
27	R	56.3	Low	50.8	Low	164 Å²	164	94 Å²	94	62%	0.619	50%	0.502	S	S	*	.	H	α-helix	trans	-70.8	-35.2	176	-167.9	-177.2	-60.9	179.9	-0.3	112.4	K23 R24 D25 L29 S30 S31	K23-R27 VanDerWaalsContact O-CB 3.27Å; K23-R27 WeakPolarHBondContact O-CB 3.44Å; K23-R27 PolarHBondContact O-N 2.97Å; K23-R27 VanDerWaalsContact O-N 3.07Å; R24-R27 CarbonylContact O-C 3.56Å; R24-R27 WeakPolarHBondContact O-CA 3.18Å; R24-R27 WeakPolarHBondContact O-CB 3.35Å; R24-R27 PolarHBondContact O-N 3.01Å; D25-R27 VanDerWaalsContact C-N 3.3Å; D25-R27 PolarHBondContact O-N 3.37Å; R27-L29 VanDerWaalsContact C-N 3.27Å; R27-L29 PolarHBondContact O-N 3.13Å; R27-S30 WeakPolarHBondContact CA-OG 3.46Å; R27-S30 PolarHBondContact O-OG 2.98Å; R27-S31 VanDerWaalsContact O-CB 3.23Å; R27-S31 WeakPolarHBondContact O-CB 3.25Å; R27-S31 PolarHBondContact O-N 3.32Å
28	C	53.4	Low	49.2	Very low	83 Å²	83	97 Å²	97	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-65	-32.9	171.6	-66.1	0	0	0	0	111.8	R24 D25	R24-C28 PolarHBondContact O-N 3.33Å; R24-C28 PolarHBondContact O-SG 2.87Å; R24-C28 VanDerWaalsContact O-SG 3.34Å; D25-C28 WeakPolarHBondContact O-CB 3.34Å; D25-C28 PolarHBondContact O-N 3.35Å
29	L	41.4	Very low	47.3	Very low	89 Å²	89	107 Å²	107	47%	0.466	57%	0.573	S	S	.	*	H	α-helix	trans	-76.5	-42.9	173.8	-66.4	169.3	0	0	0	112.5	D25 V26 R27 S31 S32 Y292	D25-L29 WeakPolarHBondContact O-CG 3.31Å; D25-L29 PolarHBondContact O-N 3.04Å; V26-L29 PolarHBondContact O-N 2.76Å; R27-L29 VanDerWaalsContact C-N 3.27Å; R27-L29 PolarHBondContact O-N 3.13Å; L29-S31 PolarHBondContact O-N 3.36Å; L29-S32 WeakPolarHBondContact O-CB 3.46Å; L29-S32 PolarHBondContact O-N 3.3Å; L29-S32 VanDerWaalsContact O-N 3.12Å; L29-S32 PolarHBondContact O-OG 3.33Å; L29-S32 VanDerWaalsContact O-OG 3.09Å; L29-Y292 HydrophobicContact CD2-CE1 4.23Å
30	S	45.3	Very low	45.2	Very low	77 Å²	77	110.3 Å²	110.3	54%	0.538	59%	0.587	S	S	.	*	H	α-helix	trans	-70.9	-20.6	177.5	73.3	0	0	0	0	112.9	V26 R27 S32	V26-S30 WeakPolarHBondContact O-CB 3.36Å; V26-S30 PolarHBondContact O-N 3.16Å; V26-S30 PolarHBondContact O-OG 3.37Å; R27-S30 WeakPolarHBondContact CA-OG 3.46Å; R27-S30 PolarHBondContact O-OG 2.98Å; S30-S32 PolarHBondContact O-N 3.45Å
31	S	43.6	Very low	43.4	Very low	97 Å²	97	111.6 Å²	111.6	68%	0.678	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	5	170.7	-169.3	0	0	0	0	113.3	R27 L29 E33	R27-S31 VanDerWaalsContact O-CB 3.23Å; R27-S31 WeakPolarHBondContact O-CB 3.25Å; R27-S31 PolarHBondContact O-N 3.32Å; L29-S31 PolarHBondContact O-N 3.36Å; S31-E33 VanDerWaalsContact C-N 3.32Å
32	S	34.2	Very low	41.6	Very low	84 Å²	84	119.9 Å²	119.9	59%	0.587	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	21.7	169.1	89	0	0	0	0	113.3	L29 S30 I34	L29-S32 WeakPolarHBondContact O-CB 3.46Å; L29-S32 PolarHBondContact O-N 3.3Å; L29-S32 VanDerWaalsContact O-N 3.12Å; L29-S32 PolarHBondContact O-OG 3.33Å; L29-S32 VanDerWaalsContact O-OG 3.09Å; S30-S32 PolarHBondContact O-N 3.45Å; S32-I34 PolarHBondContact O-N 3.36Å
33	E	34.6	Very low	39.7	Very low	174 Å²	174	123.1 Å²	123.1	81%	0.813	66%	0.656	S	S	*	*			trans	-66.1	113.5	157.9	-89.4	-170.5	153.2	0	0	109	S31 E35	S31-E33 VanDerWaalsContact C-N 3.32Å; E33-E35 VanDerWaalsContact C-N 3.34Å; E33-E35 PolarHBondContact O-N 3.01Å
34	I	32	Very low	37.8	Very low	155 Å²	155	121.1 Å²	121.1	80%	0.795	66%	0.664	S	S	*	*			trans	-75	86.2	-179.2	-63.3	145.2	0	0	0	107.4	S32 D36	S32-I34 PolarHBondContact O-N 3.36Å; I34-D36 VanDerWaalsContact C-N 3.34Å; I34-D36 HydrophobicContact CG2-CB 4.47Å; I34-D36 PolarHBondContact O-N 3.47Å
35	E	31.6	Very low	36.1	Very low	196 Å²	196	125.2 Å²	125.2	92%	0.916	69%	0.686	S	S	*	*			trans	-81.8	89.9	158	-75.7	-161.1	146.1	0	0	109	E33	E33-E35 VanDerWaalsContact C-N 3.34Å; E33-E35 PolarHBondContact O-N 3.01Å
36	D	28.3	Very low	34.3	Very low	137 Å²	137	128 Å²	128	73%	0.733	71%	0.709	S	S	*	*			trans	-65.2	135.7	166	-153.6	10.9	0	0	0	109.8	I34	I34-D36 VanDerWaalsContact C-N 3.34Å; I34-D36 HydrophobicContact CG2-CB 4.47Å; I34-D36 PolarHBondContact O-N 3.47Å
37	D	27.1	Very low	32.9	Very low	163 Å²	163	132.8 Å²	132.8	87%	0.872	72%	0.723	S	S	*	*			trans	41.2	97.3	174	-84.6	-21.8	0	0	0	119.5
38	G	27.2	Very low	31.5	Very low	80 Å²	80	130.6 Å²	130.6	83%	0.825	72%	0.724	S	S	*	*			trans	-156.3	82.4	175.4	0	0	0	0	0	116
39	Y	25.3	Very low	30.1	Very low	228 Å²	228	134.3 Å²	134.3	89%	0.894	74%	0.738	S	S	*	*			trans	-34.4	135	178.2	-155	-99.1	0	0	0	117.8	P41	Y39-P41 WeakPolarHBondContact O-CD 3.44Å
40	I	24.5	Very low	29.3	Very low	134 Å²	134	135.8 Å²	135.8	69%	0.687	75%	0.746	S	S	*	*			trans	-52.4	138.8	173.7	-63.9	163.7	0	0	0	112.4	E42	I40-E42 HydrophobicContact CG2-CG 4.02Å; I40-E42 VanDerWaalsContact CG2-N 3.34Å
41	P	26.3	Very low	28.4	Very low	107 Å²	107	136.5 Å²	136.5	70%	0.695	75%	0.752	S	S	*	*				-123.6	121.5	128.8	33.8	-28.4	0	0	0	112.2	Y39 T43	Y39-P41 WeakPolarHBondContact O-CD 3.44Å; P41-T43 VanDerWaalsContact C-N 3.32Å; P41-T43 PolarHBondContact O-N 3.4Å
42	E	26.7	Very low	27.7	Very low	181 Å²	181	140.5 Å²	140.5	85%	0.846	76%	0.764	S	S	*	*			trans	-61.1	90.5	167	-70.2	179	115	0	0	110	I40 A44	I40-E42 HydrophobicContact CG2-CG 4.02Å; I40-E42 VanDerWaalsContact CG2-N 3.34Å; E42-A44 PolarHBondContact O-N 3.38Å; E42-A44 VanDerWaalsContact O-N 3.09Å
43	T	27.7	Very low	27.3	Very low	107 Å²	107	144 Å²	144	66%	0.656	78%	0.776	S	S	*	*			trans	-85.3	76.5	164.3	-50.9	0	0	0	0	108.1	P41 Q45	P41-T43 VanDerWaalsContact C-N 3.32Å; P41-T43 PolarHBondContact O-N 3.4Å; T43-Q45 HydrophobicContact CG2-CG 4.14Å; T43-Q45 PolarHBondContact O-N 3.34Å
44	A	25.7	Very low	26.7	Very low	93 Å²	93	139.4 Å²	139.4	77%	0.769	76%	0.763	S	S	*	*			trans	-68.4	68	171.6	0	0	0	0	0	110.8	E42 S46	E42-A44 PolarHBondContact O-N 3.38Å; E42-A44 VanDerWaalsContact O-N 3.09Å; A44-S46 VanDerWaalsContact C-N 3.33Å; A44-S46 PolarHBondContact O-N 2.96Å
45	Q	26.2	Very low	26.2	Very low	149 Å²	149	137.9 Å²	137.9	70%	0.696	76%	0.763	S	S	*	*			trans	-75.8	92.1	165	-88.1	-173.1	3.8	0	0	108.9	T43 F47	T43-Q45 HydrophobicContact CG2-CG 4.14Å; T43-Q45 PolarHBondContact O-N 3.34Å; Q45-F47 PolarHBondContact O-N 3.04Å
46	S	23.3	Very low	25.9	Very low	102 Å²	102	133.4 Å²	133.4	71%	0.713	75%	0.749	S	S	*	*			trans	-58.2	103.1	167.7	47.9	0	0	0	0	110.5	A44 N48	A44-S46 VanDerWaalsContact C-N 3.33Å; A44-S46 PolarHBondContact O-N 2.96Å; S46-N48 PolarHBondContact O-N 3.03Å
47	F	30.6	Very low	25.9	Very low	188 Å²	188	133.4 Å²	133.4	83%	0.825	75%	0.749	S	S	*	*			trans	-69.3	88.9	155.3	-80.8	-76.5	0	0	0	107.9	Q45 N49	Q45-F47 PolarHBondContact O-N 3.04Å; F47-N49 PolarHBondContact O-N 3.5Å; F47-N49 VanDerWaalsContact O-N 3.12Å
48	N	27.2	Very low	25.8	Very low	118 Å²	118	132.5 Å²	132.5	63%	0.631	74%	0.744	S	S	*	*			trans	-64.9	106.4	-173.7	-169.1	-6.8	0	0	0	109.7	S46 N50	S46-N48 PolarHBondContact O-N 3.03Å; N48-N50 VanDerWaalsContact C-N 3.33Å; N48-N50 PolarHBondContact O-N 3.43Å; N48-N50 PolarHBondContact OD1-ND2 2.86Å
49	N	23.6	Very low	25.6	Very low	161 Å²	161	138.9 Å²	138.9	86%	0.861	74%	0.743	S	S	*	*			trans	-64.2	91.6	170.7	-79	-44.7	0	0	0	109.6	F47	F47-N49 PolarHBondContact O-N 3.5Å; F47-N49 VanDerWaalsContact O-N 3.12Å
50	N	24.1	Very low	25.6	Very low	120 Å²	120	136.5 Å²	136.5	64%	0.642	75%	0.745	S	S	*	*			trans	-142.8	119	170.3	-94.9	-57.2	0	0	0	112.5	N48	N48-N50 VanDerWaalsContact C-N 3.33Å; N48-N50 PolarHBondContact O-N 3.43Å; N48-N50 PolarHBondContact OD1-ND2 2.86Å
51	S	26.2	Very low	25.9	Very low	93 Å²	93	136.2 Å²	136.2	65%	0.65	75%	0.749	S	S	*	*			trans	68.4	69.1	145.4	-55.3	0	0	0	0	118.8
52	L	28.7	Very low	25.7	Very low	181 Å²	181	139.4 Å²	139.4	95%	0.948	76%	0.755	S	S	*	*			trans	-112.3	85.1	131.8	-83.1	173.8	0	0	0	109.8	S54	L52-S54 PolarHBondContact O-N 3.32Å
53	L	25.7	Very low	25.5	Very low	157 Å²	157	140.3 Å²	140.3	82%	0.822	76%	0.756	S	S	*	*			trans	-60.8	112.9	164.1	-80.4	159.1	0	0	0	109.2
54	S	21.7	Very low	25.6	Very low	78 Å²	78	141.2 Å²	141.2	55%	0.545	76%	0.763	S	S	.	*			trans	10.7	123.2	144.9	-171.3	0	0	0	0	118.7	L52 V56	L52-S54 PolarHBondContact O-N 3.32Å; S54-V56 WeakPolarHBondContact OG-CG2 3.42Å; S54-V56 PolarHBondContact OG-N 2.91Å; S54-V56 VanDerWaalsContact OG-N 3.14Å
55	P	23.1	Very low	25.7	Very low	123 Å²	123	142.9 Å²	142.9	80%	0.799	76%	0.764	S	S	*	*			trans	-82	99.6	139	30.5	-22.4	0	0	0	109	D57	P55-D57 VanDerWaalsContact C-N 3.33Å; P55-D57 PolarHBondContact O-N 2.89Å
56	V	25.2	Very low	25.6	Very low	101 Å²	101	143.4 Å²	143.4	61%	0.612	77%	0.767	S	S	*	*			trans	-72.4	90.5	165.4	177.8	0	0	0	0	107.9	S54 N58	S54-V56 WeakPolarHBondContact OG-CG2 3.42Å; S54-V56 PolarHBondContact OG-N 2.91Å; S54-V56 VanDerWaalsContact OG-N 3.14Å; V56-N58 VanDerWaalsContact C-N 3.34Å; V56-N58 HydrophobicContact CG1-CB 4.31Å; V56-N58 VanDerWaalsContact CG1-CG 3.43Å; V56-N58 VanDerWaalsContact CG1-ND2 3.34Å; V56-N58 WeakPolarHBondContact CG1-ND2 3.31Å; V56-N58 WeakPolarHBondContact CG1-OD1 3.46Å; V56-N58 PolarHBondContact O-N 2.89Å
57	D	28.2	Very low	25.7	Very low	138 Å²	138	145.1 Å²	145.1	74%	0.738	77%	0.772	S	S	*	*			trans	-87.2	79.6	168.5	-126	-34	0	0	0	109.9	P55 R59	P55-D57 VanDerWaalsContact C-N 3.33Å; P55-D57 PolarHBondContact O-N 2.89Å; D57-R59 VanDerWaalsContact C-N 3.32Å; D57-R59 PolarHBondContact O-N 3.3Å
58	N	24.2	Very low	25.3	Very low	143 Å²	143	142.6 Å²	142.6	77%	0.765	77%	0.766	S	S	*	*			trans	-66.8	84.9	174.1	-85.2	-30.7	0	0	0	110.8	V56	V56-N58 VanDerWaalsContact C-N 3.34Å; V56-N58 HydrophobicContact CG1-CB 4.31Å; V56-N58 VanDerWaalsContact CG1-CG 3.43Å; V56-N58 VanDerWaalsContact CG1-ND2 3.34Å; V56-N58 WeakPolarHBondContact CG1-ND2 3.31Å; V56-N58 WeakPolarHBondContact CG1-OD1 3.46Å; V56-N58 PolarHBondContact O-N 2.89Å
59	R	24.2	Very low	25.3	Very low	215 Å²	215	147.7 Å²	147.7	81%	0.811	78%	0.777	S	S	*	*			trans	-105.9	88.8	162.6	-74.8	-163.1	176.3	-158.9	-0.3	111.8	D57 V61	D57-R59 VanDerWaalsContact C-N 3.32Å; D57-R59 PolarHBondContact O-N 3.3Å; R59-V61 VanDerWaalsContact C-N 3.27Å; R59-V61 HydrophobicContact CB-CG2 4.39Å; R59-V61 PolarHBondContact O-N 3.34Å
60	L	25	Very low	25.3	Very low	178 Å²	178	145 Å²	145	93%	0.932	77%	0.771	S	S	*	*			trans	-65.9	77.5	171.1	-156.5	98	0	0	0	110.8	Q62	L60-Q62 PolarHBondContact O-N 2.91Å
61	V	29.3	Very low	25.3	Very low	127 Å²	127	145.6 Å²	145.6	77%	0.77	78%	0.779	S	S	*	*			trans	-91.4	99.2	176.9	-176.5	0	0	0	0	110.2	R59	R59-V61 VanDerWaalsContact C-N 3.27Å; R59-V61 HydrophobicContact CB-CG2 4.39Å; R59-V61 PolarHBondContact O-N 3.34Å
62	Q	23.6	Very low	25.3	Very low	175 Å²	175	147.5 Å²	147.5	82%	0.818	78%	0.781	S	S	*	*			trans	4.4	117.5	162.3	-66.6	172.7	-13.1	0	0	118	L60	L60-Q62 PolarHBondContact O-N 2.91Å
63	K	22.7	Very low	25.4	Very low	199 Å²	199	147.3 Å²	147.3	87%	0.865	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-56.5	133.6	160.3	-68.4	179.2	176.8	179.1	0	110.1	T65	K63-T65 PolarHBondContact O-N 3.48Å
64	P	29.7	Very low	25.3	Very low	126 Å²	126	148.9 Å²	148.9	82%	0.818	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-60.6	131	166.6	-22.7	34.1	0	0	0	111.1	Q66	P64-Q66 PolarHBondContact O-N 3.32Å
65	T	27	Very low	25.7	Very low	129 Å²	129	155.1 Å²	155.1	79%	0.791	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-52	125.7	179	-54.9	0	0	0	0	112.3	K63 V67	K63-T65 PolarHBondContact O-N 3.48Å; T65-V67 PolarHBondContact O-N 3.12Å
66	Q	24.8	Very low	25.9	Very low	159 Å²	159	158 Å²	158	74%	0.743	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-61.1	122.4	167	-75.6	-178.1	-19.3	0	0	110	P64 I68	P64-Q66 PolarHBondContact O-N 3.32Å; Q66-I68 HydrophobicContact CB-CD1 4.48Å; Q66-I68 HydrophobicContact CB-CG1 4.12Å; Q66-I68 PolarHBondContact O-N 3.32Å
67	V	25.4	Very low	25.9	Very low	138 Å²	138	157.9 Å²	157.9	84%	0.836	79%	0.793	S	S	*	*			trans	-78.9	87.3	170.6	-179.8	0	0	0	0	108.6	T65	T65-V67 PolarHBondContact O-N 3.12Å
68	I	22.1	Very low	26.1	Very low	136 Å²	136	158 Å²	158	70%	0.697	79%	0.791	S	S	*	*			trans	-93.9	91.9	170.7	-55.8	176.9	0	0	0	109.1	Q66	Q66-I68 HydrophobicContact CB-CD1 4.48Å; Q66-I68 HydrophobicContact CB-CG1 4.12Å; Q66-I68 PolarHBondContact O-N 3.32Å
69	R	26.2	Very low	26.2	Very low	225 Å²	225	157.3 Å²	157.3	85%	0.849	79%	0.787	S	S	*	*			trans	-158.2	137.1	157.9	-70.6	-166.6	-176.6	148.2	2	109.1
70	S	24.5	Very low	26.3	Very low	105 Å²	105	151.9 Å²	151.9	73%	0.734	78%	0.782	S	S	*	*			cis	-155	136.7	-20.2	-77.2	0	0	0	0	106.8	D72	S70-D72 PolarHBondContact O-N 2.93Å
71	T	23.7	Very low	26.6	Very low	132 Å²	132	151.5 Å²	151.5	81%	0.81	77%	0.773	S	S	*	*			trans	-65	119.9	158.9	46.8	0	0	0	0	108.9
72	D	26.6	Very low	26.6	Very low	132 Å²	132	150.8 Å²	150.8	71%	0.706	77%	0.771	S	S	*	*			trans	173.8	86.7	142.4	-93.7	-28.7	0	0	0	112	S70	S70-D72 PolarHBondContact O-N 2.93Å
73	Q	29.7	Very low	26.9	Very low	177 Å²	177	153.7 Å²	153.7	83%	0.827	77%	0.774	S	S	*	*			trans	-131.7	65.8	149.4	-73.3	-159	1.2	0	0	110.5	Y75	Q73-Y75 PolarHBondContact O-N 2.93Å
74	K	25.3	Very low	27.3	Very low	190 Å²	190	151.3 Å²	151.3	83%	0.826	77%	0.77	S	S	*	*			trans	-65.8	82.1	157.4	-77.5	176	175.7	165.4	0	109.7
75	Y	30	Very low	27.3	Very low	209 Å²	209	151.7 Å²	151.7	82%	0.82	76%	0.764	S	S	*	*			trans	-95	119.6	160.6	-86.2	-77	0	0	0	111	Q73	Q73-Y75 PolarHBondContact O-N 2.93Å
76	K	27.3	Very low	27.4	Very low	185 Å²	185	151.8 Å²	151.8	80%	0.804	77%	0.767	S	S	*	*			trans	-56.6	139.3	-170	-70.1	166.8	174.4	172.4	0	112	I78	K76-I78 PolarHBondContact O-N 3.48Å; K76-I78 VanDerWaalsContact O-N 3.11Å
77	S	24.1	Very low	27.8	Very low	98 Å²	98	149.3 Å²	149.3	69%	0.685	77%	0.767	S	S	*	*			trans	-48.8	115.5	150.1	176.1	0	0	0	0	109.6
78	I	32	Very low	28.1	Very low	139 Å²	139	153.4 Å²	153.4	71%	0.713	77%	0.768	S	S	*	*			trans	-112.7	94.5	154.3	-53.3	-177.2	0	0	0	105.8	K76 S80	K76-I78 PolarHBondContact O-N 3.48Å; K76-I78 VanDerWaalsContact O-N 3.11Å; I78-S80 WeakPolarHBondContact CG2-OG 3.12Å; I78-S80 PolarHBondContact O-N 2.82Å
79	L	27.4	Very low	28.5	Very low	130 Å²	130	154 Å²	154	68%	0.681	77%	0.772	S	S	*	*			trans	-72.3	69	177.3	-137.8	123	0	0	0	109.6	K81	L79-K81 VanDerWaalsContact C-N 3.27Å; L79-K81 HydrophobicContact CD2-CD 4.47Å; L79-K81 HydrophobicContact CD2-CG 4.12Å; L79-K81 PolarHBondContact O-N 2.76Å
80	S	27.2	Very low	28.7	Very low	100 Å²	100	149.2 Å²	149.2	70%	0.699	76%	0.764	S	S	*	*			trans	-72.9	78.4	177.4	-66.1	0	0	0	0	110.5	I78 P82	I78-S80 WeakPolarHBondContact CG2-OG 3.12Å; I78-S80 PolarHBondContact O-N 2.82Å; S80-P82 WeakPolarHBondContact O-CD 3.49Å
81	K	29.2	Very low	29	Very low	171 Å²	171	153.3 Å²	153.3	74%	0.743	77%	0.769	S	S	*	*			trans	-62.5	120	167.6	-66.4	-178.9	178.5	179.9	0	108.5	L79 R83	L79-K81 VanDerWaalsContact C-N 3.27Å; L79-K81 HydrophobicContact CD2-CD 4.47Å; L79-K81 HydrophobicContact CD2-CG 4.12Å; L79-K81 PolarHBondContact O-N 2.76Å; K81-R83 PolarHBondContact O-N 3.45Å
82	P	30.9	Very low	29.4	Very low	112 Å²	112	156 Å²	156	73%	0.727	77%	0.765	S	S	*	*			trans	-71.2	98.3	172.2	28.8	-32.1	0	0	0	109.1	S80 I84	S80-P82 WeakPolarHBondContact O-CD 3.49Å; P82-I84 HydrophobicContact CB-CD1 4.46Å; P82-I84 HydrophobicContact CB-CG1 4.36Å; P82-I84 PolarHBondContact O-N 2.67Å
83	R	28.6	Very low	29.6	Very low	235 Å²	235	156.4 Å²	156.4	89%	0.887	76%	0.763	S	S	*	*			trans	-70.8	81.6	166.3	179.4	-174.1	-89	164.8	-8.1	108.3	K81	K81-R83 PolarHBondContact O-N 3.45Å
84	I	32.8	Very low	29.7	Very low	149 Å²	149	155.1 Å²	155.1	76%	0.764	77%	0.767	S	S	*	*			trans	-93.6	110.3	167.3	-61.7	176.6	0	0	0	106.9	P82	P82-I84 HydrophobicContact CB-CD1 4.46Å; P82-I84 HydrophobicContact CB-CG1 4.36Å; P82-I84 PolarHBondContact O-N 2.67Å
85	L	29.5	Very low	30	Very low	135 Å²	135	151.3 Å²	151.3	71%	0.707	76%	0.76	S	S	*	*			trans	-59.5	149.7	169.7	-75.1	148.2	0	0	0	109.7	S87	L85-S87 VanDerWaalsContact C-N 3.31Å; L85-S87 PolarHBondContact O-N 3.21Å
86	P	27.6	Very low	30.1	Very low	130 Å²	130	152 Å²	152	84%	0.844	76%	0.761	S	S	*	*			trans	-69.3	86.5	179.9	29.1	-34.7	0	0	0	111	R88	P86-R88 PolarHBondContact O-N 3.37Å; P86-R88 VanDerWaalsContact O-N 3.15Å
87	S	34	Very low	30.3	Very low	108 Å²	108	153.3 Å²	153.3	76%	0.755	77%	0.767	S	S	*	*			trans	-74.7	103.6	170.3	-169.1	0	0	0	0	109.2	L85	L85-S87 VanDerWaalsContact C-N 3.31Å; L85-S87 PolarHBondContact O-N 3.21Å
88	R	31	Very low	30.7	Very low	223 Å²	223	156.1 Å²	156.1	84%	0.842	77%	0.773	S	S	*	*			trans	-2.2	124.9	158.8	-162.2	174.7	-170.9	164.6	0.5	115.9	P86 D90	P86-R88 PolarHBondContact O-N 3.37Å; P86-R88 VanDerWaalsContact O-N 3.15Å; R88-D90 PolarHBondContact O-N 2.83Å
89	N	30.8	Very low	30.8	Very low	149 Å²	149	154 Å²	154	80%	0.797	78%	0.777	S	S	*	*			trans	-55.6	105.2	173.8	-69.7	-17	0	0	0	112.5	F91	N89-F91 PolarHBondContact O-N 2.9Å
90	D	30.9	Very low	30.9	Very low	125 Å²	125	152.3 Å²	152.3	67%	0.668	78%	0.781	S	S	*	*			trans	-79.7	65.4	162.3	-76.7	-33.7	0	0	0	110.4	R88 Y92	R88-D90 PolarHBondContact O-N 2.83Å; D90-Y92 HydrophobicContact CB-CD2 4.08Å; D90-Y92 HydrophobicContact CB-CE2 4.42Å; D90-Y92 PolarHBondContact O-N 3.25Å
91	F	31.2	Very low	31.2	Very low	190 Å²	190	155.3 Å²	155.3	83%	0.833	79%	0.79	S	S	*	*			trans	-80.6	63.9	168.9	-131.3	-82.2	0	0	0	109.6	N89 Q93	N89-F91 PolarHBondContact O-N 2.9Å; F91-Q93 VanDerWaalsContact C-N 3.3Å; F91-Q93 PolarHBondContact O-N 3.02Å
92	Y	32.5	Very low	31.3	Very low	190 Å²	190	152.4 Å²	152.4	75%	0.745	79%	0.786	S	S	*	*			trans	-70.5	89.2	173.2	-86.5	-82.6	0	0	0	110.5	D90	D90-Y92 HydrophobicContact CB-CD2 4.08Å; D90-Y92 HydrophobicContact CB-CE2 4.42Å; D90-Y92 PolarHBondContact O-N 3.25Å
93	Q	29.2	Very low	31.2	Very low	140 Å²	140	155.3 Å²	155.3	65%	0.654	79%	0.79	S	S	*	*			trans	31.1	99.2	134.1	-57.9	179.6	14.7	0	0	115.6	F91 T95	F91-Q93 VanDerWaalsContact C-N 3.3Å; F91-Q93 PolarHBondContact O-N 3.02Å; Q93-T95 PolarHBondContact O-N 3.46Å; Q93-T95 PolarHBondContact O-OG1 2.71Å
94	T	32.2	Very low	31.2	Very low	150 Å²	150	154.3 Å²	154.3	92%	0.92	79%	0.787	S	S	*	*			trans	-66.9	81.5	155.1	-43.9	0	0	0	0	108.6	R96	T94-R96 PolarHBondContact O-N 3.29Å
95	T	31.3	Very low	31.2	Very low	109 Å²	109	155.1 Å²	155.1	67%	0.669	79%	0.788	S	S	*	*			trans	-63.8	104	179.2	3.6	0	0	0	0	109.1	Q93 K97	Q93-T95 PolarHBondContact O-N 3.46Å; Q93-T95 PolarHBondContact O-OG1 2.71Å; T95-K97 PolarHBondContact O-N 2.93Å; T95-K97 VanDerWaalsContact O-N 3.13Å
96	R	31.8	Very low	31.2	Very low	225 Å²	225	155.3 Å²	155.3	85%	0.849	80%	0.795	S	S	*	*			trans	-53.5	121.1	163.1	-98.3	-177.4	174	170.7	-1.4	107.6	T94 L98	T94-R96 PolarHBondContact O-N 3.29Å; R96-L98 PolarHBondContact O-N 2.6Å
97	K	31.5	Very low	31.6	Very low	211 Å²	211	156.7 Å²	156.7	92%	0.917	79%	0.794	S	S	*	*			trans	-64.9	87.3	166.1	-68.4	-171.9	177.9	-175.3	0	108.8	T95 A99	T95-K97 PolarHBondContact O-N 2.93Å; T95-K97 VanDerWaalsContact O-N 3.13Å; K97-A99 PolarHBondContact O-N 2.93Å
98	L	33.8	Very low	31.8	Very low	158 Å²	158	157.8 Å²	157.8	83%	0.827	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.2	122.9	154.3	-94.4	109.7	0	0	0	107.1	R96 A100	R96-L98 PolarHBondContact O-N 2.6Å; L98-A100 PolarHBondContact O-N 3.34Å
99	A	32.7	Very low	32.1	Very low	95 Å²	95	155 Å²	155	79%	0.785	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-58.8	132.3	174.5	0	0	0	0	0	109.3	K97 N101	K97-A99 PolarHBondContact O-N 2.93Å; A99-N101 PolarHBondContact O-N 3.48Å
100	A	30.4	Very low	32.5	Very low	93 Å²	93	156.4 Å²	156.4	77%	0.769	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-62.9	122.4	173.6	0	0	0	0	0	109.4	L98	L98-A100 PolarHBondContact O-N 3.34Å
101	N	34.1	Very low	33.2	Very low	164 Å²	164	155 Å²	155	88%	0.877	80%	0.798	S	S	*	*			trans	-141.8	118.4	148.1	-105.3	-22.9	0	0	0	109.1	A99	A99-N101 PolarHBondContact O-N 3.48Å
102	T	31.7	Very low	33.9	Very low	110 Å²	110	151.5 Å²	151.5	68%	0.675	80%	0.795	S	S	*	*			trans	-74.8	122.4	-170.8	43.5	0	0	0	0	112.4
103	H	28.3	Very low	34.5	Very low	173 Å²	173	147.1 Å²	147.1	80%	0.801	80%	0.798	S	S	*	*			trans	-146.3	109.4	139.3	-121.7	50.5	0	0	0	111.2	Q105	H103-Q105 PolarHBondContact O-N 3.21Å
104	Y	27.4	Very low	35.2	Very low	213 Å²	213	146.5 Å²	146.5	84%	0.835	81%	0.807	S	S	*	*			trans	-75.9	118.1	166.8	-72.3	-95.3	0	0	0	108
105	Q	34.1	Very low	36	Very low	166 Å²	166	143.8 Å²	143.8	78%	0.776	79%	0.794	S	S	*	*			trans	-121.7	99.3	154	-86.3	-176.7	-12.6	0	0	108.3	H103 L107	H103-Q105 PolarHBondContact O-N 3.21Å; Q105-L107 PolarHBondContact O-N 2.9Å
106	T	28.5	Very low	36.9	Very low	140 Å²	140	146.8 Å²	146.8	86%	0.859	81%	0.807	S	S	*	*			trans	-48.1	120.3	159.6	31.1	0	0	0	0	110.1
107	L	37	Very low	37.6	Very low	158 Å²	158	139.9 Å²	139.9	83%	0.827	79%	0.793	S	S	*	*			trans	-127.9	95.3	164	-102.7	164.8	0	0	0	108.4	Q105	Q105-L107 PolarHBondContact O-N 2.9Å
108	D	37.2	Very low	38.1	Very low	132 Å²	132	135 Å²	135	71%	0.706	78%	0.783	S	S	*	*			trans	17.7	126.4	167.9	-67.5	-58.4	0	0	0	121.5	K110	D108-K110 PolarHBondContact O-N 3.49Å
109	D	38.3	Very low	38.9	Very low	163 Å²	163	133.4 Å²	133.4	87%	0.872	78%	0.782	S	S	*	*			trans	-53	95.1	154.1	-81.6	-54.3	0	0	0	111.6
110	K	38.6	Very low	39.5	Very low	180 Å²	180	135.6 Å²	135.6	78%	0.783	78%	0.779	S	S	*	*			trans	-119	92.4	153.6	-65.6	-62.4	172.2	-160.4	0	108.6	D108	D108-K110 PolarHBondContact O-N 3.49Å
111	A	44.5	Very low	40.3	Very low	94 Å²	94	142 Å²	142	78%	0.777	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-49.4	125.8	164.1	0	0	0	0	0	108.6	A113	A111-A113 PolarHBondContact O-N 2.92Å
112	P	47.5	Very low	41.2	Very low	118 Å²	118	140 Å²	140	77%	0.766	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-62.2	138.5	-176.3	23.1	-31.6	0	0	0	110	C114	P112-C114 PolarHBondContact O-N 3.37Å
113	A	45.6	Very low	41.8	Very low	98 Å²	98	140.7 Å²	140.7	81%	0.81	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-61.2	120.3	-179.3	0	0	0	0	0	110.3	A111 S115	A111-A113 PolarHBondContact O-N 2.92Å; A113-S115 PolarHBondContact O-N 3.36Å; A113-S115 VanDerWaalsContact O-N 3.15Å
114	C	42.9	Very low	42.9	Very low	126 Å²	126	138.7 Å²	138.7	85%	0.851	77%	0.772	S	S	*	*			trans	-62.7	114	169.7	-61.8	0	0	0	0	108.6	P112	P112-C114 PolarHBondContact O-N 3.37Å
115	S	48.3	Very low	43.9	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	77%	0.766	S	S	*	*			trans	-83	136.2	171.1	48	0	0	0	0	110.1	A113 S117	A113-S115 PolarHBondContact O-N 3.36Å; A113-S115 VanDerWaalsContact O-N 3.15Å; S115-S117 PolarHBondContact O-N 2.96Å
116	D	51.8	Low	44.4	Very low	173 Å²	173	135.6 Å²	135.6	93%	0.925	77%	0.765	S	S	*	*	S	Bend	trans	-72	22.7	178.2	-65	-52.2	0	0	0	113.9
117	S	44.8	Very low	45.5	Very low	80 Å²	80	133.6 Å²	133.6	56%	0.559	75%	0.752	S	S	*	*	S	Bend	trans	-81.3	127.9	168.7	-62.9	0	0	0	0	108.3	S115	S115-S117 PolarHBondContact O-N 2.96Å
118	P	43.4	Very low	45.9	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	75%	0.746	S	S	*	*			trans	-55.3	144.4	173.7	25.7	-34.1	0	0	0	108.5	I120	P118-I120 PolarHBondContact O-N 3.35Å
119	P	49.1	Very low	46.6	Very low	124 Å²	124	132 Å²	132	81%	0.805	75%	0.751	S	S	*	*			trans	-52.4	114.4	-172.1	21.1	-33.1	0	0	0	108.4	R121	P119-R121 PolarHBondContact O-N 3.41Å
120	I	45.2	Very low	47.1	Very low	140 Å²	140	131.3 Å²	131.3	72%	0.718	74%	0.736	S	S	*	*			trans	-59.6	103	169.7	-63.5	174.4	0	0	0	102.9	P118 D122	P118-I120 PolarHBondContact O-N 3.35Å; I120-D122 PolarHBondContact O-N 2.94Å
121	R	48.1	Very low	48.3	Very low	227 Å²	227	132.8 Å²	132.8	86%	0.857	74%	0.742	S	S	*	*			trans	-66.7	94.7	175.7	-172.6	-177.9	-163.5	169.6	4.8	102.9	P119 T123	P119-R121 PolarHBondContact O-N 3.41Å; R121-T123 PolarHBondContact O-N 2.87Å
122	D	52.8	Low	48.9	Very low	124 Å²	124	137 Å²	137	66%	0.663	74%	0.738	S	S	*	*			trans	-51.8	102.6	173.4	-79.2	-39.5	0	0	0	105.2	I120 D124	I120-D122 PolarHBondContact O-N 2.94Å; D122-D124 PolarHBondContact O-N 3.36Å
123	T	44.1	Very low	49.6	Very low	124 Å²	124	134.6 Å²	134.6	76%	0.761	73%	0.728	S	S	*	*			trans	-70.6	67.9	156.8	38.1	0	0	0	0	105	R121 T125	R121-T123 PolarHBondContact O-N 2.87Å; T123-T125 PolarHBondContact O-N 3.34Å
124	D	51.5	Low	50.2	Low	130 Å²	130	134.7 Å²	134.7	70%	0.695	72%	0.715	S	S	*	*			trans	-43.1	100.5	151.8	-92.1	-22.4	0	0	0	104.2	D122 W126	D122-D124 PolarHBondContact O-N 3.36Å; D124-W126 VanDerWaalsContact C-N 3.32Å; D124-W126 PolarHBondContact O-N 2.97Å
125	T	47.9	Very low	50.9	Low	117 Å²	117	136.5 Å²	136.5	72%	0.718	71%	0.71	S	S	*	*			trans	-56.1	105.2	-176.6	-58.4	0	0	0	0	104.6	T123 T127	T123-T125 PolarHBondContact O-N 3.34Å; T125-T127 HydrophobicContact CG2-CG2 4.27Å; T125-T127 PolarHBondContact O-N 2.98Å; T125-T127 PolarHBondContact O-OG1 3.36Å
126	W	44.5	Very low	51.5	Low	197 Å²	197	136.9 Å²	136.9	75%	0.746	70%	0.702	S	S	*	*			trans	-75.1	64	-170.1	-133.5	85.7	0	0	0	108.5	D124 P128 L134	D124-W126 VanDerWaalsContact C-N 3.32Å; D124-W126 PolarHBondContact O-N 2.97Å; W126-P128 WeakPolarHBondContact O-CD 3.37Å; W126-L134 HydrophobicContact CH2-CD1 4.35Å
127	T	51.7	Low	51.9	Low	98 Å²	98	131.7 Å²	131.7	60%	0.601	68%	0.677	S	S	*	*			trans	-53.6	113.1	165.7	48.2	0	0	0	0	104.5	T125 N129	T125-T127 HydrophobicContact CG2-CG2 4.27Å; T125-T127 PolarHBondContact O-N 2.98Å; T125-T127 PolarHBondContact O-OG1 3.36Å; T127-N129 PolarHBondContact O-N 2.93Å
128	P	47.1	Very low	53.5	Low	106 Å²	106	132.2 Å²	132.2	69%	0.688	68%	0.677	S	S	*	*			trans	-76.1	75.1	-179.3	8.2	5.1	0	0	0	106.9	W126 R130	W126-P128 WeakPolarHBondContact O-CD 3.37Å; P128-R130 PolarHBondContact O-N 3.11Å
129	N	50.8	Low	55.4	Low	152 Å²	152	133.4 Å²	133.4	81%	0.813	67%	0.673	S	S	*	*			trans	-73.4	24	176.3	-151.3	-2.8	0	0	0	111.3	T127	T127-N129 PolarHBondContact O-N 2.93Å
130	R	49.4	Very low	57	Low	147 Å²	147	134.8 Å²	134.8	56%	0.555	67%	0.667	S	S	*	*			trans	-116.2	98.8	176.5	-156	-173.4	-72	-145.9	1.9	106.1	P128 R132	P128-R130 PolarHBondContact O-N 3.11Å; R130-R132 WeakPolarHBondContact CD-O 3.47Å; R130-R132 VanDerWaalsContact CG-O 3.29Å; R130-R132 WeakPolarHBondContact CG-O 3.24Å; R130-R132 PolarHBondContact O-N 3.42Å
131	K	63.2	Low	58.9	Low	212 Å²	212	133.4 Å²	133.4	92%	0.922	66%	0.657	S	S	*	*	S	Bend	trans	-62.4	1.3	176.5	-64.5	-177.1	177.5	-179.8	0	114.3
132	R	57.3	Low	60.7	Low	182 Å²	182	127.1 Å²	127.1	69%	0.687	64%	0.64	S	S	*	*	S	Bend	trans	-136.9	143.1	-172.7	-70.8	-165.3	-178.4	141	0.5	108.9	R130 E136	R130-R132 WeakPolarHBondContact CD-O 3.47Å; R130-R132 VanDerWaalsContact CG-O 3.29Å; R130-R132 WeakPolarHBondContact CG-O 3.24Å; R130-R132 PolarHBondContact O-N 3.42Å; R132-E136 VanDerWaalsContact CA-OE2 3.28Å; R132-E136 WeakPolarHBondContact CA-OE2 3.41Å; R132-E136 WeakPolarHBondContact CB-OE2 3.42Å; R132-E136 WeakPolarHBondContact CG-OE2 3.46Å
133	A	61.8	Low	62.3	Low	68 Å²	68	128.6 Å²	128.6	56%	0.562	64%	0.636	S	S	*	*			trans	-63.2	152.7	179.3	0	0	0	0	0	110.8	H135 E136	A133-H135 PolarHBondContact O-N 3.29Å; A133-H135 VanDerWaalsContact O-N 3.08Å; A133-E136 HydrophobicContact CB-CB 4.14Å; A133-E136 PolarHBondContact O-N 3.14Å; A133-E136 VanDerWaalsContact O-N 3.14Å
134	L	58.4	Low	64.5	Low	100 Å²	100	127 Å²	127	52%	0.524	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.2	-31.3	-179.7	-133.9	86.2	0	0	0	112.7	W126	W126-L134 HydrophobicContact CH2-CD1 4.35Å
135	H	56.9	Low	66.2	Low	163 Å²	163	124.1 Å²	124.1	76%	0.755	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.4	41.4	178.2	-56.3	-67.7	0	0	0	111.1	A133 P137	A133-H135 PolarHBondContact O-N 3.29Å; A133-H135 VanDerWaalsContact O-N 3.08Å; H135-P137 WeakPolarHBondContact O-CD 3.37Å
136	E	61.1	Low	68.4	Low	102 Å²	102	124 Å²	124	48%	0.477	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-60.2	123.6	164.4	-169.3	171.5	168.4	0	0	108.1	R132 A133 T138	R132-E136 VanDerWaalsContact CA-OE2 3.28Å; R132-E136 WeakPolarHBondContact CA-OE2 3.41Å; R132-E136 WeakPolarHBondContact CB-OE2 3.42Å; R132-E136 WeakPolarHBondContact CG-OE2 3.46Å; A133-E136 HydrophobicContact CB-CB 4.14Å; A133-E136 PolarHBondContact O-N 3.14Å; A133-E136 VanDerWaalsContact O-N 3.14Å; E136-T138 PolarHBondContact O-N 2.85Å
137	P	61.8	Low	70.7	Confident	63 Å²	63	118.8 Å²	118.8	41%	0.409	59%	0.589	S	S	.	*	P	Polyproline II helix	trans	-56.6	119.5	-178.5	-26.2	35.1	0	0	0	109.4	H135 Q141 L142	H135-P137 WeakPolarHBondContact O-CD 3.37Å; P137-Q141 HydrophobicContact CB-CB 4.14Å; P137-L142 HydrophobicContact CB-CD2 4.09Å; P137-L142 HydrophobicContact CB-CG 4.28Å
138	T	76.8	Confident	72.7	Confident	91 Å²	91	116.8 Å²	116.8	56%	0.558	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-54.3	147.6	-179	-52	0	0	0	0	108.7	E136 K140 Q141 L142	E136-T138 PolarHBondContact O-N 2.85Å; T138-K140 HydrophobicContact CG2-CB 4.46Å; T138-K140 CarbonylContact O-C 3.6Å; T138-K140 PolarHBondContact O-N 3.45Å; T138-Q141 WeakPolarHBondContact O-CA 3.49Å; T138-Q141 VanDerWaalsContact O-CB 3.31Å; T138-Q141 WeakPolarHBondContact O-CB 3.23Å; T138-Q141 PolarHBondContact O-N 2.82Å; T138-L142 PolarHBondContact O-N 3.07Å
139	E	83.1	Confident	75	Confident	134 Å²	134	120.1 Å²	120.1	63%	0.626	58%	0.577	S	S	*	*	H	α-helix	trans	-48.7	-37.2	-178.9	-170.2	-172.4	161.1	0	0	112.7	Q141 L142 R143	E139-Q141 PolarHBondContact O-N 3.26Å; E139-L142 PolarHBondContact O-N 2.88Å; E139-L142 VanDerWaalsContact O-N 3.15Å; E139-R143 WeakPolarHBondContact O-CG 3.45Å; E139-R143 PolarHBondContact O-N 3.28Å
140	K	84.2	Confident	77.1	Confident	154 Å²	154	116.7 Å²	116.7	67%	0.67	56%	0.558	S	S	*	*	H	α-helix	trans	-58.1	-37.9	172	-169.7	172.6	-176.6	175.2	0	114.2	T138 N144	T138-K140 HydrophobicContact CG2-CB 4.46Å; T138-K140 CarbonylContact O-C 3.6Å; T138-K140 PolarHBondContact O-N 3.45Å; K140-N144 VanDerWaalsContact O-CB 3.3Å; K140-N144 WeakPolarHBondContact O-CB 3.49Å; K140-N144 PolarHBondContact O-N 2.91Å; K140-N144 PolarHBondContact O-OD1 3.1Å
141	Q	84.4	Confident	79.3	Confident	111 Å²	111	117 Å²	117	52%	0.519	56%	0.56	S	S	.	*	H	α-helix	trans	-70.1	-37.1	173.6	-65.1	-179.2	-17.3	0	0	112.1	P137 T138 E139 N144 S145	P137-Q141 HydrophobicContact CB-CB 4.14Å; T138-Q141 WeakPolarHBondContact O-CA 3.49Å; T138-Q141 VanDerWaalsContact O-CB 3.31Å; T138-Q141 WeakPolarHBondContact O-CB 3.23Å; T138-Q141 PolarHBondContact O-N 2.82Å; E139-Q141 PolarHBondContact O-N 3.26Å; Q141-N144 PolarHBondContact O-N 2.87Å; Q141-S145 WeakPolarHBondContact O-CB 3.24Å; Q141-S145 PolarHBondContact O-N 3.27Å; Q141-S145 PolarHBondContact O-OG 2.89Å
142	L	85.9	Confident	80.8	Confident	94 Å²	94	112.7 Å²	112.7	49%	0.492	54%	0.543	S	S	.	.	H	α-helix	trans	-67.4	-42.8	174.3	-64.7	176.1	0	0	0	111.8	P137 T138 E139 S145 Q146	P137-L142 HydrophobicContact CB-CD2 4.09Å; P137-L142 HydrophobicContact CB-CG 4.28Å; T138-L142 PolarHBondContact O-N 3.07Å; E139-L142 PolarHBondContact O-N 2.88Å; E139-L142 VanDerWaalsContact O-N 3.15Å; L142-S145 PolarHBondContact O-N 3.34Å; L142-S145 PolarHBondContact O-OG 3.21Å; L142-Q146 WeakPolarHBondContact O-CB 3.32Å; L142-Q146 PolarHBondContact O-N 3.46Å
143	R	86	Confident	82.7	Confident	155 Å²	155	108.4 Å²	108.4	59%	0.585	53%	0.533	S	S	*	.	H	α-helix	trans	-59.7	-47.1	171.6	-69	-70.3	-169.1	157.3	3.4	111.1	E139 S145 Q146 E147	E139-R143 WeakPolarHBondContact O-CG 3.45Å; E139-R143 PolarHBondContact O-N 3.28Å; R143-S145 PolarHBondContact O-N 3.06Å; R143-Q146 PolarHBondContact O-N 2.91Å; R143-E147 WeakPolarHBondContact O-CB 3.48Å; R143-E147 PolarHBondContact O-N 3.01Å
144	N	90	Very high	84.3	Confident	90 Å²	90	110.6 Å²	110.6	48%	0.481	53%	0.531	S	S	.	.	H	α-helix	trans	-63	-37	177.4	-73.5	2.5	0	0	0	113	K140 Q141 S148	K140-N144 VanDerWaalsContact O-CB 3.3Å; K140-N144 WeakPolarHBondContact O-CB 3.49Å; K140-N144 PolarHBondContact O-N 2.91Å; K140-N144 PolarHBondContact O-OD1 3.1Å; Q141-N144 PolarHBondContact O-N 2.87Å; N144-S148 VanDerWaalsContact O-CB 3.22Å; N144-S148 WeakPolarHBondContact O-CB 3.26Å; N144-S148 PolarHBondContact O-N 2.98Å
145	S	88.6	Confident	86	Confident	70 Å²	70	108.2 Å²	108.2	49%	0.49	53%	0.526	S	S	.	.	H	α-helix	trans	-73	-39.4	178.5	69.3	0	0	0	0	111.8	Q141 L142 R143 S148 R149	Q141-S145 WeakPolarHBondContact O-CB 3.24Å; Q141-S145 PolarHBondContact O-N 3.27Å; Q141-S145 PolarHBondContact O-OG 2.89Å; L142-S145 PolarHBondContact O-N 3.34Å; L142-S145 PolarHBondContact O-OG 3.21Å; R143-S145 PolarHBondContact O-N 3.06Å; S145-S148 PolarHBondContact O-N 2.85Å; S145-R149 WeakPolarHBondContact O-CB 3.33Å; S145-R149 PolarHBondContact O-N 3.07Å
146	Q	92.7	Very high	87.9	Confident	114 Å²	114	105.8 Å²	105.8	53%	0.533	51%	0.513	S	S	.	.	H	α-helix	trans	-61.1	-46.6	171.2	-175.2	179.3	4.2	0	0	111.3	L142 R143 R149 I150	L142-Q146 WeakPolarHBondContact O-CB 3.32Å; L142-Q146 PolarHBondContact O-N 3.46Å; R143-Q146 PolarHBondContact O-N 2.91Å; Q146-R149 WeakPolarHBondContact O-CB 3.3Å; Q146-R149 PolarHBondContact O-N 3.39Å; Q146-I150 HydrophobicContact CG-CD1 4.18Å; Q146-I150 WeakPolarHBondContact O-CG1 3.48Å; Q146-I150 PolarHBondContact O-N 2.79Å
147	E	93.5	Very high	89.5	Confident	89 Å²	89	106.6 Å²	106.6	42%	0.416	52%	0.52	S	S	.	.	H	α-helix	trans	-65	-41	178	-163.7	-171.3	159.6	0	0	111.9	R143 R149 I150 R151	R143-E147 WeakPolarHBondContact O-CB 3.48Å; R143-E147 PolarHBondContact O-N 3.01Å; E147-R149 VanDerWaalsContact C-N 3.35Å; E147-R149 PolarHBondContact O-N 3.28Å; E147-I150 PolarHBondContact O-N 3.36Å; E147-R151 WeakPolarHBondContact O-CG 3.32Å; E147-R151 PolarHBondContact O-N 2.94Å; E147-R151 IonicContact OE1-CZ 3.6Å; E147-R151 IonicContact OE1-NE 2.82Å; E147-R151 PolarHBondContact OE1-NE 3.09Å; E147-R151 IonicContact OE1-NH2 2.71Å; E147-R151 PolarHBondContact OE1-NH2 3.12Å
148	S	92.8	Very high	91	Very high	56 Å²	56	107.4 Å²	107.4	39%	0.392	53%	0.527	S	S	.	.	H	α-helix	trans	-58.9	-44.6	172.8	-174.2	0	0	0	0	111.7	N144 S145 I150 R151 Q152	N144-S148 VanDerWaalsContact O-CB 3.22Å; N144-S148 WeakPolarHBondContact O-CB 3.26Å; N144-S148 PolarHBondContact O-N 2.98Å; S145-S148 PolarHBondContact O-N 2.85Å; S148-I150 PolarHBondContact O-N 2.89Å; S148-R151 PolarHBondContact O-N 3.47Å; S148-Q152 WeakPolarHBondContact O-CG 3.46Å; S148-Q152 PolarHBondContact O-N 3.49Å
149	R	96	Very high	91.8	Very high	176 Å²	176	109.3 Å²	109.3	66%	0.664	53%	0.53	S	S	*	.	H	α-helix	trans	-61.7	-41.6	175.3	-173.1	-178.3	-179.4	-149.4	0.4	112	S145 Q146 E147 Q152 L153	S145-R149 WeakPolarHBondContact O-CB 3.33Å; S145-R149 PolarHBondContact O-N 3.07Å; Q146-R149 WeakPolarHBondContact O-CB 3.3Å; Q146-R149 PolarHBondContact O-N 3.39Å; E147-R149 VanDerWaalsContact C-N 3.35Å; E147-R149 PolarHBondContact O-N 3.28Å; R149-Q152 PolarHBondContact O-N 3.19Å; R149-L153 HydrophobicContact CG-CD1 4.38Å; R149-L153 WeakPolarHBondContact O-CG 3.27Å; R149-L153 PolarHBondContact O-N 3.4Å
150	I	95.1	Very high	92.4	Very high	80 Å²	80	110.1 Å²	110.1	41%	0.41	53%	0.528	S	S	.	.	H	α-helix	trans	-62.6	-46.2	175.9	-69.1	164.6	0	0	0	110.6	Q146 E147 S148 Q152 L153 Q154	Q146-I150 HydrophobicContact CG-CD1 4.18Å; Q146-I150 WeakPolarHBondContact O-CG1 3.48Å; Q146-I150 PolarHBondContact O-N 2.79Å; E147-I150 PolarHBondContact O-N 3.36Å; S148-I150 PolarHBondContact O-N 2.89Å; I150-Q152 VanDerWaalsContact C-N 3.34Å; I150-Q152 PolarHBondContact O-N 2.65Å; I150-L153 PolarHBondContact O-N 2.85Å; I150-Q154 WeakPolarHBondContact O-CG 3.49Å; I150-Q154 PolarHBondContact O-N 2.95Å
151	R	95.4	Very high	92.8	Very high	154 Å²	154	106.3 Å²	106.3	58%	0.581	52%	0.521	S	S	*	.	H	α-helix	trans	-60.7	-40	176	-67.7	173.6	-172.3	-147.1	9.1	112.2	E147 S148 Q154 A155	E147-R151 WeakPolarHBondContact O-CG 3.32Å; E147-R151 PolarHBondContact O-N 2.94Å; E147-R151 IonicContact OE1-CZ 3.6Å; E147-R151 IonicContact OE1-NE 2.82Å; E147-R151 PolarHBondContact OE1-NE 3.09Å; E147-R151 IonicContact OE1-NH2 2.71Å; E147-R151 PolarHBondContact OE1-NH2 3.12Å; S148-R151 PolarHBondContact O-N 3.47Å; R151-Q154 PolarHBondContact O-N 3.31Å; R151-A155 WeakPolarHBondContact O-CB 3.47Å; R151-A155 PolarHBondContact O-N 3.26Å
152	Q	95.5	Very high	93.2	Very high	121 Å²	121	103.6 Å²	103.6	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-64.4	-40.7	174.8	-73.1	177.8	6.7	0	0	112.5	S148 R149 I150 A155 K156	S148-Q152 WeakPolarHBondContact O-CG 3.46Å; S148-Q152 PolarHBondContact O-N 3.49Å; R149-Q152 PolarHBondContact O-N 3.19Å; I150-Q152 VanDerWaalsContact C-N 3.34Å; I150-Q152 PolarHBondContact O-N 2.65Å; Q152-A155 PolarHBondContact O-N 3.03Å; Q152-K156 WeakPolarHBondContact O-CG 3.31Å; Q152-K156 PolarHBondContact O-N 2.89Å
153	L	96.9	Very high	93.6	Very high	91 Å²	91	101.3 Å²	101.3	48%	0.476	51%	0.512	S	S	.	.	H	α-helix	trans	-66.8	-43.5	176.1	-71.7	170.5	0	0	0	111.6	R149 I150 A155 K156 L157	R149-L153 HydrophobicContact CG-CD1 4.38Å; R149-L153 WeakPolarHBondContact O-CG 3.27Å; R149-L153 PolarHBondContact O-N 3.4Å; I150-L153 PolarHBondContact O-N 2.85Å; L153-A155 VanDerWaalsContact C-N 3.35Å; L153-A155 PolarHBondContact O-N 3.19Å; L153-K156 PolarHBondContact O-N 2.94Å; L153-L157 WeakPolarHBondContact O-CG 3.25Å; L153-L157 PolarHBondContact O-N 2.9Å
154	Q	95.1	Very high	93.9	Very high	114 Å²	114	98.9 Å²	98.9	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-59.2	-44.3	173.6	-74	175.2	-37.1	0	0	111.7	I150 R151 K156 L157 S158	I150-Q154 WeakPolarHBondContact O-CG 3.49Å; I150-Q154 PolarHBondContact O-N 2.95Å; R151-Q154 PolarHBondContact O-N 3.31Å; Q154-K156 PolarHBondContact O-N 3.34Å; Q154-L157 PolarHBondContact O-N 3.11Å; Q154-S158 PolarHBondContact O-N 2.95Å; Q154-S158 PolarHBondContact O-OG 3.37Å; Q154-S158 VanDerWaalsContact O-OG 3.07Å
155	A	94.2	Very high	94	Very high	50 Å²	50	101 Å²	101	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-42.1	175.8	0	0	0	0	0	112.7	R151 Q152 L153 S158 Q159	R151-A155 WeakPolarHBondContact O-CB 3.47Å; R151-A155 PolarHBondContact O-N 3.26Å; Q152-A155 PolarHBondContact O-N 3.03Å; L153-A155 VanDerWaalsContact C-N 3.35Å; L153-A155 PolarHBondContact O-N 3.19Å; A155-S158 PolarHBondContact O-N 3.15Å; A155-Q159 WeakPolarHBondContact O-CG 3.49Å; A155-Q159 PolarHBondContact O-N 2.87Å
156	K	96.8	Very high	94	Very high	113 Å²	113	102.8 Å²	102.8	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-42.8	174.4	-76.4	-175.1	175.5	-172.3	0	112.2	Q152 L153 Q154 S158 Q159 Y160	Q152-K156 WeakPolarHBondContact O-CG 3.31Å; Q152-K156 PolarHBondContact O-N 2.89Å; L153-K156 PolarHBondContact O-N 2.94Å; Q154-K156 PolarHBondContact O-N 3.34Å; K156-S158 VanDerWaalsContact C-N 3.34Å; K156-S158 PolarHBondContact O-N 3.26Å; K156-Q159 WeakPolarHBondContact O-CB 3.45Å; K156-Q159 PolarHBondContact O-N 3.32Å; K156-Y160 HydrophobicContact CB-CE2 4.23Å; K156-Y160 WeakPolarHBondContact O-CD2 3.44Å; K156-Y160 PolarHBondContact O-N 2.92Å
157	L	94.8	Very high	93.7	Very high	118 Å²	118	102.2 Å²	102.2	62%	0.618	52%	0.518	S	S	*	.	H	α-helix	trans	-62.1	-40.8	175.3	-70.9	171.8	0	0	0	111.8	L153 Q154 Q159 Y160 S161	L153-L157 WeakPolarHBondContact O-CG 3.25Å; L153-L157 PolarHBondContact O-N 2.9Å; Q154-L157 PolarHBondContact O-N 3.11Å; L157-Q159 VanDerWaalsContact C-N 3.35Å; L157-Q159 PolarHBondContact O-N 2.91Å; L157-Y160 PolarHBondContact O-N 3.44Å; L157-S161 WeakPolarHBondContact O-CB 3.46Å; L157-S161 PolarHBondContact O-N 2.98Å
158	S	92.7	Very high	93.4	Very high	80 Å²	80	104.1 Å²	104.1	56%	0.559	53%	0.527	S	S	*	.	H	α-helix	trans	-62.7	-38.9	173	-57.6	0	0	0	0	112.5	Q154 A155 K156 S161 A162	Q154-S158 PolarHBondContact O-N 2.95Å; Q154-S158 PolarHBondContact O-OG 3.37Å; Q154-S158 VanDerWaalsContact O-OG 3.07Å; A155-S158 PolarHBondContact O-N 3.15Å; K156-S158 VanDerWaalsContact C-N 3.34Å; K156-S158 PolarHBondContact O-N 3.26Å; S158-S161 PolarHBondContact O-N 3.21Å; S158-A162 WeakPolarHBondContact O-CB 3.38Å; S158-A162 PolarHBondContact O-N 3.07Å
159	Q	93.4	Very high	93	Very high	132 Å²	132	104.1 Å²	104.1	62%	0.617	53%	0.53	S	S	*	.	H	α-helix	trans	-65.2	-44.3	174.7	-74	173.4	-13	0	0	112.2	A155 K156 L157 A162 A163	A155-Q159 WeakPolarHBondContact O-CG 3.49Å; A155-Q159 PolarHBondContact O-N 2.87Å; K156-Q159 WeakPolarHBondContact O-CB 3.45Å; K156-Q159 PolarHBondContact O-N 3.32Å; L157-Q159 VanDerWaalsContact C-N 3.35Å; L157-Q159 PolarHBondContact O-N 2.91Å; Q159-A162 PolarHBondContact O-N 3.32Å; Q159-A163 WeakPolarHBondContact O-CB 3.49Å; Q159-A163 PolarHBondContact O-N 3.37Å
160	Y	95.8	Very high	92.5	Very high	150 Å²	150	100.5 Å²	100.5	59%	0.588	52%	0.52	S	S	*	.	H	α-helix	trans	-65.1	-39	175.5	-64.9	-48.6	0	0	0	112.2	K156 L157 A163 L164	K156-Y160 HydrophobicContact CB-CE2 4.23Å; K156-Y160 WeakPolarHBondContact O-CD2 3.44Å; K156-Y160 PolarHBondContact O-N 2.92Å; L157-Y160 PolarHBondContact O-N 3.44Å; Y160-A163 PolarHBondContact O-N 2.91Å; Y160-L164 WeakPolarHBondContact O-CB 3.3Å; Y160-L164 VanDerWaalsContact O-CG 3.31Å; Y160-L164 WeakPolarHBondContact O-CG 3.24Å; Y160-L164 PolarHBondContact O-N 3.48Å
161	S	93.9	Very high	91.7	Very high	75 Å²	75	100.3 Å²	100.3	52%	0.524	52%	0.524	S	S	.	.	H	α-helix	trans	-60.9	-45.8	174.2	-168	0	0	0	0	111.7	L157 S158 L164 E165	L157-S161 WeakPolarHBondContact O-CB 3.46Å; L157-S161 PolarHBondContact O-N 2.98Å; S158-S161 PolarHBondContact O-N 3.21Å; S161-L164 PolarHBondContact O-N 3.19Å; S161-E165 PolarHBondContact O-N 3.49Å
162	A	92.5	Very high	90.6	Very high	54 Å²	54	99 Å²	99	45%	0.446	53%	0.528	S	S	.	.	H	α-helix	trans	-66.2	-38.4	177.9	0	0	0	0	0	112.3	S158 Q159 E165 E166	S158-A162 WeakPolarHBondContact O-CB 3.38Å; S158-A162 PolarHBondContact O-N 3.07Å; Q159-A162 PolarHBondContact O-N 3.32Å; A162-E165 PolarHBondContact O-N 3.46Å; A162-E166 WeakPolarHBondContact O-CB 3.38Å; A162-E166 PolarHBondContact O-N 2.88Å
163	A	93.9	Very high	89.5	Confident	45 Å²	45	96.1 Å²	96.1	37%	0.372	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-36.2	175.6	0	0	0	0	0	112.5	Q159 Y160 L167	Q159-A163 WeakPolarHBondContact O-CB 3.49Å; Q159-A163 PolarHBondContact O-N 3.37Å; Y160-A163 PolarHBondContact O-N 2.91Å; A163-L167 WeakPolarHBondContact O-CB 3.47Å; A163-L167 WeakPolarHBondContact O-CG 3.38Å; A163-L167 PolarHBondContact O-N 2.92Å
164	L	92.4	Very high	87.6	Confident	104 Å²	104	96.3 Å²	96.3	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-67.5	-40.9	172.8	-74.2	169.8	0	0	0	111.8	Y160 S161 L167 Q168	Y160-L164 WeakPolarHBondContact O-CB 3.3Å; Y160-L164 VanDerWaalsContact O-CG 3.31Å; Y160-L164 WeakPolarHBondContact O-CG 3.24Å; Y160-L164 PolarHBondContact O-N 3.48Å; S161-L164 PolarHBondContact O-N 3.19Å; L164-L167 PolarHBondContact O-N 3.08Å; L164-Q168 WeakPolarHBondContact O-CG 3.45Å; L164-Q168 PolarHBondContact O-N 3.33Å
165	E	90.9	Very high	85.5	Confident	136 Å²	136	96.6 Å²	96.6	64%	0.636	53%	0.528	S	S	*	.	H	α-helix	trans	-63.5	-41.8	174.1	-170.6	177.1	-177.9	0	0	111.5	S161 A162 Q168 A169	S161-E165 PolarHBondContact O-N 3.49Å; A162-E165 PolarHBondContact O-N 3.46Å; E165-Q168 PolarHBondContact O-N 3.49Å; E165-A169 WeakPolarHBondContact O-CB 3.33Å; E165-A169 PolarHBondContact O-N 3.28Å
166	E	90.5	Very high	83.2	Confident	106 Å²	106	97.7 Å²	97.7	50%	0.495	54%	0.537	S	S	.	.	H	α-helix	trans	-63.7	-40.1	174.5	-166.4	-168.7	152.5	0	0	112.2	A162 A169 K170	A162-E166 WeakPolarHBondContact O-CB 3.38Å; A162-E166 PolarHBondContact O-N 2.88Å; E166-A169 PolarHBondContact O-N 3.12Å; E166-K170 HydrophobicContact CG-CD 4.39Å; E166-K170 WeakPolarHBondContact O-CB 3.41Å; E166-K170 WeakPolarHBondContact O-CG 3.37Å; E166-K170 PolarHBondContact O-N 3.37Å; E166-K170 WeakPolarHBondContact OE1-CE 3.45Å; E166-K170 IonicContact OE1-NZ 2.6Å; E166-K170 PolarHBondContact OE1-NZ 2.84Å
167	L	84.6	Confident	80.4	Confident	102 Å²	102	99.7 Å²	99.7	53%	0.534	55%	0.548	S	S	.	.	H	α-helix	trans	-64.4	-43.6	174	-78.2	168.9	0	0	0	111.7	A163 L164 K170 C171	A163-L167 WeakPolarHBondContact O-CB 3.47Å; A163-L167 WeakPolarHBondContact O-CG 3.38Å; A163-L167 PolarHBondContact O-N 2.92Å; L164-L167 PolarHBondContact O-N 3.08Å; L167-K170 PolarHBondContact O-N 3.42Å; L167-C171 PolarHBondContact O-N 3.45Å; L167-C171 PolarHBondContact O-SG 2.74Å
168	Q	88.7	Confident	77.8	Confident	130 Å²	130	98.8 Å²	98.8	61%	0.607	55%	0.552	S	S	*	*	H	α-helix	trans	-62	-43.9	174.8	-72.9	177.8	7.2	0	0	111.4	L164 E165 K170 C171 L172	L164-Q168 WeakPolarHBondContact O-CG 3.45Å; L164-Q168 PolarHBondContact O-N 3.33Å; E165-Q168 PolarHBondContact O-N 3.49Å; Q168-K170 PolarHBondContact O-N 3.23Å; Q168-C171 PolarHBondContact O-N 2.9Å; Q168-L172 WeakPolarHBondContact O-CG 3.05Å; Q168-L172 PolarHBondContact O-N 3.13Å
169	A	83.4	Confident	75	Confident	56 Å²	56	103.4 Å²	103.4	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-61.3	-42.5	175.5	0	0	0	0	0	112.2	E165 E166 L172 S173	E165-A169 WeakPolarHBondContact O-CB 3.33Å; E165-A169 PolarHBondContact O-N 3.28Å; E166-A169 PolarHBondContact O-N 3.12Å; A169-L172 PolarHBondContact O-N 2.71Å; A169-S173 PolarHBondContact O-N 2.88Å; A169-S173 PolarHBondContact O-OG 3.43Å
170	K	85.3	Confident	72.1	Confident	100 Å²	100	105.5 Å²	105.5	44%	0.435	57%	0.574	S	S	.	*	H	α-helix	trans	-63.3	-43.8	174.9	-79.9	170.5	172	168.3	0	112.5	E166 L167 Q168 L172 S173 N174	E166-K170 HydrophobicContact CG-CD 4.39Å; E166-K170 WeakPolarHBondContact O-CB 3.41Å; E166-K170 WeakPolarHBondContact O-CG 3.37Å; E166-K170 PolarHBondContact O-N 3.37Å; E166-K170 WeakPolarHBondContact OE1-CE 3.45Å; E166-K170 IonicContact OE1-NZ 2.6Å; E166-K170 PolarHBondContact OE1-NZ 2.84Å; L167-K170 PolarHBondContact O-N 3.42Å; Q168-K170 PolarHBondContact O-N 3.23Å; K170-L172 VanDerWaalsContact C-N 3.32Å; K170-L172 PolarHBondContact O-N 2.82Å; K170-S173 WeakPolarHBondContact CA-OG 3.22Å; K170-S173 PolarHBondContact O-N 3.34Å; K170-S173 PolarHBondContact O-OG 2.98Å; K170-N174 WeakPolarHBondContact O-CB 3.23Å; K170-N174 PolarHBondContact O-N 3.15Å; K170-N174 PolarHBondContact O-ND2 2.87Å; K170-N174 PolarHBondContact O-OD1 2.97Å
171	C	78.1	Confident	69	Low	76 Å²	76	105.6 Å²	105.6	51%	0.514	58%	0.584	S	S	.	*	H	α-helix	trans	-60.3	-42.4	174.8	-71.6	0	0	0	0	111.7	L167 Q168 N175	L167-C171 PolarHBondContact O-N 3.45Å; L167-C171 PolarHBondContact O-SG 2.74Å; Q168-C171 PolarHBondContact O-N 2.9Å; C171-N175 PolarHBondContact O-N 2.78Å; C171-N175 PolarHBondContact O-ND2 3.14Å
172	L	74.3	Confident	65.8	Low	127 Å²	127	106.1 Å²	106.1	67%	0.665	60%	0.601	S	S	*	*	H	α-helix	trans	-68.1	-37.6	176.2	-68.3	169.9	0	0	0	112.7	Q168 A169 K170 A176	Q168-L172 WeakPolarHBondContact O-CG 3.05Å; Q168-L172 PolarHBondContact O-N 3.13Å; A169-L172 PolarHBondContact O-N 2.71Å; K170-L172 VanDerWaalsContact C-N 3.32Å; K170-L172 PolarHBondContact O-N 2.82Å; L172-A176 PolarHBondContact O-N 3.21Å
173	S	71	Confident	63	Low	59 Å²	59	107.9 Å²	107.9	41%	0.413	61%	0.611	S	S	.	*	H	α-helix	trans	-72.8	-37	178.2	65.7	0	0	0	0	113.3	A169 K170 N175 A176 Q177	A169-S173 PolarHBondContact O-N 2.88Å; A169-S173 PolarHBondContact O-OG 3.43Å; K170-S173 WeakPolarHBondContact CA-OG 3.22Å; K170-S173 PolarHBondContact O-N 3.34Å; K170-S173 PolarHBondContact O-OG 2.98Å; S173-N175 PolarHBondContact O-N 3.37Å; S173-A176 WeakPolarHBondContact O-CB 3.24Å; S173-A176 PolarHBondContact O-N 2.91Å; S173-Q177 PolarHBondContact O-N 2.86Å
174	N	57.5	Low	59.7	Low	96 Å²	96	112.7 Å²	112.7	51%	0.513	64%	0.635	S	S	.	*	H	α-helix	trans	-64.4	-33.3	177.1	-70.1	-8.2	0	0	0	111.5	K170 A176 S178	K170-N174 WeakPolarHBondContact O-CB 3.23Å; K170-N174 PolarHBondContact O-N 3.15Å; K170-N174 PolarHBondContact O-ND2 2.87Å; K170-N174 PolarHBondContact O-OD1 2.97Å; N174-A176 VanDerWaalsContact C-N 3.33Å; N174-S178 WeakPolarHBondContact O-CB 3.34Å; N174-S178 PolarHBondContact O-N 3.19Å; N174-S178 PolarHBondContact O-OG 2.97Å
175	N	50.9	Low	56.6	Low	119 Å²	119	113.7 Å²	113.7	64%	0.636	65%	0.65	S	S	*	*	H	α-helix	trans	-69	-29.9	172.6	-70.1	-18.1	0	0	0	112.6	C171 S173	C171-N175 PolarHBondContact O-N 2.78Å; C171-N175 PolarHBondContact O-ND2 3.14Å; S173-N175 PolarHBondContact O-N 3.37Å
176	A	45.3	Very low	53.6	Low	74 Å²	74	116.1 Å²	116.1	61%	0.612	66%	0.658	S	S	*	*	H	α-helix	trans	-75.3	-38	175.4	0	0	0	0	0	112.8	L172 S173 N174	L172-A176 PolarHBondContact O-N 3.21Å; S173-A176 WeakPolarHBondContact O-CB 3.24Å; S173-A176 PolarHBondContact O-N 2.91Å; N174-A176 VanDerWaalsContact C-N 3.33Å
177	Q	38.6	Very low	50.5	Low	154 Å²	154	117.1 Å²	117.1	72%	0.72	67%	0.671	S	S	*	*	H	α-helix	trans	-81.9	-14.1	-177.6	-150.9	170.4	12.4	0	0	113.7	S173 Q179	S173-Q177 PolarHBondContact O-N 2.86Å; Q177-Q179 PolarHBondContact O-N 3.45Å
178	S	39.5	Very low	47.7	Very low	99 Å²	99	120.8 Å²	120.8	69%	0.692	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-3.7	177.2	-61.9	0	0	0	0	114.5	N174	N174-S178 WeakPolarHBondContact O-CB 3.34Å; N174-S178 PolarHBondContact O-N 3.19Å; N174-S178 PolarHBondContact O-OG 2.97Å
179	Q	35	Very low	44.6	Very low	177 Å²	177	124.3 Å²	124.3	83%	0.827	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-5.8	-178	-152.1	169	13.1	0	0	114.8	Q177	Q177-Q179 PolarHBondContact O-N 3.45Å
180	E	31.6	Very low	42	Very low	177 Å²	177	130.9 Å²	130.9	83%	0.827	72%	0.717	S	S	*	*	S	Bend	trans	-122.6	39.2	-179.6	-74.8	-155.9	146.5	0	0	115
181	L	31.2	Very low	39.6	Very low	151 Å²	151	131.2 Å²	131.2	79%	0.791	73%	0.729	S	S	*	*			trans	-125.5	40.1	166.9	-74.6	177.4	0	0	0	113.8	S183	L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 2.84Å
182	G	27.6	Very low	37.1	Very low	86 Å²	86	134.8 Å²	134.8	89%	0.887	74%	0.743	S	S	*	*			trans	-86	48.5	162	0	0	0	0	0	113.3
183	S	32.4	Very low	35.2	Very low	92 Å²	92	137.4 Å²	137.4	64%	0.643	76%	0.757	S	S	*	*	S	Bend	trans	-138.9	139.7	170.9	78.3	0	0	0	0	113.5	L181 C185	L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 2.84Å; S183-C185 PolarHBondContact O-N 3.22Å; S183-C185 VanDerWaalsContact O-N 3.1Å
184	T	26.2	Very low	32.9	Very low	145 Å²	145	142.7 Å²	142.7	89%	0.89	77%	0.772	S	S	*	*			trans	-86.3	76.9	-161.8	39.8	0	0	0	0	113.2	K186	T184-K186 PolarHBondContact O-N 3.39Å
185	C	26.3	Very low	31.5	Very low	125 Å²	125	145.3 Å²	145.3	85%	0.845	79%	0.785	S	S	*	*			trans	-79.4	101.9	175.7	-154	0	0	0	0	112.3	S183	S183-C185 PolarHBondContact O-N 3.22Å; S183-C185 VanDerWaalsContact O-N 3.1Å
186	K	28.8	Very low	30.5	Very low	187 Å²	187	144.4 Å²	144.4	81%	0.813	79%	0.785	S	S	*	*			trans	-72	133.7	173.6	-80.6	-177.7	177.4	178	0	111.8	T184	T184-K186 PolarHBondContact O-N 3.39Å
187	V	25.5	Very low	29.7	Very low	128 Å²	128	146.3 Å²	146.3	78%	0.776	79%	0.789	S	S	*	*			trans	63.4	112.7	145.6	-175.7	0	0	0	0	117.5
188	Q	25	Very low	29.3	Very low	178 Å²	178	146.3 Å²	146.3	83%	0.832	79%	0.794	S	S	*	*				-174.3	126.8	110.8	-95.3	-170.8	58.6	0	0	111.3
189	K	23.7	Very low	28.7	Very low	205 Å²	205	149.4 Å²	149.4	89%	0.891	80%	0.797	S	S	*	*			trans	-96.1	120.9	165.3	-68.2	-179.5	178	-179.2	0	108.8
190	K	29.4	Very low	28.6	Very low	193 Å²	193	146.3 Å²	146.3	84%	0.839	80%	0.795	S	S	*	*			trans	-173.3	158.4	161.8	-108.8	162.2	-170.2	-176.1	0	111
191	P	34.1	Very low	28.6	Very low	107 Å²	107	147.3 Å²	147.3	70%	0.695	80%	0.796	S	S	*	*				-132.9	167.5	-99.7	40.6	-25.8	0	0	0	116.2
192	L	24.7	Very low	28.2	Very low	151 Å²	151	145.4 Å²	145.4	79%	0.791	80%	0.796	S	S	*	*			trans	20.6	98.9	147.5	-74.4	157.8	0	0	0	117.6
193	L	34.5	Very low	28.2	Very low	183 Å²	183	147.3 Å²	147.3	96%	0.958	79%	0.79	S	S	*	*			trans	-72.6	134.8	147.5	-85.7	158.5	0	0	0	108.9
194	K	22.7	Very low	28.1	Very low	169 Å²	169	149.9 Å²	149.9	74%	0.735	80%	0.795	S	S	*	*			trans	-145.6	168.1	-164.5	-161.4	179	-172.2	-178.3	0	107.3
195	I	28.8	Very low	28.1	Very low	152 Å²	152	148.3 Å²	148.3	78%	0.779	79%	0.79	S	S	*	*			trans	89.4	135.9	166.4	-51.4	152.9	0	0	0	114.5
196	P	30.2	Very low	28.1	Very low	99 Å²	99	146.6 Å²	146.6	64%	0.643	78%	0.78	S	S	*	*			cis	-129.6	148.1	-24.2	33.2	-15.9	0	0	0	114.8
197	V	27.3	Very low	28.2	Very low	114 Å²	114	144.9 Å²	144.9	69%	0.691	78%	0.778	S	S	*	*			trans	-89.9	122.9	157.6	174.7	0	0	0	0	108
198	N	30.8	Very low	28.6	Very low	154 Å²	154	145.9 Å²	145.9	82%	0.824	78%	0.777	S	S	*	*			trans	-101.9	115.3	169.7	-92.7	-29.4	0	0	0	109.5
199	H	27.9	Very low	28.6	Very low	164 Å²	164	148.9 Å²	148.9	76%	0.759	78%	0.781	S	S	*	*			trans	-83.9	141.4	177.5	-55.5	-89.8	0	0	0	110.9
200	S	32.8	Very low	28.9	Very low	112 Å²	112	144 Å²	144	78%	0.783	77%	0.77	S	S	*	*			trans	-153.8	102.1	161.7	-82.7	0	0	0	0	112.8
201	K	30.1	Very low	28.8	Very low	198 Å²	198	143.9 Å²	143.9	86%	0.861	77%	0.77	S	S	*	*			trans	35.2	108.6	138.2	-54.8	170.7	-173.5	176	0	116
202	S	24.5	Very low	28.3	Very low	111 Å²	111	144.1 Å²	144.1	78%	0.776	77%	0.774	S	S	*	*				56.6	120	78.3	-175.8	0	0	0	0	114.2
203	V	27.4	Very low	28.5	Very low	126 Å²	126	142.5 Å²	142.5	76%	0.764	78%	0.775	S	S	*	*			trans	170.5	150.2	131.7	150.3	0	0	0	0	111.3
204	I	30.5	Very low	28.4	Very low	146 Å²	146	138.6 Å²	138.6	75%	0.749	77%	0.769	S	S	*	*			trans	81.5	87.8	177.9	-60	143.6	0	0	0	116.7
205	S	24.7	Very low	28.6	Very low	113 Å²	113	137.8 Å²	137.8	79%	0.79	78%	0.779	S	S	*	*			trans	-71.3	143.2	135	48.4	0	0	0	0	111.2
206	S	26.7	Very low	28.6	Very low	89 Å²	89	142.1 Å²	142.1	62%	0.622	79%	0.785	S	S	*	*			trans	147.7	164.3	147	59.8	0	0	0	0	112.2
207	I	31.6	Very low	28.3	Very low	151 Å²	151	142.1 Å²	142.1	77%	0.774	79%	0.788	S	S	*	*			trans	72.4	111.3	166.7	-57.2	166.1	0	0	0	113.4
208	I	33.7	Very low	28.2	Very low	149 Å²	149	143.8 Å²	143.8	76%	0.764	79%	0.787	S	S	*	*			cis	-146.2	141.3	8.8	-91.4	151.5	0	0	0	111.5
209	R	24.6	Very low	28.2	Very low	241 Å²	241	144.1 Å²	144.1	91%	0.909	79%	0.788	S	S	*	*			trans	-117.2	135.5	150.1	-148.4	-171.8	-160.6	172.2	6.9	104.5
210	P	30.7	Very low	28.1	Very low	102 Å²	102	141.5 Å²	141.5	66%	0.662	78%	0.784	S	S	*	*				-156.1	-162.7	92.4	40.4	-18	0	0	0	111.6
211	K	26.9	Very low	27.8	Very low	191 Å²	191	141.9 Å²	141.9	83%	0.83	79%	0.785	S	S	*	*			cis	-131.3	152.1	-4.6	-77.1	-178.7	178	176.8	0	109.5
212	S	24.4	Very low	27.4	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	78%	0.783	S	S	*	*			trans	-95.2	136.7	155.9	51.6	0	0	0	0	110.4
213	S	28.2	Very low	27.7	Very low	116 Å²	116	143.4 Å²	143.4	81%	0.811	78%	0.784	S	S	*	*			trans	168.8	108.4	144.4	55.2	0	0	0	0	112.7
214	A	31.6	Very low	27.7	Very low	102 Å²	102	143.8 Å²	143.8	84%	0.843	78%	0.782	S	S	*	*			trans	-166.8	69.1	156.9	0	0	0	0	0	111	R216	A214-R216 PolarHBondContact O-N 3.04Å
215	T	27.8	Very low	27.4	Very low	152 Å²	152	141.4 Å²	141.4	93%	0.933	78%	0.775	S	S	*	*			trans	-65.3	113.6	164.8	42	0	0	0	0	109.3
216	R	28.5	Very low	27.4	Very low	243 Å²	243	144 Å²	144	92%	0.917	77%	0.774	S	S	*	*			trans	-114.2	131	167.9	-157.5	174.4	-176.3	-142.3	-0.3	109.8	A214	A214-R216 PolarHBondContact O-N 3.04Å
217	S	24.6	Very low	27.4	Very low	99 Å²	99	149.4 Å²	149.4	69%	0.692	79%	0.789	S	S	*	*			trans	-66.6	144.8	-167.3	52.5	0	0	0	0	114.4
218	H	25	Very low	27	Very low	148 Å²	148	147 Å²	147	69%	0.685	79%	0.786	S	S	*	*			trans	9.8	116.4	132.3	149.7	-73.4	0	0	0	115.6	V220	H218-V220 VanDerWaalsContact CD2-CG2 3.46Å; H218-V220 WeakPolarHBondContact CD2-CG2 3.36Å
219	L	29.4	Very low	26.7	Very low	162 Å²	162	145 Å²	145	85%	0.848	79%	0.786	S	S	*	*			trans	-125.8	90.2	151.2	-84.2	172.4	0	0	0	107.1	C221	L219-C221 PolarHBondContact O-N 3.45Å
220	V	26.4	Very low	26.9	Very low	109 Å²	109	143.3 Å²	143.3	66%	0.661	79%	0.785	S	S	*	*			trans	-78.6	98.4	168.5	170.6	0	0	0	0	107.7	H218 R222	H218-V220 VanDerWaalsContact CD2-CG2 3.46Å; H218-V220 WeakPolarHBondContact CD2-CG2 3.36Å; V220-R222 PolarHBondContact O-N 2.88Å; V220-R222 VanDerWaalsContact O-N 3.1Å
221	C	26.6	Very low	26.7	Very low	120 Å²	120	146 Å²	146	81%	0.811	79%	0.792	S	S	*	*			trans	-72.4	97.6	168	-73.7	0	0	0	0	109.3	L219	L219-C221 PolarHBondContact O-N 3.45Å
222	R	22	Very low	26.8	Very low	215 Å²	215	144.5 Å²	144.5	81%	0.811	79%	0.791	S	S	*	*			trans	-77.6	122.8	172.3	-167.5	179.9	-168.6	171.1	3.3	109.2	V220 N224	V220-R222 PolarHBondContact O-N 2.88Å; V220-R222 VanDerWaalsContact O-N 3.1Å; R222-N224 PolarHBondContact O-N 2.82Å
223	P	30.7	Very low	26.8	Very low	125 Å²	125	148 Å²	148	81%	0.812	79%	0.792	S	S	*	*			trans	-68.5	123	172.4	-14.6	29.1	0	0	0	109.2
224	N	26.2	Very low	26.7	Very low	134 Å²	134	148 Å²	148	72%	0.717	79%	0.792	S	S	*	*			trans	-111.6	110	178.4	-145.8	30.6	0	0	0	109.7	R222	R222-N224 PolarHBondContact O-N 2.82Å
225	T	25.7	Very low	26.4	Very low	97 Å²	97	150.7 Å²	150.7	60%	0.595	79%	0.792	S	S	*	*			trans	43.5	134.6	141.4	53.9	0	0	0	0	122.3
226	Q	24.8	Very low	26	Very low	166 Å²	166	148 Å²	148	78%	0.776	78%	0.78	S	S	*	*			trans	76.7	93.6	141.1	-68.8	166.2	4.5	0	0	119.2
227	H	26.5	Very low	26	Very low	204 Å²	204	146.8 Å²	146.8	94%	0.944	78%	0.781	S	S	*	*				-121.4	125.5	128.9	-83.1	-68.8	0	0	0	109.2
228	S	23.7	Very low	26	Very low	101 Å²	101	149 Å²	149	71%	0.706	79%	0.786	S	S	*	*			trans	-113.9	160.8	-179.6	55	0	0	0	0	111.6
229	S	26.1	Very low	25.9	Very low	107 Å²	107	146.6 Å²	146.6	75%	0.748	79%	0.786	S	S	*	*			trans	64.3	110.7	161.5	57.6	0	0	0	0	118.9
230	K	29.2	Very low	25.7	Very low	205 Å²	205	145.4 Å²	145.4	89%	0.891	79%	0.785	S	S	*	*				-158.4	109	113.7	-101.6	163.6	-170.9	-179.5	0	109.5
231	I	26.7	Very low	25.5	Very low	158 Å²	158	146.8 Å²	146.8	81%	0.81	79%	0.789	S	S	*	*			trans	-97.9	124.5	171.1	-65.2	169.8	0	0	0	107
232	I	29.1	Very low	25.5	Very low	160 Å²	160	149.2 Å²	149.2	82%	0.821	79%	0.792	S	S	*	*			trans	-117.8	120.9	165.6	-62.1	177.4	0	0	0	106
233	K	23.4	Very low	25.5	Very low	185 Å²	185	144.6 Å²	144.6	80%	0.804	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-73.9	135.9	-178.3	-75.4	179.9	170.9	-178.2	0	110.6
234	S	26.5	Very low	25.2	Very low	115 Å²	115	146.4 Å²	146.4	80%	0.804	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76.1	145.9	162	41.6	0	0	0	0	110.4
235	N	25	Very low	25.2	Very low	160 Å²	160	146 Å²	146	86%	0.856	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-92.7	135.1	170.6	-77.2	-20.7	0	0	0	109.4
236	S	21.1	Very low	25.2	Very low	96 Å²	96	148.5 Å²	148.5	67%	0.671	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-90.7	150	169.8	70.6	0	0	0	0	111.1
237	F	28.3	Very low	25.3	Very low	216 Å²	216	146.7 Å²	146.7	95%	0.947	80%	0.797	S	S	*	*			trans	-141.8	138.8	150.7	-110.1	-84.1	0	0	0	108.6
238	N	24.7	Very low	25.5	Very low	146 Å²	146	142.9 Å²	142.9	78%	0.781	79%	0.791	S	S	*	*			trans	-87.6	159.1	-164.1	-80	-24.3	0	0	0	114.3
239	S	21.6	Very low	25.7	Very low	98 Å²	98	145 Å²	145	69%	0.685	79%	0.793	S	S	*	*			trans	-53	153.9	170.9	-169.6	0	0	0	0	114
240	V	25.3	Very low	25.6	Very low	136 Å²	136	146.2 Å²	146.2	82%	0.824	80%	0.801	S	S	*	*			trans	-130.1	117.4	156	174.3	0	0	0	0	107.6
241	D	22.1	Very low	25.7	Very low	139 Å²	139	141.9 Å²	141.9	74%	0.743	79%	0.792	S	S	*	*			trans	-68.5	144.2	175.4	-60.7	-63.4	0	0	0	111.8
242	L	27.3	Very low	26	Very low	170 Å²	170	141 Å²	141	89%	0.89	79%	0.794	S	S	*	*			trans	-130.8	138.9	160.6	-87.9	170.6	0	0	0	110.2
243	T	22.6	Very low	26.2	Very low	119 Å²	119	138.6 Å²	138.6	73%	0.73	79%	0.792	S	S	*	*			trans	-101.8	175.4	-165.1	41.6	0	0	0	0	112.8
244	H	23.4	Very low	26.6	Very low	162 Å²	162	137.3 Å²	137.3	75%	0.75	79%	0.792	S	S	*	*			trans	111.9	137.7	150.8	-89.6	-84	0	0	0	121.8
245	D	27.3	Very low	27.1	Very low	125 Å²	125	134.7 Å²	134.7	67%	0.668	77%	0.774	S	S	*	*			trans	84	84.3	149.6	-59.6	-17.7	0	0	0	122.5
246	N	25.6	Very low	28.3	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	78%	0.775	S	S	*	*				37.5	105.2	120	-69	-42.2	0	0	0	119.4
247	C	26.6	Very low	29.4	Very low	128 Å²	128	133.9 Å²	133.9	87%	0.865	77%	0.767	S	S	*	*			trans	-145.4	125	140.9	-100	0	0	0	0	111.1
248	P	29.4	Very low	30.3	Very low	124 Å²	124	127 Å²	127	81%	0.805	75%	0.75	S	S	*	*			trans	-100.7	100.5	-179.7	35.4	-28.9	0	0	0	111.9
249	I	28.7	Very low	31.6	Very low	146 Å²	146	128.3 Å²	128.3	75%	0.749	74%	0.744	S	S	*	*			trans	-135.3	114.3	160.6	-58.2	-177.5	0	0	0	109.3	T251	I249-T251 VanDerWaalsContact C-N 3.3Å; I249-T251 HydrophobicContact CG2-CG2 4.22Å; I249-T251 PolarHBondContact O-N 2.84Å
250	S	24.8	Very low	33.3	Very low	132 Å²	132	127 Å²	127	92%	0.923	73%	0.729	S	S	*	*			trans	-75.3	77.4	174.1	-53.8	0	0	0	0	111.2
251	T	31.6	Very low	35	Very low	115 Å²	115	126.4 Å²	126.4	71%	0.706	72%	0.717	S	S	*	*			trans	-90.7	111.1	158.6	43.5	0	0	0	0	108.6	I249 S253	I249-T251 VanDerWaalsContact C-N 3.3Å; I249-T251 HydrophobicContact CG2-CG2 4.22Å; I249-T251 PolarHBondContact O-N 2.84Å; T251-S253 PolarHBondContact O-N 3.26Å; T251-S253 VanDerWaalsContact O-N 3.07Å
252	T	31.5	Very low	36.7	Very low	139 Å²	139	127 Å²	127	85%	0.853	71%	0.71	S	S	*	*			trans	-39.9	112.7	179.4	-52.1	0	0	0	0	111.5	I254	T252-I254 PolarHBondContact O-N 2.82Å
253	S	33.3	Very low	39	Very low	110 Å²	110	122.5 Å²	122.5	77%	0.769	69%	0.687	S	S	*	*			trans	-55	120.5	-177.9	-44.1	0	0	0	0	110	T251 S255	T251-S253 PolarHBondContact O-N 3.26Å; T251-S253 VanDerWaalsContact O-N 3.07Å; S253-S255 VanDerWaalsContact C-N 3.33Å; S253-S255 PolarHBondContact O-N 2.88Å
254	I	31.7	Very low	41.3	Very low	157 Å²	157	120.6 Å²	120.6	81%	0.805	68%	0.678	S	S	*	*			trans	-66.8	98.7	167.8	-58.4	172.1	0	0	0	105.8	T252 T256	T252-I254 PolarHBondContact O-N 2.82Å; I254-T256 PolarHBondContact O-N 2.92Å
255	S	38.2	Very low	43.9	Very low	61 Å²	61	118.6 Å²	118.6	43%	0.427	67%	0.668	S	S	.	*			trans	-59.7	124.6	171.4	167.9	0	0	0	0	108.1	S253 N257 D260	S253-S255 VanDerWaalsContact C-N 3.33Å; S253-S255 PolarHBondContact O-N 2.88Å; S255-N257 PolarHBondContact O-N 3.23Å; S255-N257 PolarHBondContact OG-N 3.1Å; S255-D260 PolarHBondContact OG-OD2 2.84Å
256	T	50.1	Low	46.1	Very low	142 Å²	142	117 Å²	117	87%	0.871	66%	0.662	S	S	*	*			trans	-81.7	3.7	-178.7	42.9	0	0	0	0	113.2	I254	I254-T256 PolarHBondContact O-N 2.92Å
257	N	43.2	Very low	48.4	Very low	97 Å²	97	113.2 Å²	113.2	52%	0.519	65%	0.647	S	S	.	*			trans	-87.9	112.7	171.8	-87.8	-41.5	0	0	0	110.9	S255 R259 D260 H261	S255-N257 PolarHBondContact O-N 3.23Å; S255-N257 PolarHBondContact OG-N 3.1Å; N257-R259 HydrophobicContact CB-CB 4.46Å; N257-R259 PolarHBondContact O-N 3.35Å; N257-R259 VanDerWaalsContact O-N 3.09Å; N257-D260 HydrophobicContact CB-CB 4.15Å; N257-D260 VanDerWaalsContact CB-CG 3.48Å; N257-D260 WeakPolarHBondContact CB-OD1 3.48Å; N257-D260 PolarHBondContact O-N 3.29Å; N257-H261 PolarHBondContact O-N 3.49Å
258	A	48.3	Very low	50.8	Low	71 Å²	71	110.5 Å²	110.5	59%	0.587	63%	0.63	S	S	*	*	H	α-helix	trans	-55	-27	167.6	0	0	0	0	0	112.2	H261 Y262	A258-H261 PolarHBondContact O-N 3.37Å; A258-Y262 WeakPolarHBondContact O-CD2 3.23Å; A258-Y262 PolarHBondContact O-N 2.89Å
259	R	50.6	Low	53.2	Low	174 Å²	174	109.2 Å²	109.2	66%	0.657	62%	0.616	S	S	*	*	H	α-helix	trans	-59.3	-52	172.7	-163.3	75.9	-162.3	-177.4	3	111.8	N257 H261 Y262 D263	N257-R259 HydrophobicContact CB-CB 4.46Å; N257-R259 PolarHBondContact O-N 3.35Å; N257-R259 VanDerWaalsContact O-N 3.09Å; R259-H261 PolarHBondContact O-N 2.93Å; R259-Y262 PolarHBondContact O-N 2.95Å; R259-D263 IonicContact NE-OD2 3.8Å; R259-D263 PolarHBondContact O-N 2.9Å
260	D	58	Low	55.4	Low	70 Å²	70	110.6 Å²	110.6	37%	0.374	61%	0.612	S	S	.	*	H	α-helix	trans	-61.4	-33.5	179.7	-56.9	5.5	0	0	0	111.7	S255 N257 S264	S255-D260 PolarHBondContact OG-OD2 2.84Å; N257-D260 HydrophobicContact CB-CB 4.15Å; N257-D260 VanDerWaalsContact CB-CG 3.48Å; N257-D260 WeakPolarHBondContact CB-OD1 3.48Å; N257-D260 PolarHBondContact O-N 3.29Å; D260-S264 WeakPolarHBondContact O-CA 3.25Å; D260-S264 WeakPolarHBondContact O-CB 3.47Å; D260-S264 PolarHBondContact O-N 3.47Å
261	H	60.8	Low	57.6	Low	124 Å²	124	109.8 Å²	109.8	57%	0.574	59%	0.594	S	S	*	*	H	α-helix	trans	-66.4	-41.2	174.3	179.2	-89.3	0	0	0	112.3	N257 A258 R259 K265	N257-H261 PolarHBondContact O-N 3.49Å; A258-H261 PolarHBondContact O-N 3.37Å; R259-H261 PolarHBondContact O-N 2.93Å; H261-K265 VanDerWaalsContact O-CB 3.24Å; H261-K265 WeakPolarHBondContact O-CB 3.49Å; H261-K265 PolarHBondContact O-N 3Å
262	Y	58.8	Low	59.5	Low	151 Å²	151	110 Å²	110	59%	0.592	59%	0.586	S	S	*	*	H	α-helix	trans	-68.4	-46.8	173.5	-75.6	-68.4	0	0	0	111.8	A258 R259 S264 K265 V266	A258-Y262 WeakPolarHBondContact O-CD2 3.23Å; A258-Y262 PolarHBondContact O-N 2.89Å; R259-Y262 PolarHBondContact O-N 2.95Å; Y262-S264 VanDerWaalsContact C-N 3.31Å; Y262-S264 PolarHBondContact O-N 3.29Å; Y262-K265 PolarHBondContact O-N 3.46Å; Y262-K265 VanDerWaalsContact O-N 3.16Å; Y262-V266 WeakPolarHBondContact O-CB 3.35Å; Y262-V266 WeakPolarHBondContact O-CG2 3.39Å; Y262-V266 PolarHBondContact O-N 3.4Å
263	D	74.9	Confident	61.4	Low	76 Å²	76	105.5 Å²	105.5	41%	0.406	56%	0.563	S	S	.	*	H	α-helix	trans	-65.6	-35.5	-179.1	-67.1	-22.3	0	0	0	110.9	R259 S267	R259-D263 IonicContact NE-OD2 3.8Å; R259-D263 PolarHBondContact O-N 2.9Å; D263-S267 VanDerWaalsContact O-CB 3.22Å; D263-S267 WeakPolarHBondContact O-CB 3.49Å; D263-S267 PolarHBondContact O-N 3.36Å; D263-S267 PolarHBondContact O-OG 3.14Å
264	S	71	Confident	62.8	Low	78 Å²	78	103.4 Å²	103.4	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-67.2	-41.7	170.9	-178.4	0	0	0	0	112.5	D260 Y262 S267 S268	D260-S264 WeakPolarHBondContact O-CA 3.25Å; D260-S264 WeakPolarHBondContact O-CB 3.47Å; D260-S264 PolarHBondContact O-N 3.47Å; Y262-S264 VanDerWaalsContact C-N 3.31Å; Y262-S264 PolarHBondContact O-N 3.29Å; S264-S267 PolarHBondContact O-N 3.25Å; S264-S268 VanDerWaalsContact O-CB 3.3Å; S264-S268 WeakPolarHBondContact O-CB 3.34Å; S264-S268 PolarHBondContact O-N 2.87Å
265	K	78.7	Confident	64.4	Low	121 Å²	121	100 Å²	100	53%	0.526	53%	0.527	S	S	.	.	H	α-helix	trans	-68.4	-39.1	177.4	-170.1	176.2	-176.8	-176.9	0	112.3	H261 Y262 S268 L269	H261-K265 VanDerWaalsContact O-CB 3.24Å; H261-K265 WeakPolarHBondContact O-CB 3.49Å; H261-K265 PolarHBondContact O-N 3Å; Y262-K265 PolarHBondContact O-N 3.46Å; Y262-K265 VanDerWaalsContact O-N 3.16Å; K265-S268 PolarHBondContact O-N 3.45Å; K265-L269 HydrophobicContact CG-CD1 4.4Å; K265-L269 WeakPolarHBondContact O-CB 3.42Å; K265-L269 WeakPolarHBondContact O-CG 3.48Å; K265-L269 PolarHBondContact O-N 2.9Å
266	V	72	Confident	65.7	Low	91 Å²	91	100.7 Å²	100.7	55%	0.552	53%	0.531	S	S	*	.	H	α-helix	trans	-65.4	-45.2	172.4	171.7	0	0	0	0	110	Y262 S268 L269 W270	Y262-V266 WeakPolarHBondContact O-CB 3.35Å; Y262-V266 WeakPolarHBondContact O-CG2 3.39Å; Y262-V266 PolarHBondContact O-N 3.4Å; V266-S268 VanDerWaalsContact C-N 3.32Å; V266-S268 PolarHBondContact O-N 3.27Å; V266-L269 PolarHBondContact O-N 2.9Å; V266-W270 VanDerWaalsContact O-CB 3.24Å; V266-W270 WeakPolarHBondContact O-CB 3.37Å; V266-W270 PolarHBondContact O-N 3.4Å
267	S	73.7	Confident	65.8	Low	70 Å²	70	100 Å²	100	49%	0.49	52%	0.522	S	S	.	.	H	α-helix	trans	-60.9	-40	175.3	-59.4	0	0	0	0	111.9	D263 S264 W270 E271	D263-S267 VanDerWaalsContact O-CB 3.22Å; D263-S267 WeakPolarHBondContact O-CB 3.49Å; D263-S267 PolarHBondContact O-N 3.36Å; D263-S267 PolarHBondContact O-OG 3.14Å; S264-S267 PolarHBondContact O-N 3.25Å; S267-W270 PolarHBondContact O-N 3.13Å; S267-E271 VanDerWaalsContact O-CB 3.29Å; S267-E271 WeakPolarHBondContact O-CB 3.14Å; S267-E271 WeakPolarHBondContact O-CG 3.37Å; S267-E271 PolarHBondContact O-N 3.31Å
268	S	77.7	Confident	66	Low	72 Å²	72	99 Å²	99	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-68.3	-39.5	176.7	178.7	0	0	0	0	112.6	S264 K265 V266 W270 Q272	S264-S268 VanDerWaalsContact O-CB 3.3Å; S264-S268 WeakPolarHBondContact O-CB 3.34Å; S264-S268 PolarHBondContact O-N 2.87Å; K265-S268 PolarHBondContact O-N 3.45Å; V266-S268 VanDerWaalsContact C-N 3.32Å; V266-S268 PolarHBondContact O-N 3.27Å; S268-W270 VanDerWaalsContact C-N 3.34Å; S268-Q272 VanDerWaalsContact O-CB 3.23Å; S268-Q272 WeakPolarHBondContact O-CB 3.46Å; S268-Q272 PolarHBondContact O-N 2.97Å
269	L	79.1	Confident	66.1	Low	97 Å²	97	102.1 Å²	102.1	51%	0.508	52%	0.522	S	S	.	.	H	α-helix	trans	-67.8	-35	172.9	-76.7	165.6	0	0	0	112	K265 V266 Q272 A273	K265-L269 HydrophobicContact CG-CD1 4.4Å; K265-L269 WeakPolarHBondContact O-CB 3.42Å; K265-L269 WeakPolarHBondContact O-CG 3.48Å; K265-L269 PolarHBondContact O-N 2.9Å; V266-L269 PolarHBondContact O-N 2.9Å; L269-Q272 PolarHBondContact O-N 3.45Å; L269-A273 WeakPolarHBondContact O-CB 3.43Å; L269-A273 PolarHBondContact O-N 2.85Å
270	W	74.8	Confident	65.8	Low	175 Å²	175	100.9 Å²	100.9	66%	0.663	53%	0.528	S	S	*	.	H	α-helix	trans	-70.7	-46.9	177	-173.1	-104.1	0	0	0	112	V266 S267 S268 Q272 A273 I274	V266-W270 VanDerWaalsContact O-CB 3.24Å; V266-W270 WeakPolarHBondContact O-CB 3.37Å; V266-W270 PolarHBondContact O-N 3.4Å; S267-W270 PolarHBondContact O-N 3.13Å; S268-W270 VanDerWaalsContact C-N 3.34Å; W270-Q272 VanDerWaalsContact C-N 3.31Å; W270-Q272 PolarHBondContact O-N 3.01Å; W270-A273 PolarHBondContact O-N 3.47Å; W270-I274 HydrophobicContact CZ2-CD1 4.46Å; W270-I274 VanDerWaalsContact NE1-CD1 3.33Å; W270-I274 WeakPolarHBondContact O-CG1 3.5Å; W270-I274 PolarHBondContact O-N 3.38Å
271	E	72.9	Confident	65.2	Low	115 Å²	115	101.5 Å²	101.5	54%	0.537	55%	0.552	S	S	.	*	H	α-helix	trans	-54.2	-46.4	167.1	-82.9	-81	156.7	0	0	111	S267 A273 I274 N275	S267-E271 VanDerWaalsContact O-CB 3.29Å; S267-E271 WeakPolarHBondContact O-CB 3.14Å; S267-E271 WeakPolarHBondContact O-CG 3.37Å; S267-E271 PolarHBondContact O-N 3.31Å; E271-A273 VanDerWaalsContact C-N 3.34Å; E271-A273 PolarHBondContact O-N 3.19Å; E271-I274 PolarHBondContact O-N 3.01Å; E271-N275 VanDerWaalsContact O-CB 3.25Å; E271-N275 WeakPolarHBondContact O-CB 3.23Å; E271-N275 VanDerWaalsContact O-CG 3.27Å; E271-N275 PolarHBondContact O-N 2.92Å; E271-N275 PolarHBondContact O-ND2 2.74Å; E271-N275 PolarHBondContact OE2-ND2 3.26Å
272	Q	70.4	Confident	64.3	Low	119 Å²	119	99.9 Å²	99.9	56%	0.556	55%	0.554	S	S	*	*	H	α-helix	trans	-64	-38.9	177.7	-172.1	176.8	12	0	0	111.9	S268 L269 W270 S276	S268-Q272 VanDerWaalsContact O-CB 3.23Å; S268-Q272 WeakPolarHBondContact O-CB 3.46Å; S268-Q272 PolarHBondContact O-N 2.97Å; L269-Q272 PolarHBondContact O-N 3.45Å; W270-Q272 VanDerWaalsContact C-N 3.31Å; W270-Q272 PolarHBondContact O-N 3.01Å; Q272-S276 VanDerWaalsContact O-CB 3.25Å; Q272-S276 WeakPolarHBondContact O-CB 3.31Å; Q272-S276 PolarHBondContact O-N 2.83Å; Q272-S276 PolarHBondContact O-OG 3.44Å
273	A	70.7	Confident	63.2	Low	45 Å²	45	98 Å²	98	37%	0.372	56%	0.563	S	S	.	*	H	α-helix	trans	-66.5	-45.6	175.4	0	0	0	0	0	111.9	L269 W270 E271 S276 L277	L269-A273 WeakPolarHBondContact O-CB 3.43Å; L269-A273 PolarHBondContact O-N 2.85Å; W270-A273 PolarHBondContact O-N 3.47Å; E271-A273 VanDerWaalsContact C-N 3.34Å; E271-A273 PolarHBondContact O-N 3.19Å; A273-S276 CarbonylContact O-C 3.59Å; A273-S276 WeakPolarHBondContact O-CB 3.36Å; A273-S276 PolarHBondContact O-N 3.3Å; A273-L277 VanDerWaalsContact O-CG 3.31Å; A273-L277 WeakPolarHBondContact O-CG 3.43Å; A273-L277 PolarHBondContact O-N 3.45Å
274	I	63.5	Low	61.5	Low	66 Å²	66	97.7 Å²	97.7	34%	0.338	57%	0.571	S	S	.	*	H	α-helix	trans	-63	-46.3	175.9	-72.7	178.5	0	0	0	111	W270 E271 S276 L277 N278	W270-I274 HydrophobicContact CZ2-CD1 4.46Å; W270-I274 VanDerWaalsContact NE1-CD1 3.33Å; W270-I274 WeakPolarHBondContact O-CG1 3.5Å; W270-I274 PolarHBondContact O-N 3.38Å; E271-I274 PolarHBondContact O-N 3.01Å; I274-S276 PolarHBondContact O-N 3.35Å; I274-L277 CarbonylContact O-C 3.58Å; I274-L277 WeakPolarHBondContact O-CA 3.42Å; I274-L277 WeakPolarHBondContact O-CB 3.49Å; I274-L277 PolarHBondContact O-N 2.94Å; I274-N278 WeakPolarHBondContact O-CB 3.28Å; I274-N278 PolarHBondContact O-N 2.81Å
275	N	66	Low	60	Low	86 Å²	86	99.7 Å²	99.7	46%	0.46	58%	0.58	S	S	.	*	H	α-helix	trans	-66	-28	176.5	-70.8	-51.1	0	0	0	112.4	E271	E271-N275 VanDerWaalsContact O-CB 3.25Å; E271-N275 WeakPolarHBondContact O-CB 3.23Å; E271-N275 VanDerWaalsContact O-CG 3.27Å; E271-N275 PolarHBondContact O-N 2.92Å; E271-N275 PolarHBondContact O-ND2 2.74Å; E271-N275 PolarHBondContact OE2-ND2 3.26Å
276	S	64.8	Low	57.9	Low	74 Å²	74	99.7 Å²	99.7	52%	0.517	59%	0.59	S	S	.	*	H	α-helix	trans	-74.5	-24.9	170.8	-58.1	0	0	0	0	113.3	Q272 A273 I274	Q272-S276 VanDerWaalsContact O-CB 3.25Å; Q272-S276 WeakPolarHBondContact O-CB 3.31Å; Q272-S276 PolarHBondContact O-N 2.83Å; Q272-S276 PolarHBondContact O-OG 3.44Å; A273-S276 CarbonylContact O-C 3.59Å; A273-S276 WeakPolarHBondContact O-CB 3.36Å; A273-S276 PolarHBondContact O-N 3.3Å; I274-S276 PolarHBondContact O-N 3.35Å
277	L	52.2	Low	55.9	Low	129 Å²	129	99.9 Å²	99.9	68%	0.675	60%	0.595	S	S	*	*	H	α-helix	trans	-81.4	-34.3	173	-71.3	162.9	0	0	0	111.7	A273 I274 L279	A273-L277 VanDerWaalsContact O-CG 3.31Å; A273-L277 WeakPolarHBondContact O-CG 3.43Å; A273-L277 PolarHBondContact O-N 3.45Å; I274-L277 CarbonylContact O-C 3.58Å; I274-L277 WeakPolarHBondContact O-CA 3.42Å; I274-L277 WeakPolarHBondContact O-CB 3.49Å; I274-L277 PolarHBondContact O-N 2.94Å; L277-L279 PolarHBondContact O-N 3.43Å
278	N	46.6	Very low	53.9	Low	75 Å²	75	103.5 Å²	103.5	40%	0.401	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-75.1	5.4	177.9	-70.7	-19.8	0	0	0	114.3	I274 D280	I274-N278 WeakPolarHBondContact O-CB 3.28Å; I274-N278 PolarHBondContact O-N 2.81Å; N278-D280 PolarHBondContact O-N 2.79Å
279	L	50.3	Low	51.8	Low	137 Å²	137	105.9 Å²	105.9	72%	0.717	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-68.7	-17.5	-177.8	-113.2	158.5	0	0	0	113.8	L277	L277-L279 PolarHBondContact O-N 3.43Å
280	D	45.4	Very low	49.5	Very low	147 Å²	147	104.3 Å²	104.3	79%	0.786	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-119.5	54.2	178	-74.5	-43	0	0	0	112.8	N278 S282	N278-D280 PolarHBondContact O-N 2.79Å; D280-S282 PolarHBondContact O-N 2.95Å; D280-S282 PolarHBondContact O-OG 2.71Å
281	G	44.7	Very low	47.6	Very low	84 Å²	84	103.8 Å²	103.8	87%	0.866	63%	0.629	S	S	*	*			trans	60.2	-2	147.8	0	0	0	0	0	120.5
282	S	42.5	Very low	46	Very low	89 Å²	89	106.5 Å²	106.5	62%	0.622	64%	0.636	S	S	*	*			trans	-92.3	133	179.4	53.4	0	0	0	0	110.5	D280 A284	D280-S282 PolarHBondContact O-N 2.95Å; D280-S282 PolarHBondContact O-OG 2.71Å; S282-A284 PolarHBondContact O-N 3.36Å
283	S	35.7	Very low	44.2	Very low	111 Å²	111	109 Å²	109	78%	0.776	65%	0.652	S	S	*	*			trans	-70.9	90.5	-177.2	55.3	0	0	0	0	111	V285	S283-V285 PolarHBondContact O-N 2.88Å
284	A	39.7	Very low	42.4	Very low	71 Å²	71	116 Å²	116	59%	0.587	67%	0.674	S	S	*	*			trans	-65.4	96.8	173.3	0	0	0	0	0	110.2	S282 T286	S282-A284 PolarHBondContact O-N 3.36Å; A284-T286 PolarHBondContact O-N 2.92Å
285	V	39.1	Very low	40.9	Very low	120 Å²	120	120.3 Å²	120.3	73%	0.727	70%	0.698	S	S	*	*			trans	-75.6	120.3	176	177.6	0	0	0	0	109.4	S283 C287	S283-V285 PolarHBondContact O-N 2.88Å; V285-C287 PolarHBondContact O-N 3.39Å
286	T	35.2	Very low	39.2	Very low	121 Å²	121	125.5 Å²	125.5	74%	0.742	72%	0.719	S	S	*	*			trans	-74.3	92.7	-177	-41.6	0	0	0	0	111.9	A284 Q288	A284-T286 PolarHBondContact O-N 2.92Å; T286-Q288 PolarHBondContact O-N 3.08Å
287	C	28.8	Very low	37.4	Very low	95 Å²	95	126.7 Å²	126.7	64%	0.642	73%	0.728	S	S	*	*			trans	-70.4	124.8	170.6	-66.6	0	0	0	0	111.2	V285	V285-C287 PolarHBondContact O-N 3.39Å
288	Q	31.8	Very low	36.5	Very low	145 Å²	145	126.2 Å²	126.2	68%	0.678	73%	0.732	S	S	*	*			trans	-75.8	152.7	178.2	-72	-70.8	-17.6	0	0	111.8	T286 G290	T286-Q288 PolarHBondContact O-N 3.08Å; Q288-G290 PolarHBondContact O-N 3.46Å
289	P	33.5	Very low	35.9	Very low	123 Å²	123	129.3 Å²	129.3	80%	0.799	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	92.3	-172.6	30.3	-34	0	0	0	111.7
290	G	30.8	Very low	34.9	Very low	63 Å²	63	131.9 Å²	131.9	65%	0.649	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.6	-21.3	175.7	0	0	0	0	0	117.6	Q288	Q288-G290 PolarHBondContact O-N 3.46Å
291	E	34.7	Very low	34.1	Very low	164 Å²	164	130.3 Å²	130.3	77%	0.766	76%	0.76	S	S	*	*			trans	-86.5	-7.7	-167.7	-62.9	-166.4	132.3	0	0	115.8	L293	E291-L293 PolarHBondContact O-N 3.06Å
292	Y	39.1	Very low	33.3	Very low	173 Å²	173	135 Å²	135	68%	0.678	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	3	-171.7	-77.1	-78.2	0	0	0	117.1	L29	L29-Y292 HydrophobicContact CD2-CE1 4.23Å
293	L	33.8	Very low	32.4	Very low	172 Å²	172	136.8 Å²	136.8	90%	0.901	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	4.6	-171.5	-86.3	172.5	0	0	0	116.9	E291	E291-L293 PolarHBondContact O-N 3.06Å
294	K	32.5	Very low	31.9	Very low	191 Å²	191	134.4 Å²	134.4	83%	0.83	77%	0.768	S	S	*	*	S	Bend	trans	-104	-18.5	-179.2	-82.6	-175.5	174.7	177.3	0	116.9
295	N	31	Very low	31.4	Very low	157 Å²	157	139.3 Å²	139.3	84%	0.84	78%	0.783	S	S	*	*			trans	-116.2	46.3	-166.4	-65.3	-8.8	0	0	0	114.4
296	Q	31.2	Very low	31	Very low	194 Å²	194	140.2 Å²	140.2	91%	0.907	79%	0.789	S	S	*	*			trans	-105.6	85.2	160.9	-73.9	-163.7	15.4	0	0	110.8
297	S	26.7	Very low	30.8	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	79%	0.788	S	S	*	*			trans	-83.3	131.8	161.7	178.2	0	0	0	0	108.8	V299	S297-V299 PolarHBondContact O-N 2.65Å
298	P	34.5	Very low	31	Very low	119 Å²	119	139 Å²	139	77%	0.773	79%	0.788	S	S	*	*			trans	-73.1	99.1	-177.1	28.7	-33.6	0	0	0	111.1
299	V	32.5	Very low	31.5	Very low	141 Å²	141	139.9 Å²	139.9	86%	0.855	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-69.3	137	177	-177.8	0	0	0	0	110.5	S297	S297-V299 PolarHBondContact O-N 2.65Å
300	K	30.5	Very low	31.7	Very low	191 Å²	191	141.4 Å²	141.4	83%	0.83	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-71.6	154.9	-166.8	-67.8	163.7	178.6	169.3	0	113.2	L302	K300-L302 PolarHBondContact O-N 3.29Å
301	S	28	Very low	32.4	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-59.8	118.5	176	47.3	0	0	0	0	112.8	C303	S301-C303 VanDerWaalsContact C-N 3.35Å; S301-C303 PolarHBondContact O-N 2.89Å; S301-C303 VanDerWaalsContact O-N 3.11Å
302	L	27.5	Very low	32.6	Very low	183 Å²	183	145 Å²	145	96%	0.958	79%	0.788	S	S	*	*			trans	-83.2	79.8	169.7	-163.5	75.9	0	0	0	109.6	K300	K300-L302 PolarHBondContact O-N 3.29Å
303	C	23.6	Very low	32.9	Very low	126 Å²	126	142 Å²	142	85%	0.851	78%	0.784	S	S	*	*			trans	-113.9	99.2	175	-165.3	0	0	0	0	110.3	S301	S301-C303 VanDerWaalsContact C-N 3.35Å; S301-C303 PolarHBondContact O-N 2.89Å; S301-C303 VanDerWaalsContact O-N 3.11Å
304	G	24.6	Very low	33.8	Very low	62 Å²	62	137.7 Å²	137.7	64%	0.639	77%	0.769	S	S	*	*			trans	160.8	103.4	173.8	0	0	0	0	0	113.4
305	I	30.9	Very low	35.1	Very low	174 Å²	174	132 Å²	132	89%	0.892	75%	0.753	S	S	*	*				-168.6	139.8	121	-90.1	149.1	0	0	0	107.9
306	T	29.4	Very low	36.4	Very low	139 Å²	139	128 Å²	128	85%	0.853	73%	0.731	S	S	*	*			trans	-81.3	145	-177.2	47.5	0	0	0	0	112.4
307	G	31.9	Very low	37.7	Very low	70 Å²	70	123.5 Å²	123.5	72%	0.722	71%	0.71	S	S	*	*			trans	-174.2	-62.9	171.2	0	0	0	0	0	117.9
308	D	33.1	Very low	39.7	Very low	120 Å²	120	124.3 Å²	124.3	64%	0.642	71%	0.707	S	S	*	*			trans	-126.3	58.3	-156.8	-77.2	-53.4	0	0	0	115.9	N310	D308-N310 VanDerWaalsContact C-N 3.31Å; D308-N310 PolarHBondContact O-N 3.44Å
309	Q	42.7	Very low	41.5	Very low	164 Å²	164	121.9 Å²	121.9	77%	0.766	69%	0.69	S	S	*	*	H	α-helix	trans	-74	-7	-174	-73.1	-167.9	-9.6	0	0	116.7	N313	Q309-N313 PolarHBondContact O-ND2 2.97Å; Q309-N313 VanDerWaalsContact O-ND2 3.13Å
310	N	37.3	Very low	43.4	Very low	155 Å²	155	119.6 Å²	119.6	83%	0.829	67%	0.671	S	S	*	*	H	α-helix	trans	-94.4	-23.3	-174.5	-77.5	-18.3	0	0	0	115.5	D308	D308-N310 VanDerWaalsContact C-N 3.31Å; D308-N310 PolarHBondContact O-N 3.44Å
311	I	45.2	Very low	45.4	Very low	127 Å²	127	114.6 Å²	114.6	65%	0.651	65%	0.654	S	S	*	*	H	α-helix	trans	-88.9	-35.8	178.5	-61.9	176.2	0	0	0	110.9	N313 S314	I311-N313 VanDerWaalsContact C-N 3.34Å; I311-N313 PolarHBondContact O-N 3.41Å; I311-S314 PolarHBondContact O-OG 2.92Å
312	W	38	Very low	47.6	Very low	174 Å²	174	112.7 Å²	112.7	66%	0.659	64%	0.637	S	S	*	*	H	α-helix	trans	-65.4	-32.9	-174.8	-77.6	58.5	0	0	0	113.5	S314 N316	W312-S314 PolarHBondContact O-N 3.3Å; W312-N316 VanDerWaalsContact O-CB 3.23Å; W312-N316 WeakPolarHBondContact O-CB 3.37Å; W312-N316 PolarHBondContact O-N 3.35Å; W312-N316 PolarHBondContact O-ND2 2.92Å
313	N	46.8	Very low	49.8	Very low	110 Å²	110	109 Å²	109	59%	0.588	62%	0.617	S	S	*	*	H	α-helix	trans	-65.4	-32.9	-176.5	-74.6	-24.6	0	0	0	113.7	Q309 I311 Q317	Q309-N313 PolarHBondContact O-ND2 2.97Å; Q309-N313 VanDerWaalsContact O-ND2 3.13Å; I311-N313 VanDerWaalsContact C-N 3.34Å; I311-N313 PolarHBondContact O-N 3.41Å; N313-Q317 WeakPolarHBondContact O-CB 3.37Å; N313-Q317 PolarHBondContact O-N 2.96Å
314	S	52.6	Low	52.4	Low	83 Å²	83	109.2 Å²	109.2	58%	0.58	60%	0.604	S	S	*	*	H	α-helix	trans	-76.1	-45.2	-179.2	62.2	0	0	0	0	112.3	I311 W312 Q317 L318	I311-S314 PolarHBondContact O-OG 2.92Å; W312-S314 PolarHBondContact O-N 3.3Å; S314-Q317 PolarHBondContact O-N 3.47Å; S314-L318 PolarHBondContact O-N 3.19Å
315	S	59.7	Low	54.9	Low	70 Å²	70	109.2 Å²	109.2	49%	0.49	59%	0.594	S	S	.	*	H	α-helix	trans	-64.7	-44.1	177.2	-169.1	0	0	0	0	111.3	Q317 L318 T319	S315-Q317 PolarHBondContact O-N 2.98Å; S315-L318 PolarHBondContact O-N 2.81Å; S315-T319 WeakPolarHBondContact O-CB 3.24Å; S315-T319 PolarHBondContact O-N 3.07Å; S315-T319 PolarHBondContact O-OG1 3.28Å
316	N	57.1	Low	57.2	Low	73 Å²	73	104.4 Å²	104.4	39%	0.39	57%	0.571	S	S	.	*	H	α-helix	trans	-65.2	-40.1	176.2	-69	-12	0	0	0	111.6	W312 T319 I320	W312-N316 VanDerWaalsContact O-CB 3.23Å; W312-N316 WeakPolarHBondContact O-CB 3.37Å; W312-N316 PolarHBondContact O-N 3.35Å; W312-N316 PolarHBondContact O-ND2 2.92Å; N316-T319 PolarHBondContact O-N 2.96Å; N316-I320 WeakPolarHBondContact O-CB 3.3Å; N316-I320 WeakPolarHBondContact O-CD1 3.34Å; N316-I320 WeakPolarHBondContact O-CG1 3.28Å; N316-I320 PolarHBondContact O-N 3.24Å
317	Q	60.3	Low	59.6	Low	100 Å²	100	103.5 Å²	103.5	47%	0.467	56%	0.56	S	S	.	*	H	α-helix	trans	-66.5	-39.2	177	-169.5	64.9	58.2	0	0	112.5	N313 S314 S315 N321	N313-Q317 WeakPolarHBondContact O-CB 3.37Å; N313-Q317 PolarHBondContact O-N 2.96Å; S314-Q317 PolarHBondContact O-N 3.47Å; S315-Q317 PolarHBondContact O-N 2.98Å; Q317-N321 PolarHBondContact NE2-OD1 3.5Å; Q317-N321 WeakPolarHBondContact O-CB 3.45Å; Q317-N321 PolarHBondContact O-N 3.24Å; Q317-N321 PolarHBondContact O-ND2 3.37Å; Q317-N321 PolarHBondContact O-OD1 3.5Å
318	L	68	Low	61.8	Low	117 Å²	117	103.8 Å²	103.8	61%	0.613	55%	0.545	S	S	*	.	H	α-helix	trans	-62	-46.6	173.2	-174.1	69.1	0	0	0	110.6	S314 S315 I320 N321 T322	S314-L318 PolarHBondContact O-N 3.19Å; S315-L318 PolarHBondContact O-N 2.81Å; L318-I320 PolarHBondContact O-N 2.82Å; L318-N321 PolarHBondContact O-N 3.44Å; L318-T322 PolarHBondContact O-N 3.48Å; L318-T322 PolarHBondContact O-OG1 3.38Å; L318-T322 VanDerWaalsContact O-OG1 3.12Å
319	T	72.5	Confident	64	Low	68 Å²	68	102.7 Å²	102.7	42%	0.417	54%	0.539	S	S	.	.	H	α-helix	trans	-60.7	-45.4	178.6	-56.4	0	0	0	0	111.5	S315 N316 N321 T322 I323	S315-T319 WeakPolarHBondContact O-CB 3.24Å; S315-T319 PolarHBondContact O-N 3.07Å; S315-T319 PolarHBondContact O-OG1 3.28Å; N316-T319 PolarHBondContact O-N 2.96Å; T319-N321 PolarHBondContact O-N 2.94Å; T319-T322 PolarHBondContact O-N 2.9Å; T319-I323 HydrophobicContact CG2-CD1 3.85Å; T319-I323 WeakPolarHBondContact O-CB 3.33Å; T319-I323 VanDerWaalsContact O-CG1 3.25Å; T319-I323 WeakPolarHBondContact O-CG1 3.45Å; T319-I323 PolarHBondContact O-N 2.79Å
320	I	71.1	Confident	65.5	Low	92 Å²	92	98.5 Å²	98.5	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-41.5	175.6	-71.5	163.4	0	0	0	111.3	N316 L318 I323 K324	N316-I320 WeakPolarHBondContact O-CB 3.3Å; N316-I320 WeakPolarHBondContact O-CD1 3.34Å; N316-I320 WeakPolarHBondContact O-CG1 3.28Å; N316-I320 PolarHBondContact O-N 3.24Å; L318-I320 PolarHBondContact O-N 2.82Å; I320-I323 PolarHBondContact O-N 3.27Å; I320-K324 VanDerWaalsContact O-CB 3.31Å; I320-K324 WeakPolarHBondContact O-CB 3.29Å; I320-K324 PolarHBondContact O-N 2.89Å
321	N	72.4	Confident	67.5	Low	87 Å²	87	99.7 Å²	99.7	47%	0.465	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-41.9	177.7	-69.1	-10.1	0	0	0	111.6	Q317 L318 T319 K324 S325	Q317-N321 PolarHBondContact NE2-OD1 3.5Å; Q317-N321 WeakPolarHBondContact O-CB 3.45Å; Q317-N321 PolarHBondContact O-N 3.24Å; Q317-N321 PolarHBondContact O-ND2 3.37Å; Q317-N321 PolarHBondContact O-OD1 3.5Å; L318-N321 PolarHBondContact O-N 3.44Å; T319-N321 PolarHBondContact O-N 2.94Å; N321-K324 PolarHBondContact O-N 3.23Å; N321-S325 PolarHBondContact O-N 2.86Å
322	T	75.2	Confident	69.2	Low	72 Å²	72	98.5 Å²	98.5	44%	0.442	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-45.6	175.1	-57.8	0	0	0	0	111.6	L318 T319 K324 S325 N326	L318-T322 PolarHBondContact O-N 3.48Å; L318-T322 PolarHBondContact O-OG1 3.38Å; L318-T322 VanDerWaalsContact O-OG1 3.12Å; T319-T322 PolarHBondContact O-N 2.9Å; T322-K324 VanDerWaalsContact C-N 3.27Å; T322-K324 PolarHBondContact O-N 2.92Å; T322-S325 PolarHBondContact O-N 3.13Å; T322-N326 VanDerWaalsContact O-CG 3.24Å; T322-N326 PolarHBondContact O-N 3.32Å; T322-N326 PolarHBondContact O-OD1 3.04Å
323	I	74.1	Confident	71.2	Confident	105 Å²	105	96.3 Å²	96.3	54%	0.538	52%	0.519	S	S	.	.	H	α-helix	trans	-57.7	-42.6	174.4	-71.4	166.8	0	0	0	110.4	T319 I320 N326 L327	T319-I323 HydrophobicContact CG2-CD1 3.85Å; T319-I323 WeakPolarHBondContact O-CB 3.33Å; T319-I323 VanDerWaalsContact O-CG1 3.25Å; T319-I323 WeakPolarHBondContact O-CG1 3.45Å; T319-I323 PolarHBondContact O-N 2.79Å; I320-I323 PolarHBondContact O-N 3.27Å; I323-N326 PolarHBondContact O-N 2.87Å; I323-L327 WeakPolarHBondContact O-CB 3.37Å; I323-L327 PolarHBondContact O-N 3.5Å
324	K	77.4	Confident	72.8	Confident	131 Å²	131	94.6 Å²	94.6	57%	0.57	52%	0.515	S	S	*	.	H	α-helix	trans	-65.7	-43.8	178.5	-169.7	175.6	-179.6	-178.7	0	112.3	I320 N321 T322 L327 D328	I320-K324 VanDerWaalsContact O-CB 3.31Å; I320-K324 WeakPolarHBondContact O-CB 3.29Å; I320-K324 PolarHBondContact O-N 2.89Å; N321-K324 PolarHBondContact O-N 3.23Å; T322-K324 VanDerWaalsContact C-N 3.27Å; T322-K324 PolarHBondContact O-N 2.92Å; K324-L327 WeakPolarHBondContact O-CB 3.44Å; K324-L327 PolarHBondContact O-N 2.98Å; K324-D328 PolarHBondContact O-N 3.24Å
325	S	78.2	Confident	74.3	Confident	62 Å²	62	94 Å²	94	43%	0.434	51%	0.51	S	S	.	.	H	α-helix	trans	-58	-49.2	174	-165.2	0	0	0	0	111.2	N321 T322 L327 D328 D329	N321-S325 PolarHBondContact O-N 2.86Å; T322-S325 PolarHBondContact O-N 3.13Å; S325-L327 VanDerWaalsContact C-N 3.27Å; S325-L327 PolarHBondContact O-N 2.87Å; S325-D328 PolarHBondContact O-N 2.86Å; S325-D328 VanDerWaalsContact O-N 3.15Å; S325-D329 PolarHBondContact O-N 3.41Å
326	N	77.9	Confident	75.3	Confident	74 Å²	74	93.2 Å²	93.2	40%	0.396	51%	0.508	S	S	.	.	H	α-helix	trans	-62.2	-34.4	178.2	-65.9	-5.5	0	0	0	112	T322 I323 C330	T322-N326 VanDerWaalsContact O-CG 3.24Å; T322-N326 PolarHBondContact O-N 3.32Å; T322-N326 PolarHBondContact O-OD1 3.04Å; I323-N326 PolarHBondContact O-N 2.87Å; N326-C330 VanDerWaalsContact O-CB 3.3Å; N326-C330 WeakPolarHBondContact O-CB 3.37Å; N326-C330 PolarHBondContact O-N 3.23Å; N326-C330 PolarHBondContact O-SG 3.41Å; N326-C330 VanDerWaalsContact O-SG 3.32Å
327	L	79.9	Confident	76.6	Confident	120 Å²	120	92.3 Å²	92.3	63%	0.628	51%	0.511	S	S	*	.	H	α-helix	trans	-68.5	-40.7	175.6	-160.5	97.4	0	0	0	111.8	I323 K324 S325 R331	I323-L327 WeakPolarHBondContact O-CB 3.37Å; I323-L327 PolarHBondContact O-N 3.5Å; K324-L327 WeakPolarHBondContact O-CB 3.44Å; K324-L327 PolarHBondContact O-N 2.98Å; S325-L327 VanDerWaalsContact C-N 3.27Å; S325-L327 PolarHBondContact O-N 2.87Å; L327-R331 WeakPolarHBondContact O-CB 3.3Å; L327-R331 PolarHBondContact O-N 3Å
328	D	79.3	Confident	77.8	Confident	75 Å²	75	95 Å²	95	40%	0.401	52%	0.521	S	S	.	.	H	α-helix	trans	-67.5	-41.2	175.5	-75.6	-38.1	0	0	0	111.1	K324 S325 R331 V332	K324-D328 PolarHBondContact O-N 3.24Å; S325-D328 PolarHBondContact O-N 2.86Å; S325-D328 VanDerWaalsContact O-N 3.15Å; D328-R331 WeakPolarHBondContact O-CA 3.36Å; D328-R331 WeakPolarHBondContact O-CB 3.34Å; D328-R331 PolarHBondContact O-N 3.16Å; D328-R331 VanDerWaalsContact O-N 3.1Å; D328-V332 WeakPolarHBondContact O-CG2 3.46Å; D328-V332 PolarHBondContact O-N 2.85Å
329	D	78.5	Confident	78.7	Confident	97 Å²	97	93.2 Å²	93.2	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-61.8	-45.7	173	-72	-34.4	0	0	0	111.9	S325 R331 V332 L333	S325-D329 PolarHBondContact O-N 3.41Å; D329-R331 VanDerWaalsContact C-N 3.25Å; D329-R331 PolarHBondContact O-N 2.66Å; D329-V332 PolarHBondContact O-N 2.94Å; D329-L333 WeakPolarHBondContact O-CB 3.48Å; D329-L333 PolarHBondContact O-N 2.66Å
330	C	74.8	Confident	79.1	Confident	77 Å²	77	94.9 Å²	94.9	52%	0.52	52%	0.516	S	S	.	.	H	α-helix	trans	-58.8	-37	171.5	-80.5	0	0	0	0	112	N326 L333 C334	N326-C330 VanDerWaalsContact O-CB 3.3Å; N326-C330 WeakPolarHBondContact O-CB 3.37Å; N326-C330 PolarHBondContact O-N 3.23Å; N326-C330 PolarHBondContact O-SG 3.41Å; N326-C330 VanDerWaalsContact O-SG 3.32Å; C330-L333 PolarHBondContact O-N 3.28Å; C330-C334 WeakPolarHBondContact O-CB 3.35Å; C330-C334 PolarHBondContact O-N 2.92Å; C330-C334 PolarHBondContact O-SG 3.43Å
331	R	78.9	Confident	79.8	Confident	180 Å²	180	95.5 Å²	95.5	68%	0.679	52%	0.519	S	S	*	.	H	α-helix	trans	-68.7	-38.9	177.5	-167.4	179.7	-176.1	-158.9	0.1	111.9	L327 D328 D329 S335	L327-R331 WeakPolarHBondContact O-CB 3.3Å; L327-R331 PolarHBondContact O-N 3Å; D328-R331 WeakPolarHBondContact O-CA 3.36Å; D328-R331 WeakPolarHBondContact O-CB 3.34Å; D328-R331 PolarHBondContact O-N 3.16Å; D328-R331 VanDerWaalsContact O-N 3.1Å; D329-R331 VanDerWaalsContact C-N 3.25Å; D329-R331 PolarHBondContact O-N 2.66Å; R331-S335 WeakPolarHBondContact O-CB 3.41Å; R331-S335 PolarHBondContact O-N 2.81Å; R331-S335 PolarHBondContact O-OG 3.16Å
332	V	80.6	Confident	80.6	Confident	101 Å²	101	96.6 Å²	96.6	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-62.2	-47.6	170.8	173.7	0	0	0	0	110.4	D328 D329 C334 S335 A336	D328-V332 WeakPolarHBondContact O-CG2 3.46Å; D328-V332 PolarHBondContact O-N 2.85Å; D329-V332 PolarHBondContact O-N 2.94Å; V332-C334 PolarHBondContact O-N 3.46Å; V332-S335 WeakPolarHBondContact O-CB 3.38Å; V332-S335 PolarHBondContact O-N 2.78Å; V332-S335 VanDerWaalsContact O-N 3.08Å; V332-A336 PolarHBondContact O-N 2.96Å
333	L	79.3	Confident	81.1	Confident	128 Å²	128	98.1 Å²	98.1	67%	0.67	52%	0.522	S	S	*	.	H	α-helix	trans	-61.4	-43.7	179	-157.7	101.8	0	0	0	112.2	D329 C330 S335 A336 A337	D329-L333 WeakPolarHBondContact O-CB 3.48Å; D329-L333 PolarHBondContact O-N 2.66Å; C330-L333 PolarHBondContact O-N 3.28Å; L333-S335 VanDerWaalsContact C-N 3.27Å; L333-S335 PolarHBondContact O-N 3.41Å; L333-A336 PolarHBondContact O-N 3.38Å; L333-A337 WeakPolarHBondContact O-CB 3.42Å; L333-A337 PolarHBondContact O-N 3.41Å
334	C	82.1	Confident	81.6	Confident	75 Å²	75	98 Å²	98	51%	0.507	52%	0.522	S	S	.	.	H	α-helix	trans	-62.9	-32.7	174	-75.1	0	0	0	0	112.7	C330 V332 K338	C330-C334 WeakPolarHBondContact O-CB 3.35Å; C330-C334 PolarHBondContact O-N 2.92Å; C330-C334 PolarHBondContact O-SG 3.43Å; V332-C334 PolarHBondContact O-N 3.46Å; C334-K338 WeakPolarHBondContact O-CG 3.28Å; C334-K338 PolarHBondContact O-N 2.66Å; C334-K338 VanDerWaalsContact O-N 3.12Å
335	S	83.2	Confident	82	Confident	69 Å²	69	94.4 Å²	94.4	48%	0.483	51%	0.508	S	S	.	.	H	α-helix	trans	-73	-42.9	177.6	-55.6	0	0	0	0	110.9	R331 V332 L333 K338 E339	R331-S335 WeakPolarHBondContact O-CB 3.41Å; R331-S335 PolarHBondContact O-N 2.81Å; R331-S335 PolarHBondContact O-OG 3.16Å; V332-S335 WeakPolarHBondContact O-CB 3.38Å; V332-S335 PolarHBondContact O-N 2.78Å; V332-S335 VanDerWaalsContact O-N 3.08Å; L333-S335 VanDerWaalsContact C-N 3.27Å; L333-S335 PolarHBondContact O-N 3.41Å; S335-K338 PolarHBondContact O-N 2.86Å; S335-E339 PolarHBondContact O-N 3.14Å; S335-E339 VanDerWaalsContact O-N 3.11Å
336	A	81.7	Confident	82.5	Confident	54 Å²	54	97.6 Å²	97.6	45%	0.446	52%	0.517	S	S	.	.	H	α-helix	trans	-61.8	-42.5	172.7	0	0	0	0	0	112.2	V332 L333 K338 E339 L340	V332-A336 PolarHBondContact O-N 2.96Å; L333-A336 PolarHBondContact O-N 3.38Å; A336-K338 VanDerWaalsContact C-N 3.34Å; A336-K338 PolarHBondContact O-N 3.12Å; A336-E339 PolarHBondContact O-N 3.29Å; A336-L340 WeakPolarHBondContact O-CG 3.42Å; A336-L340 PolarHBondContact O-N 3.31Å
337	A	83.5	Confident	82.8	Confident	55 Å²	55	96.7 Å²	96.7	46%	0.455	52%	0.519	S	S	.	.	H	α-helix	trans	-63	-37	176.3	0	0	0	0	0	112.8	L333 L341	L333-A337 WeakPolarHBondContact O-CB 3.42Å; L333-A337 PolarHBondContact O-N 3.41Å; A337-L341 WeakPolarHBondContact O-CB 3.2Å; A337-L341 PolarHBondContact O-N 3.5Å
338	K	85.2	Confident	82.8	Confident	156 Å²	156	93.6 Å²	93.6	68%	0.678	50%	0.501	S	S	*	.	H	α-helix	trans	-66.1	-42.4	174.2	-77.5	175.8	179.2	-176.9	0	112.6	C334 S335 A336 L341 K342	C334-K338 WeakPolarHBondContact O-CG 3.28Å; C334-K338 PolarHBondContact O-N 2.66Å; C334-K338 VanDerWaalsContact O-N 3.12Å; S335-K338 PolarHBondContact O-N 2.86Å; A336-K338 VanDerWaalsContact C-N 3.34Å; A336-K338 PolarHBondContact O-N 3.12Å; K338-L341 PolarHBondContact O-N 3.31Å; K338-K342 PolarHBondContact O-N 3.11Å
339	E	87.2	Confident	83.1	Confident	80 Å²	80	96.2 Å²	96.2	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-68.9	-38.6	178.2	-173.8	57.3	-150.3	0	0	111.6	S335 A336 L341 K342 Q343	S335-E339 PolarHBondContact O-N 3.14Å; S335-E339 VanDerWaalsContact O-N 3.11Å; A336-E339 PolarHBondContact O-N 3.29Å; E339-L341 PolarHBondContact O-N 2.92Å; E339-K342 PolarHBondContact O-N 2.77Å; E339-K342 IonicContact OE1-NZ 3.88Å; E339-K342 PolarHBondContact OE1-NZ 2.96Å; E339-K342 IonicContact OE2-NZ 3.12Å; E339-K342 PolarHBondContact OE2-NZ 2.99Å; E339-Q343 WeakPolarHBondContact O-CG 3.47Å; E339-Q343 PolarHBondContact O-N 2.9Å
340	L	82	Confident	83.4	Confident	103 Å²	103	97.9 Å²	97.9	54%	0.539	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-42.6	171.4	-75.8	175	0	0	0	112.4	A336 K342 Q343 I344	A336-L340 WeakPolarHBondContact O-CG 3.42Å; A336-L340 PolarHBondContact O-N 3.31Å; L340-K342 VanDerWaalsContact C-N 3.32Å; L340-K342 PolarHBondContact O-N 3.11Å; L340-Q343 PolarHBondContact O-N 3.3Å; L340-I344 WeakPolarHBondContact O-CG1 3.45Å; L340-I344 PolarHBondContact O-N 2.94Å
341	L	85.6	Confident	84	Confident	105 Å²	105	98.5 Å²	98.5	55%	0.55	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-41	177	-170.3	69	0	0	0	111.6	A337 K338 E339 I344 D345	A337-L341 WeakPolarHBondContact O-CB 3.2Å; A337-L341 PolarHBondContact O-N 3.5Å; K338-L341 PolarHBondContact O-N 3.31Å; E339-L341 PolarHBondContact O-N 2.92Å; L341-I344 PolarHBondContact O-N 3.27Å; L341-D345 PolarHBondContact O-N 3.3Å
342	K	88	Confident	84.3	Confident	110 Å²	110	93 Å²	93	48%	0.478	50%	0.499	S	S	.	.	H	α-helix	trans	-62.9	-41.8	175	174.1	178.1	149.5	-115.9	0	112.5	K338 E339 L340 I344 D345 E346	K338-K342 PolarHBondContact O-N 3.11Å; E339-K342 PolarHBondContact O-N 2.77Å; E339-K342 IonicContact OE1-NZ 3.88Å; E339-K342 PolarHBondContact OE1-NZ 2.96Å; E339-K342 IonicContact OE2-NZ 3.12Å; E339-K342 PolarHBondContact OE2-NZ 2.99Å; L340-K342 VanDerWaalsContact C-N 3.32Å; L340-K342 PolarHBondContact O-N 3.11Å; K342-I344 VanDerWaalsContact C-N 3.3Å; K342-I344 PolarHBondContact O-N 3.05Å; K342-D345 PolarHBondContact O-N 3.36Å; K342-E346 WeakPolarHBondContact O-CB 3.49Å; K342-E346 PolarHBondContact O-N 3.44Å
343	Q	85.2	Confident	84.3	Confident	103 Å²	103	90.4 Å²	90.4	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-64.4	-34.2	174.7	-71.1	174.8	17.6	0	0	112.3	E339 L340 A347	E339-Q343 WeakPolarHBondContact O-CG 3.47Å; E339-Q343 PolarHBondContact O-N 2.9Å; L340-Q343 PolarHBondContact O-N 3.3Å; Q343-A347 WeakPolarHBondContact O-CB 3.38Å; Q343-A347 PolarHBondContact O-N 3.12Å
344	I	84.9	Confident	84.4	Confident	104 Å²	104	87.9 Å²	87.9	53%	0.533	47%	0.474	S	S	.	.	H	α-helix	trans	-68	-45.8	174.1	-67.9	164.3	0	0	0	110.9	L340 L341 K342 E346 A347 E348	L340-I344 WeakPolarHBondContact O-CG1 3.45Å; L340-I344 PolarHBondContact O-N 2.94Å; L341-I344 PolarHBondContact O-N 3.27Å; K342-I344 VanDerWaalsContact C-N 3.3Å; K342-I344 PolarHBondContact O-N 3.05Å; I344-E346 VanDerWaalsContact C-N 3.31Å; I344-E346 PolarHBondContact O-N 3Å; I344-A347 PolarHBondContact O-N 2.98Å; I344-E348 WeakPolarHBondContact O-CB 3.33Å; I344-E348 PolarHBondContact O-N 3.35Å
345	D	85.8	Confident	84.3	Confident	55 Å²	55	91.1 Å²	91.1	29%	0.294	48%	0.476	S	S	.	.	H	α-helix	trans	-62.9	-35.8	176	-81.5	-45.6	0	0	0	111.9	L341 K342 L349 R456	L341-D345 PolarHBondContact O-N 3.3Å; K342-D345 PolarHBondContact O-N 3.36Å; D345-L349 WeakPolarHBondContact O-CG 3.23Å; D345-L349 PolarHBondContact O-N 3.47Å; D345-R456 IonicContact OD1-CZ 3.72Å; D345-R456 VanDerWaalsContact OD1-CZ 3.3Å; D345-R456 IonicContact OD1-NH1 2.62Å; D345-R456 PolarHBondContact OD1-NH1 2.6Å; D345-R456 IonicContact OD1-NH2 2.66Å; D345-R456 PolarHBondContact OD1-NH2 3.25Å
346	E	88.7	Confident	84	Confident	129 Å²	129	93.4 Å²	93.4	60%	0.603	48%	0.479	S	S	*	.	H	α-helix	trans	-68	-44.7	174.5	-175.1	165.8	-162.8	0	0	112.2	K342 I344 E348 L349 E350	K342-E346 WeakPolarHBondContact O-CB 3.49Å; K342-E346 PolarHBondContact O-N 3.44Å; I344-E346 VanDerWaalsContact C-N 3.31Å; I344-E346 PolarHBondContact O-N 3Å; E346-E348 VanDerWaalsContact C-N 3.34Å; E346-E348 PolarHBondContact O-N 3.17Å; E346-L349 WeakPolarHBondContact O-CB 3.44Å; E346-L349 PolarHBondContact O-N 2.87Å; E346-E350 PolarHBondContact O-N 3.4Å
347	A	83.8	Confident	83.7	Confident	54 Å²	54	100.2 Å²	100.2	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-36.6	174.6	0	0	0	0	0	112.5	Q343 I344 L349 E350 E351	Q343-A347 WeakPolarHBondContact O-CB 3.38Å; Q343-A347 PolarHBondContact O-N 3.12Å; I344-A347 PolarHBondContact O-N 2.98Å; A347-L349 VanDerWaalsContact C-N 3.34Å; A347-E350 PolarHBondContact O-N 2.95Å; A347-E351 WeakPolarHBondContact O-CB 3.23Å; A347-E351 PolarHBondContact O-N 3.44Å
348	E	81.2	Confident	83.3	Confident	56 Å²	56	105.2 Å²	105.2	26%	0.262	50%	0.5	S	S	.	.	H	α-helix	trans	-67.4	-34.4	174.3	-171.7	-176.9	148.8	0	0	111.6	I344 E346 N352 R456	I344-E348 WeakPolarHBondContact O-CB 3.33Å; I344-E348 PolarHBondContact O-N 3.35Å; E346-E348 VanDerWaalsContact C-N 3.34Å; E346-E348 PolarHBondContact O-N 3.17Å; E348-N352 VanDerWaalsContact O-CB 3.29Å; E348-N352 WeakPolarHBondContact O-CB 3.48Å; E348-N352 PolarHBondContact O-N 2.88Å; E348-N352 PolarHBondContact O-ND2 2.88Å; E348-R456 IonicContact OE1-NH2 2.77Å; E348-R456 PolarHBondContact OE1-NH2 2.93Å; E348-R456 IonicContact OE2-CZ 2.78Å; E348-R456 IonicContact OE2-NE 2.79Å; E348-R456 IonicContact OE2-NH2 2.9Å; E348-R456 PolarHBondContact OE2-NH2 3.15Å
349	L	84.8	Confident	82.8	Confident	129 Å²	129	99.8 Å²	99.8	68%	0.675	49%	0.485	S	S	*	.	H	α-helix	trans	-67	-42.4	172.2	-76.6	172.9	0	0	0	112	D345 E346 A347 N352 A353	D345-L349 WeakPolarHBondContact O-CG 3.23Å; D345-L349 PolarHBondContact O-N 3.47Å; E346-L349 WeakPolarHBondContact O-CB 3.44Å; E346-L349 PolarHBondContact O-N 2.87Å; A347-L349 VanDerWaalsContact C-N 3.34Å; L349-N352 PolarHBondContact O-N 3.17Å; L349-A353 WeakPolarHBondContact O-CB 3.22Å; L349-A353 PolarHBondContact O-N 3.43Å
350	E	85.6	Confident	82	Confident	132 Å²	132	100.6 Å²	100.6	62%	0.617	49%	0.492	S	S	*	.	H	α-helix	trans	-63.1	-46.7	174	-169.1	-174.8	179.6	0	0	111.1	E346 A347 N352 A353 I354	E346-E350 PolarHBondContact O-N 3.4Å; A347-E350 PolarHBondContact O-N 2.95Å; E350-N352 PolarHBondContact O-N 3.27Å; E350-A353 WeakPolarHBondContact O-CB 3Å; E350-A353 PolarHBondContact O-N 3.01Å; E350-A353 VanDerWaalsContact O-N 3.12Å; E350-I354 HydrophobicContact CG-CD1 4.06Å; E350-I354 WeakPolarHBondContact O-CG1 3.45Å; E350-I354 PolarHBondContact O-N 3.13Å
351	E	86.8	Confident	81.5	Confident	90 Å²	90	102 Å²	102	42%	0.421	49%	0.493	S	S	.	.	H	α-helix	trans	-61.2	-44	178.6	-157.2	-155	155.9	0	0	111.3	A347 A353 I354 R355	A347-E351 WeakPolarHBondContact O-CB 3.23Å; A347-E351 PolarHBondContact O-N 3.44Å; E351-A353 VanDerWaalsContact C-N 3.33Å; E351-A353 PolarHBondContact O-N 2.88Å; E351-I354 PolarHBondContact O-N 2.86Å; E351-R355 WeakPolarHBondContact O-CB 3.46Å; E351-R355 VanDerWaalsContact O-CG 3.29Å; E351-R355 WeakPolarHBondContact O-CG 3.24Å; E351-R355 PolarHBondContact O-N 3.04Å; E351-R355 IonicContact OE1-CZ 3.82Å; E351-R355 IonicContact OE1-NE 3.55Å; E351-R355 PolarHBondContact OE1-NE 2.99Å; E351-R355 IonicContact OE1-NH2 3.3Å; E351-R355 PolarHBondContact OE1-NH2 3.28Å; E351-R355 IonicContact OE2-NH2 2.66Å; E351-R355 PolarHBondContact OE2-NH2 3.33Å
352	N	84.9	Confident	80.2	Confident	65 Å²	65	101.4 Å²	101.4	35%	0.348	49%	0.49	S	S	.	.	H	α-helix	trans	-63.5	-37.7	174.7	-80.8	-54.2	0	0	0	112.2	E348 L349 E350 R355 Q356	E348-N352 VanDerWaalsContact O-CB 3.29Å; E348-N352 WeakPolarHBondContact O-CB 3.48Å; E348-N352 PolarHBondContact O-N 2.88Å; E348-N352 PolarHBondContact O-ND2 2.88Å; L349-N352 PolarHBondContact O-N 3.17Å; E350-N352 PolarHBondContact O-N 3.27Å; N352-R355 PolarHBondContact O-N 2.74Å; N352-Q356 WeakPolarHBondContact O-CB 3.33Å; N352-Q356 VanDerWaalsContact O-CG 3.25Å; N352-Q356 WeakPolarHBondContact O-CG 3.3Å; N352-Q356 PolarHBondContact O-N 3.41Å
353	A	81.9	Confident	78.8	Confident	47 Å²	47	99.7 Å²	99.7	39%	0.388	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-39.4	174	0	0	0	0	0	111.9	L349 E350 E351 Q356 R357	L349-A353 WeakPolarHBondContact O-CB 3.22Å; L349-A353 PolarHBondContact O-N 3.43Å; E350-A353 WeakPolarHBondContact O-CB 3Å; E350-A353 PolarHBondContact O-N 3.01Å; E350-A353 VanDerWaalsContact O-N 3.12Å; E351-A353 VanDerWaalsContact C-N 3.33Å; E351-A353 PolarHBondContact O-N 2.88Å; A353-Q356 PolarHBondContact O-N 2.86Å; A353-R357 WeakPolarHBondContact O-CG 3.45Å; A353-R357 PolarHBondContact O-N 3.43Å
354	I	79.7	Confident	77	Confident	74 Å²	74	103.1 Å²	103.1	38%	0.379	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-49.9	173	-69.5	166.6	0	0	0	110.2	E350 E351 Q356 R357 W358	E350-I354 HydrophobicContact CG-CD1 4.06Å; E350-I354 WeakPolarHBondContact O-CG1 3.45Å; E350-I354 PolarHBondContact O-N 3.13Å; E351-I354 PolarHBondContact O-N 2.86Å; I354-Q356 VanDerWaalsContact C-N 3.31Å; I354-Q356 PolarHBondContact O-N 3.49Å; I354-R357 WeakPolarHBondContact O-CB 3.22Å; I354-R357 PolarHBondContact O-N 2.97Å; I354-R357 VanDerWaalsContact O-N 3.08Å; I354-W358 PolarHBondContact O-N 2.83Å
355	R	81	Confident	75.6	Confident	143 Å²	143	102.2 Å²	102.2	54%	0.54	49%	0.494	S	S	.	.	H	α-helix	trans	-55.8	-42.7	176.3	-71.7	173.8	-179.7	-156.9	6.3	111.9	E351 N352 W358 A359	E351-R355 WeakPolarHBondContact O-CB 3.46Å; E351-R355 VanDerWaalsContact O-CG 3.29Å; E351-R355 WeakPolarHBondContact O-CG 3.24Å; E351-R355 PolarHBondContact O-N 3.04Å; E351-R355 IonicContact OE1-CZ 3.82Å; E351-R355 IonicContact OE1-NE 3.55Å; E351-R355 PolarHBondContact OE1-NE 2.99Å; E351-R355 IonicContact OE1-NH2 3.3Å; E351-R355 PolarHBondContact OE1-NH2 3.28Å; E351-R355 IonicContact OE2-NH2 2.66Å; E351-R355 PolarHBondContact OE2-NH2 3.33Å; N352-R355 PolarHBondContact O-N 2.74Å; R355-W358 PolarHBondContact O-N 3.32Å; R355-A359 WeakPolarHBondContact O-CB 3.42Å; R355-A359 PolarHBondContact O-N 3.36Å
356	Q	76	Confident	73.8	Confident	118 Å²	118	104.9 Å²	104.9	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-41	174.6	-72.6	-68	-17.2	0	0	112.6	N352 A353 I354 W358 A359 N360	N352-Q356 WeakPolarHBondContact O-CB 3.33Å; N352-Q356 VanDerWaalsContact O-CG 3.25Å; N352-Q356 WeakPolarHBondContact O-CG 3.3Å; N352-Q356 PolarHBondContact O-N 3.41Å; A353-Q356 PolarHBondContact O-N 2.86Å; I354-Q356 VanDerWaalsContact C-N 3.31Å; I354-Q356 PolarHBondContact O-N 3.49Å; Q356-W358 VanDerWaalsContact C-N 3.34Å; Q356-W358 PolarHBondContact O-N 2.93Å; Q356-A359 PolarHBondContact O-N 2.89Å; Q356-N360 WeakPolarHBondContact O-CB 3.4Å; Q356-N360 VanDerWaalsContact O-CG 3.26Å; Q356-N360 PolarHBondContact O-N 3.45Å; Q356-N360 PolarHBondContact O-ND2 2.89Å
357	R	75.8	Confident	71.7	Confident	196 Å²	196	102.6 Å²	102.6	74%	0.74	50%	0.497	S	S	*	.	H	α-helix	trans	-61.5	-40.7	173	-71.7	174.2	-171	-138	7.2	111.9	A353 I354 K361	A353-R357 WeakPolarHBondContact O-CG 3.45Å; A353-R357 PolarHBondContact O-N 3.43Å; I354-R357 WeakPolarHBondContact O-CB 3.22Å; I354-R357 PolarHBondContact O-N 2.97Å; I354-R357 VanDerWaalsContact O-N 3.08Å; R357-K361 WeakPolarHBondContact O-CB 3.27Å; R357-K361 PolarHBondContact O-N 2.86Å
358	W	76.2	Confident	70	Confident	160 Å²	160	104.1 Å²	104.1	61%	0.606	50%	0.497	S	S	*	.	H	α-helix	trans	-67.5	-43.9	175.2	-78.3	104.1	0	0	0	112.6	I354 R355 Q356 N360 K361 L362	I354-W358 PolarHBondContact O-N 2.83Å; R355-W358 PolarHBondContact O-N 3.32Å; Q356-W358 VanDerWaalsContact C-N 3.34Å; Q356-W358 PolarHBondContact O-N 2.93Å; W358-N360 PolarHBondContact O-N 3.28Å; W358-K361 PolarHBondContact O-N 2.78Å; W358-L362 WeakPolarHBondContact O-CG 3.42Å; W358-L362 PolarHBondContact O-N 3.02Å
359	A	73.3	Confident	68.3	Low	43 Å²	43	109.1 Å²	109.1	36%	0.355	51%	0.514	S	S	.	.	H	α-helix	trans	-58.5	-46.5	175.2	0	0	0	0	0	111.6	R355 Q356 K361 L362 T363	R355-A359 WeakPolarHBondContact O-CB 3.42Å; R355-A359 PolarHBondContact O-N 3.36Å; Q356-A359 PolarHBondContact O-N 2.89Å; A359-K361 VanDerWaalsContact C-N 3.31Å; A359-K361 PolarHBondContact O-N 3.26Å; A359-L362 PolarHBondContact O-N 2.62Å; A359-T363 PolarHBondContact O-N 3.47Å; A359-T363 PolarHBondContact O-OG1 2.87Å
360	N	70.5	Confident	66.3	Low	97 Å²	97	109.4 Å²	109.4	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-65.9	-30.8	176.7	-70.8	-24.1	0	0	0	113.3	Q356 W358 T363 Y364	Q356-N360 WeakPolarHBondContact O-CB 3.4Å; Q356-N360 VanDerWaalsContact O-CG 3.26Å; Q356-N360 PolarHBondContact O-N 3.45Å; Q356-N360 PolarHBondContact O-ND2 2.89Å; W358-N360 PolarHBondContact O-N 3.28Å; N360-T363 WeakPolarHBondContact CA-OG1 3.49Å; N360-T363 PolarHBondContact O-OG1 2.89Å; N360-Y364 PolarHBondContact O-N 3.48Å
361	K	71	Confident	64.2	Low	131 Å²	131	108.9 Å²	108.9	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-73.5	-36.3	174.2	-168.5	172.7	-176.7	179	0	111.8	R357 W358 A359 I365	R357-K361 WeakPolarHBondContact O-CB 3.27Å; R357-K361 PolarHBondContact O-N 2.86Å; W358-K361 PolarHBondContact O-N 2.78Å; A359-K361 VanDerWaalsContact C-N 3.31Å; A359-K361 PolarHBondContact O-N 3.26Å; K361-I365 WeakPolarHBondContact O-CD1 3.29Å; K361-I365 WeakPolarHBondContact O-CG1 3.49Å; K361-I365 PolarHBondContact O-N 2.84Å
362	L	59.5	Low	62	Low	93 Å²	93	110.2 Å²	110.2	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-69.2	-41.1	174.8	-72.6	168.9	0	0	0	112	W358 A359 Y364 I365 H366	W358-L362 WeakPolarHBondContact O-CG 3.42Å; W358-L362 PolarHBondContact O-N 3.02Å; A359-L362 PolarHBondContact O-N 2.62Å; L362-Y364 VanDerWaalsContact C-N 3.32Å; L362-Y364 PolarHBondContact O-N 3.06Å; L362-I365 PolarHBondContact O-N 3.18Å; L362-H366 PolarHBondContact O-CD2 3.22Å; L362-H366 PolarHBondContact O-N 3.42Å
363	T	58	Low	59.8	Low	74 Å²	74	113.8 Å²	113.8	45%	0.454	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-39.4	174.8	49.9	0	0	0	0	111.9	A359 N360 I365 H366 D367	A359-T363 PolarHBondContact O-N 3.47Å; A359-T363 PolarHBondContact O-OG1 2.87Å; N360-T363 WeakPolarHBondContact CA-OG1 3.49Å; N360-T363 PolarHBondContact O-OG1 2.89Å; T363-I365 PolarHBondContact O-N 3.07Å; T363-H366 CarbonylContact O-C 3.58Å; T363-H366 PolarHBondContact O-N 2.79Å; T363-D367 PolarHBondContact O-N 2.87Å
364	Y	48.7	Very low	57.7	Low	176 Å²	176	117.9 Å²	117.9	69%	0.69	55%	0.554	S	S	*	*	H	α-helix	trans	-56.6	-46.6	172.3	-124.7	-86.3	0	0	0	112.4	N360 L362 H366 D367 D368	N360-Y364 PolarHBondContact O-N 3.48Å; L362-Y364 VanDerWaalsContact C-N 3.32Å; L362-Y364 PolarHBondContact O-N 3.06Å; Y364-H366 PolarHBondContact O-N 3.28Å; Y364-D367 PolarHBondContact O-N 3.33Å; Y364-D368 PolarHBondContact O-N 2.93Å; Y364-D368 VanDerWaalsContact O-N 3.08Å
365	I	55.2	Low	55.4	Low	85 Å²	85	122.1 Å²	122.1	44%	0.436	57%	0.57	S	S	.	*	H	α-helix	trans	-63.4	-29.3	176.5	-65.1	162.8	0	0	0	111.9	K361 L362 T363	K361-I365 WeakPolarHBondContact O-CD1 3.29Å; K361-I365 WeakPolarHBondContact O-CG1 3.49Å; K361-I365 PolarHBondContact O-N 2.84Å; L362-I365 PolarHBondContact O-N 3.18Å; T363-I365 PolarHBondContact O-N 3.07Å
366	H	46.6	Very low	53.1	Low	110 Å²	110	120.5 Å²	120.5	51%	0.509	58%	0.581	S	S	.	*	H	α-helix	trans	-80.6	-32.5	176.8	-77.7	-64.7	0	0	0	113.8	L362 T363 Y364 R369 K370	L362-H366 PolarHBondContact O-CD2 3.22Å; L362-H366 PolarHBondContact O-N 3.42Å; T363-H366 CarbonylContact O-C 3.58Å; T363-H366 PolarHBondContact O-N 2.79Å; Y364-H366 PolarHBondContact O-N 3.28Å; H366-R369 PolarHBondContact O-N 3.45Å; H366-K370 PolarHBondContact O-N 2.97Å
367	D	46	Very low	51.1	Low	82 Å²	82	122.6 Å²	122.6	44%	0.439	60%	0.595	S	S	.	*	H	α-helix	trans	-75.6	-32.6	175.3	-77.5	-34.9	0	0	0	112.1	T363 Y364 R369 K370 L371	T363-D367 PolarHBondContact O-N 2.87Å; Y364-D367 PolarHBondContact O-N 3.33Å; D367-R369 PolarHBondContact O-N 3.31Å; D367-K370 WeakPolarHBondContact O-CB 3.4Å; D367-K370 PolarHBondContact O-N 2.78Å; D367-K370 WeakPolarHBondContact OD1-CE 3.42Å; D367-K370 IonicContact OD1-NZ 2.72Å; D367-K370 PolarHBondContact OD1-NZ 3.28Å; D367-L371 PolarHBondContact O-N 2.95Å
368	D	46.5	Very low	49	Very low	86 Å²	86	119.2 Å²	119.2	46%	0.46	60%	0.596	S	S	.	*	H	α-helix	trans	-57.9	-35.6	167.9	-79.1	-21.8	0	0	0	112	Y364 K370 L371 L372	Y364-D368 PolarHBondContact O-N 2.93Å; Y364-D368 VanDerWaalsContact O-N 3.08Å; D368-K370 VanDerWaalsContact C-N 3.28Å; D368-K370 PolarHBondContact O-N 2.96Å; D368-L371 PolarHBondContact O-N 3.34Å; D368-L372 PolarHBondContact O-N 3.46Å
369	R	45.6	Very low	46.9	Very low	160 Å²	160	120.5 Å²	120.5	60%	0.604	61%	0.606	S	S	*	*	H	α-helix	trans	-67.4	-24.4	174	-74.1	-173.8	179.5	-166.7	1.7	113.6	H366 D367 L372 N373	H366-R369 PolarHBondContact O-N 3.45Å; D367-R369 PolarHBondContact O-N 3.31Å; R369-L372 PolarHBondContact O-N 2.98Å; R369-N373 PolarHBondContact O-N 2.96Å
370	K	44.2	Very low	45	Very low	136 Å²	136	127.5 Å²	127.5	59%	0.591	63%	0.628	S	S	*	*	H	α-helix	trans	-71.4	-31.8	172.6	-70.1	177.9	-173.7	150.9	0	111.9	H366 D367 D368	H366-K370 PolarHBondContact O-N 2.97Å; D367-K370 WeakPolarHBondContact O-CB 3.4Å; D367-K370 PolarHBondContact O-N 2.78Å; D367-K370 WeakPolarHBondContact OD1-CE 3.42Å; D367-K370 IonicContact OD1-NZ 2.72Å; D367-K370 PolarHBondContact OD1-NZ 3.28Å; D368-K370 VanDerWaalsContact C-N 3.28Å; D368-K370 PolarHBondContact O-N 2.96Å
371	L	40.5	Very low	43.1	Very low	120 Å²	120	129.6 Å²	129.6	63%	0.628	64%	0.64	S	S	*	*	H	α-helix	trans	-68.8	-39	173.1	-71	170.3	0	0	0	111.8	D367 D368 N373 N374	D367-L371 PolarHBondContact O-N 2.95Å; D368-L371 PolarHBondContact O-N 3.34Å; L371-N373 VanDerWaalsContact C-N 3.34Å; L371-N373 PolarHBondContact O-N 3.03Å; L371-N374 PolarHBondContact O-N 3.24Å
372	L	40.8	Very low	41.2	Very low	118 Å²	118	131.7 Å²	131.7	62%	0.618	66%	0.657	S	S	*	*	H	α-helix	trans	-64.7	-31.4	176.6	-89.2	139.4	0	0	0	114.1	D368 R369 N374 F375	D368-L372 PolarHBondContact O-N 3.46Å; R369-L372 PolarHBondContact O-N 2.98Å; L372-N374 PolarHBondContact O-N 3.4Å; L372-F375 PolarHBondContact O-N 2.69Å
373	N	39.9	Very low	39.9	Very low	141 Å²	141	131.7 Å²	131.7	75%	0.754	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-10.9	178.2	-79.5	-12.4	0	0	0	114.4	R369 L371	R369-N373 PolarHBondContact O-N 2.96Å; L371-N373 VanDerWaalsContact C-N 3.34Å; L371-N373 PolarHBondContact O-N 3.03Å
374	N	35.8	Very low	38.6	Very low	132 Å²	132	135.8 Å²	135.8	71%	0.706	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-2.3	176.7	-72	-22	0	0	0	113.8	L371 L372 S376	L371-N374 PolarHBondContact O-N 3.24Å; L372-N374 PolarHBondContact O-N 3.4Å; N374-S376 PolarHBondContact O-N 2.87Å
375	F	32	Very low	37.8	Very low	164 Å²	164	133.2 Å²	133.2	72%	0.719	69%	0.688	S	S	*	*	S	Bend	trans	-78.2	107.2	170.1	-84.1	-83.9	0	0	0	110.5	L372 L377	L372-F375 PolarHBondContact O-N 2.69Å; F375-L377 PolarHBondContact O-N 3.15Å; F375-L377 VanDerWaalsContact O-N 3.15Å
376	S	33.4	Very low	36.8	Very low	109 Å²	109	138.4 Å²	138.4	76%	0.762	71%	0.708	S	S	*	*			trans	-57	117.5	175.5	-53.6	0	0	0	0	110.7	N374 T378	N374-S376 PolarHBondContact O-N 2.87Å; S376-T378 VanDerWaalsContact C-N 3.31Å; S376-T378 PolarHBondContact O-N 3.21Å
377	L	33.9	Very low	36	Very low	162 Å²	162	142 Å²	142	85%	0.848	73%	0.725	S	S	*	*			trans	-69.5	82.7	-177.4	-139.7	89.3	0	0	0	110.9	F375 K379	F375-L377 PolarHBondContact O-N 3.15Å; F375-L377 VanDerWaalsContact O-N 3.15Å; L377-K379 PolarHBondContact O-N 3.01Å
378	T	31.3	Very low	34.9	Very low	124 Å²	124	149.3 Å²	149.3	76%	0.761	75%	0.748	S	S	*	*			trans	-70.1	100.1	169.1	49	0	0	0	0	108.6	S376 K380	S376-T378 VanDerWaalsContact C-N 3.31Å; S376-T378 PolarHBondContact O-N 3.21Å; T378-K380 PolarHBondContact O-N 3.39Å; T378-K380 VanDerWaalsContact O-N 3.09Å
379	K	32.7	Very low	34.1	Very low	188 Å²	188	154.6 Å²	154.6	82%	0.817	77%	0.766	S	S	*	*			trans	-56.1	114.3	171.5	-65.7	-168.6	176.8	-170	0	109.2	L377	L377-K379 PolarHBondContact O-N 3.01Å
380	K	32.1	Very low	33	Very low	189 Å²	189	151.7 Å²	151.7	82%	0.822	77%	0.771	S	S	*	*			trans	-105.6	136.2	156.2	-88.7	-171.1	169.6	-176.9	0	107.5	T378 D382	T378-K380 PolarHBondContact O-N 3.39Å; T378-K380 VanDerWaalsContact O-N 3.09Å; K380-D382 PolarHBondContact O-N 3.47Å
381	D	31.3	Very low	32.1	Very low	142 Å²	142	152.2 Å²	152.2	76%	0.759	78%	0.78	S	S	*	*			trans	-69.6	122.1	-166.1	-56.8	-76.8	0	0	0	113.2	S383	D381-S383 VanDerWaalsContact C-N 3.35Å; D381-S383 PolarHBondContact O-N 3.41Å; D381-S383 PolarHBondContact O-OG 2.89Å
382	D	32.1	Very low	31.4	Very low	174 Å²	174	152.6 Å²	152.6	93%	0.93	79%	0.787	S	S	*	*			trans	-63.2	91.2	170.7	-75.1	-49.1	0	0	0	110.3	K380	K380-D382 PolarHBondContact O-N 3.47Å
383	S	32.5	Very low	30.6	Very low	93 Å²	93	154.4 Å²	154.4	65%	0.65	80%	0.797	S	S	*	*			trans	-129.8	16	-178.3	53.1	0	0	0	0	113.9	D381	D381-S383 VanDerWaalsContact C-N 3.35Å; D381-S383 PolarHBondContact O-N 3.41Å; D381-S383 PolarHBondContact O-OG 2.89Å
384	I	30.8	Very low	29.9	Very low	161 Å²	161	153.4 Å²	153.4	83%	0.826	80%	0.801	S	S	*	*			trans	-132.2	79.6	166.7	-49.5	87.3	0	0	0	111.4
385	C	30.9	Very low	29.3	Very low	121 Å²	121	154.8 Å²	154.8	82%	0.818	81%	0.807	S	S	*	*			trans	-150.2	75.1	148.1	-164.6	0	0	0	0	109.2	H387	C385-H387 PolarHBondContact O-N 3.39Å
386	K	33.9	Very low	29.4	Very low	194 Å²	194	152.2 Å²	152.2	84%	0.843	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-65.9	132.5	176.7	-74.9	-169	174.6	-174.9	0	110	Y388	K386-Y388 PolarHBondContact O-N 2.95Å
387	H	30.9	Very low	29.1	Very low	186 Å²	186	155.3 Å²	155.3	86%	0.861	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-52.6	131.6	-179.8	-74.1	-95.8	0	0	0	112.5	C385 K389	C385-H387 PolarHBondContact O-N 3.39Å; H387-K389 PolarHBondContact O-N 2.92Å
388	Y	22.8	Very low	28.6	Very low	236 Å²	236	152.6 Å²	152.6	93%	0.925	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-64.6	117.9	150.9	-83.7	-101.3	0	0	0	107.9	K386	K386-Y388 PolarHBondContact O-N 2.95Å
389	K	28.6	Very low	28.3	Very low	196 Å²	196	154.5 Å²	154.5	85%	0.852	80%	0.799	S	S	*	*			trans	-138.6	115.9	155.7	-141.4	179.9	-174	-173.6	0	108.3	H387	H387-K389 PolarHBondContact O-N 2.92Å
390	S	23.3	Very low	28.1	Very low	100 Å²	100	151.4 Å²	151.4	70%	0.699	80%	0.801	S	S	*	*			trans	-60	130.8	170.1	-42.7	0	0	0	0	108.9
391	D	23.9	Very low	27.7	Very low	147 Å²	147	151.2 Å²	151.2	79%	0.786	80%	0.803	S	S	*	*				167.3	150.9	109.1	-85.5	-20.3	0	0	0	113.2
392	V	26.1	Very low	27.5	Very low	128 Å²	128	152.8 Å²	152.8	78%	0.776	81%	0.81	S	S	*	*			trans	61.7	101.3	164.1	-177.6	0	0	0	0	118.4
393	L	23.7	Very low	27.2	Very low	156 Å²	156	152.8 Å²	152.8	82%	0.817	81%	0.805	S	S	*	*			trans	1.9	119.2	138.8	-66.5	160.6	0	0	0	117.5
394	S	26.7	Very low	27.2	Very low	120 Å²	120	153.5 Å²	153.5	84%	0.839	81%	0.807	S	S	*	*			trans	-141.8	130.4	149.1	-77.2	0	0	0	0	109.9
395	L	23.4	Very low	26.8	Very low	161 Å²	161	152.8 Å²	152.8	84%	0.843	81%	0.805	S	S	*	*			trans	-73.2	168.1	-175.7	-114.2	71.8	0	0	0	111.8
396	P	34.3	Very low	26.6	Very low	110 Å²	110	154.6 Å²	154.6	71%	0.714	81%	0.807	S	S	*	*			trans	-86.4	149.7	-150.8	35	-37.9	0	0	0	113.3
397	N	26.3	Very low	26.2	Very low	173 Å²	173	155.4 Å²	155.4	93%	0.925	81%	0.81	S	S	*	*			trans	-95.4	106.9	163	-143.6	11.8	0	0	0	109.4
398	D	23.9	Very low	26.1	Very low	105 Å²	105	151.8 Å²	151.8	56%	0.561	81%	0.806	S	S	*	*			trans	-75.9	145.6	-179.6	-137.8	-13.3	0	0	0	110.2
399	K	24.4	Very low	26.1	Very low	165 Å²	165	148.3 Å²	148.3	72%	0.717	80%	0.803	S	S	*	*			trans	36.4	114.8	153.4	-59.5	149.5	-169.4	145.5	0	118.9
400	S	27.9	Very low	26.1	Very low	122 Å²	122	146.3 Å²	146.3	85%	0.853	80%	0.799	S	S	*	*				179.7	142	103.8	44.2	0	0	0	0	114
401	Q	24.7	Very low	26.1	Very low	185 Å²	185	152 Å²	152	86%	0.864	81%	0.806	S	S	*	*			trans	-48	136.1	166.6	-63.1	164	-9.6	0	0	113.6
402	L	27	Very low	26	Very low	175 Å²	175	149.8 Å²	149.8	92%	0.916	80%	0.802	S	S	*	*			trans	-143.3	131.7	143	-105	129	0	0	0	109.4
403	Q	25.4	Very low	26.1	Very low	175 Å²	175	151.4 Å²	151.4	82%	0.818	81%	0.806	S	S	*	*			trans	-78.6	153	-176.3	-79.9	-87.3	-14.5	0	0	111.4
404	P	31.5	Very low	26	Very low	108 Å²	108	151 Å²	151	70%	0.701	81%	0.81	S	S	*	*			trans	-90.4	117.9	179.3	34	-29.9	0	0	0	112
405	N	22.7	Very low	26.1	Very low	145 Å²	145	150.4 Å²	150.4	78%	0.775	81%	0.806	S	S	*	*			trans	-149.4	117.7	162	-88.5	-31	0	0	0	108.3
406	D	27	Very low	26.1	Very low	160 Å²	160	148.6 Å²	148.6	86%	0.856	80%	0.802	S	S	*	*				179.8	158.4	98	-97.4	-31.9	0	0	0	113
407	K	25.5	Very low	25.7	Very low	210 Å²	210	153.4 Å²	153.4	91%	0.913	81%	0.812	S	S	*	*			trans	-116.5	121.8	178.8	-65.2	173	-179	172.4	0	110.5
408	S	29.9	Very low	25.5	Very low	110 Å²	110	153.6 Å²	153.6	77%	0.769	81%	0.807	S	S	*	*			trans	-152.8	109.2	160.5	55.6	0	0	0	0	107.9
409	L	22.3	Very low	25.5	Very low	164 Å²	164	157.6 Å²	157.6	86%	0.859	82%	0.82	S	S	*	*				59.7	107.7	69	-166.1	81	0	0	0	112.7
410	I	28.2	Very low	25.5	Very low	153 Å²	153	155.6 Å²	155.6	79%	0.785	82%	0.824	S	S	*	*			trans	-177.2	129.7	139.1	-95.1	152.1	0	0	0	110.7
411	R	22.5	Very low	25.5	Very low	221 Å²	221	158.9 Å²	158.9	83%	0.834	82%	0.823	S	S	*	*			trans	50.2	122.6	155.7	-71.7	178.1	173.7	151.5	-1	120.5
412	S	23.5	Very low	25.6	Very low	100 Å²	100	157.3 Å²	157.3	70%	0.699	82%	0.82	S	S	*	*				83.1	113.6	59.5	-63.2	0	0	0	0	112.7
413	D	26.9	Very low	25.6	Very low	162 Å²	162	157.5 Å²	157.5	87%	0.866	82%	0.816	S	S	*	*				-167.8	130.4	109.7	-88.2	-19.3	0	0	0	111.5
414	T	23	Very low	25.8	Very low	148 Å²	148	154 Å²	154	91%	0.908	82%	0.817	S	S	*	*			trans	-108.5	108.8	172.7	35.1	0	0	0	0	109.6
415	S	27.9	Very low	25.7	Very low	107 Å²	107	158.4 Å²	158.4	75%	0.748	82%	0.821	S	S	*	*			trans	-140.8	101.4	164.1	64.2	0	0	0	0	111.5
416	T	23	Very low	26	Very low	123 Å²	123	156.2 Å²	156.2	76%	0.755	82%	0.818	S	S	*	*			trans	2.7	121.8	143.6	-50.5	0	0	0	0	117.3
417	F	26.1	Very low	26.1	Very low	210 Å²	210	157.5 Å²	157.5	92%	0.921	82%	0.815	S	S	*	*				-161.7	151.1	120.2	-104	-68.9	0	0	0	111.4
418	Q	23.1	Very low	26.2	Very low	177 Å²	177	154.4 Å²	154.4	83%	0.827	81%	0.814	S	S	*	*			trans	-80.6	150.8	-172	-72	170.6	-42.7	0	0	113.3
419	F	22.8	Very low	26.2	Very low	190 Å²	190	157.5 Å²	157.5	83%	0.833	81%	0.813	S	S	*	*			trans	-49.5	135	173	-59	-96.6	0	0	0	114.5
420	P	25.7	Very low	26.6	Very low	123 Å²	123	154.6 Å²	154.6	80%	0.799	81%	0.807	S	S	*	*			trans	-81.2	108	136.6	28.3	-18.3	0	0	0	108.6	N422	P420-N422 PolarHBondContact O-N 3.07Å; P420-N422 VanDerWaalsContact O-N 3.1Å
421	K	27.1	Very low	26.6	Very low	190 Å²	190	154.1 Å²	154.1	83%	0.826	81%	0.806	S	S	*	*			trans	-65.2	106.7	166.6	-71.4	175.6	177.2	175.9	0	108.4
422	N	26	Very low	27	Very low	152 Å²	152	149 Å²	149	81%	0.813	80%	0.803	S	S	*	*			trans	-162.6	40.5	161.2	-97.3	-18.9	0	0	0	112.7	P420	P420-N422 PolarHBondContact O-N 3.07Å; P420-N422 VanDerWaalsContact O-N 3.1Å
423	E	28.3	Very low	27.3	Very low	179 Å²	179	151.2 Å²	151.2	84%	0.836	81%	0.807	S	S	*	*			trans	-105.5	74.6	164.7	-72.1	-166.8	146.3	0	0	110.8	Y425	E423-Y425 HydrophobicContact CG-CD2 4.31Å; E423-Y425 PolarHBondContact O-N 3.34Å
424	A	30	Very low	27.5	Very low	101 Å²	101	150.9 Å²	150.9	84%	0.835	80%	0.804	S	S	*	*			trans	-81	32.8	152.6	0	0	0	0	0	110.9	S426	A424-S426 PolarHBondContact O-N 2.83Å
425	Y	29.2	Very low	27.8	Very low	201 Å²	201	149.5 Å²	149.5	79%	0.788	80%	0.795	S	S	*	*			trans	-78.7	70.7	170.5	-78.6	-79.3	0	0	0	109.4	E423 K427	E423-Y425 HydrophobicContact CG-CD2 4.31Å; E423-Y425 PolarHBondContact O-N 3.34Å; Y425-K427 PolarHBondContact O-N 2.87Å
426	S	27.8	Very low	27.9	Very low	100 Å²	100	150 Å²	150	70%	0.699	79%	0.789	S	S	*	*			trans	-53.9	133.2	157.8	-177	0	0	0	0	108.5	A424 V428	A424-S426 PolarHBondContact O-N 2.83Å; S426-V428 PolarHBondContact O-N 3.36Å
427	K	28.7	Very low	28.4	Very low	186 Å²	186	153.7 Å²	153.7	81%	0.809	80%	0.795	S	S	*	*			trans	-36.1	103.8	174.1	-67.2	163.2	175.6	171.8	0	112.2	Y425	Y425-K427 PolarHBondContact O-N 2.87Å
428	V	27.9	Very low	28.7	Very low	145 Å²	145	151.3 Å²	151.3	88%	0.879	78%	0.784	S	S	*	*			trans	-98.3	57.5	147.1	-168.7	0	0	0	0	107	S426	S426-V428 PolarHBondContact O-N 3.36Å
429	K	30.5	Very low	29.2	Very low	175 Å²	175	147.9 Å²	147.9	76%	0.761	78%	0.78	S	S	*	*			trans	-82.6	119.4	153.5	-85.7	-169.9	172.6	-175.2	0	104.8	D431	K429-D431 PolarHBondContact O-N 3.26Å
430	S	29.8	Very low	29.7	Very low	103 Å²	103	143.3 Å²	143.3	72%	0.72	77%	0.772	S	S	*	*			trans	-44.4	107.1	178.6	30.5	0	0	0	0	111.1	C432	S430-C432 PolarHBondContact O-N 2.89Å
431	D	29.1	Very low	30.5	Very low	144 Å²	144	143 Å²	143	77%	0.77	77%	0.77	S	S	*	*			trans	-66.6	87.1	160.7	-75.8	-46.6	0	0	0	106.9	K429 N433	K429-D431 PolarHBondContact O-N 3.26Å; D431-N433 PolarHBondContact O-N 3.47Å
432	C	31.4	Very low	31	Very low	114 Å²	114	141 Å²	141	77%	0.77	77%	0.767	S	S	*	*			trans	-57.7	94.2	159.4	-65.2	0	0	0	0	106	S430 L434	S430-C432 PolarHBondContact O-N 2.89Å; C432-L434 PolarHBondContact O-N 3.38Å
433	N	29.9	Very low	31.6	Very low	145 Å²	145	137.6 Å²	137.6	78%	0.775	76%	0.76	S	S	*	*			trans	-50.4	116.1	-167.5	-90.6	-58.6	0	0	0	110	D431 V435	D431-N433 PolarHBondContact O-N 3.47Å; N433-V435 PolarHBondContact O-N 2.8Å
434	L	29.6	Very low	31.9	Very low	155 Å²	155	135.5 Å²	135.5	81%	0.812	75%	0.75	S	S	*	*			trans	-50	110.5	171.8	-172.6	81.1	0	0	0	107.1	C432 N436	C432-L434 PolarHBondContact O-N 3.38Å; L434-N436 PolarHBondContact O-N 3.18Å
435	V	30.5	Very low	32.4	Very low	119 Å²	119	139.3 Å²	139.3	72%	0.721	75%	0.748	S	S	*	*			trans	-57.3	103.7	-180	174.3	0	0	0	0	107.4	N433 K437	N433-V435 PolarHBondContact O-N 2.8Å; V435-K437 VanDerWaalsContact C-N 3.26Å; V435-K437 HydrophobicContact CG1-CG 4.38Å; V435-K437 PolarHBondContact O-N 2.77Å
436	N	29.3	Very low	32.8	Very low	117 Å²	117	137 Å²	137	63%	0.626	74%	0.744	S	S	*	*			trans	-63.8	94.3	172.8	-110	-54.6	0	0	0	106.1	L434 K438	L434-N436 PolarHBondContact O-N 3.18Å; N436-K438 PolarHBondContact O-N 3.29Å
437	K	34.2	Very low	33.4	Very low	202 Å²	202	136.6 Å²	136.6	88%	0.878	74%	0.742	S	S	*	*			trans	-69	67.3	166.7	-71.7	-174.7	175.7	-176.6	0	109	V435	V435-K437 VanDerWaalsContact C-N 3.26Å; V435-K437 HydrophobicContact CG1-CG 4.38Å; V435-K437 PolarHBondContact O-N 2.77Å
438	K	32.2	Very low	34	Very low	160 Å²	160	135.9 Å²	135.9	70%	0.696	75%	0.746	S	S	*	*			trans	-120	142	167.4	-70.7	-175.6	177.9	177.8	0	106.6	N436	N436-K438 PolarHBondContact O-N 3.29Å
439	S	33.5	Very low	35.1	Very low	104 Å²	104	135.8 Å²	135.8	73%	0.727	74%	0.739	S	S	*	*			trans	50.9	77.1	-171.4	50.4	0	0	0	0	115
440	S	32.3	Very low	36.4	Very low	95 Å²	95	131.5 Å²	131.5	66%	0.664	72%	0.724	S	S	*	*			trans	-58	125.7	143	-58.2	0	0	0	0	107.9	L442	S440-L442 PolarHBondContact O-N 2.85Å
441	P	42.9	Very low	38.5	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-70.6	-14.1	-172	25.7	-33.6	0	0	0	114.1	A443	P441-A443 VanDerWaalsContact C-N 3.28Å; P441-A443 PolarHBondContact O-N 3.37Å
442	L	37.5	Very low	40.7	Very low	147 Å²	147	127.8 Å²	127.8	77%	0.77	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-73.6	-6	-176.7	-111.7	67.1	0	0	0	116.1	S440	S440-L442 PolarHBondContact O-N 2.85Å
443	A	39.1	Very low	42.8	Very low	81 Å²	81	130.7 Å²	130.7	67%	0.669	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-97	-3.4	-174.1	0	0	0	0	0	115.1	P441	P441-A443 VanDerWaalsContact C-N 3.28Å; P441-A443 PolarHBondContact O-N 3.37Å
444	H	35.7	Very low	44.7	Very low	135 Å²	135	127.4 Å²	127.4	63%	0.625	69%	0.685	S	S	*	*			trans	-108.6	41	-179.8	-70.1	90.2	0	0	0	113.1	H446	H444-H446 AromaticContact CD2-CD2 3.97Å; H444-H446 AromaticContact CD2-NE2 3.84Å; H444-H446 PolarHBondContact O-N 3.29Å
445	F	38.9	Very low	46.6	Very low	181 Å²	181	124.4 Å²	124.4	79%	0.794	67%	0.667	S	S	*	*			trans	-67.8	74.9	146.7	-71.3	-75.2	0	0	0	108.6	S447	F445-S447 PolarHBondContact O-N 2.84Å
446	H	38	Very low	48.6	Very low	151 Å²	151	123.1 Å²	123.1	70%	0.699	65%	0.649	S	S	*	*			trans	-61.8	98.7	152.5	-84.1	-74	0	0	0	105.9	H444 L448	H444-H446 AromaticContact CD2-CD2 3.97Å; H444-H446 AromaticContact CD2-NE2 3.84Å; H444-H446 PolarHBondContact O-N 3.29Å; H446-L448 PolarHBondContact O-N 3.34Å; H446-L448 VanDerWaalsContact O-N 3.14Å
447	S	41	Very low	50.8	Low	93 Å²	93	123.6 Å²	123.6	65%	0.65	65%	0.647	S	S	*	*			trans	-43.8	126.5	160.5	-49.9	0	0	0	0	106.7	F445 I449	F445-S447 PolarHBondContact O-N 2.84Å; S447-I449 WeakPolarHBondContact O-CG1 3.44Å; S447-I449 PolarHBondContact O-N 3.45Å
448	L	40.9	Very low	52.9	Low	170 Å²	170	118 Å²	118	89%	0.89	63%	0.626	S	S	*	*			trans	-68.9	79.1	-178.4	-71.4	168.7	0	0	0	108.8	H446 L450	H446-L448 PolarHBondContact O-N 3.34Å; H446-L448 VanDerWaalsContact O-N 3.14Å; L448-L450 VanDerWaalsContact C-N 3.3Å; L448-L450 PolarHBondContact O-N 2.88Å
449	I	50.2	Low	55	Low	143 Å²	143	114.2 Å²	114.2	73%	0.733	61%	0.613	S	S	*	*			trans	-70.3	93.7	177.6	-66.6	162.3	0	0	0	106.2	S447	S447-I449 WeakPolarHBondContact O-CG1 3.44Å; S447-I449 PolarHBondContact O-N 3.45Å
450	L	57.7	Low	57	Low	86 Å²	86	114.9 Å²	114.9	45%	0.45	61%	0.605	S	S	.	*			trans	-48	130.2	166.4	-77.6	154.6	0	0	0	108.4	L448 V452 L454 H455 L458	L448-L450 VanDerWaalsContact C-N 3.3Å; L448-L450 PolarHBondContact O-N 2.88Å; L450-V452 PolarHBondContact O-N 2.93Å; L450-L454 HydrophobicContact CD2-CD2 4.04Å; L450-H455 HydrophobicContact CB-CB 4.45Å; L450-L458 HydrophobicContact CD1-CD1 4.44Å
451	P	75.5	Confident	58.8	Low	87 Å²	87	112.4 Å²	112.4	57%	0.565	59%	0.588	S	S	*	*			trans	-50.9	132.6	176.6	-28.1	35	0	0	0	110.1	K453 L454 H455	P451-K453 CarbonylContact O-C 3.59Å; P451-K453 PolarHBondContact O-N 2.85Å; P451-L454 WeakPolarHBondContact O-CA 3.41Å; P451-L454 WeakPolarHBondContact O-CB 3.39Å; P451-L454 PolarHBondContact O-N 3.42Å; P451-H455 PolarHBondContact O-N 2.92Å
452	V	74.5	Confident	60.4	Low	82 Å²	82	111.2 Å²	111.2	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-51	-34.2	-170.8	179.7	0	0	0	0	112.7	L450 R456	L450-V452 PolarHBondContact O-N 2.93Å; V452-R456 HydrophobicContact CG1-CG 4.46Å; V452-R456 WeakPolarHBondContact O-CB 3.41Å; V452-R456 WeakPolarHBondContact O-CG 3.47Å; V452-R456 PolarHBondContact O-N 3.37Å
453	K	74.9	Confident	62	Low	175 Å²	175	109 Å²	109	76%	0.761	56%	0.559	S	S	*	*	H	α-helix	trans	-60.8	-45.1	173.5	-65.2	-174.2	178.5	-176.9	0	113.2	P451 R456 Q457	P451-K453 CarbonylContact O-C 3.59Å; P451-K453 PolarHBondContact O-N 2.85Å; K453-R456 PolarHBondContact O-N 3.37Å; K453-Q457 WeakPolarHBondContact O-CG 3.47Å; K453-Q457 PolarHBondContact O-N 3.02Å
454	L	70.9	Confident	63.5	Low	75 Å²	75	113.8 Å²	113.8	39%	0.393	56%	0.559	S	S	.	*	H	α-helix	trans	-72.2	-39.4	-179.5	-151.6	157.1	0	0	0	110.2	L450 P451 Q457 L458	L450-L454 HydrophobicContact CD2-CD2 4.04Å; P451-L454 WeakPolarHBondContact O-CA 3.41Å; P451-L454 WeakPolarHBondContact O-CB 3.39Å; P451-L454 PolarHBondContact O-N 3.42Å; L454-Q457 PolarHBondContact O-N 3Å; L454-L458 HydrophobicContact CD2-CD1 3.58Å; L454-L458 HydrophobicContact CD2-CG 3.87Å; L454-L458 WeakPolarHBondContact O-CG 3.24Å; L454-L458 PolarHBondContact O-N 3.35Å
455	H	69.6	Low	64.7	Low	93 Å²	93	112.2 Å²	112.2	43%	0.431	55%	0.548	S	S	.	.	H	α-helix	trans	-59	-47	170.4	-176.5	-110.8	0	0	0	112.1	L450 P451 Q457 L458 L459	L450-H455 HydrophobicContact CB-CB 4.45Å; P451-H455 PolarHBondContact O-N 2.92Å; H455-Q457 VanDerWaalsContact C-N 3.34Å; H455-Q457 PolarHBondContact O-N 3.04Å; H455-L458 PolarHBondContact O-N 3.09Å; H455-L459 VanDerWaalsContact CE1-CD1 3.43Å; H455-L459 WeakPolarHBondContact CE1-CD1 3.44Å; H455-L459 WeakPolarHBondContact O-CG 3.38Å; H455-L459 PolarHBondContact O-N 3.2Å
456	R	71.3	Confident	66.2	Low	92 Å²	92	106.9 Å²	106.9	35%	0.347	53%	0.527	S	S	.	.	H	α-helix	trans	-61.4	-38.4	174.2	-74.9	-177.2	-179.4	-123	6	112.2	D345 E348 V452 K453 Q460	D345-R456 IonicContact OD1-CZ 3.72Å; D345-R456 VanDerWaalsContact OD1-CZ 3.3Å; D345-R456 IonicContact OD1-NH1 2.62Å; D345-R456 PolarHBondContact OD1-NH1 2.6Å; D345-R456 IonicContact OD1-NH2 2.66Å; D345-R456 PolarHBondContact OD1-NH2 3.25Å; E348-R456 IonicContact OE1-NH2 2.77Å; E348-R456 PolarHBondContact OE1-NH2 2.93Å; E348-R456 IonicContact OE2-CZ 2.78Å; E348-R456 IonicContact OE2-NE 2.79Å; E348-R456 IonicContact OE2-NH2 2.9Å; E348-R456 PolarHBondContact OE2-NH2 3.15Å; V452-R456 HydrophobicContact CG1-CG 4.46Å; V452-R456 WeakPolarHBondContact O-CB 3.41Å; V452-R456 WeakPolarHBondContact O-CG 3.47Å; V452-R456 PolarHBondContact O-N 3.37Å; K453-R456 PolarHBondContact O-N 3.37Å; R456-Q460 WeakPolarHBondContact O-CB 3.28Å; R456-Q460 VanDerWaalsContact O-CG 3.31Å; R456-Q460 WeakPolarHBondContact O-CG 3.44Å; R456-Q460 PolarHBondContact O-N 3.46Å
457	Q	76.8	Confident	67.7	Low	127 Å²	127	103 Å²	103	59%	0.593	51%	0.514	S	S	*	.	H	α-helix	trans	-66	-42.3	175.1	-77.3	173.6	-36.8	0	0	112.7	K453 L454 H455 Q460 S461	K453-Q457 WeakPolarHBondContact O-CG 3.47Å; K453-Q457 PolarHBondContact O-N 3.02Å; L454-Q457 PolarHBondContact O-N 3Å; H455-Q457 VanDerWaalsContact C-N 3.34Å; H455-Q457 PolarHBondContact O-N 3.04Å; Q457-Q460 PolarHBondContact O-N 3.43Å; Q457-S461 WeakPolarHBondContact O-CB 3.26Å; Q457-S461 PolarHBondContact O-N 3.05Å
458	L	77.6	Confident	68.6	Low	84 Å²	84	103.1 Å²	103.1	44%	0.44	51%	0.508	S	S	.	.	H	α-helix	trans	-66.7	-39.4	176	-71.4	173.1	0	0	0	112.3	L450 L454 H455 S461 K462	L450-L458 HydrophobicContact CD1-CD1 4.44Å; L454-L458 HydrophobicContact CD2-CD1 3.58Å; L454-L458 HydrophobicContact CD2-CG 3.87Å; L454-L458 WeakPolarHBondContact O-CG 3.24Å; L454-L458 PolarHBondContact O-N 3.35Å; H455-L458 PolarHBondContact O-N 3.09Å; L458-S461 PolarHBondContact O-N 2.99Å; L458-S461 PolarHBondContact O-OG 2.98Å; L458-S461 VanDerWaalsContact O-OG 3.07Å; L458-K462 WeakPolarHBondContact O-CB 3.34Å; L458-K462 PolarHBondContact O-N 3.19Å
459	L	76.9	Confident	69.5	Low	80 Å²	80	96.1 Å²	96.1	42%	0.419	47%	0.474	S	S	.	.	H	α-helix	trans	-63.7	-44.8	172.6	-75.3	176.1	0	0	0	111.6	H455 S461 K462 I463	H455-L459 VanDerWaalsContact CE1-CD1 3.43Å; H455-L459 WeakPolarHBondContact CE1-CD1 3.44Å; H455-L459 WeakPolarHBondContact O-CG 3.38Å; H455-L459 PolarHBondContact O-N 3.2Å; L459-S461 VanDerWaalsContact C-N 3.35Å; L459-S461 PolarHBondContact O-N 2.87Å; L459-K462 PolarHBondContact O-N 2.69Å; L459-I463 WeakPolarHBondContact O-CB 3.31Å; L459-I463 VanDerWaalsContact O-CG1 3.27Å; L459-I463 WeakPolarHBondContact O-CG1 3.3Å; L459-I463 PolarHBondContact O-N 3.04Å
460	Q	75	Confident	70.2	Confident	118 Å²	118	96.5 Å²	96.5	55%	0.551	47%	0.47	S	S	*	.	H	α-helix	trans	-63.5	-38.4	175.9	-75.7	-179.6	1.2	0	0	112.4	R456 Q457 R464	R456-Q460 WeakPolarHBondContact O-CB 3.28Å; R456-Q460 VanDerWaalsContact O-CG 3.31Å; R456-Q460 WeakPolarHBondContact O-CG 3.44Å; R456-Q460 PolarHBondContact O-N 3.46Å; Q457-Q460 PolarHBondContact O-N 3.43Å; Q460-R464 WeakPolarHBondContact O-CB 3.23Å; Q460-R464 VanDerWaalsContact O-CG 3.29Å; Q460-R464 WeakPolarHBondContact O-CG 3.15Å; Q460-R464 PolarHBondContact O-N 3.49Å
461	S	69.4	Low	70.2	Confident	44 Å²	44	96.2 Å²	96.2	31%	0.308	47%	0.47	S	S	.	.	H	α-helix	trans	-72.2	-33	176.8	78.2	0	0	0	0	112.5	Q457 L458 L459 R465	Q457-S461 WeakPolarHBondContact O-CB 3.26Å; Q457-S461 PolarHBondContact O-N 3.05Å; L458-S461 PolarHBondContact O-N 2.99Å; L458-S461 PolarHBondContact O-OG 2.98Å; L458-S461 VanDerWaalsContact O-OG 3.07Å; L459-S461 VanDerWaalsContact C-N 3.35Å; L459-S461 PolarHBondContact O-N 2.87Å; S461-R465 WeakPolarHBondContact O-CG 3.37Å; S461-R465 PolarHBondContact O-N 2.86Å; S461-R465 VanDerWaalsContact O-N 3.13Å; S461-R465 PolarHBondContact O-NE 2.88Å
462	K	77.5	Confident	69.3	Low	91 Å²	91	93.4 Å²	93.4	40%	0.396	45%	0.45	S	S	.	.	H	α-helix	trans	-66	-51.3	170.6	-173.8	174.5	173.5	61.9	0	111.2	L458 L459 R464 R465 D466	L458-K462 WeakPolarHBondContact O-CB 3.34Å; L458-K462 PolarHBondContact O-N 3.19Å; L459-K462 PolarHBondContact O-N 2.69Å; K462-R464 VanDerWaalsContact C-N 3.28Å; K462-R464 PolarHBondContact O-N 2.89Å; K462-R465 PolarHBondContact O-N 2.77Å; K462-D466 IonicContact NZ-OD1 3.49Å; K462-D466 VanDerWaalsContact O-CG 3.31Å; K462-D466 PolarHBondContact O-N 3.44Å
463	I	71.3	Confident	68.4	Low	101 Å²	101	93 Å²	93	52%	0.518	44%	0.439	S	S	.	.	H	α-helix	trans	-58	-40.5	178.5	-67.4	163.7	0	0	0	111.4	L459 D466 V467	L459-I463 WeakPolarHBondContact O-CB 3.31Å; L459-I463 VanDerWaalsContact O-CG1 3.27Å; L459-I463 WeakPolarHBondContact O-CG1 3.3Å; L459-I463 PolarHBondContact O-N 3.04Å; I463-D466 PolarHBondContact O-N 3.3Å; I463-V467 WeakPolarHBondContact O-CB 3.49Å; I463-V467 VanDerWaalsContact O-CG2 3.3Å; I463-V467 WeakPolarHBondContact O-CG2 3.31Å; I463-V467 PolarHBondContact O-N 3.43Å
464	R	69.2	Low	67.4	Low	181 Å²	181	91.5 Å²	91.5	68%	0.683	43%	0.433	S	S	*	.	H	α-helix	trans	-62.7	-42.6	174.8	-76.5	178.2	-178.3	-153.5	1.5	112.6	Q460 K462 V467 N468	Q460-R464 WeakPolarHBondContact O-CB 3.23Å; Q460-R464 VanDerWaalsContact O-CG 3.29Å; Q460-R464 WeakPolarHBondContact O-CG 3.15Å; Q460-R464 PolarHBondContact O-N 3.49Å; K462-R464 VanDerWaalsContact C-N 3.28Å; K462-R464 PolarHBondContact O-N 2.89Å; R464-V467 PolarHBondContact O-N 3.05Å; R464-N468 WeakPolarHBondContact O-CB 3.46Å; R464-N468 PolarHBondContact O-N 3.22Å; R464-N468 PolarHBondContact O-OD1 2.95Å
465	R	62.6	Low	66.3	Low	103 Å²	103	94.8 Å²	94.8	39%	0.389	44%	0.441	S	S	.	.	H	α-helix	trans	-66.2	-47	175.2	-75.8	178.5	-67.5	137.8	-5.1	111.8	S461 K462 V467 N468 A469	S461-R465 WeakPolarHBondContact O-CG 3.37Å; S461-R465 PolarHBondContact O-N 2.86Å; S461-R465 VanDerWaalsContact O-N 3.13Å; S461-R465 PolarHBondContact O-NE 2.88Å; K462-R465 PolarHBondContact O-N 2.77Å; R465-V467 PolarHBondContact O-N 2.87Å; R465-N468 PolarHBondContact O-N 2.93Å; R465-N468 VanDerWaalsContact O-N 3.07Å; R465-A469 WeakPolarHBondContact O-CB 3.35Å; R465-A469 PolarHBondContact O-N 2.81Å
466	D	69	Low	65.1	Low	68 Å²	68	91.4 Å²	91.4	36%	0.364	43%	0.426	S	S	.	.	H	α-helix	trans	-59.3	-34.3	177.6	-64.9	-3	0	0	0	111.9	K462 I463 K470	K462-D466 IonicContact NZ-OD1 3.49Å; K462-D466 VanDerWaalsContact O-CG 3.31Å; K462-D466 PolarHBondContact O-N 3.44Å; I463-D466 PolarHBondContact O-N 3.3Å; D466-K470 VanDerWaalsContact O-CB 3.31Å; D466-K470 WeakPolarHBondContact O-CB 3.35Å; D466-K470 VanDerWaalsContact O-CG 3.23Å; D466-K470 WeakPolarHBondContact O-CG 3.41Å; D466-K470 PolarHBondContact O-N 2.87Å; D466-K470 VanDerWaalsContact O-N 3.13Å
467	V	69.3	Low	63.6	Low	69 Å²	69	92.4 Å²	92.4	42%	0.418	44%	0.438	S	S	.	.	H	α-helix	trans	-73.4	-42.9	173	169.3	0	0	0	0	112	I463 R464 R465 K470 N471	I463-V467 WeakPolarHBondContact O-CB 3.49Å; I463-V467 VanDerWaalsContact O-CG2 3.3Å; I463-V467 WeakPolarHBondContact O-CG2 3.31Å; I463-V467 PolarHBondContact O-N 3.43Å; R464-V467 PolarHBondContact O-N 3.05Å; R465-V467 PolarHBondContact O-N 2.87Å; V467-K470 PolarHBondContact O-N 3.03Å; V467-N471 WeakPolarHBondContact O-CB 3.31Å; V467-N471 VanDerWaalsContact O-CG 3.22Å; V467-N471 PolarHBondContact O-N 2.88Å; V467-N471 PolarHBondContact O-ND2 3.23Å
468	N	60.4	Low	62.3	Low	97 Å²	97	92.6 Å²	92.6	52%	0.519	45%	0.45	S	S	.	.	H	α-helix	trans	-62.4	-49	177.1	-77	0.8	0	0	0	111.5	R464 R465 K470 N471 I472	R464-N468 WeakPolarHBondContact O-CB 3.46Å; R464-N468 PolarHBondContact O-N 3.22Å; R464-N468 PolarHBondContact O-OD1 2.95Å; R465-N468 PolarHBondContact O-N 2.93Å; R465-N468 VanDerWaalsContact O-N 3.07Å; N468-K470 PolarHBondContact O-N 3.37Å; N468-N471 WeakPolarHBondContact O-CB 3.43Å; N468-N471 PolarHBondContact O-N 3.14Å; N468-N471 VanDerWaalsContact O-N 3.14Å; N468-I472 WeakPolarHBondContact O-CG1 3.35Å; N468-I472 PolarHBondContact O-N 2.86Å
469	A	60.4	Low	60.5	Low	22 Å²	22	94.9 Å²	94.9	18%	0.182	47%	0.467	C	S	.	.	H	α-helix	trans	-57.3	-47.9	175	0	0	0	0	0	110.9	R465 N471 I472 W473	R465-A469 WeakPolarHBondContact O-CB 3.35Å; R465-A469 PolarHBondContact O-N 2.81Å; A469-N471 VanDerWaalsContact C-N 3.32Å; A469-N471 PolarHBondContact O-N 3.08Å; A469-I472 PolarHBondContact O-N 2.8Å; A469-W473 PolarHBondContact O-N 3.46Å
470	K	63.6	Low	58.9	Low	151 Å²	151	92.9 Å²	92.9	66%	0.657	46%	0.459	S	S	*	.	H	α-helix	trans	-60.8	-37.5	175.6	-79.9	175.8	-179.2	176.2	0	113.5	D466 V467 N468 F474	D466-K470 VanDerWaalsContact O-CB 3.31Å; D466-K470 WeakPolarHBondContact O-CB 3.35Å; D466-K470 VanDerWaalsContact O-CG 3.23Å; D466-K470 WeakPolarHBondContact O-CG 3.41Å; D466-K470 PolarHBondContact O-N 2.87Å; D466-K470 VanDerWaalsContact O-N 3.13Å; V467-K470 PolarHBondContact O-N 3.03Å; N468-K470 PolarHBondContact O-N 3.37Å; K470-F474 VanDerWaalsContact O-CB 3.24Å; K470-F474 WeakPolarHBondContact O-CB 3.25Å; K470-F474 PolarHBondContact O-N 3.42Å
471	N	58.8	Low	57.4	Low	81 Å²	81	91.7 Å²	91.7	43%	0.433	46%	0.459	S	S	.	.	H	α-helix	trans	-66.1	-47.2	175.9	-74	-20.5	0	0	0	110.9	V467 N468 A469 W473 F474 Y475	V467-N471 WeakPolarHBondContact O-CB 3.31Å; V467-N471 VanDerWaalsContact O-CG 3.22Å; V467-N471 PolarHBondContact O-N 2.88Å; V467-N471 PolarHBondContact O-ND2 3.23Å; N468-N471 WeakPolarHBondContact O-CB 3.43Å; N468-N471 PolarHBondContact O-N 3.14Å; N468-N471 VanDerWaalsContact O-N 3.14Å; A469-N471 VanDerWaalsContact C-N 3.32Å; A469-N471 PolarHBondContact O-N 3.08Å; N471-W473 PolarHBondContact O-N 3.12Å; N471-F474 PolarHBondContact O-N 3.5Å; N471-Y475 WeakPolarHBondContact O-CD2 3.21Å; N471-Y475 PolarHBondContact O-N 2.87Å; N471-Y475 VanDerWaalsContact O-N 3.12Å
472	I	57	Low	56.2	Low	28 Å²	28	95.5 Å²	95.5	14%	0.144	47%	0.471	C	S	.	.	H	α-helix	trans	-52.9	-53.6	174.1	-71.6	166.4	0	0	0	109.5	N468 A469 F474 Y475 L476 I488 H492 D496	N468-I472 WeakPolarHBondContact O-CG1 3.35Å; N468-I472 PolarHBondContact O-N 2.86Å; A469-I472 PolarHBondContact O-N 2.8Å; I472-F474 PolarHBondContact O-N 2.93Å; I472-Y475 PolarHBondContact O-N 3.41Å; I472-L476 HydrophobicContact CG2-CD1 3.72Å; I472-L476 WeakPolarHBondContact O-CB 3.43Å; I472-L476 WeakPolarHBondContact O-CD1 3.48Å; I472-L476 WeakPolarHBondContact O-CG 3.46Å; I472-L476 PolarHBondContact O-N 2.66Å; I472-I488 HydrophobicContact CG2-CD1 4.38Å; I472-H492 HydrophobicContact CD1-CB 4.41Å; I472-D496 WeakPolarHBondContact CD1-OD2 3.47Å
473	W	54.2	Low	54.8	Low	73 Å²	73	98.3 Å²	98.3	28%	0.277	49%	0.49	S	S	.	.	H	α-helix	trans	-66.4	-32.2	179.3	-67.9	116.8	0	0	0	114.5	R14 L17 A469 N471 Y475 L476 L477	R14-W473 HydrophobicContact CB-CH2 3.75Å; R14-W473 HydrophobicContact CB-CZ2 4.25Å; R14-W473 HydrophobicContact CG-CH2 3.46Å; R14-W473 VanDerWaalsContact CG-CH2 3.46Å; R14-W473 HydrophobicContact CG-CZ2 3.79Å; R14-W473 HydrophobicContact CG-CZ3 4.13Å; L17-W473 HydrophobicContact CD2-CE3 4.4Å; L17-W473 HydrophobicContact CD2-CH2 3.67Å; L17-W473 HydrophobicContact CD2-CZ3 3.45Å; L17-W473 VanDerWaalsContact CD2-CZ3 3.45Å; A469-W473 PolarHBondContact O-N 3.46Å; N471-W473 PolarHBondContact O-N 3.12Å; W473-Y475 VanDerWaalsContact C-N 3.33Å; W473-Y475 PolarHBondContact O-N 2.81Å; W473-L476 HydrophobicContact CE3-CB 4.41Å; W473-L476 CarbonylContact O-C 3.6Å; W473-L476 PolarHBondContact O-N 2.79Å; W473-L476 VanDerWaalsContact O-N 3.08Å; W473-L477 PolarHBondContact O-N 3.13Å; W473-L477 VanDerWaalsContact O-N 3.14Å
474	F	53.8	Low	53.8	Low	143 Å²	143	99.1 Å²	99.1	63%	0.627	50%	0.495	S	S	*	.	H	α-helix	trans	-65.5	-36.9	175.8	-173.6	-92	0	0	0	111.9	K470 N471 I472 L476	K470-F474 VanDerWaalsContact O-CB 3.24Å; K470-F474 WeakPolarHBondContact O-CB 3.25Å; K470-F474 PolarHBondContact O-N 3.42Å; N471-F474 PolarHBondContact O-N 3.5Å; I472-F474 PolarHBondContact O-N 2.93Å; F474-L476 PolarHBondContact O-N 2.93Å
475	Y	47.9	Very low	52.9	Low	145 Å²	145	92 Å²	92	57%	0.569	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-6.5	172.6	-67.5	-63.3	0	0	0	114	N471 I472 W473 T480	N471-Y475 WeakPolarHBondContact O-CD2 3.21Å; N471-Y475 PolarHBondContact O-N 2.87Å; N471-Y475 VanDerWaalsContact O-N 3.12Å; I472-Y475 PolarHBondContact O-N 3.41Å; W473-Y475 VanDerWaalsContact C-N 3.33Å; W473-Y475 PolarHBondContact O-N 2.81Å; Y475-T480 WeakPolarHBondContact O-CG2 3.33Å
476	L	46.1	Very low	52.6	Low	22 Å²	22	89.7 Å²	89.7	12%	0.115	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122	9.5	-172.5	-75.6	164.6	0	0	0	114.4	L17 I472 W473 F474 L485 I488	L17-L476 HydrophobicContact CD1-CD2 3.89Å; L17-L476 HydrophobicContact CD2-CB 4.41Å; L17-L476 HydrophobicContact CD2-CD1 3.57Å; L17-L476 HydrophobicContact CD2-CD2 4.19Å; L17-L476 HydrophobicContact CD2-CG 4.28Å; I472-L476 HydrophobicContact CG2-CD1 3.72Å; I472-L476 WeakPolarHBondContact O-CB 3.43Å; I472-L476 WeakPolarHBondContact O-CD1 3.48Å; I472-L476 WeakPolarHBondContact O-CG 3.46Å; I472-L476 PolarHBondContact O-N 2.66Å; W473-L476 HydrophobicContact CE3-CB 4.41Å; W473-L476 CarbonylContact O-C 3.6Å; W473-L476 PolarHBondContact O-N 2.79Å; W473-L476 VanDerWaalsContact O-N 3.08Å; F474-L476 PolarHBondContact O-N 2.93Å; L476-L485 HydrophobicContact CD2-CD2 3.74Å; L476-L485 HydrophobicContact CD2-CG 4Å; L476-I488 HydrophobicContact CD1-CD1 3.5Å; L476-I488 VanDerWaalsContact CD1-CD1 3.5Å; L476-I488 HydrophobicContact CD2-CD1 4.34Å; L476-I488 HydrophobicContact CG-CD1 3.92Å
477	L	39.8	Very low	52	Low	113 Å²	113	92.8 Å²	92.8	59%	0.592	49%	0.486	S	S	*	.	S	Bend	trans	-58.3	154	166.2	-131.4	65.7	0	0	0	109.7	W473 T479 T480	W473-L477 PolarHBondContact O-N 3.13Å; W473-L477 VanDerWaalsContact O-N 3.14Å; L477-T479 PolarHBondContact O-N 2.97Å; L477-T479 PolarHBondContact O-OG1 2.94Å; L477-T480 PolarHBondContact O-N 3.26Å
478	P	49	Very low	51.5	Low	131 Å²	131	90.6 Å²	90.6	85%	0.851	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	6.8	-161.8	-27.6	36.5	0	0	0	118.9
479	T	39.2	Very low	51.3	Low	131 Å²	131	89.1 Å²	89.1	80%	0.804	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-14.2	172.9	45.2	0	0	0	0	114.3	L477 T481	L477-T479 PolarHBondContact O-N 2.97Å; L477-T479 PolarHBondContact O-OG1 2.94Å; T479-T481 PolarHBondContact O-N 2.75Å
480	T	44.5	Very low	51.2	Low	39 Å²	39	90 Å²	90	24%	0.239	47%	0.47	C	S	.	.			trans	-81	97.3	174.5	52.6	0	0	0	0	111.8	Y475 L477	Y475-T480 WeakPolarHBondContact O-CG2 3.33Å; L477-T480 PolarHBondContact O-N 3.26Å
481	T	43.2	Very low	51.1	Low	92 Å²	92	88.8 Å²	88.8	56%	0.564	47%	0.47	S	S	*	.			trans	-59.8	153	160.2	50.2	0	0	0	0	110.5	T479 N483 N484	T479-T481 PolarHBondContact O-N 2.75Å; T481-N483 PolarHBondContact O-N 2.69Å; T481-N484 PolarHBondContact O-N 2.88Å
482	F	42.6	Very low	51.2	Low	124 Å²	124	89.1 Å²	89.1	54%	0.544	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.7	-30.7	-175.4	-96.5	-93	0	0	0	116.4	Q20	Q20-F482 HydrophobicContact CG-CZ 4.47Å
483	N	50	Low	51.5	Low	151 Å²	151	88.2 Å²	88.2	81%	0.807	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-14.1	-175.1	-59	-5.9	0	0	0	113.8	T481	T481-N483 PolarHBondContact O-N 2.69Å
484	N	48.9	Very low	51.9	Low	117 Å²	117	87.2 Å²	87.2	63%	0.626	47%	0.468	S	S	*	.			trans	-116.9	14.4	-170.2	-70.2	-9	0	0	0	113.5	T481 P486	T481-N484 PolarHBondContact O-N 2.88Å; N484-P486 WeakPolarHBondContact O-CD 3.29Å
485	L	51.5	Low	52.6	Low	31 Å²	31	85 Å²	85	16%	0.162	46%	0.459	C	S	.	.			trans	-66.4	126.8	165.6	-81.6	83.2	0	0	0	108.2	L17 V21 L476	L17-L485 HydrophobicContact CD1-CD2 4.19Å; V21-L485 HydrophobicContact CG2-CD2 4.12Å; L476-L485 HydrophobicContact CD2-CD2 3.74Å; L476-L485 HydrophobicContact CD2-CG 4Å
486	P	54.9	Low	53.6	Low	56 Å²	56	79.2 Å²	79.2	36%	0.364	44%	0.438	S	S	.	.			trans	-61.5	157.6	168.2	24.8	-30	0	0	0	110.2	N484 I488	N484-P486 WeakPolarHBondContact O-CD 3.29Å; P486-I488 HydrophobicContact CG-CD1 4.01Å; P486-I488 HydrophobicContact CG-CG1 4.04Å; P486-I488 PolarHBondContact O-N 2.85Å
487	D	56.4	Low	54.8	Low	133 Å²	133	79.9 Å²	79.9	71%	0.711	44%	0.442	S	S	*	.			trans	-67	79.6	173	-80.9	-42.3	0	0	0	110.8	R24 P489	R24-D487 IonicContact CZ-OD1 2.88Å; R24-D487 IonicContact NH1-OD1 2.69Å; R24-D487 PolarHBondContact NH1-OD1 2.94Å; R24-D487 IonicContact NH2-OD1 3.19Å; R24-D487 PolarHBondContact NH2-OD1 3.14Å; R24-D487 VanDerWaalsContact NH2-OD1 3.13Å; D487-P489 WeakPolarHBondContact O-CD 3.46Å
488	I	58.4	Low	56.3	Low	23 Å²	23	78 Å²	78	12%	0.118	44%	0.435	C	S	.	.			trans	-88	114	168.2	-58.9	169.4	0	0	0	105.9	I472 L476 P486 V490 V493	I472-I488 HydrophobicContact CG2-CD1 4.38Å; L476-I488 HydrophobicContact CD1-CD1 3.5Å; L476-I488 VanDerWaalsContact CD1-CD1 3.5Å; L476-I488 HydrophobicContact CD2-CD1 4.34Å; L476-I488 HydrophobicContact CG-CD1 3.92Å; P486-I488 HydrophobicContact CG-CD1 4.01Å; P486-I488 HydrophobicContact CG-CG1 4.04Å; P486-I488 PolarHBondContact O-N 2.85Å; I488-V490 PolarHBondContact O-N 2.87Å; I488-V493 HydrophobicContact CG2-CG2 3.72Å
489	P	57.2	Low	57.6	Low	65 Å²	65	74.3 Å²	74.3	42%	0.422	41%	0.408	S	S	.	.			trans	-56.3	130.8	174.8	-23.7	33.2	0	0	0	110.5	D487 I491 H492	D487-P489 WeakPolarHBondContact O-CD 3.46Å; P489-I491 HydrophobicContact CB-CB 4.41Å; P489-I491 PolarHBondContact O-N 2.92Å; P489-H492 PolarHBondContact O-N 2.75Å
490	V	57.9	Low	59.2	Low	42 Å²	42	71.6 Å²	71.6	26%	0.255	39%	0.389	S	S	.	.	H	α-helix	trans	-48.6	-34.2	172.7	169.1	0	0	0	0	111.3	V21 D25 I488 H492 V493 C494	V21-V490 HydrophobicContact CB-CG2 4.19Å; V21-V490 HydrophobicContact CG1-CG2 3.48Å; V21-V490 VanDerWaalsContact CG1-CG2 3.48Å; D25-V490 WeakPolarHBondContact OD2-CG2 3.49Å; I488-V490 PolarHBondContact O-N 2.87Å; V490-H492 VanDerWaalsContact C-N 3.31Å; V490-H492 PolarHBondContact O-N 2.69Å; V490-V493 PolarHBondContact O-N 3.32Å; V490-C494 WeakPolarHBondContact O-CB 3.19Å; V490-C494 PolarHBondContact O-N 3.08Å; V490-C494 PolarHBondContact O-SG 2.76Å; V490-C494 VanDerWaalsContact O-SG 3.38Å
491	I	61.4	Low	60.5	Low	125 Å²	125	73.1 Å²	73.1	64%	0.641	40%	0.395	S	S	*	.	H	α-helix	trans	-50.6	-46.4	175.5	-60.2	171.7	0	0	0	112	P489 C494 E495	P489-I491 HydrophobicContact CB-CB 4.41Å; P489-I491 PolarHBondContact O-N 2.92Å; I491-C494 PolarHBondContact O-N 2.99Å; I491-E495 WeakPolarHBondContact O-CB 3.2Å; I491-E495 PolarHBondContact O-N 3.34Å
492	H	61.9	Low	62.1	Low	87 Å²	87	73.4 Å²	73.4	40%	0.403	39%	0.392	S	S	.	.	H	α-helix	trans	-74	-35.6	-178.5	-69.9	-44.2	0	0	0	112.7	I472 P489 V490 C494 E495 D496	I472-H492 HydrophobicContact CD1-CB 4.41Å; P489-H492 PolarHBondContact O-N 2.75Å; V490-H492 VanDerWaalsContact C-N 3.31Å; V490-H492 PolarHBondContact O-N 2.69Å; H492-C494 VanDerWaalsContact C-N 3.34Å; H492-E495 IonicContact CE1-OE2 2.65Å; H492-E495 IonicContact ND1-OE2 2.74Å; H492-E495 PolarHBondContact ND1-OE2 3.47Å; H492-E495 PolarHBondContact O-N 3.49Å; H492-D496 WeakPolarHBondContact O-CB 3.34Å; H492-D496 PolarHBondContact O-N 2.92Å
493	V	62.8	Low	63.7	Low	9 Å²	9	71.8 Å²	71.8	6%	0.055	39%	0.386	C	S	.	.	H	α-helix	trans	-65.3	-40.7	173.9	-175.8	0	0	0	0	110.7	A18 I488 V490 L497	A18-V493 HydrophobicContact CB-CG1 4.39Å; I488-V493 HydrophobicContact CG2-CG2 3.72Å; V490-V493 PolarHBondContact O-N 3.32Å; V493-L497 VanDerWaalsContact O-CB 3.28Å; V493-L497 WeakPolarHBondContact O-CB 3.14Å; V493-L497 PolarHBondContact O-N 3.39Å
494	C	61.6	Low	65	Low	53 Å²	53	68.8 Å²	68.8	36%	0.358	37%	0.368	S	S	.	.	H	α-helix	trans	-70.5	-36.5	175	-70.9	0	0	0	0	112.7	V490 I491 H492 T498	V490-C494 WeakPolarHBondContact O-CB 3.19Å; V490-C494 PolarHBondContact O-N 3.08Å; V490-C494 PolarHBondContact O-SG 2.76Å; V490-C494 VanDerWaalsContact O-SG 3.38Å; I491-C494 PolarHBondContact O-N 2.99Å; H492-C494 VanDerWaalsContact C-N 3.34Å; C494-T498 VanDerWaalsContact O-CB 3.23Å; C494-T498 WeakPolarHBondContact O-CB 3.39Å; C494-T498 PolarHBondContact O-N 2.84Å; C494-T498 PolarHBondContact O-OG1 3.48Å
495	E	69.8	Low	66.1	Low	96 Å²	96	65.9 Å²	65.9	45%	0.449	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-47	174.9	-177.4	179.2	-170.5	0	0	110.7	I491 H492 T498 N499	I491-E495 WeakPolarHBondContact O-CB 3.2Å; I491-E495 PolarHBondContact O-N 3.34Å; H492-E495 IonicContact CE1-OE2 2.65Å; H492-E495 IonicContact ND1-OE2 2.74Å; H492-E495 PolarHBondContact ND1-OE2 3.47Å; H492-E495 PolarHBondContact O-N 3.49Å; E495-T498 PolarHBondContact O-N 2.89Å; E495-N499 WeakPolarHBondContact O-CB 3.27Å; E495-N499 VanDerWaalsContact O-CG 3.29Å; E495-N499 PolarHBondContact O-N 2.85Å; E495-N499 PolarHBondContact O-ND2 3.39Å
496	D	67.8	Low	67.3	Low	24 Å²	24	68 Å²	68	13%	0.128	37%	0.374	C	S	.	.	H	α-helix	trans	-62.2	-47	174.9	-77.7	-12.5	0	0	0	111.2	I472 H492 T498 N499 D500	I472-D496 WeakPolarHBondContact CD1-OD2 3.47Å; H492-D496 WeakPolarHBondContact O-CB 3.34Å; H492-D496 PolarHBondContact O-N 2.92Å; D496-T498 VanDerWaalsContact C-N 3.31Å; D496-T498 PolarHBondContact O-N 2.86Å; D496-N499 PolarHBondContact O-N 3.25Å; D496-D500 PolarHBondContact O-N 3.32Å
497	L	71.8	Confident	68.5	Low	36 Å²	36	68.8 Å²	68.8	19%	0.188	38%	0.375	C	S	.	.	H	α-helix	trans	-60.8	-38.3	175.9	-177.2	65.3	0	0	0	112.4	I10 V493 L501	I10-L497 HydrophobicContact CG2-CD1 4.06Å; V493-L497 VanDerWaalsContact O-CB 3.28Å; V493-L497 WeakPolarHBondContact O-CB 3.14Å; V493-L497 PolarHBondContact O-N 3.39Å; L497-L501 HydrophobicContact CG-CD1 4.3Å; L497-L501 WeakPolarHBondContact O-CB 3.38Å; L497-L501 VanDerWaalsContact O-CG 3.28Å; L497-L501 WeakPolarHBondContact O-CG 3.36Å; L497-L501 PolarHBondContact O-N 2.91Å
498	T	71.8	Confident	69.5	Low	74 Å²	74	67.2 Å²	67.2	45%	0.454	36%	0.363	S	S	.	.	H	α-helix	trans	-70.1	-40.2	177.3	-58.3	0	0	0	0	111.2	C494 E495 D496 L501 I502	C494-T498 VanDerWaalsContact O-CB 3.23Å; C494-T498 WeakPolarHBondContact O-CB 3.39Å; C494-T498 PolarHBondContact O-N 2.84Å; C494-T498 PolarHBondContact O-OG1 3.48Å; E495-T498 PolarHBondContact O-N 2.89Å; D496-T498 VanDerWaalsContact C-N 3.31Å; D496-T498 PolarHBondContact O-N 2.86Å; T498-L501 PolarHBondContact O-N 3.03Å; T498-I502 HydrophobicContact CG2-CD1 3.88Å; T498-I502 HydrophobicContact CG2-CG1 4.48Å; T498-I502 WeakPolarHBondContact O-CB 3.35Å; T498-I502 VanDerWaalsContact O-CG1 3.23Å; T498-I502 WeakPolarHBondContact O-CG1 3.3Å; T498-I502 PolarHBondContact O-N 2.85Å
499	N	75.5	Confident	70.5	Confident	53 Å²	53	71 Å²	71	28%	0.283	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-41	175	-77.7	-51.5	0	0	0	111.8	E495 D496 I502 Q503	E495-N499 WeakPolarHBondContact O-CB 3.27Å; E495-N499 VanDerWaalsContact O-CG 3.29Å; E495-N499 PolarHBondContact O-N 2.85Å; E495-N499 PolarHBondContact O-ND2 3.39Å; D496-N499 PolarHBondContact O-N 3.25Å; N499-I502 PolarHBondContact O-N 3.2Å; N499-Q503 WeakPolarHBondContact O-CB 3.38Å; N499-Q503 PolarHBondContact O-N 3Å
500	D	73.4	Confident	71.7	Confident	73 Å²	73	75.8 Å²	75.8	39%	0.39	39%	0.394	S	S	.	.	H	α-helix	trans	-62.3	-48.1	174.5	-77.9	-11	0	0	0	110.9	R14 D496 I502 Q503 E504	R14-D500 IonicContact NH1-OD2 2.77Å; R14-D500 PolarHBondContact NH1-OD2 2.93Å; D496-D500 PolarHBondContact O-N 3.32Å; D500-I502 VanDerWaalsContact C-N 3.35Å; D500-I502 PolarHBondContact O-N 2.88Å; D500-Q503 PolarHBondContact O-N 2.77Å; D500-Q503 VanDerWaalsContact O-N 3.16Å; D500-E504 WeakPolarHBondContact O-CB 3.43Å; D500-E504 PolarHBondContact O-N 3.41Å
501	L	72.5	Confident	72.8	Confident	71 Å²	71	80 Å²	80	37%	0.372	41%	0.411	S	S	.	.	H	α-helix	trans	-61	-38.8	176.2	-76	168.7	0	0	0	113.1	I10 L497 T498 A505	I10-L501 HydrophobicContact CD1-CD2 4.15Å; I10-L501 HydrophobicContact CG1-CD2 4.03Å; L497-L501 HydrophobicContact CG-CD1 4.3Å; L497-L501 WeakPolarHBondContact O-CB 3.38Å; L497-L501 VanDerWaalsContact O-CG 3.28Å; L497-L501 WeakPolarHBondContact O-CG 3.36Å; L497-L501 PolarHBondContact O-N 2.91Å; T498-L501 PolarHBondContact O-N 3.03Å; L501-A505 WeakPolarHBondContact O-CB 3.46Å; L501-A505 PolarHBondContact O-N 3.39Å
502	I	75.3	Confident	73.8	Confident	99 Å²	99	76.8 Å²	76.8	51%	0.508	40%	0.397	S	S	.	.	H	α-helix	trans	-66.9	-41.3	175	-71.4	166.8	0	0	0	110.4	T498 N499 D500 A505 V506	T498-I502 HydrophobicContact CG2-CD1 3.88Å; T498-I502 HydrophobicContact CG2-CG1 4.48Å; T498-I502 WeakPolarHBondContact O-CB 3.35Å; T498-I502 VanDerWaalsContact O-CG1 3.23Å; T498-I502 WeakPolarHBondContact O-CG1 3.3Å; T498-I502 PolarHBondContact O-N 2.85Å; N499-I502 PolarHBondContact O-N 3.2Å; D500-I502 VanDerWaalsContact C-N 3.35Å; D500-I502 PolarHBondContact O-N 2.88Å; I502-A505 PolarHBondContact O-N 2.86Å; I502-V506 HydrophobicContact CG2-CG2 4.45Å; I502-V506 WeakPolarHBondContact O-CB 3.41Å; I502-V506 VanDerWaalsContact O-CG2 3.24Å; I502-V506 WeakPolarHBondContact O-CG2 3.39Å; I502-V506 PolarHBondContact O-N 2.71Å
503	Q	77.5	Confident	74.8	Confident	89 Å²	89	77.1 Å²	77.1	42%	0.416	40%	0.401	S	S	.	.	H	α-helix	trans	-65.6	-44	178	-173.9	64.2	61.7	0	0	111.3	N499 D500 V506 D507	N499-Q503 WeakPolarHBondContact O-CB 3.38Å; N499-Q503 PolarHBondContact O-N 3Å; D500-Q503 PolarHBondContact O-N 2.77Å; D500-Q503 VanDerWaalsContact O-N 3.16Å; Q503-V506 PolarHBondContact O-N 3Å; Q503-D507 PolarHBondContact NE2-OD1 3.23Å; Q503-D507 PolarHBondContact NE2-OD2 3.25Å; Q503-D507 WeakPolarHBondContact O-CB 3.43Å; Q503-D507 PolarHBondContact O-N 3.19Å
504	E	76.9	Confident	75.8	Confident	89 Å²	89	81.2 Å²	81.2	42%	0.416	42%	0.422	S	S	.	.	H	α-helix	trans	-58.2	-48.3	175.1	-173.8	179.5	-177.6	0	0	111.5	D500 V506 D507 E508	D500-E504 WeakPolarHBondContact O-CB 3.43Å; D500-E504 PolarHBondContact O-N 3.41Å; E504-V506 VanDerWaalsContact C-N 3.34Å; E504-V506 PolarHBondContact O-N 3.27Å; E504-D507 PolarHBondContact O-N 2.94Å; E504-E508 PolarHBondContact O-N 3.46Å
505	A	71.9	Confident	76.9	Confident	56 Å²	56	84.7 Å²	84.7	46%	0.463	43%	0.428	S	S	.	.	H	α-helix	trans	-64.4	-34.5	177.2	0	0	0	0	0	113.3	L501 I502 L509	L501-A505 WeakPolarHBondContact O-CB 3.46Å; L501-A505 PolarHBondContact O-N 3.39Å; I502-A505 PolarHBondContact O-N 2.86Å; A505-L509 VanDerWaalsContact O-CB 3.3Å; A505-L509 WeakPolarHBondContact O-CB 3.33Å; A505-L509 PolarHBondContact O-N 3.32Å
506	V	76.1	Confident	77.5	Confident	75 Å²	75	83.1 Å²	83.1	46%	0.455	43%	0.425	S	S	.	.	H	α-helix	trans	-70.1	-39.8	174.2	166.6	0	0	0	0	111.2	I502 Q503 E504 L509 Y510	I502-V506 HydrophobicContact CG2-CG2 4.45Å; I502-V506 WeakPolarHBondContact O-CB 3.41Å; I502-V506 VanDerWaalsContact O-CG2 3.24Å; I502-V506 WeakPolarHBondContact O-CG2 3.39Å; I502-V506 PolarHBondContact O-N 2.71Å; Q503-V506 PolarHBondContact O-N 3Å; E504-V506 VanDerWaalsContact C-N 3.34Å; E504-V506 PolarHBondContact O-N 3.27Å; V506-L509 PolarHBondContact O-N 2.9Å; V506-Y510 WeakPolarHBondContact O-CB 3.46Å; V506-Y510 PolarHBondContact O-N 2.93Å
507	D	80	Confident	78.2	Confident	72 Å²	72	84.2 Å²	84.2	39%	0.385	44%	0.437	S	S	.	.	H	α-helix	trans	-71.8	-35.1	179.2	-67.9	-18.5	0	0	0	111.6	Q503 E504 Y510 Q511	Q503-D507 PolarHBondContact NE2-OD1 3.23Å; Q503-D507 PolarHBondContact NE2-OD2 3.25Å; Q503-D507 WeakPolarHBondContact O-CB 3.43Å; Q503-D507 PolarHBondContact O-N 3.19Å; E504-D507 PolarHBondContact O-N 2.94Å; D507-Y510 PolarHBondContact O-N 3.25Å; D507-Q511 WeakPolarHBondContact O-CB 3.13Å; D507-Q511 VanDerWaalsContact O-CG 3.28Å; D507-Q511 WeakPolarHBondContact O-CG 3.37Å; D507-Q511 PolarHBondContact O-N 2.71Å; D507-Q511 PolarHBondContact O-NE2 3Å; D507-Q511 VanDerWaalsContact O-NE2 3.13Å
508	E	78.1	Confident	78.7	Confident	100 Å²	100	85.2 Å²	85.2	47%	0.467	45%	0.447	S	S	.	.	H	α-helix	trans	-66.6	-43.7	170.5	-172	-172.6	-173.2	0	0	111.6	E504 Y510 Q511 T512	E504-E508 PolarHBondContact O-N 3.46Å; E508-Y510 VanDerWaalsContact C-N 3.31Å; E508-Y510 PolarHBondContact O-N 2.92Å; E508-Q511 PolarHBondContact O-N 2.81Å; E508-T512 WeakPolarHBondContact O-CB 3.46Å; E508-T512 PolarHBondContact O-N 3.23Å; E508-T512 PolarHBondContact O-OG1 3.28Å
509	L	79.2	Confident	79.3	Confident	104 Å²	104	85.9 Å²	85.9	55%	0.545	45%	0.446	S	S	.	.	H	α-helix	trans	-60	-43.5	174.5	177.3	63.6	0	0	0	110.9	A505 V506 T512 I513	A505-L509 VanDerWaalsContact O-CB 3.3Å; A505-L509 WeakPolarHBondContact O-CB 3.33Å; A505-L509 PolarHBondContact O-N 3.32Å; V506-L509 PolarHBondContact O-N 2.9Å; L509-T512 PolarHBondContact O-N 3.21Å; L509-I513 HydrophobicContact CD1-CD1 4Å; L509-I513 HydrophobicContact CD1-CG1 4.31Å; L509-I513 HydrophobicContact CG-CD1 3.93Å; L509-I513 VanDerWaalsContact O-CG1 3.31Å; L509-I513 WeakPolarHBondContact O-CG1 3.39Å; L509-I513 PolarHBondContact O-N 3Å
510	Y	82.2	Confident	79.6	Confident	164 Å²	164	89.2 Å²	89.2	64%	0.643	46%	0.463	S	S	*	.	H	α-helix	trans	-63.1	-46.3	177.8	-167.4	-93.2	0	0	0	111.6	V506 D507 E508 T512 I513 D514	V506-Y510 WeakPolarHBondContact O-CB 3.46Å; V506-Y510 PolarHBondContact O-N 2.93Å; D507-Y510 PolarHBondContact O-N 3.25Å; E508-Y510 VanDerWaalsContact C-N 3.31Å; E508-Y510 PolarHBondContact O-N 2.92Å; Y510-T512 VanDerWaalsContact C-N 3.3Å; Y510-T512 PolarHBondContact O-N 3.34Å; Y510-I513 PolarHBondContact O-N 2.84Å; Y510-D514 WeakPolarHBondContact O-CB 3.28Å; Y510-D514 PolarHBondContact O-N 3.24Å
511	Q	82.4	Confident	80	Confident	132 Å²	132	89.3 Å²	89.3	62%	0.617	47%	0.466	S	S	*	.	H	α-helix	trans	-61.4	-36.7	174.1	-74.1	170.2	67.3	0	0	112.6	D507 E508 D514 R515	D507-Q511 WeakPolarHBondContact O-CB 3.13Å; D507-Q511 VanDerWaalsContact O-CG 3.28Å; D507-Q511 WeakPolarHBondContact O-CG 3.37Å; D507-Q511 PolarHBondContact O-N 2.71Å; D507-Q511 PolarHBondContact O-NE2 3Å; D507-Q511 VanDerWaalsContact O-NE2 3.13Å; E508-Q511 PolarHBondContact O-N 2.81Å; Q511-D514 PolarHBondContact O-N 3.47Å; Q511-R515 VanDerWaalsContact O-CB 3.28Å; Q511-R515 WeakPolarHBondContact O-CB 3.15Å; Q511-R515 PolarHBondContact O-N 3.42Å
512	T	82.4	Confident	80.4	Confident	57 Å²	57	90 Å²	90	35%	0.35	47%	0.47	S	S	.	.	H	α-helix	trans	-69.4	-38.9	177.2	-61.8	0	0	0	0	111.8	E508 L509 Y510 T516	E508-T512 WeakPolarHBondContact O-CB 3.46Å; E508-T512 PolarHBondContact O-N 3.23Å; E508-T512 PolarHBondContact O-OG1 3.28Å; L509-T512 PolarHBondContact O-N 3.21Å; Y510-T512 VanDerWaalsContact C-N 3.3Å; Y510-T512 PolarHBondContact O-N 3.34Å; T512-T516 WeakPolarHBondContact O-CB 3.29Å; T512-T516 WeakPolarHBondContact O-CG2 3.29Å; T512-T516 PolarHBondContact O-N 3.44Å; T512-T516 PolarHBondContact O-OG1 3.25Å
513	I	83	Confident	80.5	Confident	93 Å²	93	90.6 Å²	90.6	48%	0.477	47%	0.47	S	S	.	.	H	α-helix	trans	-66.9	-45.2	173.5	-69.8	167.4	0	0	0	110.1	L509 Y510 R515 T516 A517	L509-I513 HydrophobicContact CD1-CD1 4Å; L509-I513 HydrophobicContact CD1-CG1 4.31Å; L509-I513 HydrophobicContact CG-CD1 3.93Å; L509-I513 VanDerWaalsContact O-CG1 3.31Å; L509-I513 WeakPolarHBondContact O-CG1 3.39Å; L509-I513 PolarHBondContact O-N 3Å; Y510-I513 PolarHBondContact O-N 2.84Å; I513-R515 PolarHBondContact O-N 3.2Å; I513-T516 WeakPolarHBondContact CA-OG1 3.05Å; I513-T516 PolarHBondContact O-N 2.9Å; I513-T516 PolarHBondContact O-OG1 3.49Å; I513-A517 WeakPolarHBondContact O-CB 3.49Å; I513-A517 PolarHBondContact O-N 3.05Å
514	D	83.6	Confident	80.6	Confident	95 Å²	95	91.5 Å²	91.5	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-39.5	179.5	-163.1	51.1	0	0	0	111.8	Y510 Q511 S518	Y510-D514 WeakPolarHBondContact O-CB 3.28Å; Y510-D514 PolarHBondContact O-N 3.24Å; Q511-D514 PolarHBondContact O-N 3.47Å; D514-S518 VanDerWaalsContact O-CB 3.26Å; D514-S518 WeakPolarHBondContact O-CB 3.4Å; D514-S518 PolarHBondContact O-N 2.65Å; D514-S518 PolarHBondContact O-OG 2.75Å
515	R	83.8	Confident	80.6	Confident	126 Å²	126	91 Å²	91	48%	0.475	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-48.4	172	-173.8	-176.8	64.5	76.9	8.8	112.1	Q511 I513 S518 E519	Q511-R515 VanDerWaalsContact O-CB 3.28Å; Q511-R515 WeakPolarHBondContact O-CB 3.15Å; Q511-R515 PolarHBondContact O-N 3.42Å; I513-R515 PolarHBondContact O-N 3.2Å; R515-S518 PolarHBondContact O-N 3.08Å; R515-E519 WeakPolarHBondContact CG-OE1 3.43Å; R515-E519 IonicContact CZ-OE1 3.29Å; R515-E519 IonicContact CZ-OE2 3.38Å; R515-E519 IonicContact NH1-OE1 3.28Å; R515-E519 PolarHBondContact NH1-OE1 3.28Å; R515-E519 IonicContact NH1-OE2 3.67Å; R515-E519 PolarHBondContact NH1-OE2 3.3Å; R515-E519 WeakPolarHBondContact O-CB 3.38Å; R515-E519 WeakPolarHBondContact O-CG 3.47Å; R515-E519 PolarHBondContact O-N 3.44Å
516	T	82.8	Confident	80.9	Confident	63 Å²	63	93 Å²	93	39%	0.387	48%	0.475	S	S	.	.	H	α-helix	trans	-70.9	-32.2	-178.8	49.9	0	0	0	0	112.5	T512 I513 L520	T512-T516 WeakPolarHBondContact O-CB 3.29Å; T512-T516 WeakPolarHBondContact O-CG2 3.29Å; T512-T516 PolarHBondContact O-N 3.44Å; T512-T516 PolarHBondContact O-OG1 3.25Å; I513-T516 WeakPolarHBondContact CA-OG1 3.05Å; I513-T516 PolarHBondContact O-N 2.9Å; I513-T516 PolarHBondContact O-OG1 3.49Å; T516-L520 VanDerWaalsContact O-CB 3.27Å; T516-L520 WeakPolarHBondContact O-CB 3.45Å; T516-L520 PolarHBondContact O-N 3.45Å
517	A	82.6	Confident	80.5	Confident	47 Å²	47	93 Å²	93	39%	0.388	48%	0.483	S	S	.	.	H	α-helix	trans	-65.4	-42.9	169.3	0	0	0	0	0	111.5	I513 L520 V521	I513-A517 WeakPolarHBondContact O-CB 3.49Å; I513-A517 PolarHBondContact O-N 3.05Å; A517-L520 PolarHBondContact O-N 3.1Å; A517-V521 WeakPolarHBondContact O-CB 3.45Å; A517-V521 VanDerWaalsContact O-CG2 3.29Å; A517-V521 WeakPolarHBondContact O-CG2 3.25Å; A517-V521 PolarHBondContact O-N 3.33Å
518	S	81.6	Confident	80	Confident	57 Å²	57	97.1 Å²	97.1	40%	0.399	50%	0.5	S	S	.	.	H	α-helix	trans	-63.7	-44.9	175.2	-61.7	0	0	0	0	111.9	D514 R515 L520 V521 D522	D514-S518 VanDerWaalsContact O-CB 3.26Å; D514-S518 WeakPolarHBondContact O-CB 3.4Å; D514-S518 PolarHBondContact O-N 2.65Å; D514-S518 PolarHBondContact O-OG 2.75Å; R515-S518 PolarHBondContact O-N 3.08Å; S518-L520 PolarHBondContact O-N 3.02Å; S518-V521 PolarHBondContact O-N 2.89Å; S518-D522 WeakPolarHBondContact O-CB 3.42Å; S518-D522 PolarHBondContact O-N 2.88Å
519	E	83.7	Confident	78.9	Confident	89 Å²	89	98.9 Å²	98.9	42%	0.416	51%	0.512	S	S	.	.	H	α-helix	trans	-62	-40.6	175.1	-76.3	169.2	-175.9	0	0	111.8	R515 D522 E523	R515-E519 WeakPolarHBondContact CG-OE1 3.43Å; R515-E519 IonicContact CZ-OE1 3.29Å; R515-E519 IonicContact CZ-OE2 3.38Å; R515-E519 IonicContact NH1-OE1 3.28Å; R515-E519 PolarHBondContact NH1-OE1 3.28Å; R515-E519 IonicContact NH1-OE2 3.67Å; R515-E519 PolarHBondContact NH1-OE2 3.3Å; R515-E519 WeakPolarHBondContact O-CB 3.38Å; R515-E519 WeakPolarHBondContact O-CG 3.47Å; R515-E519 PolarHBondContact O-N 3.44Å; E519-D522 PolarHBondContact O-N 3.05Å; E519-E523 WeakPolarHBondContact O-CG 3.29Å; E519-E523 PolarHBondContact O-N 2.72Å
520	L	82.4	Confident	77.2	Confident	122 Å²	122	99.7 Å²	99.7	64%	0.639	52%	0.516	S	S	*	.	H	α-helix	trans	-68.4	-36	175.9	-175	143.9	0	0	0	112.3	T516 A517 S518 L524	T516-L520 VanDerWaalsContact O-CB 3.27Å; T516-L520 WeakPolarHBondContact O-CB 3.45Å; T516-L520 PolarHBondContact O-N 3.45Å; A517-L520 PolarHBondContact O-N 3.1Å; S518-L520 PolarHBondContact O-N 3.02Å; L520-L524 VanDerWaalsContact O-CB 3.3Å; L520-L524 WeakPolarHBondContact O-CB 3.32Å; L520-L524 PolarHBondContact O-N 2.8Å
521	V	82.1	Confident	75.5	Confident	75 Å²	75	96.8 Å²	96.8	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-66.4	-42.4	171.9	167	0	0	0	0	110.7	A517 S518 L524 I525	A517-V521 WeakPolarHBondContact O-CB 3.45Å; A517-V521 VanDerWaalsContact O-CG2 3.29Å; A517-V521 WeakPolarHBondContact O-CG2 3.25Å; A517-V521 PolarHBondContact O-N 3.33Å; S518-V521 PolarHBondContact O-N 2.89Å; V521-L524 PolarHBondContact O-N 3.19Å; V521-I525 HydrophobicContact CG1-CD1 3.68Å; V521-I525 HydrophobicContact CG1-CG1 4.44Å; V521-I525 WeakPolarHBondContact O-CB 3.43Å; V521-I525 WeakPolarHBondContact O-CG1 3.38Å; V521-I525 PolarHBondContact O-N 3.35Å
522	D	80.2	Confident	73.2	Confident	86 Å²	86	98.9 Å²	98.9	46%	0.46	53%	0.527	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176	-82.6	-10.8	0	0	0	112.2	S518 E519 I525 K526	S518-D522 WeakPolarHBondContact O-CB 3.42Å; S518-D522 PolarHBondContact O-N 2.88Å; E519-D522 PolarHBondContact O-N 3.05Å; D522-I525 PolarHBondContact O-N 3.23Å; D522-K526 WeakPolarHBondContact O-CB 3.2Å; D522-K526 VanDerWaalsContact O-CG 3.23Å; D522-K526 WeakPolarHBondContact O-CG 3.37Å; D522-K526 PolarHBondContact O-N 2.79Å
523	E	79.1	Confident	71.1	Confident	111 Å²	111	99.4 Å²	99.4	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-67.7	-37.5	174.1	-70.7	-53.8	130.7	0	0	112.2	E519 K526 A527	E519-E523 WeakPolarHBondContact O-CG 3.29Å; E519-E523 PolarHBondContact O-N 2.72Å; E523-K526 PolarHBondContact O-N 3.42Å; E523-K526 IonicContact OE1-NZ 3.99Å; E523-K526 PolarHBondContact OE1-NZ 2.72Å; E523-A527 WeakPolarHBondContact O-CB 3.37Å; E523-A527 PolarHBondContact O-N 3.37Å
524	L	78.4	Confident	69	Low	109 Å²	109	99.6 Å²	99.6	57%	0.571	55%	0.545	S	S	*	.	H	α-helix	trans	-62.7	-45	172.7	-165.7	83.6	0	0	0	111	L520 V521 A527 E528	L520-L524 VanDerWaalsContact O-CB 3.3Å; L520-L524 WeakPolarHBondContact O-CB 3.32Å; L520-L524 PolarHBondContact O-N 2.8Å; V521-L524 PolarHBondContact O-N 3.19Å; L524-A527 PolarHBondContact O-N 3.23Å; L524-E528 WeakPolarHBondContact O-CB 3.38Å; L524-E528 PolarHBondContact O-N 3.2Å
525	I	78	Confident	66.6	Low	79 Å²	79	102.1 Å²	102.1	41%	0.405	56%	0.558	S	S	.	*	H	α-helix	trans	-63	-40.6	176.2	-74.1	168.2	0	0	0	110.8	V521 D522 E528 L529	V521-I525 HydrophobicContact CG1-CD1 3.68Å; V521-I525 HydrophobicContact CG1-CG1 4.44Å; V521-I525 WeakPolarHBondContact O-CB 3.43Å; V521-I525 WeakPolarHBondContact O-CG1 3.38Å; V521-I525 PolarHBondContact O-N 3.35Å; D522-I525 PolarHBondContact O-N 3.23Å; I525-E528 PolarHBondContact O-N 3.33Å; I525-L529 HydrophobicContact CG2-CD1 3.53Å; I525-L529 HydrophobicContact CG2-CG 4.29Å; I525-L529 WeakPolarHBondContact O-CB 3.47Å; I525-L529 VanDerWaalsContact O-CG 3.25Å; I525-L529 WeakPolarHBondContact O-CG 3.38Å; I525-L529 PolarHBondContact O-N 2.78Å
526	K	77.9	Confident	64.2	Low	98 Å²	98	101.6 Å²	101.6	43%	0.426	56%	0.563	S	S	.	*	H	α-helix	trans	-64	-45.6	173.4	-73.3	167.5	-157.6	167.2	0	111.6	D522 E523 E528 L529 L530	D522-K526 WeakPolarHBondContact O-CB 3.2Å; D522-K526 VanDerWaalsContact O-CG 3.23Å; D522-K526 WeakPolarHBondContact O-CG 3.37Å; D522-K526 PolarHBondContact O-N 2.79Å; E523-K526 PolarHBondContact O-N 3.42Å; E523-K526 IonicContact OE1-NZ 3.99Å; E523-K526 PolarHBondContact OE1-NZ 2.72Å; K526-E528 VanDerWaalsContact C-N 3.26Å; K526-E528 PolarHBondContact O-N 2.96Å; K526-L529 PolarHBondContact O-N 3.28Å; K526-L530 WeakPolarHBondContact O-CB 3.36Å; K526-L530 PolarHBondContact O-N 3.38Å
527	A	67.7	Low	61.7	Low	74 Å²	74	104 Å²	104	61%	0.612	58%	0.578	S	S	*	*	H	α-helix	trans	-64.6	-29.7	178.9	0	0	0	0	0	112.9	E523 L524	E523-A527 WeakPolarHBondContact O-CB 3.37Å; E523-A527 PolarHBondContact O-N 3.37Å; L524-A527 PolarHBondContact O-N 3.23Å
528	E	69.1	Low	59.3	Low	159 Å²	159	107.6 Å²	107.6	74%	0.743	59%	0.59	S	S	*	*	H	α-helix	trans	-85.1	-28.9	175.5	-164.1	167.5	-166.5	0	0	113	L524 I525 K526	L524-E528 WeakPolarHBondContact O-CB 3.38Å; L524-E528 PolarHBondContact O-N 3.2Å; I525-E528 PolarHBondContact O-N 3.33Å; K526-E528 VanDerWaalsContact C-N 3.26Å; K526-E528 PolarHBondContact O-N 2.96Å
529	L	53.9	Low	56.7	Low	136 Å²	136	109.4 Å²	109.4	71%	0.712	60%	0.603	S	S	*	*	H	α-helix	trans	-86.2	-26.4	176.7	-75.7	172.6	0	0	0	114.6	I525 K526 P531	I525-L529 HydrophobicContact CG2-CD1 3.53Å; I525-L529 HydrophobicContact CG2-CG 4.29Å; I525-L529 WeakPolarHBondContact O-CB 3.47Å; I525-L529 VanDerWaalsContact O-CG 3.25Å; I525-L529 WeakPolarHBondContact O-CG 3.38Å; I525-L529 PolarHBondContact O-N 2.78Å; K526-L529 PolarHBondContact O-N 3.28Å; L529-P531 WeakPolarHBondContact O-CD 3.35Å
530	L	44.2	Very low	54.2	Low	121 Å²	121	114.7 Å²	114.7	63%	0.634	63%	0.625	S	S	*	*			trans	-109	76.5	170.9	-73.8	150.7	0	0	0	108.7	K526 E532	K526-L530 WeakPolarHBondContact O-CB 3.36Å; K526-L530 PolarHBondContact O-N 3.38Å; L530-E532 PolarHBondContact O-N 2.81Å
531	P	46.7	Very low	51.5	Low	104 Å²	104	114.7 Å²	114.7	68%	0.675	63%	0.625	S	S	*	*			trans	-71	68.8	157.3	35.1	-34.6	0	0	0	108.3	L529 A533	L529-P531 WeakPolarHBondContact O-CD 3.35Å; P531-A533 PolarHBondContact O-N 3.49Å
532	E	34.9	Very low	49	Very low	176 Å²	176	118.6 Å²	118.6	82%	0.822	64%	0.636	S	S	*	*			trans	-65.6	76.1	137.4	-77.7	-163.8	158.3	0	0	105.8	L530 P534	L530-E532 PolarHBondContact O-N 2.81Å; E532-P534 WeakPolarHBondContact O-CD 3.48Å; E532-P534 VanDerWaalsContact O-N 3.11Å
533	A	38.1	Very low	46.4	Very low	67 Å²	67	121.1 Å²	121.1	55%	0.554	66%	0.659	S	S	*	*			trans	-53.2	115.2	149.9	0	0	0	0	0	104.5	P531 D535	P531-A533 PolarHBondContact O-N 3.49Å; A533-D535 PolarHBondContact O-N 2.79Å
534	P	37.6	Very low	44.1	Very low	98 Å²	98	121.3 Å²	121.3	64%	0.636	66%	0.664	S	S	*	*			trans	-62.1	118.8	158.2	31	-31.5	0	0	0	103.2	E532 I536	E532-P534 WeakPolarHBondContact O-CD 3.48Å; E532-P534 VanDerWaalsContact O-N 3.11Å; P534-I536 HydrophobicContact CB-CD1 4.29Å; P534-I536 HydrophobicContact CB-CG1 3.78Å; P534-I536 HydrophobicContact CG-CD1 4.12Å; P534-I536 HydrophobicContact CG-CG1 3.98Å; P534-I536 PolarHBondContact O-N 2.99Å
535	D	33.6	Very low	41.7	Very low	147 Å²	147	124.1 Å²	124.1	79%	0.786	67%	0.674	S	S	*	*			trans	-66.1	62.6	163.7	-81.7	-40.2	0	0	0	107.9	A533 T537	A533-D535 PolarHBondContact O-N 2.79Å; D535-T537 PolarHBondContact O-N 2.93Å
536	I	34.6	Very low	39.6	Very low	116 Å²	116	127.1 Å²	127.1	60%	0.595	69%	0.691	S	S	*	*			trans	-71.8	72.5	152	-37.6	-178.5	0	0	0	104.4	P534 L538	P534-I536 HydrophobicContact CB-CD1 4.29Å; P534-I536 HydrophobicContact CB-CG1 3.78Å; P534-I536 HydrophobicContact CG-CD1 4.12Å; P534-I536 HydrophobicContact CG-CG1 3.98Å; P534-I536 PolarHBondContact O-N 2.99Å; I536-L538 HydrophobicContact CG2-CD2 3.66Å; I536-L538 HydrophobicContact CG2-CG 3.77Å; I536-L538 PolarHBondContact O-N 3.46Å
537	T	29.2	Very low	38.2	Very low	112 Å²	112	127.2 Å²	127.2	69%	0.687	70%	0.701	S	S	*	*			trans	-49.6	90.4	137.6	48	0	0	0	0	105.8	D535 S539	D535-T537 PolarHBondContact O-N 2.93Å; T537-S539 PolarHBondContact O-N 3.19Å
538	L	32.6	Very low	36.6	Very low	124 Å²	124	132.3 Å²	132.3	65%	0.649	71%	0.712	S	S	*	*			trans	-62.5	84.3	157	-74.3	175.3	0	0	0	104.5	I536 F540	I536-L538 HydrophobicContact CG2-CD2 3.66Å; I536-L538 HydrophobicContact CG2-CG 3.77Å; I536-L538 PolarHBondContact O-N 3.46Å; L538-F540 HydrophobicContact CB-CE2 4.19Å; L538-F540 WeakPolarHBondContact O-CD2 3.17Å; L538-F540 PolarHBondContact O-N 2.89Å
539	S	26.8	Very low	34.7	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	72%	0.716	S	S	*	*			trans	-60.6	94.6	168.2	47.1	0	0	0	0	106.1	T537 D541	T537-S539 PolarHBondContact O-N 3.19Å; S539-D541 PolarHBondContact O-N 2.77Å
540	F	30.6	Very low	33.7	Very low	200 Å²	200	129.8 Å²	129.8	88%	0.877	72%	0.722	S	S	*	*			trans	-67	59.5	162.4	-71.6	-85.8	0	0	0	108.9	L538	L538-F540 HydrophobicContact CB-CE2 4.19Å; L538-F540 WeakPolarHBondContact O-CD2 3.17Å; L538-F540 PolarHBondContact O-N 2.89Å
541	D	26.6	Very low	33	Very low	122 Å²	122	129 Å²	129	65%	0.652	73%	0.727	S	S	*	*			trans	-132.7	70.5	178.3	-166.9	25	0	0	0	108.2	S539	S539-D541 PolarHBondContact O-N 2.77Å
542	K	28.8	Very low	32.3	Very low	156 Å²	156	129.8 Å²	129.8	68%	0.678	73%	0.73	S	S	*	*				176.3	106.2	113.3	-91.2	170.7	-177.1	-133.3	0	110.7	D544	K542-D544 PolarHBondContact O-N 2.89Å
543	C	25.1	Very low	32	Very low	139 Å²	139	126.9 Å²	126.9	94%	0.939	73%	0.727	S	S	*	*			trans	-75.4	94.5	154.3	-63.3	0	0	0	0	107.3
544	D	31.2	Very low	31.7	Very low	116 Å²	116	128 Å²	128	62%	0.62	74%	0.735	S	S	*	*			trans	-124.6	109.5	166.4	-79.5	-44.2	0	0	0	108.4	K542	K542-D544 PolarHBondContact O-N 2.89Å
545	E	28.8	Very low	31.4	Very low	167 Å²	167	130.1 Å²	130.1	78%	0.78	74%	0.741	S	S	*	*			trans	46.7	106.7	153.9	-49.1	-61.3	176.1	0	0	120.4
546	D	34.1	Very low	31.2	Very low	142 Å²	142	131.9 Å²	131.9	76%	0.759	74%	0.742	S	S	*	*				172.6	170	90.2	-120.8	-19.7	0	0	0	110.7
547	P	49	Very low	31	Very low	100 Å²	100	133.3 Å²	133.3	65%	0.649	75%	0.746	S	S	*	*			trans	-120.6	76	-130.9	31.2	-8.4	0	0	0	113.5
548	H	34.3	Very low	31.3	Very low	182 Å²	182	137.5 Å²	137.5	84%	0.843	76%	0.757	S	S	*	*			trans	-125	76.5	164.6	-70.6	-42.8	0	0	0	111.2	L550	H548-L550 PolarHBondContact O-N 2.79Å
549	G	27.8	Very low	31.5	Very low	80 Å²	80	136 Å²	136	83%	0.825	76%	0.758	S	S	*	*			trans	-68.1	95.3	175.8	0	0	0	0	0	112.5
550	L	33.4	Very low	31.8	Very low	161 Å²	161	136.8 Å²	136.8	84%	0.843	75%	0.754	S	S	*	*			trans	-118.7	100.2	160.6	-74.5	178.1	0	0	0	110	H548	H548-L550 PolarHBondContact O-N 2.79Å
551	S	29.5	Very low	31.7	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	75%	0.751	S	S	*	*			trans	30.9	106.5	148.9	-58	0	0	0	0	118.9
552	T	31.2	Very low	31.8	Very low	121 Å²	121	136.3 Å²	136.3	74%	0.742	76%	0.758	S	S	*	*			trans	54.4	119.5	135.2	-31.6	0	0	0	0	117.5	A554	T552-A554 PolarHBondContact O-N 3.18Å
553	P	30.1	Very low	31.9	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	76%	0.756	S	S	*	*			trans	-57.2	123.4	167.7	26.9	-33.2	0	0	0	108.3	L555	P553-L555 PolarHBondContact O-N 3.25Å
554	A	30.8	Very low	32	Very low	89 Å²	89	136.8 Å²	136.8	74%	0.736	76%	0.756	S	S	*	*			trans	-59.3	106.5	176.7	0	0	0	0	0	107.7	T552 F556	T552-A554 PolarHBondContact O-N 3.18Å; A554-F556 PolarHBondContact O-N 3.31Å
555	L	30.6	Very low	32	Very low	144 Å²	144	139 Å²	139	75%	0.754	76%	0.762	S	S	*	*			trans	-57.4	111.5	164.5	-73.6	166.7	0	0	0	105.6	P553 H557	P553-L555 PolarHBondContact O-N 3.25Å; L555-H557 PolarHBondContact O-CD2 3.29Å; L555-H557 PolarHBondContact O-N 3.42Å
556	F	30.9	Very low	32.1	Very low	184 Å²	184	139.9 Å²	139.9	81%	0.807	76%	0.764	S	S	*	*			trans	-48.2	103.4	174.3	-73.8	-86.7	0	0	0	108.2	A554 D560	A554-F556 PolarHBondContact O-N 3.31Å; F556-D560 HydrophobicContact CD1-CB 4.33Å; F556-D560 WeakPolarHBondContact CD1-OD2 3.39Å
557	H	29.5	Very low	31.8	Very low	145 Å²	145	141.5 Å²	141.5	67%	0.671	77%	0.773	S	S	*	*			trans	-72.3	152.8	173.8	-87	-81	0	0	0	107	L555 S559 D560	L555-H557 PolarHBondContact O-CD2 3.29Å; L555-H557 PolarHBondContact O-N 3.42Å; H557-S559 PolarHBondContact O-N 3.49Å; H557-D560 PolarHBondContact O-N 3.24Å
558	Q	35.8	Very low	30.8	Very low	200 Å²	200	140 Å²	140	94%	0.935	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	25.5	-171.2	-151.3	169.4	1.9	0	0	114
559	S	36.2	Very low	30.5	Very low	94 Å²	94	137.3 Å²	137.3	66%	0.657	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-10.7	175.4	-50.2	0	0	0	0	112.7	H557 L561	H557-S559 PolarHBondContact O-N 3.49Å; S559-L561 PolarHBondContact O-N 3.1Å
560	D	33.5	Very low	30.6	Very low	111 Å²	111	138.9 Å²	138.9	59%	0.594	76%	0.76	S	S	*	*	S	Bend	trans	-85.9	13.4	-177.9	-59.4	-30	0	0	0	113.2	F556 H557	F556-D560 HydrophobicContact CD1-CB 4.33Å; F556-D560 WeakPolarHBondContact CD1-OD2 3.39Å; H557-D560 PolarHBondContact O-N 3.24Å
561	L	28.2	Very low	30.2	Very low	153 Å²	153	137.2 Å²	137.2	80%	0.801	76%	0.757	S	S	*	*	S	Bend	trans	-132.1	123.7	171.9	-85	160.1	0	0	0	107.7	S559	S559-L561 PolarHBondContact O-N 3.1Å
562	I	28.4	Very low	30	Very low	158 Å²	158	141.4 Å²	141.4	81%	0.81	76%	0.758	S	S	*	*	S	Bend	trans	69.8	92.7	-152.8	-44.8	156.6	0	0	0	107.9
563	V	31.6	Very low	29.8	Very low	105 Å²	105	144.7 Å²	144.7	64%	0.636	76%	0.762	S	S	*	*				-146.9	109.6	57.3	173.4	0	0	0	0	110.4	E565	V563-E565 VanDerWaalsContact C-N 3.3Å; V563-E565 HydrophobicContact CG1-CB 3.28Å
564	H	27.2	Very low	29.6	Very low	201 Å²	201	146 Å²	146	93%	0.931	76%	0.763	S	S	*	*			trans	-102.2	54.3	158.9	-135.4	-28.3	0	0	0	107.8
565	E	31.1	Very low	29.5	Very low	161 Å²	161	147.6 Å²	147.6	75%	0.752	77%	0.767	S	S	*	*			trans	-88.4	134.5	176.6	-171.8	169.9	-175.1	0	0	108.6	V563	V563-E565 VanDerWaalsContact C-N 3.3Å; V563-E565 HydrophobicContact CG1-CB 3.28Å
566	F	31	Very low	29.1	Very low	187 Å²	187	147.3 Å²	147.3	82%	0.82	77%	0.766	S	S	*	*			trans	-57.5	133.3	-166.3	-77.9	-110.1	0	0	0	113.3	A568	F566-A568 VanDerWaalsContact C-N 3.26Å; F566-A568 PolarHBondContact O-N 3.34Å
567	D	27.9	Very low	28.8	Very low	176 Å²	176	146.3 Å²	146.3	94%	0.941	76%	0.764	S	S	*	*			trans	-60.1	89.9	156.2	-83.4	-51	0	0	0	109.7
568	A	27.2	Very low	28.8	Very low	68 Å²	68	146.5 Å²	146.5	56%	0.562	77%	0.77	S	S	*	*			trans	-130.7	111.5	163.6	0	0	0	0	0	107.3	F566 V570	F566-A568 VanDerWaalsContact C-N 3.26Å; F566-A568 PolarHBondContact O-N 3.34Å; A568-V570 PolarHBondContact O-N 3.15Å
569	P	27.8	Very low	28.3	Very low	125 Å²	125	144.4 Å²	144.4	81%	0.812	76%	0.76	S	S	*	*			trans	-67.7	100.4	-175.6	25.9	-33.3	0	0	0	110.3	V571	P569-V571 VanDerWaalsContact C-N 3.35Å; P569-V571 PolarHBondContact O-N 2.99Å
570	V	30.1	Very low	27.7	Very low	113 Å²	113	147 Å²	147	69%	0.685	77%	0.772	S	S	*	*			trans	-66.8	97.1	168.6	178.8	0	0	0	0	107.6	A568 Y572	A568-V570 PolarHBondContact O-N 3.15Å; V570-Y572 VanDerWaalsContact C-N 3.35Å; V570-Y572 HydrophobicContact CG1-CD2 4.36Å; V570-Y572 HydrophobicContact CG1-CE2 4.24Å; V570-Y572 WeakPolarHBondContact O-CD2 3.45Å; V570-Y572 PolarHBondContact O-N 2.87Å
571	V	26	Very low	27.4	Very low	127 Å²	127	147 Å²	147	77%	0.77	78%	0.776	S	S	*	*			trans	-66.1	96.5	172.3	178.2	0	0	0	0	108.1	P569 K573	P569-V571 VanDerWaalsContact C-N 3.35Å; P569-V571 PolarHBondContact O-N 2.99Å; V571-K573 PolarHBondContact O-N 2.8Å
572	Y	25	Very low	27.3	Very low	193 Å²	193	144.5 Å²	144.5	76%	0.757	77%	0.772	S	S	*	*			trans	-61	106.9	168.4	-81	-93.3	0	0	0	108.9	V570 D574	V570-Y572 VanDerWaalsContact C-N 3.35Å; V570-Y572 HydrophobicContact CG1-CD2 4.36Å; V570-Y572 HydrophobicContact CG1-CE2 4.24Å; V570-Y572 WeakPolarHBondContact O-CD2 3.45Å; V570-Y572 PolarHBondContact O-N 2.87Å; Y572-D574 PolarHBondContact O-N 2.88Å
573	K	26.7	Very low	27.1	Very low	190 Å²	190	144.2 Å²	144.2	83%	0.826	77%	0.772	S	S	*	*			trans	-78.3	96.9	160.2	-109	-172.3	176.3	-178.6	0	108.1	V571 C575	V571-K573 PolarHBondContact O-N 2.8Å; K573-C575 PolarHBondContact O-N 3.15Å
574	D	25.5	Very low	26.9	Very low	142 Å²	142	145.7 Å²	145.7	76%	0.759	78%	0.781	S	S	*	*			trans	-53.7	119.2	163.5	-73.8	-46.9	0	0	0	109.5	Y572	Y572-D574 PolarHBondContact O-N 2.88Å
575	C	28.4	Very low	26.8	Very low	123 Å²	123	141.9 Å²	141.9	83%	0.831	77%	0.772	S	S	*	*			trans	-113.4	56.3	164.9	-70.8	0	0	0	0	109.1	K573	K573-C575 PolarHBondContact O-N 3.15Å
576	N	23.3	Very low	26.5	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	77%	0.768	S	S	*	*			trans	-77.2	122.3	169.1	-121.5	7.2	0	0	0	109.4
577	E	25	Very low	26.2	Very low	164 Å²	164	136.2 Å²	136.2	77%	0.766	76%	0.761	S	S	*	*			trans	40.7	95	153.6	-58.3	-175.9	149.2	0	0	117.6
578	N	28.8	Very low	25.9	Very low	149 Å²	149	136 Å²	136	80%	0.797	76%	0.76	S	S	*	*			trans	-154.2	106.4	136.6	-97.1	-45.7	0	0	0	112.4
579	Q	25.4	Very low	25.7	Very low	156 Å²	156	140.4 Å²	140.4	73%	0.729	77%	0.768	S	S	*	*			trans	33.7	96.5	142.8	-56.7	-178.2	25.1	0	0	117.6	T581	Q579-T581 PolarHBondContact O-N 3.26Å
580	T	23.9	Very low	25.6	Very low	147 Å²	147	141.4 Å²	141.4	90%	0.902	77%	0.766	S	S	*	*			trans	-68.9	77.1	155.5	-40	0	0	0	0	110	S582	T580-S582 PolarHBondContact O-N 2.82Å
581	T	26.9	Very low	25.3	Very low	111 Å²	111	144 Å²	144	68%	0.681	77%	0.77	S	S	*	*			trans	-80.7	102.3	160.9	42	0	0	0	0	108.5	Q579 N583	Q579-T581 PolarHBondContact O-N 3.26Å; T581-N583 PolarHBondContact O-N 3.15Å
582	S	25.7	Very low	25.1	Very low	102 Å²	102	146.7 Å²	146.7	71%	0.713	77%	0.774	S	S	*	*			trans	-50.2	121	170	51.8	0	0	0	0	111.1	T580	T580-S582 PolarHBondContact O-N 2.82Å
583	N	25.5	Very low	25.2	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	78%	0.78	S	S	*	*			trans	-155.9	47.1	161	-96.9	-21	0	0	0	111	T581	T581-N583 PolarHBondContact O-N 3.15Å
584	V	27	Very low	24.9	Very low	135 Å²	135	141 Å²	141	82%	0.818	77%	0.769	S	S	*	*			trans	-118.5	105	148	-178.1	0	0	0	0	106.2	S586	V584-S586 PolarHBondContact O-N 3.39Å
585	T	25.2	Very low	25	Very low	121 Å²	121	139.6 Å²	139.6	74%	0.742	77%	0.769	S	S	*	*			trans	-66.1	82	175.6	-46.9	0	0	0	0	108.9	I587	T585-I587 VanDerWaalsContact C-N 3.34Å; T585-I587 PolarHBondContact O-N 3.03Å
586	S	25	Very low	24.6	Very low	96 Å²	96	140.4 Å²	140.4	67%	0.671	76%	0.764	S	S	*	*			trans	-69.1	100.6	164.6	64.6	0	0	0	0	106.9	V584 L588	V584-S586 PolarHBondContact O-N 3.39Å; S586-L588 PolarHBondContact O-N 3.09Å
587	I	23.9	Very low	24.6	Very low	133 Å²	133	138.6 Å²	138.6	68%	0.682	76%	0.762	S	S	*	*			trans	-52	104.8	175.9	-65.7	165.5	0	0	0	108.3	T585 E589	T585-I587 VanDerWaalsContact C-N 3.34Å; T585-I587 PolarHBondContact O-N 3.03Å; I587-E589 VanDerWaalsContact C-N 3.35Å; I587-E589 HydrophobicContact CG2-CB 4.05Å
588	L	22.1	Very low	24.4	Very low	172 Å²	172	137.3 Å²	137.3	90%	0.901	76%	0.761	S	S	*	*			trans	-105.9	58	164.4	-109	167.3	0	0	0	107.1	S586	S586-L588 PolarHBondContact O-N 3.09Å
589	E	22.8	Very low	24.4	Very low	160 Å²	160	138 Å²	138	75%	0.748	76%	0.764	S	S	*	*			trans	-123	159.3	168.4	-71.9	-172.4	148.1	0	0	108.7	I587	I587-E589 VanDerWaalsContact C-N 3.35Å; I587-E589 HydrophobicContact CG2-CB 4.05Å
590	I	25.8	Very low	24.2	Very low	147 Å²	147	138.5 Å²	138.5	75%	0.754	77%	0.766	S	S	*	*			trans	71.1	75.8	-167.4	-43.2	175	0	0	0	110.3
591	E	23	Very low	24.4	Very low	166 Å²	166	136 Å²	136	78%	0.776	76%	0.755	S	S	*	*				65.2	109.6	83.7	-61.5	175.3	140.9	0	0	111.4
592	Q	21.8	Very low	24.7	Very low	185 Å²	185	138.1 Å²	138.1	86%	0.864	77%	0.767	S	S	*	*				51	73.8	90.2	-71.2	-161.6	4.2	0	0	115.1
593	M	26.7	Very low	24.6	Very low	176 Å²	176	140.3 Å²	140.3	87%	0.867	77%	0.771	S	S	*	*			trans	-136.3	114.4	142.5	-86.5	170.4	166.6	0	0	106
594	S	21.2	Very low	24.6	Very low	87 Å²	87	143.8 Å²	143.8	61%	0.608	77%	0.773	S	S	*	*			cis	65.1	48	15.2	-164.4	0	0	0	0	115.8	I596	S594-I596 WeakPolarHBondContact O-CD1 3.46Å
595	C	26.5	Very low	24.4	Very low	112 Å²	112	144.4 Å²	144.4	76%	0.757	77%	0.771	S	S	*	*			trans	-117.8	107.6	141.8	-61.3	0	0	0	0	105.3
596	I	21.2	Very low	24.5	Very low	140 Å²	140	143.5 Å²	143.5	72%	0.718	77%	0.77	S	S	*	*			cis	72.4	131.8	48.6	-52.2	171.9	0	0	0	112.3	S594	S594-I596 WeakPolarHBondContact O-CD1 3.46Å
597	S	23.7	Very low	24.5	Very low	100 Å²	100	146.1 Å²	146.1	70%	0.699	78%	0.776	S	S	*	*			trans	73.2	108.5	176	-144.9	0	0	0	0	114.3
598	N	21.1	Very low	24.3	Very low	137 Å²	137	144.9 Å²	144.9	73%	0.733	78%	0.779	S	S	*	*				50.7	104.1	70.1	-67.4	3.5	0	0	0	112.2
599	D	27.2	Very low	24.5	Very low	163 Å²	163	144.9 Å²	144.9	87%	0.872	78%	0.775	S	S	*	*			trans	-112.2	83.6	148	-138.5	-17.8	0	0	0	107.8
600	E	22.5	Very low	24.7	Very low	166 Å²	166	144.9 Å²	144.9	78%	0.776	77%	0.774	S	S	*	*			trans	-89.3	99.9	170.8	176.3	-169.9	173	0	0	107.6
601	S	27.6	Very low	24.5	Very low	95 Å²	95	144.1 Å²	144.1	66%	0.664	78%	0.777	S	S	*	*			trans	176.2	84	150.6	45.4	0	0	0	0	115.8
602	V	33.5	Very low	24.6	Very low	155 Å²	155	141.4 Å²	141.4	94%	0.939	78%	0.775	S	S	*	*			trans	-136.1	69.1	138.5	-164.7	0	0	0	0	109.8
603	N	22.4	Very low	24.7	Very low	148 Å²	148	137.7 Å²	137.7	79%	0.791	77%	0.769	S	S	*	*			trans	-93.8	102.6	171.5	-163.5	-2.9	0	0	0	109.1
604	R	25.5	Very low	24.6	Very low	225 Å²	225	135.5 Å²	135.5	85%	0.849	76%	0.76	S	S	*	*			trans	-167.7	108.4	155.2	-108.5	160	-156.1	-115.2	4.5	113.9
605	L	24.4	Very low	24.9	Very low	148 Å²	148	136.6 Å²	136.6	78%	0.775	77%	0.767	S	S	*	*			trans	25.5	124	138.1	-63.5	111.4	0	0	0	118.6
606	S	25.5	Very low	25	Very low	103 Å²	103	138.7 Å²	138.7	72%	0.72	77%	0.766	S	S	*	*				-170.4	145.5	90.7	-74.4	0	0	0	0	114
607	N	25.1	Very low	25.4	Very low	151 Å²	151	139.1 Å²	139.1	81%	0.807	77%	0.77	S	S	*	*			trans	69.5	96	156.9	-58.2	-3.5	0	0	0	119.3
608	S	21.4	Very low	25.7	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	78%	0.777	S	S	*	*			trans	-50.3	139.8	136.2	51.5	0	0	0	0	112.2
609	E	25.2	Very low	25.9	Very low	171 Å²	171	140.1 Å²	140.1	80%	0.799	77%	0.773	S	S	*	*				-168.4	157.1	126.7	-107.6	165.2	-158	0	0	111
610	H	26.6	Very low	26	Very low	161 Å²	161	140.9 Å²	140.9	75%	0.745	77%	0.771	S	S	*	*			trans	67.2	76.6	179	-59.2	-57.1	0	0	0	118.4	C612	H610-C612 PolarHBondContact O-N 2.84Å
611	T	23.2	Very low	26.3	Very low	130 Å²	130	140 Å²	140	80%	0.798	77%	0.765	S	S	*	*			trans	-48.7	119.4	136.8	33.8	0	0	0	0	111.3
612	C	24.4	Very low	26.4	Very low	109 Å²	109	146.3 Å²	146.3	74%	0.736	78%	0.775	S	S	*	*			trans	-128.8	66.4	160	-95.6	0	0	0	0	109.5	H610 I614	H610-C612 PolarHBondContact O-N 2.84Å; C612-I614 PolarHBondContact O-N 2.97Å; C612-I614 VanDerWaalsContact O-N 3.12Å
613	S	24.2	Very low	26.2	Very low	107 Å²	107	143.6 Å²	143.6	75%	0.748	76%	0.759	S	S	*	*			trans	-77.1	87.6	167	-57	0	0	0	0	109.3
614	I	24.8	Very low	26.5	Very low	131 Å²	131	142 Å²	142	67%	0.672	76%	0.76	S	S	*	*			trans	-104.1	77.3	163.4	-53.3	178.9	0	0	0	107.1	C612 E616	C612-I614 PolarHBondContact O-N 2.97Å; C612-I614 VanDerWaalsContact O-N 3.12Å; I614-E616 HydrophobicContact CG2-CG 3.86Å; I614-E616 PolarHBondContact O-N 3.38Å
615	S	26.1	Very low	26.7	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	76%	0.76	S	S	*	*			trans	-84	83.9	166.9	-59.7	0	0	0	0	108.3	D617	S615-D617 VanDerWaalsContact C-N 3.35Å; S615-D617 PolarHBondContact O-N 2.94Å; S615-D617 VanDerWaalsContact O-N 3.14Å
616	E	29.3	Very low	27.2	Very low	157 Å²	157	142.4 Å²	142.4	73%	0.734	77%	0.765	S	S	*	*			trans	-81.4	85.1	170.2	-81.3	179.4	153.1	0	0	109.9	I614 I618	I614-E616 HydrophobicContact CG2-CG 3.86Å; I614-E616 PolarHBondContact O-N 3.38Å; E616-I618 PolarHBondContact O-N 2.91Å; E616-I618 VanDerWaalsContact O-N 3.11Å
617	D	29.1	Very low	27.6	Very low	148 Å²	148	146.4 Å²	146.4	79%	0.791	77%	0.772	S	S	*	*			trans	-63.4	103.3	160.9	-93.2	-39.4	0	0	0	109.2	S615	S615-D617 VanDerWaalsContact C-N 3.35Å; S615-D617 PolarHBondContact O-N 2.94Å; S615-D617 VanDerWaalsContact O-N 3.14Å
618	I	30.7	Very low	27.8	Very low	165 Å²	165	145.9 Å²	145.9	85%	0.846	77%	0.769	S	S	*	*			trans	-119.6	69.2	165.9	17.7	170.2	0	0	0	109.5	E616	E616-I618 PolarHBondContact O-N 2.91Å; E616-I618 VanDerWaalsContact O-N 3.11Å
619	S	24.6	Very low	28.3	Very low	93 Å²	93	148.8 Å²	148.8	65%	0.65	78%	0.776	S	S	*	*			trans	-133.8	133.2	157.2	66.1	0	0	0	0	109.5
620	E	30.4	Very low	28.4	Very low	180 Å²	180	146.1 Å²	146.1	84%	0.841	77%	0.772	S	S	*	*			trans	103.2	133.5	-172.5	-64.8	-168.9	-142.4	0	0	114.4
621	K	28.9	Very low	29	Very low	148 Å²	148	144.4 Å²	144.4	64%	0.643	77%	0.773	S	S	*	*			cis	-179.7	124.6	-9.1	167.6	-175.8	-175.9	179	0	109.5	T623	K621-T623 HydrophobicContact CG-CG2 4.15Å
622	Y	29.9	Very low	29.6	Very low	226 Å²	226	147.5 Å²	147.5	89%	0.886	80%	0.8	S	S	*	*			trans	-162.6	121.8	155	-85	-74.6	0	0	0	106.2
623	T	28.7	Very low	29.9	Very low	98 Å²	98	149.5 Å²	149.5	60%	0.601	80%	0.803	S	S	*	*			cis	75.6	104.2	35.6	74.6	0	0	0	0	116.7	K621	K621-T623 HydrophobicContact CG-CG2 4.15Å
624	S	29.2	Very low	30.2	Very low	115 Å²	115	151.7 Å²	151.7	80%	0.804	81%	0.806	S	S	*	*			trans	70.1	90.7	137.9	-162.9	0	0	0	0	119.3
625	E	29.3	Very low	30.5	Very low	180 Å²	180	152.8 Å²	152.8	84%	0.841	81%	0.813	S	S	*	*			trans	-115.4	110.2	143.2	-72.9	-179.4	175.9	0	0	108.2
626	F	34.7	Very low	30.7	Very low	201 Å²	201	155.4 Å²	155.4	88%	0.882	82%	0.816	S	S	*	*				-172	120	125.4	-104.2	-68.4	0	0	0	108.2
627	E	33.1	Very low	30.8	Very low	188 Å²	188	155.3 Å²	155.3	88%	0.879	82%	0.821	S	S	*	*			trans	-79.3	166.1	-166.1	-66.1	170	120.4	0	0	113.8	D629	E627-D629 PolarHBondContact O-N 3.31Å
628	D	30.8	Very low	30.9	Very low	139 Å²	139	155.8 Å²	155.8	74%	0.743	82%	0.823	S	S	*	*			trans	-56.7	115.1	178.1	-62.1	-77.8	0	0	0	114	T630	D628-T630 HydrophobicContact CB-CG2 4.22Å; D628-T630 PolarHBondContact O-N 3.1Å
629	D	32.2	Very low	30.9	Very low	168 Å²	168	155.1 Å²	155.1	90%	0.898	82%	0.822	S	S	*	*			trans	-74.8	71.7	154.8	-110.6	-18.9	0	0	0	109.1	E627	E627-D629 PolarHBondContact O-N 3.31Å
630	T	26.7	Very low	31.4	Very low	115 Å²	115	159.9 Å²	159.9	71%	0.706	84%	0.835	S	S	*	*			trans	-100	105.1	166.6	43.3	0	0	0	0	110.2	D628	D628-T630 HydrophobicContact CB-CG2 4.22Å; D628-T630 PolarHBondContact O-N 3.1Å
631	V	38.3	Very low	31.5	Very low	126 Å²	126	158.3 Å²	158.3	76%	0.764	83%	0.834	S	S	*	*			trans	-133.2	106.1	168.7	-176.4	0	0	0	0	110.6
632	S	36.3	Very low	31.7	Very low	195 Å²	195	159.2 Å²	159.2	100%	1.364	85%	0.852	S	S	*	*			trans	48.3	0	155.5	-59.9	0	0	0	0	119.3

Retrieved 632 of 632 residues in 118.2 ms (Link to these results)

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