A0A096M6H6_POEFO Loading...

G/T mismatch-specific thymine DNA glycosylase

AlphaFold DB , UniProt , Accession A0A096M6H6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 420 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	47.1	Very low	40.9	Very low	218 Å²	218	127.2 Å²	127.2	100%	1.074	66%	0.663	S	S	*	*				0	32.4	0	-71.4	163	60.4	0	0	112.6
2	T	41.8	Very low	40.6	Very low	123 Å²	123	122.4 Å²	122.4	76%	0.755	65%	0.647	S	S	*	*			trans	-93.3	-22.1	-161.2	-25.2	0	0	0	0	114.6
3	V	39.7	Very low	41.1	Very low	112 Å²	112	120.2 Å²	120.2	68%	0.679	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-30.6	-175.1	-177.8	0	0	0	0	112.9	L5	V3-L5 VanDerWaalsContact C-N 3.3Å; V3-L5 PolarHBondContact O-N 2.85Å
4	F	34.8	Very low	41.2	Very low	176 Å²	176	116.7 Å²	116.7	77%	0.772	63%	0.63	S	S	*	*	H	α-helix	trans	-71.5	-18.3	-176.1	-96.7	-89.6	0	0	0	114.8
5	L	38.6	Very low	41.4	Very low	125 Å²	125	116.3 Å²	116.3	65%	0.654	63%	0.626	S	S	*	*	H	α-helix	trans	-82.1	-26.1	-179	-75	164.2	0	0	0	113.1	V3	V3-L5 VanDerWaalsContact C-N 3.3Å; V3-L5 PolarHBondContact O-N 2.85Å
6	A	41.6	Very low	41.6	Very low	65 Å²	65	115.1 Å²	115.1	54%	0.537	62%	0.619	S	S	.	*	H	α-helix	trans	-76.8	-22.2	-178.1	0	0	0	0	0	114.3	P9	A6-P9 WeakPolarHBondContact O-CD 3.28Å
7	I	42.8	Very low	41.9	Very low	90 Å²	90	111.4 Å²	111.4	46%	0.462	60%	0.604	S	S	.	*	H	α-helix	trans	-84.5	-29.2	-172	-59.1	174	0	0	0	112.1	I10 L11	I7-I10 PolarHBondContact O-N 3.36Å; I7-L11 HydrophobicContact CG2-CD1 4.45Å; I7-L11 PolarHBondContact O-N 2.9Å; I7-L11 VanDerWaalsContact O-N 3.15Å
8	R	38.8	Very low	42.1	Very low	196 Å²	196	108.7 Å²	108.7	74%	0.74	60%	0.595	S	S	*	*	H	α-helix	trans	-54.1	-49.9	-178.8	-81.5	-175.6	165.1	-176.4	-5.1	115	I10 C12	R8-I10 PolarHBondContact O-N 3.24Å; R8-C12 WeakPolarHBondContact O-CB 3.4Å; R8-C12 PolarHBondContact O-N 2.86Å; R8-C12 VanDerWaalsContact O-N 3.13Å
9	P	38.9	Very low	42.1	Very low	77 Å²	77	110.3 Å²	110.3	50%	0.5	60%	0.596	S	S	.	*	H	α-helix	trans	-65.4	-36.8	-179.6	24.3	-33.8	0	0	0	112.7	A6 C12 V13	A6-P9 WeakPolarHBondContact O-CD 3.28Å; P9-C12 WeakPolarHBondContact O-CB 3.4Å; P9-C12 PolarHBondContact O-N 2.85Å; P9-V13 WeakPolarHBondContact O-CG2 3.44Å; P9-V13 PolarHBondContact O-N 2.7Å
10	I	45.1	Very low	42.3	Very low	111 Å²	111	109.1 Å²	109.1	57%	0.569	59%	0.588	S	S	*	*	H	α-helix	trans	-65	-46.4	-179.5	-58.4	174.7	0	0	0	110.4	I7 R8 C12 V13 C14	I7-I10 PolarHBondContact O-N 3.36Å; R8-I10 PolarHBondContact O-N 3.24Å; I10-C12 VanDerWaalsContact C-N 3.29Å; I10-C12 PolarHBondContact O-N 3.18Å; I10-V13 PolarHBondContact O-N 2.89Å; I10-C14 PolarHBondContact O-N 2.95Å; I10-C14 PolarHBondContact O-SG 3.38Å; I10-C14 VanDerWaalsContact O-SG 3.41Å
11	L	40.4	Very low	42.7	Very low	106 Å²	106	109.3 Å²	109.3	56%	0.555	59%	0.588	S	S	*	*	H	α-helix	trans	-61.2	-39.2	175.9	-127.1	75.4	0	0	0	111.9	I7 C14 L15	I7-L11 HydrophobicContact CG2-CD1 4.45Å; I7-L11 PolarHBondContact O-N 2.9Å; I7-L11 VanDerWaalsContact O-N 3.15Å; L11-C14 PolarHBondContact O-N 2.72Å; L11-L15 WeakPolarHBondContact O-CG 3.48Å; L11-L15 PolarHBondContact O-N 3.45Å; L11-L15 VanDerWaalsContact O-N 3.08Å
12	C	38	Very low	43	Very low	70 Å²	70	103.1 Å²	103.1	47%	0.473	56%	0.558	S	S	.	*	H	α-helix	trans	-63	-45.1	177.5	-162.6	0	0	0	0	111.7	R8 P9 I10 C14 L15 L16	R8-C12 WeakPolarHBondContact O-CB 3.4Å; R8-C12 PolarHBondContact O-N 2.86Å; R8-C12 VanDerWaalsContact O-N 3.13Å; P9-C12 WeakPolarHBondContact O-CB 3.4Å; P9-C12 PolarHBondContact O-N 2.85Å; I10-C12 VanDerWaalsContact C-N 3.29Å; I10-C12 PolarHBondContact O-N 3.18Å; C12-C14 PolarHBondContact O-N 3.09Å; C12-L15 PolarHBondContact O-N 3.45Å; C12-L16 WeakPolarHBondContact O-CB 3.32Å; C12-L16 WeakPolarHBondContact O-CG 3.32Å; C12-L16 PolarHBondContact O-N 3.25Å
13	V	47	Very low	43.3	Very low	94 Å²	94	102.2 Å²	102.2	57%	0.57	55%	0.548	S	S	*	.	H	α-helix	trans	-63.9	-38.8	176.5	172.7	0	0	0	0	111.9	P9 I10 S17	P9-V13 WeakPolarHBondContact O-CG2 3.44Å; P9-V13 PolarHBondContact O-N 2.7Å; I10-V13 PolarHBondContact O-N 2.89Å; V13-S17 WeakPolarHBondContact O-CB 3.48Å; V13-S17 PolarHBondContact O-N 2.9Å; V13-S17 PolarHBondContact O-OG 3.17Å
14	C	42.8	Very low	43.7	Very low	71 Å²	71	101.5 Å²	101.5	48%	0.48	54%	0.539	S	S	.	.	H	α-helix	trans	-65.9	-35.5	175.8	-68.9	0	0	0	0	113.4	I10 L11 C12 S17 S18	I10-C14 PolarHBondContact O-N 2.95Å; I10-C14 PolarHBondContact O-SG 3.38Å; I10-C14 VanDerWaalsContact O-SG 3.41Å; L11-C14 PolarHBondContact O-N 2.72Å; C12-C14 PolarHBondContact O-N 3.09Å; C14-S17 WeakPolarHBondContact CA-OG 2.95Å; C14-S17 PolarHBondContact O-OG 3Å; C14-S18 PolarHBondContact O-N 2.98Å; C14-S18 PolarHBondContact O-OG 3.23Å
15	L	43.8	Very low	44.4	Very low	110 Å²	110	99.3 Å²	99.3	58%	0.576	53%	0.526	S	S	*	.	H	α-helix	trans	-75.2	-44.5	175.4	-68	169.4	0	0	0	111.8	L11 C12 S18 F19	L11-L15 WeakPolarHBondContact O-CG 3.48Å; L11-L15 PolarHBondContact O-N 3.45Å; L11-L15 VanDerWaalsContact O-N 3.08Å; C12-L15 PolarHBondContact O-N 3.45Å; L15-S18 WeakPolarHBondContact O-CB 3.26Å; L15-S18 PolarHBondContact O-N 3.08Å; L15-F19 PolarHBondContact O-N 3.12Å
16	L	44.4	Very low	44.6	Very low	97 Å²	97	102.4 Å²	102.4	51%	0.508	53%	0.529	S	S	.	.	H	α-helix	trans	-59.7	-47.3	175.2	-82.4	161.8	0	0	0	111.7	C12 S18 F19 I20	C12-L16 WeakPolarHBondContact O-CB 3.32Å; C12-L16 WeakPolarHBondContact O-CG 3.32Å; C12-L16 PolarHBondContact O-N 3.25Å; L16-S18 VanDerWaalsContact C-N 3.29Å; L16-S18 PolarHBondContact O-N 3.32Å; L16-F19 PolarHBondContact O-N 3.1Å; L16-I20 WeakPolarHBondContact O-CB 3.49Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 2.86Å
17	S	46.5	Very low	44.5	Very low	52 Å²	52	104.7 Å²	104.7	36%	0.364	53%	0.528	S	S	.	.	H	α-helix	trans	-62.1	-35.1	176.9	50	0	0	0	0	112.6	V13 C14 I20 I21	V13-S17 WeakPolarHBondContact O-CB 3.48Å; V13-S17 PolarHBondContact O-N 2.9Å; V13-S17 PolarHBondContact O-OG 3.17Å; C14-S17 WeakPolarHBondContact CA-OG 2.95Å; C14-S17 PolarHBondContact O-OG 3Å; S17-I20 PolarHBondContact O-N 3.5Å; S17-I21 WeakPolarHBondContact O-CB 3.43Å; S17-I21 WeakPolarHBondContact O-CD1 3.44Å; S17-I21 WeakPolarHBondContact O-CG1 3.21Å; S17-I21 PolarHBondContact O-N 2.87Å
18	S	44.9	Very low	44.6	Very low	63 Å²	63	103.5 Å²	103.5	44%	0.441	53%	0.527	S	S	.	.	H	α-helix	trans	-64.8	-43.6	173.3	-61.4	0	0	0	0	112.4	C14 L15 L16 I22	C14-S18 PolarHBondContact O-N 2.98Å; C14-S18 PolarHBondContact O-OG 3.23Å; L15-S18 WeakPolarHBondContact O-CB 3.26Å; L15-S18 PolarHBondContact O-N 3.08Å; L16-S18 VanDerWaalsContact C-N 3.29Å; L16-S18 PolarHBondContact O-N 3.32Å; S18-I22 WeakPolarHBondContact O-CG1 3.45Å; S18-I22 PolarHBondContact O-N 3.26Å
19	F	43.3	Very low	44.9	Very low	139 Å²	139	101.1 Å²	101.1	61%	0.61	52%	0.518	S	S	*	.	H	α-helix	trans	-66.2	-42.6	174.8	-95.4	-98.2	0	0	0	112.6	L15 L16 I21 I22 I23	L15-F19 PolarHBondContact O-N 3.12Å; L16-F19 PolarHBondContact O-N 3.1Å; F19-I21 VanDerWaalsContact C-N 3.34Å; F19-I21 PolarHBondContact O-N 3.01Å; F19-I22 WeakPolarHBondContact O-CB 3.35Å; F19-I22 PolarHBondContact O-N 3.37Å; F19-I22 VanDerWaalsContact O-N 3.12Å; F19-I23 WeakPolarHBondContact O-CG1 3.31Å; F19-I23 PolarHBondContact O-N 3.2Å
20	I	46.7	Very low	45.1	Very low	86 Å²	86	104.2 Å²	104.2	44%	0.441	52%	0.521	S	S	.	.	H	α-helix	trans	-62.3	-41.2	177.3	-70.7	164.3	0	0	0	110.5	L16 S17 I22 I23 I24	L16-I20 WeakPolarHBondContact O-CB 3.49Å; L16-I20 VanDerWaalsContact O-CG1 3.25Å; L16-I20 WeakPolarHBondContact O-CG1 3.32Å; L16-I20 PolarHBondContact O-N 2.86Å; S17-I20 PolarHBondContact O-N 3.5Å; I20-I22 VanDerWaalsContact C-N 3.32Å; I20-I22 PolarHBondContact O-N 3.13Å; I20-I23 PolarHBondContact O-N 2.83Å; I20-I24 HydrophobicContact CG2-CD1 3.63Å; I20-I24 HydrophobicContact CG2-CG1 4.25Å; I20-I24 WeakPolarHBondContact O-CB 3.45Å; I20-I24 VanDerWaalsContact O-CG1 3.28Å; I20-I24 WeakPolarHBondContact O-CG1 3.36Å; I20-I24 PolarHBondContact O-N 2.91Å
21	I	50.7	Low	44.8	Very low	115 Å²	115	103.4 Å²	103.4	59%	0.59	52%	0.515	S	S	*	.	H	α-helix	trans	-61.2	-39.4	173.6	-72.7	165	0	0	0	111.5	S17 F19 Y25	S17-I21 WeakPolarHBondContact O-CB 3.43Å; S17-I21 WeakPolarHBondContact O-CD1 3.44Å; S17-I21 WeakPolarHBondContact O-CG1 3.21Å; S17-I21 PolarHBondContact O-N 2.87Å; F19-I21 VanDerWaalsContact C-N 3.34Å; F19-I21 PolarHBondContact O-N 3.01Å; I21-Y25 VanDerWaalsContact O-CB 3.22Å; I21-Y25 WeakPolarHBondContact O-CB 3.18Å; I21-Y25 PolarHBondContact O-N 2.98Å
22	I	51.6	Low	45.1	Very low	88 Å²	88	101.3 Å²	101.3	45%	0.451	51%	0.513	S	S	.	.	H	α-helix	trans	-67.7	-41.1	176.2	-67.6	165.2	0	0	0	111.3	S18 F19 I20 Y25 R26	S18-I22 WeakPolarHBondContact O-CG1 3.45Å; S18-I22 PolarHBondContact O-N 3.26Å; F19-I22 WeakPolarHBondContact O-CB 3.35Å; F19-I22 PolarHBondContact O-N 3.37Å; F19-I22 VanDerWaalsContact O-N 3.12Å; I20-I22 VanDerWaalsContact C-N 3.32Å; I20-I22 PolarHBondContact O-N 3.13Å; I22-Y25 PolarHBondContact O-N 3.06Å; I22-R26 WeakPolarHBondContact O-CB 3.45Å; I22-R26 WeakPolarHBondContact O-CG 3.24Å; I22-R26 PolarHBondContact O-N 3.1Å
23	I	49.1	Very low	45.4	Very low	104 Å²	104	104.8 Å²	104.8	53%	0.533	53%	0.526	S	S	.	.	H	α-helix	trans	-65.9	-48.1	177.7	-69.1	166.4	0	0	0	110.5	F19 I20 Y25 R26 F27	F19-I23 WeakPolarHBondContact O-CG1 3.31Å; F19-I23 PolarHBondContact O-N 3.2Å; I20-I23 PolarHBondContact O-N 2.83Å; I23-Y25 VanDerWaalsContact C-N 3.33Å; I23-Y25 PolarHBondContact O-N 2.93Å; I23-R26 PolarHBondContact O-N 3.04Å; I23-F27 WeakPolarHBondContact O-CB 3.44Å; I23-F27 PolarHBondContact O-N 2.61Å
24	I	48.2	Very low	45.1	Very low	96 Å²	96	106 Å²	106	49%	0.492	53%	0.526	S	S	.	.	H	α-helix	trans	-59	-44.4	174.7	-68.1	169.9	0	0	0	110.2	I20 R26 F27 S28	I20-I24 HydrophobicContact CG2-CD1 3.63Å; I20-I24 HydrophobicContact CG2-CG1 4.25Å; I20-I24 WeakPolarHBondContact O-CB 3.45Å; I20-I24 VanDerWaalsContact O-CG1 3.28Å; I20-I24 WeakPolarHBondContact O-CG1 3.36Å; I20-I24 PolarHBondContact O-N 2.91Å; I24-R26 PolarHBondContact O-N 3.32Å; I24-F27 PolarHBondContact O-N 3.45Å; I24-S28 WeakPolarHBondContact O-CB 3.22Å; I24-S28 PolarHBondContact O-N 2.83Å; I24-S28 PolarHBondContact O-OG 3.49Å
25	Y	49.6	Very low	44.9	Very low	130 Å²	130	109.4 Å²	109.4	51%	0.51	54%	0.535	S	S	.	.	H	α-helix	trans	-64.1	-38.2	178.6	-166.8	-101.1	0	0	0	112.7	I21 I22 I23 R29	I21-Y25 VanDerWaalsContact O-CB 3.22Å; I21-Y25 WeakPolarHBondContact O-CB 3.18Å; I21-Y25 PolarHBondContact O-N 2.98Å; I22-Y25 PolarHBondContact O-N 3.06Å; I23-Y25 VanDerWaalsContact C-N 3.33Å; I23-Y25 PolarHBondContact O-N 2.93Å; Y25-R29 WeakPolarHBondContact O-CB 3.24Å; Y25-R29 PolarHBondContact O-N 2.94Å; Y25-R29 VanDerWaalsContact O-N 3.08Å
26	R	43	Very low	44.7	Very low	190 Å²	190	112.3 Å²	112.3	72%	0.717	55%	0.545	S	S	*	.	H	α-helix	trans	-67.5	-41.6	172.1	-74.7	-178.2	176.6	-146.9	-0.8	111.9	I22 I23 I24 R29 Y30	I22-R26 WeakPolarHBondContact O-CB 3.45Å; I22-R26 WeakPolarHBondContact O-CG 3.24Å; I22-R26 PolarHBondContact O-N 3.1Å; I23-R26 PolarHBondContact O-N 3.04Å; I24-R26 PolarHBondContact O-N 3.32Å; R26-R29 PolarHBondContact O-N 3.36Å; R26-Y30 WeakPolarHBondContact O-CB 3.32Å; R26-Y30 PolarHBondContact O-N 3.28Å
27	F	38.5	Very low	44.5	Very low	114 Å²	114	112.7 Å²	112.7	50%	0.5	55%	0.553	S	S	.	*	H	α-helix	trans	-69	-42	-179.6	-169.6	-98.9	0	0	0	112.4	I23 I24 Y30 Q31	I23-F27 WeakPolarHBondContact O-CB 3.44Å; I23-F27 PolarHBondContact O-N 2.61Å; I24-F27 PolarHBondContact O-N 3.45Å; F27-Y30 WeakPolarHBondContact O-CB 3.49Å; F27-Y30 PolarHBondContact O-N 3.23Å; F27-Q31 HydrophobicContact CD1-CG 4.37Å; F27-Q31 VanDerWaalsContact CE1-CD 3.46Å; F27-Q31 HydrophobicContact CE1-CG 3.98Å; F27-Q31 HydrophobicContact CZ-CG 4.27Å; F27-Q31 PolarHBondContact O-N 2.8Å
28	S	45.7	Very low	44	Very low	64 Å²	64	119.5 Å²	119.5	45%	0.448	58%	0.58	S	S	.	*	H	α-helix	trans	-65.9	-35.5	171.6	-59.7	0	0	0	0	112.3	I24 Y30 A32	I24-S28 WeakPolarHBondContact O-CB 3.22Å; I24-S28 PolarHBondContact O-N 2.83Å; I24-S28 PolarHBondContact O-OG 3.49Å; S28-Y30 VanDerWaalsContact C-N 3.3Å; S28-A32 VanDerWaalsContact O-CB 3.24Å; S28-A32 WeakPolarHBondContact O-CB 3.33Å; S28-A32 PolarHBondContact O-N 3.42Å
29	R	45.6	Very low	43.4	Very low	147 Å²	147	121 Å²	121	56%	0.555	60%	0.596	S	S	*	*	H	α-helix	trans	-64.1	-36.4	171.1	-170.5	178.5	-173.8	168.3	8	111.5	Y25 R26 N33 E384	Y25-R29 WeakPolarHBondContact O-CB 3.24Å; Y25-R29 PolarHBondContact O-N 2.94Å; Y25-R29 VanDerWaalsContact O-N 3.08Å; R26-R29 PolarHBondContact O-N 3.36Å; R29-N33 PolarHBondContact O-N 3.13Å; R29-E384 IonicContact CZ-OE2 2.71Å; R29-E384 IonicContact NH1-OE2 2.69Å; R29-E384 IonicContact NH2-OE2 3.23Å; R29-E384 PolarHBondContact NH2-OE2 2.95Å
30	Y	41.3	Very low	43	Very low	142 Å²	142	123.9 Å²	123.9	56%	0.557	61%	0.611	S	S	*	*	H	α-helix	trans	-69.5	-49.2	176.2	-177.2	-100.2	0	0	0	112.3	R26 F27 S28 A32 N33 Q34	R26-Y30 WeakPolarHBondContact O-CB 3.32Å; R26-Y30 PolarHBondContact O-N 3.28Å; F27-Y30 WeakPolarHBondContact O-CB 3.49Å; F27-Y30 PolarHBondContact O-N 3.23Å; S28-Y30 VanDerWaalsContact C-N 3.3Å; Y30-A32 PolarHBondContact O-N 2.77Å; Y30-N33 PolarHBondContact O-N 3.07Å; Y30-Q34 HydrophobicContact CE1-CG 4.29Å; Y30-Q34 WeakPolarHBondContact O-CG 3.33Å; Y30-Q34 PolarHBondContact O-N 2.61Å; Y30-Q34 PolarHBondContact OH-NE2 2.86Å
31	Q	40.4	Very low	42.3	Very low	94 Å²	94	127.8 Å²	127.8	44%	0.439	63%	0.627	S	S	.	*	H	α-helix	trans	-65.7	-36.3	178.3	-74.4	-164.8	-30.9	0	0	113	F27 N33 Q34 Q35	F27-Q31 HydrophobicContact CD1-CG 4.37Å; F27-Q31 VanDerWaalsContact CE1-CD 3.46Å; F27-Q31 HydrophobicContact CE1-CG 3.98Å; F27-Q31 HydrophobicContact CZ-CG 4.27Å; F27-Q31 PolarHBondContact O-N 2.8Å; Q31-N33 PolarHBondContact O-N 2.91Å; Q31-Q34 PolarHBondContact O-N 3.22Å; Q31-Q35 PolarHBondContact O-N 3.24Å
32	A	45.6	Very low	41.4	Very low	62 Å²	62	129.2 Å²	129.2	51%	0.512	63%	0.633	S	S	.	*	H	α-helix	trans	-61.2	-29.6	174.9	0	0	0	0	0	113.1	S28 Y30 Q34	S28-A32 VanDerWaalsContact O-CB 3.24Å; S28-A32 WeakPolarHBondContact O-CB 3.33Å; S28-A32 PolarHBondContact O-N 3.42Å; Y30-A32 PolarHBondContact O-N 2.77Å; A32-Q34 VanDerWaalsContact C-N 3.33Å
33	N	44.3	Very low	40.3	Very low	142 Å²	142	132 Å²	132	76%	0.759	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-14.4	173.6	-90.6	21.3	0	0	0	113.8	R29 Y30 Q31	R29-N33 PolarHBondContact O-N 3.13Å; Y30-N33 PolarHBondContact O-N 3.07Å; Q31-N33 PolarHBondContact O-N 2.91Å
34	Q	40.9	Very low	39.2	Very low	121 Å²	121	130 Å²	130	57%	0.565	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-10.3	-175.2	-68.8	-75.5	3.2	0	0	113.7	Y30 Q31 A32	Y30-Q34 HydrophobicContact CE1-CG 4.29Å; Y30-Q34 WeakPolarHBondContact O-CG 3.33Å; Y30-Q34 PolarHBondContact O-N 2.61Å; Y30-Q34 PolarHBondContact OH-NE2 2.86Å; Q31-Q34 PolarHBondContact O-N 3.22Å; A32-Q34 VanDerWaalsContact C-N 3.33Å
35	Q	39.8	Very low	38.9	Very low	142 Å²	142	132.4 Å²	132.4	66%	0.664	65%	0.645	S	S	*	*	S	Bend	trans	-104.6	-0	-168.2	-72.9	-169.6	-44.5	0	0	116.3	Q31	Q31-Q35 PolarHBondContact O-N 3.24Å
36	H	38.7	Very low	38.2	Very low	170 Å²	170	133.8 Å²	133.8	79%	0.787	66%	0.656	S	S	*	*			trans	-138.1	72.1	-179.6	-69	-55.9	0	0	0	114.8
37	P	40.1	Very low	37.7	Very low	106 Å²	106	129.5 Å²	129.5	69%	0.688	66%	0.655	S	S	*	*			trans	-67	147.5	141.4	33.4	-31.4	0	0	0	109.6
38	E	36.4	Very low	37.6	Very low	195 Å²	195	132.6 Å²	132.6	91%	0.911	68%	0.676	S	S	*	*			trans	58.8	99	170	-54.9	-164.1	161	0	0	119.1
39	A	31.2	Very low	37.1	Very low	95 Å²	95	132 Å²	132	79%	0.785	68%	0.68	S	S	*	*			trans	-152.1	102.1	150.9	0	0	0	0	0	110.4	H41	A39-H41 PolarHBondContact O-N 2.6Å
40	Q	35.3	Very low	36.3	Very low	198 Å²	198	133.8 Å²	133.8	93%	0.925	69%	0.694	S	S	*	*			trans	-80.9	73.5	-174.6	-72.5	-173.8	-21.3	0	0	113.9
41	H	32.6	Very low	35.6	Very low	168 Å²	168	138 Å²	138	78%	0.778	71%	0.711	S	S	*	*			trans	-151.4	93.9	152.8	-134.9	69.1	0	0	0	112.8	A39	A39-H41 PolarHBondContact O-N 2.6Å
42	M	32	Very low	35	Very low	146 Å²	146	138.1 Å²	138.1	72%	0.719	73%	0.727	S	S	*	*			trans	-90.4	114.4	-177.7	-69.8	-171.4	74	0	0	112.4	S44	M42-S44 PolarHBondContact O-N 2.74Å
43	M	27.3	Very low	34.2	Very low	147 Å²	147	142.3 Å²	142.3	72%	0.724	74%	0.741	S	S	*	*			trans	-76	105.3	157	-73.7	-67.7	103.3	0	0	109.7
44	S	27.3	Very low	33.3	Very low	62 Å²	62	139 Å²	139	43%	0.434	74%	0.741	S	S	.	*			trans	-80	158.9	166.5	-161.8	0	0	0	0	110.8	M42 H46	M42-S44 PolarHBondContact O-N 2.74Å; S44-H46 PolarHBondContact O-N 3.08Å
45	Y	42.2	Very low	32.7	Very low	146 Å²	146	142.4 Å²	142.4	57%	0.573	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	2.4	-170.3	-82.5	-73.4	0	0	0	115.5	Y387	Y45-Y387 PolarHBondContact OH-O 3.22Å; Y45-Y387 VanDerWaalsContact OH-O 3.12Å
46	H	34.3	Very low	32.2	Very low	158 Å²	158	144.3 Å²	144.3	73%	0.731	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-6.4	-170.5	-58.9	-55.6	0	0	0	116.2	S44	S44-H46 PolarHBondContact O-N 3.08Å
47	S	31.9	Very low	31.6	Very low	100 Å²	100	144.9 Å²	144.9	70%	0.699	76%	0.764	S	S	*	*			trans	-137.5	96.3	178.5	-164.2	0	0	0	0	113
48	L	37.3	Very low	30.9	Very low	180 Å²	180	148.7 Å²	148.7	94%	0.942	77%	0.773	S	S	*	*			trans	-152.5	44.9	163.5	-115	163	0	0	0	110.1
49	G	33.7	Very low	30.8	Very low	52 Å²	52	145 Å²	145	54%	0.536	77%	0.765	S	S	.	*			trans	-99.7	161.9	164.9	0	0	0	0	0	111.1
50	H	29.2	Very low	30.5	Very low	183 Å²	183	147 Å²	147	85%	0.847	77%	0.767	S	S	*	*			trans	78.7	155.6	-179.6	-49.4	-71.8	0	0	0	116.9
51	Y	28	Very low	30.1	Very low	232 Å²	232	145.8 Å²	145.8	91%	0.91	76%	0.764	S	S	*	*			trans	62	121	-165.8	-57.9	-80.6	0	0	0	116.1
52	A	27.4	Very low	29.9	Very low	95 Å²	95	142.1 Å²	142.1	79%	0.785	76%	0.762	S	S	*	*			cis	-155.8	143.5	-17.3	0	0	0	0	0	107.6
53	D	28.9	Very low	29.6	Very low	151 Å²	151	143.7 Å²	143.7	81%	0.807	77%	0.768	S	S	*	*			trans	-133.6	115	170.4	-144.3	-5.1	0	0	0	107.9	Y55	D53-Y55 PolarHBondContact O-N 2.92Å
54	G	25.3	Very low	29.6	Very low	72 Å²	72	145.2 Å²	145.2	74%	0.742	78%	0.778	S	S	*	*			trans	-92.2	102.3	-169.4	0	0	0	0	0	111	M56	G54-M56 PolarHBondContact O-N 3.35Å
55	Y	28.6	Very low	29.5	Very low	193 Å²	193	147.5 Å²	147.5	76%	0.757	79%	0.794	S	S	*	*			trans	-70.9	121.2	170.4	-76.2	-104	0	0	0	109.8	D53	D53-Y55 PolarHBondContact O-N 2.92Å
56	M	27.7	Very low	28.8	Very low	181 Å²	181	147.4 Å²	147.4	89%	0.892	81%	0.809	S	S	*	*			trans	-126.4	103	159	-68	-64.8	-64.4	0	0	106.3	G54	G54-M56 PolarHBondContact O-N 3.35Å
57	E	27.6	Very low	28.4	Very low	182 Å²	182	148.8 Å²	148.8	85%	0.85	82%	0.815	S	S	*	*			trans	-85.5	134.3	167	-65.7	-176.6	141.5	0	0	108.2
58	E	25.2	Very low	28.2	Very low	187 Å²	187	155 Å²	155	87%	0.874	82%	0.823	S	S	*	*			trans	-129.5	134.4	170.7	-164.6	164.2	-153.4	0	0	107.5
59	P	33.1	Very low	27.8	Very low	117 Å²	117	154.7 Å²	154.7	76%	0.76	82%	0.817	S	S	*	*			trans	-81.6	154.7	-152.9	30.1	-36.1	0	0	0	114.9
60	V	26.7	Very low	27.9	Very low	136 Å²	136	156.5 Å²	156.5	82%	0.824	82%	0.819	S	S	*	*			trans	-72.8	126	175.5	179.2	0	0	0	0	110.5
61	M	25.9	Very low	27.8	Very low	174 Å²	174	152.3 Å²	152.3	86%	0.857	81%	0.81	S	S	*	*			trans	-120.6	105	165.1	-78.2	-66.5	-70.1	0	0	109.6
62	A	28.1	Very low	27.6	Very low	90 Å²	90	149.9 Å²	149.9	74%	0.744	81%	0.807	S	S	*	*			trans	-156.5	87.3	171.7	0	0	0	0	0	109.7
63	E	26.5	Very low	28.3	Very low	180 Å²	180	149.9 Å²	149.9	84%	0.841	80%	0.799	S	S	*	*			trans	-68.5	143.8	159.9	-64.3	-173.6	131.1	0	0	109.6
64	L	26.3	Very low	28.2	Very low	178 Å²	178	151.8 Å²	151.8	93%	0.932	80%	0.803	S	S	*	*			trans	-163.3	121	139.4	-107.4	177.9	0	0	0	109.5
65	S	25.6	Very low	28.3	Very low	110 Å²	110	157 Å²	157	77%	0.769	81%	0.808	S	S	*	*			trans	-86.4	142.3	-173.4	-52.7	0	0	0	0	113
66	V	26.9	Very low	29.2	Very low	145 Å²	145	152.1 Å²	152.1	88%	0.879	80%	0.8	S	S	*	*			trans	-137.1	144.8	149.6	-172	0	0	0	0	108.9
67	H	26.9	Very low	29.2	Very low	186 Å²	186	152.9 Å²	152.9	86%	0.861	80%	0.799	S	S	*	*			trans	-57.2	156.8	-166.2	-68.9	-90.2	0	0	0	117.4
68	R	27.7	Very low	29.3	Very low	230 Å²	230	153.6 Å²	153.6	87%	0.868	80%	0.795	S	S	*	*			trans	-133.2	137.9	155.5	-177.9	177.8	-175	141.8	1.7	108.9
69	E	27.7	Very low	29.6	Very low	175 Å²	175	152.1 Å²	152.1	82%	0.818	79%	0.788	S	S	*	*			trans	-134.8	163.7	167.5	-90.8	-74.4	108.4	0	0	108.1
70	P	35.7	Very low	29.3	Very low	90 Å²	90	151.4 Å²	151.4	58%	0.584	79%	0.786	S	S	*	*			trans	-123.1	166.7	-146.1	42.9	-33.3	0	0	0	118.5
71	S	27.5	Very low	29.8	Very low	94 Å²	94	155.8 Å²	155.8	66%	0.657	79%	0.789	S	S	*	*			trans	55	112.4	142.8	60.9	0	0	0	0	122.7
72	E	25.1	Very low	31	Very low	181 Å²	181	153 Å²	153	85%	0.846	78%	0.784	S	S	*	*				75.4	168.7	118.6	-73.9	-162.7	-179.3	0	0	121.6
73	P	41.1	Very low	32.1	Very low	95 Å²	95	155.2 Å²	155.2	62%	0.617	79%	0.79	S	S	*	*			cis	-132.7	178.4	-37.7	33.1	-15.9	0	0	0	113
74	Q	27.5	Very low	32.5	Very low	191 Å²	191	151.1 Å²	151.1	89%	0.893	79%	0.788	S	S	*	*			trans	159.9	146.8	131.7	-86.7	172.6	4.6	0	0	114.9
75	E	27.8	Very low	32.8	Very low	182 Å²	182	148.9 Å²	148.9	85%	0.85	79%	0.787	S	S	*	*			trans	-108.9	-177.5	167.8	-107.1	-161.1	-165.4	0	0	109.4
76	P	46.7	Very low	33.1	Very low	90 Å²	90	147 Å²	147	58%	0.584	79%	0.785	S	S	*	*			cis	-127.6	-168.9	-15.5	29.5	-8.1	0	0	0	112
77	F	27.3	Very low	33.4	Very low	198 Å²	198	148 Å²	148	87%	0.868	78%	0.78	S	S	*	*				-174	177.2	119.5	-115.9	-88.9	0	0	0	113.8
78	Y	30.1	Very low	33.7	Very low	197 Å²	197	149.3 Å²	149.3	77%	0.773	78%	0.779	S	S	*	*			trans	-95.7	171.4	-158.9	-112.8	-109.2	0	0	0	116.8
79	H	31.4	Very low	33.8	Very low	155 Å²	155	145.3 Å²	145.3	72%	0.718	77%	0.77	S	S	*	*			trans	107.2	117.5	137.8	-90.3	-58.6	0	0	0	123.5
80	S	27.7	Very low	34	Very low	102 Å²	102	143 Å²	143	71%	0.713	76%	0.759	S	S	*	*				89.8	129.3	128.7	-63.1	0	0	0	0	122.8
81	Y	36.8	Very low	33.9	Very low	229 Å²	229	146 Å²	146	90%	0.898	77%	0.765	S	S	*	*			trans	-87.1	158.8	165.1	-82.3	-96.4	0	0	0	112.6
82	P	50.8	Low	34	Very low	114 Å²	114	148.7 Å²	148.7	74%	0.74	77%	0.771	S	S	*	*			trans	-108.7	168.3	141.3	-5.3	26.2	0	0	0	113.2
83	P	50.6	Low	34.1	Very low	137 Å²	137	143.6 Å²	143.6	89%	0.89	77%	0.767	S	S	*	*			trans	-110.1	-163.6	-156.5	42.8	-36.5	0	0	0	116.6
84	A	34.9	Very low	33.6	Very low	95 Å²	95	146.4 Å²	146.4	79%	0.785	77%	0.772	S	S	*	*			trans	-110.4	-177.7	-156.1	0	0	0	0	0	116.9
85	S	33.8	Very low	34.4	Very low	131 Å²	131	142.9 Å²	142.9	92%	0.916	77%	0.766	S	S	*	*			trans	-159.4	140.6	164.4	-67.8	0	0	0	0	108.2
86	G	30.8	Very low	34.5	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	75%	0.747	S	S	*	*			cis	-162.2	-165.1	-1.2	0	0	0	0	0	112.2
87	H	34.4	Very low	33.6	Very low	165 Å²	165	142.1 Å²	142.1	76%	0.764	76%	0.759	S	S	*	*			trans	-66.6	163.4	-174.9	-63.7	-92.3	0	0	0	113.5
88	Y	32.2	Very low	33.7	Very low	213 Å²	213	136.3 Å²	136.3	84%	0.835	74%	0.743	S	S	*	*			cis	-150.1	131.6	41.3	-73.3	-102.5	0	0	0	114.7
89	Q	30.8	Very low	33.7	Very low	146 Å²	146	134 Å²	134	68%	0.682	74%	0.739	S	S	*	*				20.5	133	108.2	-167.8	167.3	14.5	0	0	117.7
90	E	31.8	Very low	33.8	Very low	127 Å²	127	134.5 Å²	134.5	59%	0.593	74%	0.741	S	S	*	*			cis	-150.7	-149.7	3.1	-132.4	176.9	87.3	0	0	108.8
91	Q	32.8	Very low	35.1	Very low	154 Å²	154	134.4 Å²	134.4	72%	0.72	74%	0.738	S	S	*	*			cis	-153.3	171.5	10.9	-159.5	142.3	72.4	0	0	113.2
92	I	28.7	Very low	35	Very low	150 Å²	150	131.4 Å²	131.4	77%	0.769	73%	0.732	S	S	*	*			trans	-27.6	143.9	171.7	-63.5	158.4	0	0	0	119.6
93	G	27.8	Very low	34.2	Very low	74 Å²	74	133.1 Å²	133.1	76%	0.763	73%	0.73	S	S	*	*			trans	179.3	47.9	169	0	0	0	0	0	119.8
94	Q	31.5	Very low	33.2	Very low	153 Å²	153	134.6 Å²	134.6	72%	0.715	73%	0.73	S	S	*	*			trans	-128.2	151.8	161.5	-81.4	-154.6	9.6	0	0	109.3	S96	Q94-S96 PolarHBondContact OE1-OG 2.65Å
95	P	42.7	Very low	33.1	Very low	118 Å²	118	137.9 Å²	137.9	77%	0.766	73%	0.729	S	S	*	*				-98.1	161.9	71.2	-19.8	38.3	0	0	0	114.6
96	S	30.4	Very low	33	Very low	67 Å²	67	139.9 Å²	139.9	47%	0.469	72%	0.723	S	S	.	*			cis	67.1	144.4	30.6	-24.9	0	0	0	0	112.3	Q94	Q94-S96 PolarHBondContact OE1-OG 2.65Å
97	F	28.5	Very low	32.9	Very low	189 Å²	189	142.3 Å²	142.3	83%	0.829	72%	0.719	S	S	*	*			cis	-149.7	167.5	13.1	-86	-91.4	0	0	0	106.9
98	S	29.2	Very low	32.7	Very low	75 Å²	75	141.1 Å²	141.1	52%	0.524	71%	0.714	S	S	.	*			cis	178.8	179.8	-21.9	56.4	0	0	0	0	109.4
99	E	30.4	Very low	32.5	Very low	148 Å²	148	138.5 Å²	138.5	69%	0.692	71%	0.709	S	S	*	*			trans	57.7	153.8	138.3	-74.5	161.3	141	0	0	122.3
100	H	33.3	Very low	32.5	Very low	167 Å²	167	138.4 Å²	138.4	77%	0.773	71%	0.712	S	S	*	*			cis	-155.9	-174.8	-18.5	-125.2	-0.4	0	0	0	109.5
101	P	55.2	Low	32.3	Very low	99 Å²	99	140 Å²	140	64%	0.643	72%	0.719	S	S	*	*			trans	-103.4	-176.2	-169.3	40	-33.3	0	0	0	113.9
102	Q	34.3	Very low	32.2	Very low	167 Å²	167	141.3 Å²	141.3	78%	0.78	73%	0.725	S	S	*	*				166.1	148.9	121.4	-88.2	-174	7.2	0	0	114.7
103	H	33.4	Very low	32.7	Very low	150 Å²	150	138.6 Å²	138.6	69%	0.694	72%	0.718	S	S	*	*			trans	43.8	127	146.6	-76.9	-111.2	0	0	0	122.8
104	L	30.8	Very low	32.8	Very low	168 Å²	168	144.5 Å²	144.5	88%	0.88	73%	0.725	S	S	*	*				-159.2	165.3	95.4	-143.6	68	0	0	0	112.6
105	Q	33	Very low	32.7	Very low	163 Å²	163	145.2 Å²	145.2	76%	0.762	73%	0.728	S	S	*	*			trans	-118.9	145.1	175	-57	166	-56.7	0	0	110.4
106	H	30.5	Very low	32	Very low	173 Å²	173	147.8 Å²	147.8	80%	0.801	74%	0.735	S	S	*	*			trans	-159.6	161.4	139.8	-124.4	58.4	0	0	0	116.5
107	L	29.3	Very low	32.2	Very low	123 Å²	123	153 Å²	153	64%	0.644	75%	0.751	S	S	*	*			trans	-47.2	177.2	178.3	-81.5	57	0	0	0	118.1
108	Q	29.7	Very low	32.8	Very low	139 Å²	139	148.8 Å²	148.8	65%	0.65	74%	0.743	S	S	*	*			cis	171.9	149.9	-27.5	-165.4	179.7	16.5	0	0	109.1
109	H	28.6	Very low	32.9	Very low	159 Å²	159	151.1 Å²	151.1	74%	0.736	76%	0.757	S	S	*	*			trans	60.3	166.3	171.1	-66.3	-58.8	0	0	0	116.7
110	L	29.8	Very low	32.9	Very low	144 Å²	144	152.7 Å²	152.7	75%	0.754	76%	0.764	S	S	*	*			cis	-122.4	-166.5	-7.2	-55.8	71.4	0	0	0	108.1
111	Q	29.2	Very low	32.6	Very low	159 Å²	159	153.7 Å²	153.7	74%	0.743	77%	0.769	S	S	*	*			cis	-152.5	137.4	-6.8	-154.2	167.4	3.4	0	0	113.6
112	H	30.3	Very low	31.3	Very low	182 Å²	182	155.4 Å²	155.4	84%	0.843	78%	0.778	S	S	*	*			trans	-131.4	157.3	142.9	-97.3	11.5	0	0	0	104.8
113	P	39.4	Very low	31	Very low	94 Å²	94	154.8 Å²	154.8	61%	0.61	78%	0.775	S	S	*	*			cis	-143.3	171.9	34.8	42.1	-24.7	0	0	0	116.5
114	Q	29.1	Very low	30.8	Very low	198 Å²	198	156.1 Å²	156.1	93%	0.925	78%	0.781	S	S	*	*			trans	-139.6	124.4	134.8	-78.9	-157.3	-14.8	0	0	112.3
115	H	29.7	Very low	30.7	Very low	167 Å²	167	155.2 Å²	155.2	77%	0.773	77%	0.773	S	S	*	*			trans	-37.7	144.8	155.8	-78.5	-106.8	0	0	0	116.6
116	L	28.8	Very low	30.4	Very low	172 Å²	172	156.2 Å²	156.2	90%	0.901	78%	0.777	S	S	*	*			trans	-161	127	135.2	-107	160.9	0	0	0	110.1
117	Q	33.7	Very low	30.4	Very low	176 Å²	176	155 Å²	155	82%	0.822	77%	0.774	S	S	*	*			trans	-130.4	-179.9	164.8	-57.9	-174.8	-52.9	0	0	107.5
118	P	40.4	Very low	30.3	Very low	101 Å²	101	155.2 Å²	155.2	66%	0.656	77%	0.774	S	S	*	*				-124.3	175.9	-87.1	38.2	-22.3	0	0	0	112.4
119	P	32.7	Very low	30.3	Very low	124 Å²	124	157.1 Å²	157.1	81%	0.805	78%	0.782	S	S	*	*			trans	-95.8	112.5	147.4	0.1	20.5	0	0	0	107.5
120	Q	29.2	Very low	30.2	Very low	181 Å²	181	157.4 Å²	157.4	85%	0.846	78%	0.784	S	S	*	*				57.2	127.8	74.7	-71.7	-162.6	-34.8	0	0	114.3
121	Q	27.2	Very low	30.2	Very low	188 Å²	188	159.2 Å²	159.2	88%	0.879	79%	0.789	S	S	*	*			trans	-78.6	153.4	178.5	-62.2	149.6	-77.4	0	0	110.3
122	T	29	Very low	30.4	Very low	136 Å²	136	160.4 Å²	160.4	83%	0.834	79%	0.794	S	S	*	*			trans	-125.6	113.6	159.2	-47.5	0	0	0	0	107.9
123	E	26.8	Very low	30.6	Very low	153 Å²	153	158 Å²	158	72%	0.715	80%	0.795	S	S	*	*			trans	-73.5	135.7	171.7	-62.5	171.4	89.2	0	0	109.7
124	Q	29.4	Very low	30.1	Very low	178 Å²	178	160.6 Å²	160.6	83%	0.832	80%	0.803	S	S	*	*			trans	-129.9	110.9	152.7	-83.2	-167.6	-21	0	0	109.9
125	Q	27.9	Very low	30.2	Very low	150 Å²	150	158.2 Å²	158.2	70%	0.701	80%	0.797	S	S	*	*			trans	-77.9	138.2	173.2	-58.8	163.3	1.5	0	0	108.5
126	H	28.7	Very low	30.5	Very low	184 Å²	184	158.3 Å²	158.3	85%	0.852	80%	0.797	S	S	*	*			trans	-115.1	96.8	161.7	-97	-72.7	0	0	0	109.6
127	M	28.6	Very low	31.3	Very low	147 Å²	147	154.5 Å²	154.5	72%	0.724	78%	0.783	S	S	*	*			trans	-81.7	150.8	169.7	-82.1	-100.1	60.6	0	0	111.2
128	I	27.8	Very low	31.3	Very low	127 Å²	127	154.6 Å²	154.6	65%	0.651	78%	0.783	S	S	*	*			trans	-40.7	140.3	170.7	-63.4	159.5	0	0	0	112.4	Q130	I128-Q130 HydrophobicContact CG2-CG 4.12Å
129	H	29.6	Very low	31.2	Very low	179 Å²	179	154.2 Å²	154.2	83%	0.829	79%	0.788	S	S	*	*			trans	-126	140.2	149.8	-145.6	64.8	0	0	0	109.9
130	Q	26.6	Very low	31.5	Very low	165 Å²	165	154.1 Å²	154.1	77%	0.771	79%	0.788	S	S	*	*			trans	-101.2	156.2	-179.3	-65.2	169.7	-32.9	0	0	109.9	I128	I128-Q130 HydrophobicContact CG2-CG 4.12Å
131	Q	30	Very low	32.5	Very low	183 Å²	183	150.8 Å²	150.8	86%	0.855	78%	0.782	S	S	*	*			trans	-159.1	118.4	150.1	-113.5	162.9	19.7	0	0	110.2
132	E	32.8	Very low	33.2	Very low	184 Å²	184	147.7 Å²	147.7	86%	0.86	78%	0.778	S	S	*	*			trans	-86.8	170.2	164.1	-65.7	-179	123.1	0	0	109.9
133	P	35.3	Very low	33.9	Very low	131 Å²	131	146.9 Å²	146.9	85%	0.851	78%	0.775	S	S	*	*				-119.2	164.3	129.8	-4.2	24.5	0	0	0	113.5
134	D	28.8	Very low	34.3	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	78%	0.779	S	S	*	*			trans	-84.2	173.6	-154.6	-132.8	-48.8	0	0	0	117.2
135	L	31.9	Very low	34.5	Very low	149 Å²	149	142.3 Å²	142.3	78%	0.78	78%	0.779	S	S	*	*			trans	-68.2	169.6	172.1	-63.6	149.8	0	0	0	110.9
136	Q	35.9	Very low	34.8	Very low	168 Å²	168	141.1 Å²	141.1	79%	0.785	78%	0.782	S	S	*	*				-173	-169.3	69.8	-70.2	-161.6	-3.7	0	0	110.3
137	P	45.3	Very low	35.2	Very low	93 Å²	93	138.3 Å²	138.3	60%	0.604	78%	0.781	S	S	*	*				-128.3	-168.5	-106.4	32.5	-7.6	0	0	0	114
138	H	34.6	Very low	35.5	Very low	178 Å²	178	137.5 Å²	137.5	82%	0.824	78%	0.784	S	S	*	*				168	122	127.3	-87	-61	0	0	0	114.8
139	A	36.5	Very low	35.8	Very low	93 Å²	93	141.2 Å²	141.2	77%	0.769	80%	0.795	S	S	*	*			trans	42.7	156.6	144.2	0	0	0	0	0	124.9
140	P	39.9	Very low	36.1	Very low	122 Å²	122	141.7 Å²	141.7	79%	0.792	80%	0.795	S	S	*	*			trans	-124.2	-144.9	-167	35.8	-11.3	0	0	0	114.6
141	P	51.1	Low	36.7	Very low	111 Å²	111	144 Å²	144	72%	0.721	80%	0.802	S	S	*	*				-109.4	-173	-108.2	42.1	-25.5	0	0	0	114.4
142	P	41.8	Very low	37.1	Very low	123 Å²	123	146.9 Å²	146.9	80%	0.799	81%	0.805	S	S	*	*				-148.5	-148.3	94.1	43.4	-22.2	0	0	0	113.7
143	P	43.5	Very low	37.4	Very low	118 Å²	118	141.5 Å²	141.5	77%	0.766	80%	0.799	S	S	*	*				-133	180	-111.8	40.2	-18.8	0	0	0	118.5
144	A	33.6	Very low	37.7	Very low	98 Å²	98	143.8 Å²	143.8	81%	0.81	79%	0.791	S	S	*	*			trans	71.9	155.7	171.7	0	0	0	0	0	115.8
145	V	33.8	Very low	38.3	Very low	137 Å²	137	140.8 Å²	140.8	83%	0.83	78%	0.78	S	S	*	*			cis	-134.2	154.8	22.5	-172.6	0	0	0	0	112
146	T	35.5	Very low	39.3	Very low	125 Å²	125	137 Å²	137	77%	0.767	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-87.2	133.8	-180	44.3	0	0	0	0	114.7
147	P	36.3	Very low	39.7	Very low	126 Å²	126	137.9 Å²	137.9	82%	0.818	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-82.2	131.9	166.2	-14.5	31	0	0	0	112.7
148	V	35.8	Very low	39.7	Very low	129 Å²	129	139.5 Å²	139.5	78%	0.782	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-69.4	128.7	-177.5	176.2	0	0	0	0	112.7	K150	V148-K150 PolarHBondContact O-N 2.92Å
149	K	34.1	Very low	40.3	Very low	206 Å²	206	135.2 Å²	135.2	90%	0.896	75%	0.751	S	S	*	*			trans	-66	88.2	170.4	-73.3	-177.9	177.8	175.5	0	111.8	K151	K149-K151 PolarHBondContact O-N 2.81Å
150	K	34.5	Very low	40.9	Very low	189 Å²	189	134.3 Å²	134.3	82%	0.822	74%	0.735	S	S	*	*			trans	-68.8	100.4	168.6	-75	-175.2	175.8	178.1	0	110.6	V148 R152	V148-K150 PolarHBondContact O-N 2.92Å; K150-R152 PolarHBondContact O-N 2.84Å
151	K	38.8	Very low	41.5	Very low	213 Å²	213	130.4 Å²	130.4	93%	0.926	71%	0.714	S	S	*	*			trans	-58	99.8	164.6	-88.7	-176.3	172.3	178.6	0	109.3	K149 G153	K149-K151 PolarHBondContact O-N 2.81Å; K151-G153 PolarHBondContact O-N 3.39Å
152	R	38.8	Very low	41.4	Very low	243 Å²	243	130.2 Å²	130.2	92%	0.917	71%	0.706	S	S	*	*			trans	-77.4	109.1	160.5	-82.6	-176	167.6	174.1	-3.6	108.1	K150 R154	K150-R152 PolarHBondContact O-N 2.84Å; R152-R154 PolarHBondContact O-N 3.19Å
153	G	38.9	Very low	41.9	Very low	71 Å²	71	130.4 Å²	130.4	73%	0.732	70%	0.695	S	S	*	*			trans	-64.3	126	171.3	0	0	0	0	0	110.3	K151	K151-G153 PolarHBondContact O-N 3.39Å
154	R	42.6	Very low	42.4	Very low	179 Å²	179	130.3 Å²	130.3	68%	0.675	68%	0.684	S	S	*	*			trans	-73.7	131.1	169.6	-173	176.8	-172.9	165	2.1	108.2	R152 A156	R152-R154 PolarHBondContact O-N 3.19Å; R154-A156 PolarHBondContact O-N 3.44Å
155	P	41.1	Very low	43.5	Very low	86 Å²	86	129.7 Å²	129.7	56%	0.558	67%	0.67	S	S	*	*			trans	-67	108.1	175.7	26.9	-33.1	0	0	0	109.4	K157 Q158	P155-K157 PolarHBondContact O-N 3.44Å; P155-K157 VanDerWaalsContact O-N 3.12Å; P155-Q158 PolarHBondContact O-N 2.9Å
156	A	51.8	Low	44.7	Very low	69 Å²	69	129.4 Å²	129.4	57%	0.57	66%	0.657	S	S	*	*	H	α-helix	trans	-59.2	-27.5	-174.8	0	0	0	0	0	113.3	R154 Q158 Q159	R154-A156 PolarHBondContact O-N 3.44Å; A156-Q158 PolarHBondContact O-N 3Å; A156-Q158 VanDerWaalsContact O-N 3.14Å; A156-Q159 PolarHBondContact O-N 2.9Å
157	K	45.9	Very low	45.9	Very low	186 Å²	186	128.9 Å²	128.9	81%	0.809	65%	0.646	S	S	*	*	H	α-helix	trans	-59.9	-26.2	-173.8	-151.6	173.3	-172.4	-179.5	0	114.4	P155	P155-K157 PolarHBondContact O-N 3.44Å; P155-K157 VanDerWaalsContact O-N 3.12Å
158	Q	44.7	Very low	47	Very low	128 Å²	128	129.4 Å²	129.4	60%	0.598	64%	0.638	S	S	*	*	H	α-helix	trans	-84.2	-33.2	-178	-158.3	160.9	7.5	0	0	112.6	P155 A156 V160 A161 D162	P155-Q158 PolarHBondContact O-N 2.9Å; A156-Q158 PolarHBondContact O-N 3Å; A156-Q158 VanDerWaalsContact O-N 3.14Å; Q158-V160 PolarHBondContact O-N 2.87Å; Q158-A161 PolarHBondContact O-N 3.03Å; Q158-D162 WeakPolarHBondContact O-CB 3.41Å; Q158-D162 PolarHBondContact O-N 2.84Å
159	Q	47	Very low	48.2	Very low	88 Å²	88	129.4 Å²	129.4	41%	0.411	63%	0.631	S	S	.	*	H	α-helix	trans	-71.2	-15.8	174.6	-64.9	-168	-93.5	0	0	113.8	A156 K163	A156-Q159 PolarHBondContact O-N 2.9Å; Q159-K163 WeakPolarHBondContact O-CG 3.48Å
160	V	49.4	Very low	49.8	Very low	73 Å²	73	124.2 Å²	124.2	44%	0.442	61%	0.613	S	S	.	*	H	α-helix	trans	-79.1	-52.8	173.1	176.9	0	0	0	0	109.2	Q158 D162 K163 E164	Q158-V160 PolarHBondContact O-N 2.87Å; V160-D162 PolarHBondContact O-N 2.89Å; V160-K163 WeakPolarHBondContact O-CA 3.42Å; V160-K163 WeakPolarHBondContact O-CB 3.21Å; V160-K163 PolarHBondContact O-N 2.91Å; V160-E164 HydrophobicContact CG1-CG 4.26Å; V160-E164 VanDerWaalsContact CG1-OE1 3.31Å; V160-E164 WeakPolarHBondContact CG1-OE1 3.25Å; V160-E164 WeakPolarHBondContact O-CG 3.15Å; V160-E164 PolarHBondContact O-N 2.9Å
161	A	51.3	Low	51.5	Low	41 Å²	41	122.1 Å²	122.1	34%	0.339	61%	0.606	S	S	.	*	H	α-helix	trans	-58.4	-43.1	175	0	0	0	0	0	113.3	Q158 K163 E164 V165	Q158-A161 PolarHBondContact O-N 3.03Å; A161-K163 PolarHBondContact O-N 3.48Å; A161-E164 PolarHBondContact O-N 3.5Å; A161-V165 WeakPolarHBondContact O-CB 3.41Å; A161-V165 WeakPolarHBondContact O-CG2 3.37Å; A161-V165 PolarHBondContact O-N 3.04Å
162	D	50.1	Low	52.9	Low	106 Å²	106	113.8 Å²	113.8	57%	0.567	58%	0.577	S	S	*	*	H	α-helix	trans	-63.7	-21.4	176	-68.3	-23.6	0	0	0	113	Q158 V160 K166	Q158-D162 WeakPolarHBondContact O-CB 3.41Å; Q158-D162 PolarHBondContact O-N 2.84Å; V160-D162 PolarHBondContact O-N 2.89Å; D162-K166 WeakPolarHBondContact O-CB 3.41Å
163	K	52.9	Low	54.3	Low	128 Å²	128	106.1 Å²	106.1	56%	0.557	55%	0.552	S	S	*	*	H	α-helix	trans	-86.1	-50.7	172.5	-89	-176.8	157.2	-139.1	0	111.7	Q159 V160 A161 V165 K166 E167	Q159-K163 WeakPolarHBondContact O-CG 3.48Å; V160-K163 WeakPolarHBondContact O-CA 3.42Å; V160-K163 WeakPolarHBondContact O-CB 3.21Å; V160-K163 PolarHBondContact O-N 2.91Å; A161-K163 PolarHBondContact O-N 3.48Å; K163-V165 VanDerWaalsContact C-N 3.35Å; K163-V165 PolarHBondContact O-N 2.69Å; K163-K166 CarbonylContact O-C 3.55Å; K163-K166 WeakPolarHBondContact O-CA 3.47Å; K163-K166 WeakPolarHBondContact O-CB 3.14Å; K163-K166 PolarHBondContact O-N 2.87Å; K163-E167 WeakPolarHBondContact O-CB 3.48Å; K163-E167 WeakPolarHBondContact O-CG 3.16Å; K163-E167 PolarHBondContact O-N 3.39Å
164	E	53.2	Low	55.6	Low	116 Å²	116	105.3 Å²	105.3	54%	0.542	54%	0.538	S	S	.	.	H	α-helix	trans	-55.9	-49.2	-178.8	-70.7	165.1	157	0	0	110.6	V160 A161 K166 E167 E168	V160-E164 HydrophobicContact CG1-CG 4.26Å; V160-E164 VanDerWaalsContact CG1-OE1 3.31Å; V160-E164 WeakPolarHBondContact CG1-OE1 3.25Å; V160-E164 WeakPolarHBondContact O-CG 3.15Å; V160-E164 PolarHBondContact O-N 2.9Å; A161-E164 PolarHBondContact O-N 3.5Å; E164-K166 PolarHBondContact O-N 3.45Å; E164-E167 PolarHBondContact O-N 3.24Å; E164-E168 VanDerWaalsContact O-CB 3.25Å; E164-E168 WeakPolarHBondContact O-CB 3.5Å; E164-E168 PolarHBondContact O-N 2.83Å
165	V	57.4	Low	56.6	Low	84 Å²	84	99.5 Å²	99.5	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-62.1	-31.6	176	173.5	0	0	0	0	112.2	A161 K163 M169	A161-V165 WeakPolarHBondContact O-CB 3.41Å; A161-V165 WeakPolarHBondContact O-CG2 3.37Å; A161-V165 PolarHBondContact O-N 3.04Å; K163-V165 VanDerWaalsContact C-N 3.35Å; K163-V165 PolarHBondContact O-N 2.69Å; V165-M169 VanDerWaalsContact O-CB 3.32Å; V165-M169 WeakPolarHBondContact O-CB 3.27Å; V165-M169 VanDerWaalsContact O-CG 3.29Å; V165-M169 WeakPolarHBondContact O-CG 3.34Å; V165-M169 PolarHBondContact O-N 2.85Å
166	K	57.9	Low	57.9	Low	131 Å²	131	100 Å²	100	57%	0.57	52%	0.522	S	S	*	.	H	α-helix	trans	-76.7	-44	177.6	-173.7	-174.8	172.8	-167.4	0	111.9	D162 K163 E164 E168 M169 D170	D162-K166 WeakPolarHBondContact O-CB 3.41Å; K163-K166 CarbonylContact O-C 3.55Å; K163-K166 WeakPolarHBondContact O-CA 3.47Å; K163-K166 WeakPolarHBondContact O-CB 3.14Å; K163-K166 PolarHBondContact O-N 2.87Å; E164-K166 PolarHBondContact O-N 3.45Å; K166-E168 VanDerWaalsContact C-N 3.34Å; K166-M169 PolarHBondContact O-N 3.27Å; K166-D170 WeakPolarHBondContact O-CB 3.32Å; K166-D170 PolarHBondContact O-N 3.3Å
167	E	60.3	Low	58.3	Low	114 Å²	114	103.8 Å²	103.8	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-65.1	-40.3	178.1	-71.4	168.8	-159.4	0	0	109.8	K163 E164 D170 E171	K163-E167 WeakPolarHBondContact O-CB 3.48Å; K163-E167 WeakPolarHBondContact O-CG 3.16Å; K163-E167 PolarHBondContact O-N 3.39Å; E164-E167 PolarHBondContact O-N 3.24Å; E167-D170 PolarHBondContact O-N 2.9Å; E167-E171 WeakPolarHBondContact O-CB 3.49Å; E167-E171 PolarHBondContact O-N 3.44Å
168	E	60.3	Low	59	Low	137 Å²	137	97.8 Å²	97.8	64%	0.64	51%	0.51	S	S	*	.	H	α-helix	trans	-65.5	-36.8	171.5	-167.1	179.5	-136.6	0	0	112.5	E164 K166 A172	E164-E168 VanDerWaalsContact O-CB 3.25Å; E164-E168 WeakPolarHBondContact O-CB 3.5Å; E164-E168 PolarHBondContact O-N 2.83Å; K166-E168 VanDerWaalsContact C-N 3.34Å; E168-A172 WeakPolarHBondContact O-CB 3.3Å; E168-A172 PolarHBondContact O-N 3.47Å
169	M	61.1	Low	59.8	Low	130 Å²	130	99.4 Å²	99.4	64%	0.64	52%	0.515	S	S	*	.	H	α-helix	trans	-67.9	-43	172.2	-86.2	-172.5	61.9	0	0	113.4	V165 K166 A172 E173	V165-M169 VanDerWaalsContact O-CB 3.32Å; V165-M169 WeakPolarHBondContact O-CB 3.27Å; V165-M169 VanDerWaalsContact O-CG 3.29Å; V165-M169 WeakPolarHBondContact O-CG 3.34Å; V165-M169 PolarHBondContact O-N 2.85Å; K166-M169 PolarHBondContact O-N 3.27Å; M169-A172 PolarHBondContact O-N 3.19Å; M169-E173 PolarHBondContact O-N 3.03Å
170	D	68.5	Low	60.4	Low	96 Å²	96	102.9 Å²	102.9	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-68.6	-38	178.5	-82.5	-34.5	0	0	0	110.5	K166 E167 A174	K166-D170 WeakPolarHBondContact O-CB 3.32Å; K166-D170 PolarHBondContact O-N 3.3Å; E167-D170 PolarHBondContact O-N 2.9Å; D170-A174 VanDerWaalsContact O-CB 3.3Å; D170-A174 WeakPolarHBondContact O-CB 3.42Å; D170-A174 PolarHBondContact O-N 2.98Å
171	E	70.3	Confident	60.8	Low	145 Å²	145	103.3 Å²	103.3	68%	0.678	53%	0.527	S	S	*	.	H	α-helix	trans	-67	-41.2	170.8	-175.3	164.5	-151.3	0	0	111.9	E167 E173 A174 A175	E167-E171 WeakPolarHBondContact O-CB 3.49Å; E167-E171 PolarHBondContact O-N 3.44Å; E171-E173 PolarHBondContact O-N 2.82Å; E171-A174 CarbonylContact O-C 3.57Å; E171-A174 WeakPolarHBondContact O-CB 3.37Å; E171-A174 PolarHBondContact O-N 3.34Å; E171-A174 VanDerWaalsContact O-N 3.16Å; E171-A175 WeakPolarHBondContact O-CB 3.4Å; E171-A175 PolarHBondContact O-N 3.04Å
172	A	66.4	Low	61	Low	38 Å²	38	106.5 Å²	106.5	31%	0.314	54%	0.538	S	S	.	.	H	α-helix	trans	-65	-38	175.4	0	0	0	0	0	112.7	E168 M169 K176	E168-A172 WeakPolarHBondContact O-CB 3.3Å; E168-A172 PolarHBondContact O-N 3.47Å; M169-A172 PolarHBondContact O-N 3.19Å; A172-K176 WeakPolarHBondContact O-CB 3.29Å; A172-K176 VanDerWaalsContact O-CD 3.23Å; A172-K176 WeakPolarHBondContact O-CD 3.09Å; A172-K176 WeakPolarHBondContact O-CG 3.29Å; A172-K176 PolarHBondContact O-N 2.87Å
173	E	68.3	Low	61.7	Low	83 Å²	83	107.1 Å²	107.1	39%	0.388	54%	0.541	S	S	.	.	H	α-helix	trans	-71.6	-33.6	169.2	-86.8	-57.2	125.8	0	0	112.6	M169 E171 K176 K177 R180	M169-E173 PolarHBondContact O-N 3.03Å; E171-E173 PolarHBondContact O-N 2.82Å; E173-K176 PolarHBondContact O-N 3.31Å; E173-K176 WeakPolarHBondContact OE1-CD 3.26Å; E173-K176 IonicContact OE1-NZ 2.71Å; E173-K176 PolarHBondContact OE1-NZ 3Å; E173-K177 WeakPolarHBondContact O-CB 3.46Å; E173-K177 PolarHBondContact O-N 2.89Å; E173-R180 IonicContact OE2-NH1 3.89Å; E173-R180 PolarHBondContact OE2-NH1 3.46Å; E173-R180 VanDerWaalsContact OE2-NH1 3.13Å
174	A	66.1	Low	62.9	Low	53 Å²	53	107.4 Å²	107.4	44%	0.438	54%	0.539	S	S	.	.	H	α-helix	trans	-61.6	-44.6	171.7	0	0	0	0	0	111.4	D170 E171 K177 A178	D170-A174 VanDerWaalsContact O-CB 3.3Å; D170-A174 WeakPolarHBondContact O-CB 3.42Å; D170-A174 PolarHBondContact O-N 2.98Å; E171-A174 CarbonylContact O-C 3.57Å; E171-A174 WeakPolarHBondContact O-CB 3.37Å; E171-A174 PolarHBondContact O-N 3.34Å; E171-A174 VanDerWaalsContact O-N 3.16Å; A174-K177 WeakPolarHBondContact O-CB 3.3Å; A174-K177 PolarHBondContact O-N 3.32Å; A174-A178 WeakPolarHBondContact O-CB 3.43Å; A174-A178 PolarHBondContact O-N 3.39Å
175	A	64.6	Low	64.7	Low	57 Å²	57	102 Å²	102	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-43.7	175.2	0	0	0	0	0	112.1	E171 K177 A178 K179	E171-A175 WeakPolarHBondContact O-CB 3.4Å; E171-A175 PolarHBondContact O-N 3.04Å; A175-K177 VanDerWaalsContact C-N 3.33Å; A175-K177 PolarHBondContact O-N 3.32Å; A175-A178 PolarHBondContact O-N 3.45Å; A175-K179 VanDerWaalsContact O-CB 3.3Å; A175-K179 WeakPolarHBondContact O-CB 3.22Å; A175-K179 PolarHBondContact O-N 3.15Å
176	K	67.4	Low	66.2	Low	98 Å²	98	104.2 Å²	104.2	43%	0.426	52%	0.522	S	S	.	.	H	α-helix	trans	-63.6	-37.7	173	-69.1	158.2	-167.7	158.8	0	111.9	A172 E173 R180	A172-K176 WeakPolarHBondContact O-CB 3.29Å; A172-K176 VanDerWaalsContact O-CD 3.23Å; A172-K176 WeakPolarHBondContact O-CD 3.09Å; A172-K176 WeakPolarHBondContact O-CG 3.29Å; A172-K176 PolarHBondContact O-N 2.87Å; E173-K176 PolarHBondContact O-N 3.31Å; E173-K176 WeakPolarHBondContact OE1-CD 3.26Å; E173-K176 IonicContact OE1-NZ 2.71Å; E173-K176 PolarHBondContact OE1-NZ 3Å; K176-R180 VanDerWaalsContact O-CB 3.29Å; K176-R180 WeakPolarHBondContact O-CB 3.34Å; K176-R180 WeakPolarHBondContact O-CD 3.46Å; K176-R180 WeakPolarHBondContact O-CG 3.48Å; K176-R180 PolarHBondContact O-N 2.9Å
177	K	61.6	Low	67.6	Low	147 Å²	147	100.3 Å²	100.3	64%	0.639	52%	0.52	S	S	*	.	H	α-helix	trans	-66.9	-44.6	176.1	-178.5	-176.3	177.8	-171.5	0	110.8	E173 A174 A175 R180 V181	E173-K177 WeakPolarHBondContact O-CB 3.46Å; E173-K177 PolarHBondContact O-N 2.89Å; A174-K177 WeakPolarHBondContact O-CB 3.3Å; A174-K177 PolarHBondContact O-N 3.32Å; A175-K177 VanDerWaalsContact C-N 3.33Å; A175-K177 PolarHBondContact O-N 3.32Å; K177-R180 PolarHBondContact O-N 3.46Å; K177-V181 WeakPolarHBondContact O-CG2 3.16Å; K177-V181 PolarHBondContact O-N 3.47Å
178	A	60.3	Low	69.1	Low	61 Å²	61	97.3 Å²	97.3	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-60.1	-47.7	172.6	0	0	0	0	0	111.4	A174 A175 R180 V181 L182	A174-A178 WeakPolarHBondContact O-CB 3.43Å; A174-A178 PolarHBondContact O-N 3.39Å; A175-A178 PolarHBondContact O-N 3.45Å; A178-R180 VanDerWaalsContact C-N 3.35Å; A178-R180 PolarHBondContact O-N 3.05Å; A178-V181 PolarHBondContact O-N 3.46Å; A178-V181 VanDerWaalsContact O-N 3.08Å; A178-L182 WeakPolarHBondContact O-CB 3.19Å; A178-L182 PolarHBondContact O-N 3.34Å
179	K	60.6	Low	70.7	Confident	161 Å²	161	93 Å²	93	70%	0.7	49%	0.491	S	S	*	.	H	α-helix	trans	-62.9	-36.7	176.6	-164.3	166.9	-174.5	169.9	0	112.7	A175 N183	A175-K179 VanDerWaalsContact O-CB 3.3Å; A175-K179 WeakPolarHBondContact O-CB 3.22Å; A175-K179 PolarHBondContact O-N 3.15Å; K179-N183 VanDerWaalsContact O-CB 3.28Å; K179-N183 WeakPolarHBondContact O-CB 3.49Å; K179-N183 PolarHBondContact O-N 2.98Å
180	R	60.7	Low	72.2	Confident	162 Å²	162	89.6 Å²	89.6	61%	0.611	48%	0.478	S	S	*	.	H	α-helix	trans	-68.1	-32.6	171.5	-76.3	166.5	176.6	149.9	-1.6	113	E173 K176 K177 A178 R184	E173-R180 IonicContact OE2-NH1 3.89Å; E173-R180 PolarHBondContact OE2-NH1 3.46Å; E173-R180 VanDerWaalsContact OE2-NH1 3.13Å; K176-R180 VanDerWaalsContact O-CB 3.29Å; K176-R180 WeakPolarHBondContact O-CB 3.34Å; K176-R180 WeakPolarHBondContact O-CD 3.46Å; K176-R180 WeakPolarHBondContact O-CG 3.48Å; K176-R180 PolarHBondContact O-N 2.9Å; K177-R180 PolarHBondContact O-N 3.46Å; A178-R180 VanDerWaalsContact C-N 3.35Å; A178-R180 PolarHBondContact O-N 3.05Å; R180-R184 PolarHBondContact O-N 3.27Å
181	V	58	Low	73.4	Confident	82 Å²	82	88.3 Å²	88.3	50%	0.497	48%	0.481	S	S	.	.	H	α-helix	trans	-73.3	-47.1	174.9	167	0	0	0	0	110.8	K177 A178 N183 R184	K177-V181 WeakPolarHBondContact O-CG2 3.16Å; K177-V181 PolarHBondContact O-N 3.47Å; A178-V181 PolarHBondContact O-N 3.46Å; A178-V181 VanDerWaalsContact O-N 3.08Å; V181-N183 VanDerWaalsContact C-N 3.33Å; V181-N183 PolarHBondContact O-N 3.13Å; V181-R184 WeakPolarHBondContact O-CB 3.38Å; V181-R184 PolarHBondContact O-N 3.04Å; V181-R184 VanDerWaalsContact O-N 3.14Å
182	L	54.4	Low	74.6	Confident	108 Å²	108	86.3 Å²	86.3	57%	0.565	47%	0.471	S	S	*	.	H	α-helix	trans	-60.5	-41.9	177.4	-172.1	67.8	0	0	0	111.7	A178 R184 G187	A178-L182 WeakPolarHBondContact O-CB 3.19Å; A178-L182 PolarHBondContact O-N 3.34Å; L182-R184 PolarHBondContact O-N 3.46Å; L182-G187 PolarHBondContact O-N 2.87Å
183	N	66.1	Low	76	Confident	118 Å²	118	84.5 Å²	84.5	63%	0.631	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-83	8	179.2	-149.5	5.3	0	0	0	114	K179 V181 F185	K179-N183 VanDerWaalsContact O-CB 3.28Å; K179-N183 WeakPolarHBondContact O-CB 3.49Å; K179-N183 PolarHBondContact O-N 2.98Å; V181-N183 VanDerWaalsContact C-N 3.33Å; V181-N183 PolarHBondContact O-N 3.13Å; N183-F185 VanDerWaalsContact C-N 3.31Å
184	R	78.3	Confident	77.4	Confident	135 Å²	135	83.7 Å²	83.7	51%	0.509	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-70.6	-29.2	175.9	-176.4	179	171.7	-166.7	-4.9	112.7	R180 V181 L182	R180-R184 PolarHBondContact O-N 3.27Å; V181-R184 WeakPolarHBondContact O-CB 3.38Å; V181-R184 PolarHBondContact O-N 3.04Å; V181-R184 VanDerWaalsContact O-N 3.14Å; L182-R184 PolarHBondContact O-N 3.46Å
185	F	89.6	Confident	78.8	Confident	3 Å²	3	85.2 Å²	85.2	1%	0.013	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-128.2	33.4	-174.4	-54.4	-61.3	0	0	0	111.2	N183 G187 M188 V190 V193 L217 L218 Y221	N183-F185 VanDerWaalsContact C-N 3.31Å; F185-G187 VanDerWaalsContact C-N 3.3Å; F185-G187 PolarHBondContact O-N 3.28Å; F185-M188 HydrophobicContact CB-CB 4.1Å; F185-M188 WeakPolarHBondContact CB-O 3.47Å; F185-M188 WeakPolarHBondContact O-CB 3.42Å; F185-M188 PolarHBondContact O-N 3.25Å; F185-V190 HydrophobicContact CE2-CG2 4.36Å; F185-V193 HydrophobicContact CB-CG2 4.06Å; F185-V193 HydrophobicContact CD1-CG2 4.18Å; F185-V193 HydrophobicContact CD2-CG2 3.95Å; F185-V193 HydrophobicContact CE1-CG1 4.42Å; F185-V193 HydrophobicContact CE2-CG2 4.41Å; F185-V193 HydrophobicContact CG-CG2 3.82Å; F185-V193 HydrophobicContact CZ-CG1 4.4Å; F185-L217 HydrophobicContact CE1-CB 4.2Å; F185-L217 HydrophobicContact CZ-CB 3.71Å; F185-L217 HydrophobicContact CZ-CD1 4.13Å; F185-L218 HydrophobicContact CD1-CD1 4.37Å; F185-L218 HydrophobicContact CE1-CD1 4.1Å; F185-Y221 HydrophobicContact CB-CD2 3.65Å; F185-Y221 HydrophobicContact CB-CE2 3.79Å; F185-Y221 HydrophobicContact CB-CG 4.15Å; F185-Y221 AromaticContact CD1-CD1 3.92Å; F185-Y221 HydrophobicContact CD1-CD1 3.92Å; F185-Y221 AromaticContact CD1-CD2 3.97Å; F185-Y221 HydrophobicContact CD1-CD2 3.97Å; F185-Y221 AromaticContact CD1-CG 3.56Å; F185-Y221 HydrophobicContact CD1-CG 3.56Å; F185-Y221 HydrophobicContact CE1-CG 4.39Å; F185-Y221 HydrophobicContact CG-CD2 4.2Å; F185-Y221 HydrophobicContact CG-CG 4.26Å; F185-Y221 WeakPolarHBondContact O-CE2 3.45Å
186	N	89.1	Confident	80.4	Confident	129 Å²	129	86.3 Å²	86.3	69%	0.69	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	44.9	176.6	-160.5	82	0	0	0	113.7	Y221	N186-Y221 WeakPolarHBondContact CB-OH 3.37Å
187	G	87.6	Confident	81.8	Confident	50 Å²	50	84.8 Å²	84.8	52%	0.515	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	-20.2	-179.4	0	0	0	0	0	115.4	L182 F185	L182-G187 PolarHBondContact O-N 2.87Å; F185-G187 VanDerWaalsContact C-N 3.3Å; F185-G187 PolarHBondContact O-N 3.28Å
188	M	91.9	Very high	83.6	Confident	50 Å²	50	78.1 Å²	78.1	25%	0.246	43%	0.43	C	S	.	.			trans	-70.4	135.4	178.5	-169.5	171.9	-82.4	0	0	111.7	F185 E192 V193 K196 Y221	F185-M188 HydrophobicContact CB-CB 4.1Å; F185-M188 WeakPolarHBondContact CB-O 3.47Å; F185-M188 WeakPolarHBondContact O-CB 3.42Å; F185-M188 PolarHBondContact O-N 3.25Å; M188-E192 HydrophobicContact CG-CB 3.55Å; M188-E192 HydrophobicContact CG-CG 4.46Å; M188-E192 HydrophobicContact SD-CB 4.14Å; M188-V193 HydrophobicContact CB-CG2 4.35Å; M188-V193 HydrophobicContact CG-CG2 3.82Å; M188-V193 HydrophobicContact SD-CG2 3.75Å; M188-K196 HydrophobicContact SD-CD 4.39Å; M188-Y221 HydrophobicContact SD-CD2 4.27Å
189	S	93	Very high	85.4	Confident	47 Å²	47	79.1 Å²	79.1	33%	0.329	43%	0.432	S	S	.	.			trans	-72.2	163.3	177.8	73.7	0	0	0	0	112.5	A191 E192 V193	S189-A191 PolarHBondContact O-N 3.18Å; S189-E192 WeakPolarHBondContact CA-OE2 3.49Å; S189-E192 WeakPolarHBondContact CB-OE2 3.5Å; S189-E192 PolarHBondContact N-OE2 3.37Å; S189-E192 PolarHBondContact O-N 3.44Å; S189-E192 WeakPolarHBondContact OG-CG 3.47Å; S189-E192 PolarHBondContact OG-N 3.05Å; S189-E192 PolarHBondContact OG-OE2 3.09Å; S189-V193 WeakPolarHBondContact O-CG2 3.33Å; S189-V193 PolarHBondContact O-N 3.41Å; S189-V193 VanDerWaalsContact O-N 3.11Å
190	V	92.9	Very high	87.2	Confident	58 Å²	58	73.9 Å²	73.9	35%	0.352	41%	0.411	S	S	.	.	H	α-helix	trans	-63.3	-33.6	175.4	-175.7	0	0	0	0	111.4	F185 V193 M194 L217	F185-V190 HydrophobicContact CE2-CG2 4.36Å; V190-V193 PolarHBondContact O-N 2.65Å; V190-M194 HydrophobicContact CG1-CG 4.46Å; V190-M194 HydrophobicContact CG1-SD 4.02Å; V190-M194 WeakPolarHBondContact O-CB 3.28Å; V190-M194 WeakPolarHBondContact O-CG 3.42Å; V190-M194 PolarHBondContact O-N 2.98Å; V190-L217 HydrophobicContact CG1-CD1 4.25Å; V190-L217 HydrophobicContact CG1-CD2 4.24Å
191	A	94.4	Very high	89	Confident	70 Å²	70	66.4 Å²	66.4	58%	0.579	38%	0.384	S	S	*	.	H	α-helix	trans	-67.2	-47.5	179.3	0	0	0	0	0	111.8	S189 V193 M194 A195	S189-A191 PolarHBondContact O-N 3.18Å; A191-V193 VanDerWaalsContact C-N 3.31Å; A191-V193 PolarHBondContact O-N 2.74Å; A191-M194 CarbonylContact O-C 3.59Å; A191-M194 PolarHBondContact O-N 2.96Å; A191-M194 VanDerWaalsContact O-N 3.08Å; A191-A195 PolarHBondContact O-N 3.33Å
192	E	95.6	Very high	90.9	Very high	102 Å²	102	64.7 Å²	64.7	48%	0.477	37%	0.371	S	S	.	.	H	α-helix	trans	-61.4	-38.4	174.9	-68.2	160.8	100.6	0	0	112	M188 S189 M194 A195 K196	M188-E192 HydrophobicContact CG-CB 3.55Å; M188-E192 HydrophobicContact CG-CG 4.46Å; M188-E192 HydrophobicContact SD-CB 4.14Å; S189-E192 WeakPolarHBondContact CA-OE2 3.49Å; S189-E192 WeakPolarHBondContact CB-OE2 3.5Å; S189-E192 PolarHBondContact N-OE2 3.37Å; S189-E192 PolarHBondContact O-N 3.44Å; S189-E192 WeakPolarHBondContact OG-CG 3.47Å; S189-E192 PolarHBondContact OG-N 3.05Å; S189-E192 PolarHBondContact OG-OE2 3.09Å; E192-M194 VanDerWaalsContact C-N 3.33Å; E192-M194 PolarHBondContact O-N 2.6Å; E192-A195 PolarHBondContact O-N 3.01Å; E192-K196 PolarHBondContact O-N 2.88Å
193	V	96.3	Very high	93	Very high	0 Å²	0	61 Å²	61	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-34.3	173.9	172	0	0	0	0	112.1	F185 M188 S189 V190 A191 L217 Y221 T270	F185-V193 HydrophobicContact CB-CG2 4.06Å; F185-V193 HydrophobicContact CD1-CG2 4.18Å; F185-V193 HydrophobicContact CD2-CG2 3.95Å; F185-V193 HydrophobicContact CE1-CG1 4.42Å; F185-V193 HydrophobicContact CE2-CG2 4.41Å; F185-V193 HydrophobicContact CG-CG2 3.82Å; F185-V193 HydrophobicContact CZ-CG1 4.4Å; M188-V193 HydrophobicContact CB-CG2 4.35Å; M188-V193 HydrophobicContact CG-CG2 3.82Å; M188-V193 HydrophobicContact SD-CG2 3.75Å; S189-V193 WeakPolarHBondContact O-CG2 3.33Å; S189-V193 PolarHBondContact O-N 3.41Å; S189-V193 VanDerWaalsContact O-N 3.11Å; V190-V193 PolarHBondContact O-N 2.65Å; A191-V193 VanDerWaalsContact C-N 3.31Å; A191-V193 PolarHBondContact O-N 2.74Å; V193-L217 HydrophobicContact CG1-CB 3.89Å; V193-L217 HydrophobicContact CG1-CD2 3.98Å; V193-L217 WeakPolarHBondContact CG1-O 3.37Å; V193-Y221 HydrophobicContact CG2-CD2 4.12Å; V193-T270 WeakPolarHBondContact O-CG2 3.31Å
194	M	96.4	Very high	94.5	Very high	67 Å²	67	62 Å²	62	33%	0.33	35%	0.353	S	S	.	.	H	α-helix	trans	-77	-24.8	176.1	-75.2	177.2	60.1	0	0	113.6	V190 A191 E192 K196 L217 T270 P272	V190-M194 HydrophobicContact CG1-CG 4.46Å; V190-M194 HydrophobicContact CG1-SD 4.02Å; V190-M194 WeakPolarHBondContact O-CB 3.28Å; V190-M194 WeakPolarHBondContact O-CG 3.42Å; V190-M194 PolarHBondContact O-N 2.98Å; A191-M194 CarbonylContact O-C 3.59Å; A191-M194 PolarHBondContact O-N 2.96Å; A191-M194 VanDerWaalsContact O-N 3.08Å; E192-M194 VanDerWaalsContact C-N 3.33Å; E192-M194 PolarHBondContact O-N 2.6Å; M194-K196 VanDerWaalsContact C-N 3.32Å; M194-L217 HydrophobicContact CG-CD2 3.4Å; M194-L217 HydrophobicContact SD-CD2 4.14Å; M194-T270 HydrophobicContact CG-CG2 4.5Å; M194-P272 HydrophobicContact SD-CG 4.31Å
195	A	96.9	Very high	95.4	Very high	85 Å²	85	62.5 Å²	62.5	70%	0.702	37%	0.366	S	S	*	.	H	α-helix	trans	-74.3	-21.3	173.3	0	0	0	0	0	113.1	A191 E192	A191-A195 PolarHBondContact O-N 3.33Å; E192-A195 PolarHBondContact O-N 3.01Å
196	K	97.7	Very high	95.8	Very high	80 Å²	80	62.5 Å²	62.5	35%	0.348	37%	0.366	S	S	.	.			trans	-73.3	143.3	171.2	-73.9	-177.7	170.9	-175.5	0	111.5	M188 E192 M194 A220 T270	M188-K196 HydrophobicContact SD-CD 4.39Å; E192-K196 PolarHBondContact O-N 2.88Å; M194-K196 VanDerWaalsContact C-N 3.32Å; K196-A220 HydrophobicContact CB-CB 4.18Å; K196-T270 VanDerWaalsContact O-CB 3.31Å; K196-T270 WeakPolarHBondContact O-CB 3.4Å; K196-T270 PolarHBondContact O-OG1 3.43Å
197	T	97.1	Very high	96.3	Very high	66 Å²	66	56.6 Å²	56.6	41%	0.405	33%	0.334	S	S	.	.			trans	-97.2	-175.8	163.6	71.1	0	0	0	0	110.6	E268	T197-E268 WeakPolarHBondContact CB-OE1 3.43Å; T197-E268 HydrophobicContact CG2-CG 3.63Å; T197-E268 VanDerWaalsContact CG2-OE1 3.29Å; T197-E268 WeakPolarHBondContact CG2-OE1 3.34Å; T197-E268 PolarHBondContact OG1-OE1 2.89Å
198	L	98.1	Very high	96.8	Very high	6 Å²	6	54.2 Å²	54.2	3%	0.031	31%	0.31	C	S	.	.			trans	-128.8	115.8	176.4	172.8	64.4	0	0	0	108.4	D200 P215 R224 H225	L198-D200 PolarHBondContact O-N 2.88Å; L198-P215 HydrophobicContact CB-CB 3.81Å; L198-P215 HydrophobicContact CB-CG 3.55Å; L198-P215 HydrophobicContact CD2-CB 4.14Å; L198-P215 HydrophobicContact CD2-CG 4.21Å; L198-R224 VanDerWaalsContact CD1-N 3.26Å; L198-H225 VanDerWaalsContact CD2-CE1 3.45Å; L198-H225 WeakPolarHBondContact CD2-CE1 3.3Å
199	P	98.1	Very high	97.1	Very high	83 Å²	83	51.9 Å²	51.9	54%	0.539	30%	0.298	S	S	.	.			trans	-56.1	136	176.7	-27.8	36	0	0	0	112.6	H225	P199-H225 PolarHBondContact O-NE2 2.82Å
200	D	98.7	Very high	97.4	Very high	50 Å²	50	49.7 Å²	49.7	27%	0.267	28%	0.283	S	S	.	.			trans	-65.8	156.1	168.1	-63.9	-31.6	0	0	0	110.2	L198 L202 T264 K292	L198-D200 PolarHBondContact O-N 2.88Å; D200-L202 HydrophobicContact CB-CD1 3.61Å; D200-L202 HydrophobicContact CB-CG 3.92Å; D200-T264 VanDerWaalsContact OD1-CA 3.26Å; D200-T264 WeakPolarHBondContact OD1-CA 3.46Å; D200-T264 PolarHBondContact OD1-OG1 3.15Å; D200-T264 PolarHBondContact OD2-OG1 3.44Å; D200-K292 WeakPolarHBondContact OD2-CE 3.26Å; D200-K292 IonicContact OD2-NZ 3.91Å; D200-K292 PolarHBondContact OD2-NZ 2.84Å
201	V	98.8	Very high	97.7	Very high	6 Å²	6	46.9 Å²	46.9	4%	0.036	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-120.7	88.8	176.5	-177.3	0	0	0	0	106.9	P256 G262 F263	V201-P256 HydrophobicContact CG1-CG 3.54Å; V201-G262 CarbonylContact O-C 3.16Å; V201-G262 WeakPolarHBondContact O-CA 3.3Å; V201-F263 HydrophobicContact CB-CB 4.1Å; V201-F263 HydrophobicContact CB-CD2 4.08Å; V201-F263 HydrophobicContact CG1-CD2 4.45Å; V201-F263 HydrophobicContact CG2-CB 4.46Å; V201-F263 HydrophobicContact CG2-CD2 4.43Å; V201-F263 PolarHBondContact N-O 2.85Å; V201-F263 PolarHBondContact O-N 2.88Å
202	L	98.4	Very high	97.9	Very high	45 Å²	45	43.7 Å²	43.7	24%	0.236	24%	0.239	C	C	.	.			trans	-120.9	142.3	-169.1	-69.7	165.2	0	0	0	110.9	D200 L209 K292 Y296	D200-L202 HydrophobicContact CB-CD1 3.61Å; D200-L202 HydrophobicContact CB-CG 3.92Å; L202-L209 HydrophobicContact CD2-CD1 3.57Å; L202-L209 HydrophobicContact CD2-CD2 3.64Å; L202-L209 HydrophobicContact CD2-CG 4.28Å; L202-K292 HydrophobicContact CD1-CD 4.45Å; L202-Y296 HydrophobicContact CB-CD2 4.13Å; L202-Y296 HydrophobicContact CB-CE1 4.4Å; L202-Y296 HydrophobicContact CB-CE2 3.99Å; L202-Y296 HydrophobicContact CB-CG 4.42Å; L202-Y296 HydrophobicContact CD1-CD2 3.93Å; L202-Y296 HydrophobicContact CD1-CE2 3.62Å; L202-Y296 HydrophobicContact CD2-CD2 4.14Å; L202-Y296 HydrophobicContact CG-CD2 4.29Å; L202-Y296 HydrophobicContact CG-CE2 4.27Å
203	A	98.3	Very high	98	Very high	32 Å²	32	40.3 Å²	40.3	26%	0.264	23%	0.225	S	C	.	.			trans	-143.8	164.7	172.5	0	0	0	0	0	108.6	L206 P256	A203-L206 HydrophobicContact CB-CD2 4.18Å; A203-L206 HydrophobicContact CB-CG 4.2Å; A203-L206 WeakPolarHBondContact O-CD1 3.49Å; A203-L206 WeakPolarHBondContact O-CG 3.34Å; A203-P256 HydrophobicContact CB-CB 4.04Å
204	Y	98	Very high	98.1	Very high	137 Å²	137	41.2 Å²	41.2	54%	0.537	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	159.9	166.2	-65	-84.6	0	0	0	110.1	L206 K295 Y296	Y204-L206 PolarHBondContact O-N 2.83Å; Y204-K295 VanDerWaalsContact CE1-O 3.32Å; Y204-K295 WeakPolarHBondContact CE1-O 3.5Å; Y204-K295 VanDerWaalsContact OH-CE 3.28Å; Y204-K295 WeakPolarHBondContact OH-CE 3.49Å; Y204-Y296 HydrophobicContact CD1-CD1 4.12Å; Y204-Y296 HydrophobicContact CD2-CD1 4.32Å; Y204-Y296 HydrophobicContact CD2-CE1 4.49Å; Y204-Y296 AromaticContact CE1-CD1 3.97Å; Y204-Y296 HydrophobicContact CE1-CD1 3.97Å; Y204-Y296 HydrophobicContact CE1-CE1 4.4Å; Y204-Y296 HydrophobicContact CE2-CD1 4.15Å; Y204-Y296 AromaticContact CE2-CE1 3.98Å; Y204-Y296 HydrophobicContact CE2-CE1 3.98Å; Y204-Y296 HydrophobicContact CG-CD1 4.31Å; Y204-Y296 AromaticContact CZ-CD1 3.97Å; Y204-Y296 AromaticContact CZ-CE1 3.94Å
205	N	95.8	Very high	98.1	Very high	146 Å²	146	38.1 Å²	38.1	78%	0.781	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	25.2	175.4	-49.7	-33.1	0	0	0	115
206	L	98.8	Very high	98.1	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.016	19%	0.192	C	C	.	.			trans	-65.6	137.3	173.1	-71.4	172.5	0	0	0	111.3	A203 Y204 P256 S260 P298 L299	A203-L206 HydrophobicContact CB-CD2 4.18Å; A203-L206 HydrophobicContact CB-CG 4.2Å; A203-L206 WeakPolarHBondContact O-CD1 3.49Å; A203-L206 WeakPolarHBondContact O-CG 3.34Å; Y204-L206 PolarHBondContact O-N 2.83Å; L206-P256 HydrophobicContact CD2-CB 3.97Å; L206-S260 WeakPolarHBondContact CD2-O 3.34Å; L206-P298 HydrophobicContact CB-CB 4.02Å; L206-P298 CarbonylContact O-C 3.57Å; L206-P298 WeakPolarHBondContact O-CA 3.18Å; L206-L299 PolarHBondContact O-N 3.43Å
207	D	98.8	Very high	98.1	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.027	18%	0.178	C	C	.	.	S	Bend	trans	-72.2	-40.7	170.4	-72.6	-10.3	0	0	0	110	S260 L299 I300 R370 K374	D207-S260 VanDerWaalsContact CG-CB 3.48Å; D207-S260 PolarHBondContact N-O 2.86Å; D207-L299 WeakPolarHBondContact O-CB 3.45Å; D207-I300 PolarHBondContact O-N 2.87Å; D207-R370 HydrophobicContact CB-CG 3.78Å; D207-R370 WeakPolarHBondContact OD2-CD 3.19Å; D207-R370 IonicContact OD2-CZ 3.82Å; D207-R370 IonicContact OD2-NE 3.77Å; D207-R370 IonicContact OD2-NH1 2.9Å; D207-R370 PolarHBondContact OD2-NH1 3.42Å; D207-K374 WeakPolarHBondContact OD1-CD 3.45Å; D207-K374 WeakPolarHBondContact OD1-CE 3.33Å; D207-K374 IonicContact OD1-NZ 2.7Å; D207-K374 PolarHBondContact OD1-NZ 3.41Å; D207-K374 IonicContact OD2-NZ 3.8Å
208	I	98.9	Very high	98	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.9	-175.6	-59.7	167.6	0	0	0	109.7	I210 L242 S260 I261 G262 I300 A302 L366 R370	I208-I210 HydrophobicContact CG2-CD1 3.64Å; I208-I210 HydrophobicContact CG2-CG1 4.21Å; I208-L242 HydrophobicContact CD1-CD2 3.97Å; I208-S260 PolarHBondContact N-O 2.91Å; I208-S260 VanDerWaalsContact N-O 3.1Å; I208-I261 HydrophobicContact CB-CG1 4.32Å; I208-I261 HydrophobicContact CD1-CG1 4.48Å; I208-I261 CarbonylContact O-C 3.57Å; I208-I261 WeakPolarHBondContact O-CA 3.16Å; I208-G262 PolarHBondContact O-N 3.34Å; I208-I300 HydrophobicContact CG1-CB 4.46Å; I208-I300 HydrophobicContact CG1-CD1 4.34Å; I208-A302 HydrophobicContact CG2-CB 3.8Å; I208-L366 HydrophobicContact CD1-CD1 4.18Å; I208-L366 HydrophobicContact CD1-CD2 4.17Å; I208-L366 HydrophobicContact CD1-CG 3.89Å; I208-L366 HydrophobicContact CG1-CD1 4.33Å; I208-L366 HydrophobicContact CG2-CD1 4.49Å; I208-L366 HydrophobicContact CG2-CD2 4.21Å; I208-R370 HydrophobicContact CD1-CB 4.37Å; I208-R370 HydrophobicContact CD1-CG 4.18Å; I208-R370 HydrophobicContact CG1-CG 4.21Å
209	L	98.9	Very high	98	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	112.4	163.8	178.6	51.3	0	0	0	109.8	L202 I211 G262 T264 L293 P298 I300 A302	L202-L209 HydrophobicContact CD2-CD1 3.57Å; L202-L209 HydrophobicContact CD2-CD2 3.64Å; L202-L209 HydrophobicContact CD2-CG 4.28Å; L209-I211 HydrophobicContact CG-CG1 4.29Å; L209-I211 PolarHBondContact O-N 2.99Å; L209-G262 VanDerWaalsContact CD1-C 3.47Å; L209-T264 HydrophobicContact CD1-CG2 3.88Å; L209-T264 HydrophobicContact CD2-CG2 3.89Å; L209-T264 HydrophobicContact CG-CG2 3.87Å; L209-L293 HydrophobicContact CD2-CD2 3.84Å; L209-P298 HydrophobicContact CB-CB 3.93Å; L209-P298 HydrophobicContact CB-CG 3.79Å; L209-P298 HydrophobicContact CD2-CG 4.23Å; L209-I300 PolarHBondContact N-O 2.9Å; L209-A302 PolarHBondContact O-N 3.18Å
210	I	98.9	Very high	98	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	113.9	176.3	-56.1	-65.3	0	0	0	109.1	I208 Y226 F233 I261 G262 F263 T264 A302 M343 L366	I208-I210 HydrophobicContact CG2-CD1 3.64Å; I208-I210 HydrophobicContact CG2-CG1 4.21Å; I210-Y226 HydrophobicContact CG2-CE2 4.01Å; I210-F233 HydrophobicContact CD1-CE2 4.05Å; I210-F233 HydrophobicContact CG1-CE2 3.97Å; I210-F233 HydrophobicContact CG1-CZ 4.18Å; I210-F233 HydrophobicContact CG2-CD2 4.49Å; I210-F233 HydrophobicContact CG2-CE2 3.93Å; I210-I261 HydrophobicContact CD1-CG2 4.5Å; I210-I261 HydrophobicContact CG1-CG2 3.76Å; I210-G262 PolarHBondContact N-O 2.86Å; I210-F263 HydrophobicContact CB-CD1 3.82Å; I210-F263 HydrophobicContact CB-CE1 4.01Å; I210-F263 HydrophobicContact CG1-CD1 4.37Å; I210-F263 HydrophobicContact CG1-CE1 4.11Å; I210-F263 HydrophobicContact CG2-CD1 4.15Å; I210-F263 HydrophobicContact CG2-CE1 4.24Å; I210-T264 PolarHBondContact O-N 2.94Å; I210-A302 HydrophobicContact CD1-CB 4.06Å; I210-M343 HydrophobicContact CD1-CE 4.25Å; I210-L366 HydrophobicContact CD1-CD2 4.4Å
211	I	98.9	Very high	97.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	104.1	-178.2	-59.1	159.9	0	0	0	108.7	L209 T264 L289 L293 A301 A302 F303 N304 I308	L209-I211 HydrophobicContact CG-CG1 4.29Å; L209-I211 PolarHBondContact O-N 2.99Å; I211-T264 HydrophobicContact CB-CG2 4.28Å; I211-T264 HydrophobicContact CG1-CG2 3.72Å; I211-T264 HydrophobicContact CG2-CG2 4.4Å; I211-L289 HydrophobicContact CD1-CD1 4.4Å; I211-L289 HydrophobicContact CD1-CD2 4.28Å; I211-L289 HydrophobicContact CG1-CD1 4.27Å; I211-L289 HydrophobicContact CG2-CD1 4.27Å; I211-L289 HydrophobicContact CG2-CD2 3.67Å; I211-L293 HydrophobicContact CD1-CD1 4.39Å; I211-L293 HydrophobicContact CD1-CD2 4.44Å; I211-A301 HydrophobicContact CD1-CB 3.82Å; I211-A302 PolarHBondContact N-O 3.2Å; I211-F303 HydrophobicContact CB-CD1 4.23Å; I211-F303 HydrophobicContact CD1-CD1 4.04Å; I211-F303 HydrophobicContact CD1-CD2 4.12Å; I211-F303 HydrophobicContact CD1-CE1 3.77Å; I211-F303 HydrophobicContact CD1-CE2 3.84Å; I211-F303 HydrophobicContact CD1-CG 4.21Å; I211-F303 HydrophobicContact CD1-CZ 3.66Å; I211-F303 HydrophobicContact CG2-CD1 3.93Å; I211-F303 HydrophobicContact CG2-CE1 4.13Å; I211-N304 VanDerWaalsContact O-CB 3.25Å; I211-N304 WeakPolarHBondContact O-CB 3.5Å; I211-N304 PolarHBondContact O-N 3.05Å; I211-I308 HydrophobicContact CG2-CD1 4.27Å
212	G	98.4	Very high	97.9	Very high	2 Å²	2	30.8 Å²	30.8	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	170.1	171.6	0	0	0	0	0	113	Y226 T264 N265 M266	G212-Y226 WeakPolarHBondContact CA-OH 3.05Å; G212-T264 PolarHBondContact N-O 3.25Å; G212-N265 WeakPolarHBondContact CA-OD1 3.47Å; G212-N265 CarbonylContact O-C 3.54Å; G212-N265 WeakPolarHBondContact O-CA 3.45Å; G212-M266 PolarHBondContact O-N 2.85Å
213	I	97.7	Very high	97.8	Very high	32 Å²	32	30 Å²	30	16%	0.164	16%	0.162	C	C	.	.	S	Bend	trans	-75.1	-66.5	173.9	-58.2	172	0	0	0	109.2	M266 V267 L277 I308	I213-M266 WeakPolarHBondContact O-CB 3.38Å; I213-M266 PolarHBondContact O-N 3.42Å; I213-V267 PolarHBondContact O-N 2.99Å; I213-L277 HydrophobicContact CG2-CD1 3.93Å; I213-I308 HydrophobicContact CB-CG2 4.03Å; I213-I308 HydrophobicContact CG1-CD1 3.99Å; I213-I308 HydrophobicContact CG1-CG1 4.19Å; I213-I308 HydrophobicContact CG1-CG2 3.83Å; I213-I308 HydrophobicContact CG2-CG2 3.67Å
214	N	98	Very high	97.8	Very high	19 Å²	19	31.6 Å²	31.6	10%	0.102	16%	0.161	C	C	.	.	S	Bend	trans	-159.1	165.8	175.1	77.8	-58	0	0	0	109.3	G216 N265 V267 R269 T271 L277	N214-G216 PolarHBondContact O-N 2.85Å; N214-N265 WeakPolarHBondContact CA-OD1 3.2Å; N214-N265 PolarHBondContact N-OD1 3.06Å; N214-V267 VanDerWaalsContact CA-O 3.28Å; N214-V267 WeakPolarHBondContact CA-O 3.46Å; N214-V267 HydrophobicContact CB-CB 4.16Å; N214-V267 VanDerWaalsContact CB-O 3.26Å; N214-V267 WeakPolarHBondContact CB-O 3.39Å; N214-R269 PolarHBondContact ND2-O 2.85Å; N214-T271 PolarHBondContact ND2-N 3Å; N214-T271 PolarHBondContact ND2-OG1 3.44Å; N214-L277 HydrophobicContact CB-CD1 3.96Å
215	P	97.7	Very high	97.9	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.006	14%	0.136	C	C	.	.			trans	-65	121.8	177.4	-21.9	35.4	0	0	0	111.4	L198 A220 V267 E268 T270 T271	L198-P215 HydrophobicContact CB-CB 3.81Å; L198-P215 HydrophobicContact CB-CG 3.55Å; L198-P215 HydrophobicContact CD2-CB 4.14Å; L198-P215 HydrophobicContact CD2-CG 4.21Å; P215-A220 HydrophobicContact CB-CB 4.39Å; P215-V267 WeakPolarHBondContact CD-O 3.49Å; P215-E268 VanDerWaalsContact CD-O 3.27Å; P215-E268 WeakPolarHBondContact CD-O 3.24Å; P215-E268 WeakPolarHBondContact CG-O 3.17Å; P215-T270 VanDerWaalsContact O-CA 3.31Å; P215-T270 WeakPolarHBondContact O-CA 3.25Å; P215-T271 PolarHBondContact O-N 2.88Å
216	G	96.7	Very high	98	Very high	23 Å²	23	19.5 Å²	19.5	24%	0.237	10%	0.104	C	C	.	.	B	Isolated β-bridge	trans	-73.2	150.6	164.9	0	0	0	0	0	110.4	N214 L218 S219 A220 T271	N214-G216 PolarHBondContact O-N 2.85Å; G216-L218 PolarHBondContact O-N 2.75Å; G216-S219 WeakPolarHBondContact O-CA 3.45Å; G216-S219 VanDerWaalsContact O-CB 3.24Å; G216-S219 WeakPolarHBondContact O-CB 3.31Å; G216-S219 PolarHBondContact O-N 2.83Å; G216-S219 PolarHBondContact O-OG 3.35Å; G216-A220 PolarHBondContact O-N 3.25Å; G216-T271 WeakPolarHBondContact CA-O 3.32Å
217	L	96.3	Very high	97.9	Very high	12 Å²	12	19.6 Å²	19.6	6%	0.063	10%	0.104	C	C	.	.	H	α-helix	trans	-39.7	-43.7	-178.6	-59.3	174.6	0	0	0	115.6	F185 V190 V193 M194 Y221 T270 T271 P272	F185-L217 HydrophobicContact CE1-CB 4.2Å; F185-L217 HydrophobicContact CZ-CB 3.71Å; F185-L217 HydrophobicContact CZ-CD1 4.13Å; V190-L217 HydrophobicContact CG1-CD1 4.25Å; V190-L217 HydrophobicContact CG1-CD2 4.24Å; V193-L217 HydrophobicContact CG1-CB 3.89Å; V193-L217 HydrophobicContact CG1-CD2 3.98Å; V193-L217 WeakPolarHBondContact CG1-O 3.37Å; M194-L217 HydrophobicContact CG-CD2 3.4Å; M194-L217 HydrophobicContact SD-CD2 4.14Å; L217-Y221 VanDerWaalsContact O-CB 3.25Å; L217-Y221 WeakPolarHBondContact O-CB 3.27Å; L217-Y221 PolarHBondContact O-N 3.06Å; L217-T270 HydrophobicContact CD2-CG2 4.14Å; L217-T271 PolarHBondContact N-O 3.23Å; L217-P272 HydrophobicContact CD1-CB 4.42Å; L217-P272 HydrophobicContact CD1-CG 4.29Å
218	L	96.3	Very high	97.7	Very high	33 Å²	33	23.1 Å²	23.1	17%	0.173	12%	0.123	C	C	.	.	H	α-helix	trans	-74.2	-27.4	-179.1	-163.3	71.4	0	0	0	113.2	F185 G216 Y221 K222 P227 N228	F185-L218 HydrophobicContact CD1-CD1 4.37Å; F185-L218 HydrophobicContact CE1-CD1 4.1Å; G216-L218 PolarHBondContact O-N 2.75Å; L218-Y221 HydrophobicContact CD1-CD1 4.06Å; L218-K222 WeakPolarHBondContact O-CB 3.26Å; L218-K222 WeakPolarHBondContact O-CG 3.28Å; L218-K222 PolarHBondContact O-N 3.34Å; L218-P227 HydrophobicContact CB-CG 4.38Å; L218-P227 HydrophobicContact CD2-CG 4.42Å; L218-P227 WeakPolarHBondContact CD2-O 3.46Å; L218-P227 HydrophobicContact CG-CG 4.18Å; L218-P227 WeakPolarHBondContact O-CG 3.3Å; L218-N228 HydrophobicContact CD2-CB 4.38Å
219	S	98	Very high	97.3	Very high	18 Å²	18	29.1 Å²	29.1	13%	0.126	16%	0.162	C	C	.	.	H	α-helix	trans	-65.2	-51.2	172.7	-45.8	0	0	0	0	110.6	G216 K222 G223 R224 P227	G216-S219 WeakPolarHBondContact O-CA 3.45Å; G216-S219 VanDerWaalsContact O-CB 3.24Å; G216-S219 WeakPolarHBondContact O-CB 3.31Å; G216-S219 PolarHBondContact O-N 2.83Å; G216-S219 PolarHBondContact O-OG 3.35Å; S219-K222 PolarHBondContact O-N 3.18Å; S219-G223 WeakPolarHBondContact O-CA 3.48Å; S219-G223 PolarHBondContact O-N 3.26Å; S219-R224 VanDerWaalsContact CA-O 3.26Å; S219-R224 WeakPolarHBondContact CA-O 3.42Å; S219-R224 VanDerWaalsContact CB-O 3.3Å; S219-R224 WeakPolarHBondContact CB-O 3.41Å; S219-R224 PolarHBondContact O-N 3.15Å; S219-P227 WeakPolarHBondContact OG-CD 3.47Å
220	A	97.8	Very high	97	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-43.7	178	0	0	0	0	0	112.7	K196 P215 G216 K222 G223 T270	K196-A220 HydrophobicContact CB-CB 4.18Å; P215-A220 HydrophobicContact CB-CB 4.39Å; G216-A220 PolarHBondContact O-N 3.25Å; A220-K222 VanDerWaalsContact C-N 3.34Å; A220-K222 PolarHBondContact O-N 3.39Å; A220-G223 PolarHBondContact O-N 3.13Å; A220-T270 HydrophobicContact CB-CG2 3.49Å; A220-T270 VanDerWaalsContact CB-CG2 3.49Å; A220-T270 WeakPolarHBondContact CB-OG1 3.36Å
221	Y	97.4	Very high	97	Very high	62 Å²	62	31.6 Å²	31.6	24%	0.243	18%	0.181	C	C	.	.	H	α-helix	trans	-55.9	-46.6	175.6	168.3	-104.8	0	0	0	112.3	F185 N186 M188 V193 L217 L218	F185-Y221 HydrophobicContact CB-CD2 3.65Å; F185-Y221 HydrophobicContact CB-CE2 3.79Å; F185-Y221 HydrophobicContact CB-CG 4.15Å; F185-Y221 AromaticContact CD1-CD1 3.92Å; F185-Y221 HydrophobicContact CD1-CD1 3.92Å; F185-Y221 AromaticContact CD1-CD2 3.97Å; F185-Y221 HydrophobicContact CD1-CD2 3.97Å; F185-Y221 AromaticContact CD1-CG 3.56Å; F185-Y221 HydrophobicContact CD1-CG 3.56Å; F185-Y221 HydrophobicContact CE1-CG 4.39Å; F185-Y221 HydrophobicContact CG-CD2 4.2Å; F185-Y221 HydrophobicContact CG-CG 4.26Å; F185-Y221 WeakPolarHBondContact O-CE2 3.45Å; N186-Y221 WeakPolarHBondContact CB-OH 3.37Å; M188-Y221 HydrophobicContact SD-CD2 4.27Å; V193-Y221 HydrophobicContact CG2-CD2 4.12Å; L217-Y221 VanDerWaalsContact O-CB 3.25Å; L217-Y221 WeakPolarHBondContact O-CB 3.27Å; L217-Y221 PolarHBondContact O-N 3.06Å; L218-Y221 HydrophobicContact CD1-CD1 4.06Å
222	K	97.1	Very high	96.9	Very high	73 Å²	73	32.7 Å²	32.7	32%	0.317	19%	0.187	S	C	.	.	H	α-helix	trans	-83.7	-13.8	-180	-65.4	-161.6	-173.7	178	0	114.5	L218 S219 A220 R224 P227 Y249	L218-K222 WeakPolarHBondContact O-CB 3.26Å; L218-K222 WeakPolarHBondContact O-CG 3.28Å; L218-K222 PolarHBondContact O-N 3.34Å; S219-K222 PolarHBondContact O-N 3.18Å; A220-K222 VanDerWaalsContact C-N 3.34Å; A220-K222 PolarHBondContact O-N 3.39Å; K222-R224 VanDerWaalsContact C-N 3.33Å; K222-R224 HydrophobicContact CB-CB 4.29Å; K222-R224 HydrophobicContact CB-CG 4.4Å; K222-P227 HydrophobicContact CD-CB 3.94Å; K222-P227 HydrophobicContact CD-CG 4.43Å; K222-Y249 HydrophobicContact CD-CD2 4.28Å; K222-Y249 HydrophobicContact CD-CE1 4.42Å; K222-Y249 HydrophobicContact CD-CE2 3.57Å; K222-Y249 PolarHBondContact NZ-OH 2.91Å
223	G	98	Very high	97	Very high	29 Å²	29	32.6 Å²	32.6	30%	0.299	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	37.5	-168.9	0	0	0	0	0	113.3	S219 A220	S219-G223 WeakPolarHBondContact O-CA 3.48Å; S219-G223 PolarHBondContact O-N 3.26Å; A220-G223 PolarHBondContact O-N 3.13Å
224	R	98.4	Very high	97	Very high	65 Å²	65	31.9 Å²	31.9	25%	0.245	18%	0.181	C	C	.	.	S	Bend	trans	-142.6	154.6	-172.6	-64.7	-67	172.4	144.3	1.2	113.9	L198 S219 K222 P227 Y249 M250 D252	L198-R224 VanDerWaalsContact CD1-N 3.26Å; S219-R224 VanDerWaalsContact CA-O 3.26Å; S219-R224 WeakPolarHBondContact CA-O 3.42Å; S219-R224 VanDerWaalsContact CB-O 3.3Å; S219-R224 WeakPolarHBondContact CB-O 3.41Å; S219-R224 PolarHBondContact O-N 3.15Å; K222-R224 VanDerWaalsContact C-N 3.33Å; K222-R224 HydrophobicContact CB-CB 4.29Å; K222-R224 HydrophobicContact CB-CG 4.4Å; R224-P227 VanDerWaalsContact O-CD 3.3Å; R224-P227 WeakPolarHBondContact O-CD 3.41Å; R224-Y249 HydrophobicContact CB-CD2 3.64Å; R224-Y249 HydrophobicContact CB-CE2 4.45Å; R224-Y249 HydrophobicContact CB-CG 4.44Å; R224-Y249 HydrophobicContact CG-CD2 3.86Å; R224-Y249 HydrophobicContact CG-CE2 4.35Å; R224-M250 PolarHBondContact NH1-O 3.41Å; R224-M250 VanDerWaalsContact NH1-O 3.08Å; R224-D252 VanDerWaalsContact CA-OD2 3.27Å; R224-D252 WeakPolarHBondContact CA-OD2 3.31Å; R224-D252 WeakPolarHBondContact CB-OD2 3.35Å; R224-D252 WeakPolarHBondContact CD-OD1 3.32Å; R224-D252 WeakPolarHBondContact CD-OD2 3.46Å; R224-D252 IonicContact CZ-OD1 3.98Å; R224-D252 IonicContact NE-OD1 2.8Å; R224-D252 IonicContact NH1-OD1 2.61Å; R224-D252 PolarHBondContact NH1-OD1 3.06Å
225	H	98.8	Very high	97	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.014	20%	0.199	C	C	.	.	S	Bend	trans	-84.7	130.6	-176	-71.7	-84.1	0	0	0	113.4	L198 P199 P227 W234 Y249 D252 F263	L198-H225 VanDerWaalsContact CD2-CE1 3.45Å; L198-H225 WeakPolarHBondContact CD2-CE1 3.3Å; P199-H225 PolarHBondContact O-NE2 2.82Å; H225-P227 VanDerWaalsContact C-CD 3.42Å; H225-W234 PolarHBondContact O-NE1 2.83Å; H225-Y249 VanDerWaalsContact O-CB 3.28Å; H225-Y249 WeakPolarHBondContact O-CB 3.33Å; H225-D252 HydrophobicContact CB-CB 4.16Å; H225-D252 IonicContact CD2-OD2 3.66Å; H225-D252 PolarHBondContact N-OD2 3.5Å; H225-F263 HydrophobicContact CB-CD1 4.09Å; H225-F263 HydrophobicContact CB-CD2 4.44Å; H225-F263 HydrophobicContact CB-CE1 4.39Å; H225-F263 HydrophobicContact CB-CG 4.11Å; H225-F263 AromaticContact CG-CG 3.81Å
226	Y	98.3	Very high	97.1	Very high	27 Å²	27	36.2 Å²	36.2	11%	0.106	20%	0.199	C	C	.	.	S	Bend	trans	48.3	44	179.9	-51.2	-77.9	0	0	0	117.5	I210 G212 N228 F233 W234 F263 N304	I210-Y226 HydrophobicContact CG2-CE2 4.01Å; G212-Y226 WeakPolarHBondContact CA-OH 3.05Å; Y226-N228 VanDerWaalsContact C-N 3.29Å; Y226-N228 PolarHBondContact O-N 3.46Å; Y226-F233 HydrophobicContact CD1-CB 4.14Å; Y226-F233 HydrophobicContact CD1-CG 4.49Å; Y226-F233 HydrophobicContact CD2-CB 4.13Å; Y226-F233 AromaticContact CD2-CD1 3.56Å; Y226-F233 HydrophobicContact CD2-CD1 3.56Å; Y226-F233 HydrophobicContact CD2-CD2 4.2Å; Y226-F233 HydrophobicContact CD2-CE1 4.08Å; Y226-F233 AromaticContact CD2-CG 3.66Å; Y226-F233 HydrophobicContact CD2-CG 3.66Å; Y226-F233 HydrophobicContact CE2-CD1 4.3Å; Y226-F233 HydrophobicContact CE2-CD2 4.21Å; Y226-F233 HydrophobicContact CE2-CE2 4.49Å; Y226-F233 HydrophobicContact CE2-CG 4.14Å; Y226-F233 HydrophobicContact CG-CB 3.8Å; Y226-F233 AromaticContact CG-CD1 3.98Å; Y226-F233 HydrophobicContact CG-CD1 3.98Å; Y226-F233 AromaticContact CG-CG 3.88Å; Y226-F233 HydrophobicContact CG-CG 3.88Å; Y226-W234 PolarHBondContact O-NE1 2.88Å; Y226-F263 HydrophobicContact CD2-CD1 4.37Å; Y226-F263 HydrophobicContact CD2-CE1 4.06Å; Y226-F263 AromaticContact CE2-CD1 3.82Å; Y226-F263 HydrophobicContact CE2-CD1 3.82Å; Y226-F263 AromaticContact CE2-CE1 3.81Å; Y226-F263 HydrophobicContact CE2-CE1 3.81Å; Y226-N304 VanDerWaalsContact CE1-ND2 3.34Å; Y226-N304 WeakPolarHBondContact CE1-ND2 3.49Å; Y226-N304 PolarHBondContact OH-ND2 3.3Å
227	P	97.6	Very high	97.2	Very high	5 Å²	5	35.2 Å²	35.2	3%	0.032	19%	0.188	C	C	.	.			trans	-81.1	2.6	-172.6	35.9	-39.4	0	0	0	115.7	L218 S219 K222 R224 H225 P229 Y249	L218-P227 HydrophobicContact CB-CG 4.38Å; L218-P227 HydrophobicContact CD2-CG 4.42Å; L218-P227 WeakPolarHBondContact CD2-O 3.46Å; L218-P227 HydrophobicContact CG-CG 4.18Å; L218-P227 WeakPolarHBondContact O-CG 3.3Å; S219-P227 WeakPolarHBondContact OG-CD 3.47Å; K222-P227 HydrophobicContact CD-CB 3.94Å; K222-P227 HydrophobicContact CD-CG 4.43Å; R224-P227 VanDerWaalsContact O-CD 3.3Å; R224-P227 WeakPolarHBondContact O-CD 3.41Å; H225-P227 VanDerWaalsContact C-CD 3.42Å; P227-P229 WeakPolarHBondContact O-CD 3.4Å; P227-Y249 HydrophobicContact CB-CD1 3.58Å; P227-Y249 HydrophobicContact CB-CD2 3.76Å; P227-Y249 HydrophobicContact CB-CE1 4.16Å; P227-Y249 HydrophobicContact CB-CE2 4.31Å; P227-Y249 HydrophobicContact CB-CG 3.38Å
228	N	94.6	Very high	97.3	Very high	78 Å²	78	38 Å²	38	42%	0.417	20%	0.2	S	C	.	.			trans	-73.8	122	178.2	178.9	-8.2	0	0	0	109.4	L218 Y226 G230 N231	L218-N228 HydrophobicContact CD2-CB 4.38Å; Y226-N228 VanDerWaalsContact C-N 3.29Å; Y226-N228 PolarHBondContact O-N 3.46Å; N228-G230 PolarHBondContact O-N 2.97Å; N228-G230 PolarHBondContact OD1-N 2.85Å; N228-N231 HydrophobicContact CB-CB 4.15Å; N228-N231 WeakPolarHBondContact O-CB 3.48Å; N228-N231 PolarHBondContact O-N 3.3Å
229	P	90.1	Very high	97.3	Very high	127 Å²	127	40.1 Å²	40.1	83%	0.825	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.7	179.1	-25.2	35.5	0	0	0	115	P227	P227-P229 WeakPolarHBondContact O-CD 3.4Å
230	G	92.4	Very high	97.3	Very high	26 Å²	26	39.7 Å²	39.7	27%	0.268	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-6.6	171.2	0	0	0	0	0	114.9	N228 H232 P348	N228-G230 PolarHBondContact O-N 2.97Å; N228-G230 PolarHBondContact OD1-N 2.85Å; G230-H232 PolarHBondContact O-CD2 3.24Å; G230-H232 VanDerWaalsContact O-CD2 3.28Å; G230-P348 VanDerWaalsContact O-CB 3.28Å; G230-P348 WeakPolarHBondContact O-CB 3.5Å; G230-P348 VanDerWaalsContact O-CD 3.28Å; G230-P348 WeakPolarHBondContact O-CD 3.33Å; G230-P348 VanDerWaalsContact O-CG 3.24Å; G230-P348 WeakPolarHBondContact O-CG 3.43Å
231	N	97.8	Very high	97.2	Very high	27 Å²	27	41.6 Å²	41.6	14%	0.144	23%	0.227	C	C	.	.			trans	-79	135.6	175.9	-173.8	-65.9	0	0	0	110.3	N228 F233 S346 S347	N228-N231 HydrophobicContact CB-CB 4.15Å; N228-N231 WeakPolarHBondContact O-CB 3.48Å; N228-N231 PolarHBondContact O-N 3.3Å; N231-F233 WeakPolarHBondContact OD1-CB 3.45Å; N231-F233 PolarHBondContact OD1-N 3.2Å; N231-S346 PolarHBondContact ND2-OG 3.28Å; N231-S346 VanDerWaalsContact OD1-CB 3.3Å; N231-S346 WeakPolarHBondContact OD1-CB 3.18Å; N231-S346 PolarHBondContact OD1-OG 3.38Å; N231-S347 PolarHBondContact ND2-N 3.47Å
232	H	98.5	Very high	97.2	Very high	23 Å²	23	39.1 Å²	39.1	11%	0.106	22%	0.218	C	C	.	.	S	Bend	trans	-83.3	-13.7	-172.9	-56.4	172.4	0	0	0	113.6	G230 W234 K235 C236 S346 P354 R355 A356 K359	G230-H232 PolarHBondContact O-CD2 3.24Å; G230-H232 VanDerWaalsContact O-CD2 3.28Å; H232-W234 PolarHBondContact O-N 3.3Å; H232-K235 CarbonylContact O-C 3.59Å; H232-K235 PolarHBondContact O-N 2.84Å; H232-C236 PolarHBondContact O-N 3.38Å; H232-C236 PolarHBondContact O-SG 3.08Å; H232-C236 VanDerWaalsContact O-SG 3.38Å; H232-S346 WeakPolarHBondContact CB-O 3.49Å; H232-S346 PolarHBondContact N-O 3.38Å; H232-P354 PolarHBondContact CE1-O 3.22Å; H232-R355 PolarHBondContact CE1-O 3.22Å; H232-R355 VanDerWaalsContact ND1-C 3.25Å; H232-R355 PolarHBondContact ND1-O 3.02Å; H232-A356 HydrophobicContact CB-CB 3.97Å; H232-A356 WeakPolarHBondContact ND1-CA 3.3Å; H232-A356 PolarHBondContact ND1-N 3.44Å; H232-K359 HydrophobicContact CB-CD 4.37Å; H232-K359 WeakPolarHBondContact ND1-CE 3.33Å; H232-K359 PolarHBondContact ND1-NZ 3.47Å
233	F	98.8	Very high	97.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-47.9	-62.4	-170.8	174.9	-98.4	0	0	0	112.9	I210 Y226 N231 K235 C236 L237 F263 Y363	I210-F233 HydrophobicContact CD1-CE2 4.05Å; I210-F233 HydrophobicContact CG1-CE2 3.97Å; I210-F233 HydrophobicContact CG1-CZ 4.18Å; I210-F233 HydrophobicContact CG2-CD2 4.49Å; I210-F233 HydrophobicContact CG2-CE2 3.93Å; Y226-F233 HydrophobicContact CD1-CB 4.14Å; Y226-F233 HydrophobicContact CD1-CG 4.49Å; Y226-F233 HydrophobicContact CD2-CB 4.13Å; Y226-F233 AromaticContact CD2-CD1 3.56Å; Y226-F233 HydrophobicContact CD2-CD1 3.56Å; Y226-F233 HydrophobicContact CD2-CD2 4.2Å; Y226-F233 HydrophobicContact CD2-CE1 4.08Å; Y226-F233 AromaticContact CD2-CG 3.66Å; Y226-F233 HydrophobicContact CD2-CG 3.66Å; Y226-F233 HydrophobicContact CE2-CD1 4.3Å; Y226-F233 HydrophobicContact CE2-CD2 4.21Å; Y226-F233 HydrophobicContact CE2-CE2 4.49Å; Y226-F233 HydrophobicContact CE2-CG 4.14Å; Y226-F233 HydrophobicContact CG-CB 3.8Å; Y226-F233 AromaticContact CG-CD1 3.98Å; Y226-F233 HydrophobicContact CG-CD1 3.98Å; Y226-F233 AromaticContact CG-CG 3.88Å; Y226-F233 HydrophobicContact CG-CG 3.88Å; N231-F233 WeakPolarHBondContact OD1-CB 3.45Å; N231-F233 PolarHBondContact OD1-N 3.2Å; F233-K235 PolarHBondContact O-N 3.22Å; F233-C236 PolarHBondContact O-N 2.9Å; F233-C236 VanDerWaalsContact O-N 3.11Å; F233-L237 HydrophobicContact CE1-CD2 4.16Å; F233-L237 HydrophobicContact CZ-CD1 4.15Å; F233-L237 HydrophobicContact CZ-CD2 4.17Å; F233-L237 WeakPolarHBondContact O-CB 3.49Å; F233-L237 PolarHBondContact O-N 2.83Å; F233-F263 AromaticContact CE1-CE1 3.64Å; F233-F263 HydrophobicContact CE1-CE1 3.64Å; F233-F263 AromaticContact CE1-CZ 3.71Å; F233-F263 HydrophobicContact CE1-CZ 3.71Å; F233-F263 HydrophobicContact CE2-CE1 4.21Å; F233-F263 AromaticContact CZ-CE1 3.44Å; F233-F263 HydrophobicContact CZ-CE1 3.44Å; F233-F263 VanDerWaalsContact CZ-CE1 3.44Å; F233-F263 AromaticContact CZ-CZ 3.71Å; F233-F263 HydrophobicContact CZ-CZ 3.71Å; F233-Y363 AromaticContact CD2-CE1 3.86Å; F233-Y363 HydrophobicContact CD2-CE1 3.86Å; F233-Y363 HydrophobicContact CE2-CE1 4.03Å
234	W	98.6	Very high	97.2	Very high	18 Å²	18	41 Å²	41	7%	0.068	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-29.5	-177.7	-68.3	109.6	0	0	0	113.1	H225 Y226 H232 L237 F238 Q246 L247 D252 L255 F263	H225-W234 PolarHBondContact O-NE1 2.83Å; Y226-W234 PolarHBondContact O-NE1 2.88Å; H232-W234 PolarHBondContact O-N 3.3Å; W234-L237 HydrophobicContact CE3-CD2 4.02Å; W234-L237 HydrophobicContact CZ3-CD2 3.97Å; W234-F238 PolarHBondContact O-N 2.97Å; W234-Q246 PolarHBondContact O-NE2 3.39Å; W234-L247 HydrophobicContact CE3-CB 3.88Å; W234-L247 HydrophobicContact CZ3-CB 3.93Å; W234-D252 HydrophobicContact CH2-CB 4.21Å; W234-D252 HydrophobicContact CZ2-CB 4.1Å; W234-L255 HydrophobicContact CH2-CD1 4.08Å; W234-L255 HydrophobicContact CH2-CD2 3.8Å; W234-L255 HydrophobicContact CZ3-CD1 4.03Å; W234-L255 HydrophobicContact CZ3-CD2 3.76Å; W234-F263 HydrophobicContact CH2-CE2 4.47Å; W234-F263 HydrophobicContact CH2-CZ 4.07Å; W234-F263 HydrophobicContact CZ2-CZ 4.3Å
235	K	98.4	Very high	97.1	Very high	111 Å²	111	44.3 Å²	44.3	48%	0.483	24%	0.239	S	C	.	.	H	α-helix	trans	-78.5	-38.8	176	-178.9	165.6	180	169.9	0	112.3	H232 F233 L239 A356	H232-K235 CarbonylContact O-C 3.59Å; H232-K235 PolarHBondContact O-N 2.84Å; F233-K235 PolarHBondContact O-N 3.22Å; K235-L239 HydrophobicContact CD-CD1 4.33Å; K235-L239 HydrophobicContact CG-CD1 3.78Å; K235-L239 HydrophobicContact CG-CG 4.22Å; K235-L239 VanDerWaalsContact O-CB 3.31Å; K235-L239 WeakPolarHBondContact O-CB 3.34Å; K235-L239 VanDerWaalsContact O-CG 3.25Å; K235-L239 WeakPolarHBondContact O-CG 3.44Å; K235-L239 PolarHBondContact O-N 3.03Å; K235-A356 HydrophobicContact CD-CB 3.96Å; K235-A356 HydrophobicContact CG-CB 4.13Å
236	C	98.7	Very high	97	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.7	-39.1	175.5	-66.4	0	0	0	0	111.5	H232 F233 F238 L239 S240 A356 Y363	H232-C236 PolarHBondContact O-N 3.38Å; H232-C236 PolarHBondContact O-SG 3.08Å; H232-C236 VanDerWaalsContact O-SG 3.38Å; F233-C236 PolarHBondContact O-N 2.9Å; F233-C236 VanDerWaalsContact O-N 3.11Å; C236-F238 PolarHBondContact O-N 3.18Å; C236-L239 PolarHBondContact O-N 2.97Å; C236-S240 WeakPolarHBondContact O-CB 3.45Å; C236-S240 PolarHBondContact O-N 3.38Å; C236-S240 PolarHBondContact O-OG 3.24Å; C236-S240 VanDerWaalsContact O-OG 3.04Å; C236-A356 PolarHBondContact SG-O 3.11Å; C236-A356 VanDerWaalsContact SG-O 3.37Å; C236-Y363 HydrophobicContact CB-CD1 3.7Å; C236-Y363 HydrophobicContact CB-CD2 3.75Å; C236-Y363 HydrophobicContact CB-CE1 3.76Å; C236-Y363 HydrophobicContact CB-CE2 3.84Å; C236-Y363 HydrophobicContact CB-CG 3.72Å
237	L	98.6	Very high	97	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-59.3	-42.8	177.1	-166.5	76.8	0	0	0	112.6	F233 W234 S240 L242 T243 L255 I261	F233-L237 HydrophobicContact CE1-CD2 4.16Å; F233-L237 HydrophobicContact CZ-CD1 4.15Å; F233-L237 HydrophobicContact CZ-CD2 4.17Å; F233-L237 WeakPolarHBondContact O-CB 3.49Å; F233-L237 PolarHBondContact O-N 2.83Å; W234-L237 HydrophobicContact CE3-CD2 4.02Å; W234-L237 HydrophobicContact CZ3-CD2 3.97Å; L237-S240 PolarHBondContact O-OG 2.92Å; L237-L242 HydrophobicContact CD1-CB 3.68Å; L237-L242 HydrophobicContact CD1-CD1 3.86Å; L237-L242 HydrophobicContact CD1-CG 4.41Å; L237-L242 HydrophobicContact CG-CB 4.12Å; L237-L242 WeakPolarHBondContact O-CB 3.46Å; L237-L242 PolarHBondContact O-N 2.77Å; L237-L242 VanDerWaalsContact O-N 3.13Å; L237-T243 HydrophobicContact CD2-CG2 3.6Å; L237-T243 HydrophobicContact CG-CG2 3.85Å; L237-T243 PolarHBondContact O-N 3.24Å; L237-T243 PolarHBondContact O-OG1 2.83Å; L237-L255 HydrophobicContact CD2-CD2 3.96Å; L237-I261 HydrophobicContact CD1-CD1 3.98Å
238	F	98.4	Very high	97	Very high	72 Å²	72	51 Å²	51	32%	0.316	27%	0.273	S	S	.	.	H	α-helix	trans	-72	-50.3	173.7	172	-121.8	0	0	0	112	W234 C236 S240 G241 Q245 Q246	W234-F238 PolarHBondContact O-N 2.97Å; C236-F238 PolarHBondContact O-N 3.18Å; F238-S240 PolarHBondContact O-N 3.04Å; F238-S240 VanDerWaalsContact O-N 3.15Å; F238-G241 PolarHBondContact O-N 3.38Å; F238-Q245 WeakPolarHBondContact CD2-O 3.13Å; F238-Q246 HydrophobicContact CB-CB 4.45Å; F238-Q246 HydrophobicContact CD1-CB 3.78Å; F238-Q246 HydrophobicContact CD1-CG 4.26Å; F238-Q246 HydrophobicContact CD2-CB 4.4Å; F238-Q246 HydrophobicContact CE1-CB 4.09Å; F238-Q246 HydrophobicContact CG-CB 3.95Å
239	L	97.4	Very high	97.2	Very high	76 Å²	76	50 Å²	50	40%	0.398	26%	0.264	S	S	.	.	H	α-helix	trans	-67.2	-16	-175.7	-70.5	-179.8	0	0	0	114.5	K235 C236 V360	K235-L239 HydrophobicContact CD-CD1 4.33Å; K235-L239 HydrophobicContact CG-CD1 3.78Å; K235-L239 HydrophobicContact CG-CG 4.22Å; K235-L239 VanDerWaalsContact O-CB 3.31Å; K235-L239 WeakPolarHBondContact O-CB 3.34Å; K235-L239 VanDerWaalsContact O-CG 3.25Å; K235-L239 WeakPolarHBondContact O-CG 3.44Å; K235-L239 PolarHBondContact O-N 3.03Å; C236-L239 PolarHBondContact O-N 2.97Å; L239-V360 HydrophobicContact CB-CG2 3.63Å
240	S	97.5	Very high	97.6	Very high	10 Å²	10	49 Å²	49	7%	0.07	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-6.5	172	67.3	0	0	0	0	114.2	C236 L237 F238 L242 Y363 K367	C236-S240 WeakPolarHBondContact O-CB 3.45Å; C236-S240 PolarHBondContact O-N 3.38Å; C236-S240 PolarHBondContact O-OG 3.24Å; C236-S240 VanDerWaalsContact O-OG 3.04Å; L237-S240 PolarHBondContact O-OG 2.92Å; F238-S240 PolarHBondContact O-N 3.04Å; F238-S240 VanDerWaalsContact O-N 3.15Å; S240-L242 VanDerWaalsContact C-N 3.31Å; S240-L242 WeakPolarHBondContact OG-CG 3.49Å; S240-L242 PolarHBondContact OG-N 2.95Å; S240-Y363 WeakPolarHBondContact OG-CB 3.36Å; S240-K367 WeakPolarHBondContact O-CD 3.37Å
241	G	96.3	Very high	97.9	Very high	40 Å²	40	51 Å²	51	41%	0.412	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	24.7	-172.3	0	0	0	0	0	114.2	F238 K367	F238-G241 PolarHBondContact O-N 3.38Å; G241-K367 WeakPolarHBondContact O-CD 3.5Å; G241-K367 WeakPolarHBondContact O-CE 3.48Å
242	L	97.3	Very high	97.9	Very high	11 Å²	11	49.7 Å²	49.7	6%	0.058	25%	0.245	C	C	.	.	S	Bend	trans	-74.7	-17.3	166.2	-79.2	168	0	0	0	111.9	I208 L237 S240 Y363 L366 K367	I208-L242 HydrophobicContact CD1-CD2 3.97Å; L237-L242 HydrophobicContact CD1-CB 3.68Å; L237-L242 HydrophobicContact CD1-CD1 3.86Å; L237-L242 HydrophobicContact CD1-CG 4.41Å; L237-L242 HydrophobicContact CG-CB 4.12Å; L237-L242 WeakPolarHBondContact O-CB 3.46Å; L237-L242 PolarHBondContact O-N 2.77Å; L237-L242 VanDerWaalsContact O-N 3.13Å; S240-L242 VanDerWaalsContact C-N 3.31Å; S240-L242 WeakPolarHBondContact OG-CG 3.49Å; S240-L242 PolarHBondContact OG-N 2.95Å; L242-Y363 HydrophobicContact CD1-CD1 4.2Å; L242-L366 HydrophobicContact CD1-CD2 4.31Å; L242-K367 HydrophobicContact CD2-CB 3.66Å; L242-K367 HydrophobicContact CD2-CG 4.01Å; L242-K367 HydrophobicContact CG-CB 3.98Å; L242-K367 HydrophobicContact CG-CG 4.48Å
243	T	98	Very high	97.9	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.012	26%	0.262	C	S	.	.	S	Bend	trans	-140.1	142.1	170.3	51.9	0	0	0	0	108.3	L237 Q245 L247 Y259	L237-T243 HydrophobicContact CD2-CG2 3.6Å; L237-T243 HydrophobicContact CG-CG2 3.85Å; L237-T243 PolarHBondContact O-N 3.24Å; L237-T243 PolarHBondContact O-OG1 2.83Å; T243-Q245 PolarHBondContact O-N 3.33Å; T243-Q245 PolarHBondContact OG1-O 2.93Å; T243-L247 HydrophobicContact CG2-CD1 3.84Å; T243-L247 HydrophobicContact CG2-CG 4.5Å; T243-Y259 HydrophobicContact CG2-CD1 3.85Å; T243-Y259 HydrophobicContact CG2-CD2 4.02Å; T243-Y259 HydrophobicContact CG2-CE1 3.76Å; T243-Y259 HydrophobicContact CG2-CE2 3.91Å; T243-Y259 HydrophobicContact CG2-CG 3.99Å
244	E	95.8	Very high	97.8	Very high	138 Å²	138	54.6 Å²	54.6	65%	0.645	27%	0.271	S	S	*	.	S	Bend	trans	-74.9	-17.4	-176.1	-46.2	70.7	-153.4	0	0	112.4	Y259	E244-Y259 WeakPolarHBondContact OE1-CE1 3.25Å; E244-Y259 WeakPolarHBondContact OE2-CE1 3.19Å; E244-Y259 PolarHBondContact OE2-OH 3.13Å
245	Q	96.5	Very high	97.8	Very high	135 Å²	135	53.7 Å²	53.7	63%	0.631	27%	0.267	S	S	*	.	S	Bend	trans	-129.6	154.9	-173.6	-57.2	-172.7	14.9	0	0	111.3	F238 T243 L247	F238-Q245 WeakPolarHBondContact CD2-O 3.13Å; T243-Q245 PolarHBondContact O-N 3.33Å; T243-Q245 PolarHBondContact OG1-O 2.93Å; Q245-L247 VanDerWaalsContact C-N 3.32Å; Q245-L247 HydrophobicContact CB-CD2 4.38Å; Q245-L247 PolarHBondContact O-N 3.21Å
246	Q	97.7	Very high	97.8	Very high	92 Å²	92	49.7 Å²	49.7	43%	0.43	25%	0.252	S	S	.	.			trans	-75	84	176	-178.5	55.4	95.2	0	0	111	W234 F238	W234-Q246 PolarHBondContact O-NE2 3.39Å; F238-Q246 HydrophobicContact CB-CB 4.45Å; F238-Q246 HydrophobicContact CD1-CB 3.78Å; F238-Q246 HydrophobicContact CD1-CG 4.26Å; F238-Q246 HydrophobicContact CD2-CB 4.4Å; F238-Q246 HydrophobicContact CE1-CB 4.09Å; F238-Q246 HydrophobicContact CG-CB 3.95Å
247	L	98.1	Very high	97.8	Very high	17 Å²	17	57.4 Å²	57.4	9%	0.089	29%	0.288	C	S	.	.			trans	-69.1	170.9	174.7	-55.8	-172.6	0	0	0	112.3	W234 T243 Q245 H251 L255 Y259	W234-L247 HydrophobicContact CE3-CB 3.88Å; W234-L247 HydrophobicContact CZ3-CB 3.93Å; T243-L247 HydrophobicContact CG2-CD1 3.84Å; T243-L247 HydrophobicContact CG2-CG 4.5Å; Q245-L247 VanDerWaalsContact C-N 3.32Å; Q245-L247 HydrophobicContact CB-CD2 4.38Å; Q245-L247 PolarHBondContact O-N 3.21Å; L247-H251 HydrophobicContact CB-CB 4.39Å; L247-H251 HydrophobicContact CD1-CB 4.38Å; L247-L255 HydrophobicContact CD1-CD1 3.76Å; L247-Y259 HydrophobicContact CD1-CD2 4.41Å; L247-Y259 HydrophobicContact CD1-CE2 3.73Å
248	N	98	Very high	97.8	Very high	68 Å²	68	63.7 Å²	63.7	36%	0.364	32%	0.316	S	S	.	.			trans	-145.5	173.5	173.9	72.1	64.2	0	0	0	110.6	M250 H251	N248-M250 PolarHBondContact O-N 2.89Å; N248-M250 WeakPolarHBondContact OD1-CB 3.47Å; N248-M250 PolarHBondContact OD1-N 3.24Å; N248-H251 PolarHBondContact N-ND1 2.58Å; N248-H251 PolarHBondContact ND2-CE1 3.48Å; N248-H251 WeakPolarHBondContact O-CB 3.41Å; N248-H251 PolarHBondContact O-N 3.22Å; N248-H251 PolarHBondContact O-ND1 3.24Å
249	Y	98.3	Very high	97.8	Very high	57 Å²	57	62 Å²	62	22%	0.224	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-51.9	-19.8	-174.2	75	-95.9	0	0	0	117.2	K222 R224 H225 P227 H251	K222-Y249 HydrophobicContact CD-CD2 4.28Å; K222-Y249 HydrophobicContact CD-CE1 4.42Å; K222-Y249 HydrophobicContact CD-CE2 3.57Å; K222-Y249 PolarHBondContact NZ-OH 2.91Å; R224-Y249 HydrophobicContact CB-CD2 3.64Å; R224-Y249 HydrophobicContact CB-CE2 4.45Å; R224-Y249 HydrophobicContact CB-CG 4.44Å; R224-Y249 HydrophobicContact CG-CD2 3.86Å; R224-Y249 HydrophobicContact CG-CE2 4.35Å; H225-Y249 VanDerWaalsContact O-CB 3.28Å; H225-Y249 WeakPolarHBondContact O-CB 3.33Å; P227-Y249 HydrophobicContact CB-CD1 3.58Å; P227-Y249 HydrophobicContact CB-CD2 3.76Å; P227-Y249 HydrophobicContact CB-CE1 4.16Å; P227-Y249 HydrophobicContact CB-CE2 4.31Å; P227-Y249 HydrophobicContact CB-CG 3.38Å; Y249-H251 PolarHBondContact O-N 2.72Å
250	M	98.3	Very high	97.8	Very high	106 Å²	106	60 Å²	60	52%	0.522	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-68.4	-18.5	174.3	-65.5	-62.1	-61.5	0	0	113.2	R224 N248	R224-M250 PolarHBondContact NH1-O 3.41Å; R224-M250 VanDerWaalsContact NH1-O 3.08Å; N248-M250 PolarHBondContact O-N 2.89Å; N248-M250 WeakPolarHBondContact OD1-CB 3.47Å; N248-M250 PolarHBondContact OD1-N 3.24Å
251	H	98.4	Very high	97.9	Very high	66 Å²	66	59.6 Å²	59.6	31%	0.306	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-92.7	-6.8	-174.3	-56.2	79.2	0	0	0	113.4	L247 N248 Y249 Q253 S254 L255	L247-H251 HydrophobicContact CB-CB 4.39Å; L247-H251 HydrophobicContact CD1-CB 4.38Å; N248-H251 PolarHBondContact N-ND1 2.58Å; N248-H251 PolarHBondContact ND2-CE1 3.48Å; N248-H251 WeakPolarHBondContact O-CB 3.41Å; N248-H251 PolarHBondContact O-N 3.22Å; N248-H251 PolarHBondContact O-ND1 3.24Å; Y249-H251 PolarHBondContact O-N 2.72Å; H251-Q253 VanDerWaalsContact C-N 3.32Å; H251-Q253 PolarHBondContact O-N 2.95Å; H251-S254 WeakPolarHBondContact O-CA 3.48Å; H251-S254 PolarHBondContact O-N 3.08Å; H251-S254 PolarHBondContact O-OG 3.11Å; H251-L255 HydrophobicContact CB-CD1 4.15Å; H251-L255 VanDerWaalsContact O-CD1 3.25Å; H251-L255 WeakPolarHBondContact O-CD1 3.47Å; H251-L255 PolarHBondContact O-N 3.4Å
252	D	98.3	Very high	98	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-50.6	-45.2	-172.6	56.7	-3.1	0	0	0	114	R224 H225 W234 S254 L255 F263	R224-D252 VanDerWaalsContact CA-OD2 3.27Å; R224-D252 WeakPolarHBondContact CA-OD2 3.31Å; R224-D252 WeakPolarHBondContact CB-OD2 3.35Å; R224-D252 WeakPolarHBondContact CD-OD1 3.32Å; R224-D252 WeakPolarHBondContact CD-OD2 3.46Å; R224-D252 IonicContact CZ-OD1 3.98Å; R224-D252 IonicContact NE-OD1 2.8Å; R224-D252 IonicContact NH1-OD1 2.61Å; R224-D252 PolarHBondContact NH1-OD1 3.06Å; H225-D252 HydrophobicContact CB-CB 4.16Å; H225-D252 IonicContact CD2-OD2 3.66Å; H225-D252 PolarHBondContact N-OD2 3.5Å; W234-D252 HydrophobicContact CH2-CB 4.21Å; W234-D252 HydrophobicContact CZ2-CB 4.1Å; D252-S254 PolarHBondContact O-N 3.44Å; D252-L255 PolarHBondContact O-N 3.36Å; D252-F263 HydrophobicContact CB-CD2 4.31Å; D252-F263 HydrophobicContact CB-CE2 4.03Å
253	Q	98.3	Very high	98.1	Very high	99 Å²	99	57.2 Å²	57.2	46%	0.463	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-62.9	-19	176.4	-58.6	-61.1	-27.2	0	0	114.5	H251	H251-Q253 VanDerWaalsContact C-N 3.32Å; H251-Q253 PolarHBondContact O-N 2.95Å
254	S	97.9	Very high	98.1	Very high	27 Å²	27	57.1 Å²	57.1	19%	0.189	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-98.4	-5.8	-180	69	0	0	0	0	114.3	H251 D252 K258	H251-S254 WeakPolarHBondContact O-CA 3.48Å; H251-S254 PolarHBondContact O-N 3.08Å; H251-S254 PolarHBondContact O-OG 3.11Å; D252-S254 PolarHBondContact O-N 3.44Å; S254-K258 WeakPolarHBondContact O-CB 3.39Å; S254-K258 WeakPolarHBondContact O-CG 3.45Å; S254-K258 PolarHBondContact O-N 3.24Å; S254-K258 VanDerWaalsContact O-N 3.09Å
255	L	98.3	Very high	98.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-69.6	-31.5	178.8	-96.7	66.8	0	0	0	114.8	W234 L237 L247 H251 D252 Y259 S260 I261 F263	W234-L255 HydrophobicContact CH2-CD1 4.08Å; W234-L255 HydrophobicContact CH2-CD2 3.8Å; W234-L255 HydrophobicContact CZ3-CD1 4.03Å; W234-L255 HydrophobicContact CZ3-CD2 3.76Å; L237-L255 HydrophobicContact CD2-CD2 3.96Å; L247-L255 HydrophobicContact CD1-CD1 3.76Å; H251-L255 HydrophobicContact CB-CD1 4.15Å; H251-L255 VanDerWaalsContact O-CD1 3.25Å; H251-L255 WeakPolarHBondContact O-CD1 3.47Å; H251-L255 PolarHBondContact O-N 3.4Å; D252-L255 PolarHBondContact O-N 3.36Å; L255-Y259 HydrophobicContact CD1-CD2 4.27Å; L255-Y259 HydrophobicContact CG-CD2 3.98Å; L255-Y259 CarbonylContact O-C 3.5Å; L255-Y259 WeakPolarHBondContact O-CA 3.37Å; L255-Y259 WeakPolarHBondContact O-CB 3.39Å; L255-Y259 PolarHBondContact O-N 3.33Å; L255-S260 PolarHBondContact O-N 3.33Å; L255-S260 VanDerWaalsContact O-N 3.12Å; L255-I261 CarbonylContact C-O 3.57Å; L255-I261 HydrophobicContact CB-CB 4.22Å; L255-I261 WeakPolarHBondContact CB-O 3.42Å; L255-I261 HydrophobicContact CD2-CB 4.31Å; L255-I261 HydrophobicContact CD2-CG2 4.28Å; L255-I261 PolarHBondContact O-N 3.25Å; L255-I261 VanDerWaalsContact O-N 3.08Å; L255-F263 HydrophobicContact CB-CE2 4.2Å; L255-F263 HydrophobicContact CD2-CE2 3.77Å; L255-F263 HydrophobicContact CD2-CZ 3.67Å
256	P	98.6	Very high	98.3	Very high	26 Å²	26	45 Å²	45	17%	0.169	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-44.3	172.7	-27.6	36.1	0	0	0	112.7	V201 A203 L206 S260 I261	V201-P256 HydrophobicContact CG1-CG 3.54Å; A203-P256 HydrophobicContact CB-CB 4.04Å; L206-P256 HydrophobicContact CD2-CB 3.97Å; P256-S260 VanDerWaalsContact O-CA 3.31Å; P256-S260 WeakPolarHBondContact O-CA 3.25Å; P256-S260 PolarHBondContact O-N 3.42Å; P256-I261 WeakPolarHBondContact CD-O 3.09Å; P256-I261 VanDerWaalsContact N-O 3.1Å
257	E	98	Very high	98.3	Very high	162 Å²	162	41.1 Å²	41.1	76%	0.757	20%	0.201	S	C	*	.	H	α-helix	trans	-71.8	-47.1	-178.4	-178.6	-171.2	-154	0	0	112
258	K	97.8	Very high	98.3	Very high	134 Å²	134	45.3 Å²	45.3	58%	0.583	22%	0.22	S	C	*	.	H	α-helix	trans	-88.8	-24.9	-169.8	-65.3	-178.8	178	-179.2	0	114.7	S254	S254-K258 WeakPolarHBondContact O-CB 3.39Å; S254-K258 WeakPolarHBondContact O-CG 3.45Å; S254-K258 PolarHBondContact O-N 3.24Å; S254-K258 VanDerWaalsContact O-N 3.09Å
259	Y	98.1	Very high	98.3	Very high	35 Å²	35	46.4 Å²	46.4	14%	0.137	22%	0.219	C	C	.	.	H	α-helix	trans	-133.8	-3.6	-170.5	-63.4	-73.1	0	0	0	113.7	T243 E244 L247 L255 I261	T243-Y259 HydrophobicContact CG2-CD1 3.85Å; T243-Y259 HydrophobicContact CG2-CD2 4.02Å; T243-Y259 HydrophobicContact CG2-CE1 3.76Å; T243-Y259 HydrophobicContact CG2-CE2 3.91Å; T243-Y259 HydrophobicContact CG2-CG 3.99Å; E244-Y259 WeakPolarHBondContact OE1-CE1 3.25Å; E244-Y259 WeakPolarHBondContact OE2-CE1 3.19Å; E244-Y259 PolarHBondContact OE2-OH 3.13Å; L247-Y259 HydrophobicContact CD1-CD2 4.41Å; L247-Y259 HydrophobicContact CD1-CE2 3.73Å; L255-Y259 HydrophobicContact CD1-CD2 4.27Å; L255-Y259 HydrophobicContact CG-CD2 3.98Å; L255-Y259 CarbonylContact O-C 3.5Å; L255-Y259 WeakPolarHBondContact O-CA 3.37Å; L255-Y259 WeakPolarHBondContact O-CB 3.39Å; L255-Y259 PolarHBondContact O-N 3.33Å; Y259-I261 WeakPolarHBondContact O-CG1 3.3Å; Y259-I261 PolarHBondContact O-N 3.03Å
260	S	98.6	Very high	98.2	Very high	35 Å²	35	43.8 Å²	43.8	25%	0.245	21%	0.209	C	C	.	.	S	Bend	trans	56.1	32.9	-170.4	-51.4	0	0	0	0	113	L206 D207 I208 L255 P256	L206-S260 WeakPolarHBondContact CD2-O 3.34Å; D207-S260 VanDerWaalsContact CG-CB 3.48Å; D207-S260 PolarHBondContact N-O 2.86Å; I208-S260 PolarHBondContact N-O 2.91Å; I208-S260 VanDerWaalsContact N-O 3.1Å; L255-S260 PolarHBondContact O-N 3.33Å; L255-S260 VanDerWaalsContact O-N 3.12Å; P256-S260 VanDerWaalsContact O-CA 3.31Å; P256-S260 WeakPolarHBondContact O-CA 3.25Å; P256-S260 PolarHBondContact O-N 3.42Å
261	I	98.9	Very high	98.2	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	120.5	179.8	-55.9	-178.3	0	0	0	110.7	I208 I210 L237 L255 P256 Y259	I208-I261 HydrophobicContact CB-CG1 4.32Å; I208-I261 HydrophobicContact CD1-CG1 4.48Å; I208-I261 CarbonylContact O-C 3.57Å; I208-I261 WeakPolarHBondContact O-CA 3.16Å; I210-I261 HydrophobicContact CD1-CG2 4.5Å; I210-I261 HydrophobicContact CG1-CG2 3.76Å; L237-I261 HydrophobicContact CD1-CD1 3.98Å; L255-I261 CarbonylContact C-O 3.57Å; L255-I261 HydrophobicContact CB-CB 4.22Å; L255-I261 WeakPolarHBondContact CB-O 3.42Å; L255-I261 HydrophobicContact CD2-CB 4.31Å; L255-I261 HydrophobicContact CD2-CG2 4.28Å; L255-I261 PolarHBondContact O-N 3.25Å; L255-I261 VanDerWaalsContact O-N 3.08Å; P256-I261 WeakPolarHBondContact CD-O 3.09Å; P256-I261 VanDerWaalsContact N-O 3.1Å; Y259-I261 WeakPolarHBondContact O-CG1 3.3Å; Y259-I261 PolarHBondContact O-N 3.03Å
262	G	98.9	Very high	97.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	173.7	173.8	0	0	0	0	0	113.8	V201 I208 L209 I210	V201-G262 CarbonylContact O-C 3.16Å; V201-G262 WeakPolarHBondContact O-CA 3.3Å; I208-G262 PolarHBondContact O-N 3.34Å; L209-G262 VanDerWaalsContact CD1-C 3.47Å; I210-G262 PolarHBondContact N-O 2.86Å
263	F	98.9	Very high	97.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	135.7	178.9	-62.6	-79.9	0	0	0	112.4	V201 I210 H225 Y226 F233 W234 D252 L255	V201-F263 HydrophobicContact CB-CB 4.1Å; V201-F263 HydrophobicContact CB-CD2 4.08Å; V201-F263 HydrophobicContact CG1-CD2 4.45Å; V201-F263 HydrophobicContact CG2-CB 4.46Å; V201-F263 HydrophobicContact CG2-CD2 4.43Å; V201-F263 PolarHBondContact N-O 2.85Å; V201-F263 PolarHBondContact O-N 2.88Å; I210-F263 HydrophobicContact CB-CD1 3.82Å; I210-F263 HydrophobicContact CB-CE1 4.01Å; I210-F263 HydrophobicContact CG1-CD1 4.37Å; I210-F263 HydrophobicContact CG1-CE1 4.11Å; I210-F263 HydrophobicContact CG2-CD1 4.15Å; I210-F263 HydrophobicContact CG2-CE1 4.24Å; H225-F263 HydrophobicContact CB-CD1 4.09Å; H225-F263 HydrophobicContact CB-CD2 4.44Å; H225-F263 HydrophobicContact CB-CE1 4.39Å; H225-F263 HydrophobicContact CB-CG 4.11Å; H225-F263 AromaticContact CG-CG 3.81Å; Y226-F263 HydrophobicContact CD2-CD1 4.37Å; Y226-F263 HydrophobicContact CD2-CE1 4.06Å; Y226-F263 AromaticContact CE2-CD1 3.82Å; Y226-F263 HydrophobicContact CE2-CD1 3.82Å; Y226-F263 AromaticContact CE2-CE1 3.81Å; Y226-F263 HydrophobicContact CE2-CE1 3.81Å; F233-F263 AromaticContact CE1-CE1 3.64Å; F233-F263 HydrophobicContact CE1-CE1 3.64Å; F233-F263 AromaticContact CE1-CZ 3.71Å; F233-F263 HydrophobicContact CE1-CZ 3.71Å; F233-F263 HydrophobicContact CE2-CE1 4.21Å; F233-F263 AromaticContact CZ-CE1 3.44Å; F233-F263 HydrophobicContact CZ-CE1 3.44Å; F233-F263 VanDerWaalsContact CZ-CE1 3.44Å; F233-F263 AromaticContact CZ-CZ 3.71Å; F233-F263 HydrophobicContact CZ-CZ 3.71Å; W234-F263 HydrophobicContact CH2-CE2 4.47Å; W234-F263 HydrophobicContact CH2-CZ 4.07Å; W234-F263 HydrophobicContact CZ2-CZ 4.3Å; D252-F263 HydrophobicContact CB-CD2 4.31Å; D252-F263 HydrophobicContact CB-CE2 4.03Å; L255-F263 HydrophobicContact CB-CE2 4.2Å; L255-F263 HydrophobicContact CD2-CE2 3.77Å; L255-F263 HydrophobicContact CD2-CZ 3.67Å
264	T	98.8	Very high	96.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	171.8	166	-174.7	0	0	0	0	109.7	D200 L209 I210 I211 G212 L289	D200-T264 VanDerWaalsContact OD1-CA 3.26Å; D200-T264 WeakPolarHBondContact OD1-CA 3.46Å; D200-T264 PolarHBondContact OD1-OG1 3.15Å; D200-T264 PolarHBondContact OD2-OG1 3.44Å; L209-T264 HydrophobicContact CD1-CG2 3.88Å; L209-T264 HydrophobicContact CD2-CG2 3.89Å; L209-T264 HydrophobicContact CG-CG2 3.87Å; I210-T264 PolarHBondContact O-N 2.94Å; I211-T264 HydrophobicContact CB-CG2 4.28Å; I211-T264 HydrophobicContact CG1-CG2 3.72Å; I211-T264 HydrophobicContact CG2-CG2 4.4Å; G212-T264 PolarHBondContact N-O 3.25Å; T264-L289 HydrophobicContact CG2-CD1 3.64Å
265	N	98.7	Very high	96.6	Very high	14 Å²	14	45 Å²	45	8%	0.075	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	160.4	164.3	-67.7	-90.1	0	0	0	111.3	G212 N214	G212-N265 WeakPolarHBondContact CA-OD1 3.47Å; G212-N265 CarbonylContact O-C 3.54Å; G212-N265 WeakPolarHBondContact O-CA 3.45Å; N214-N265 WeakPolarHBondContact CA-OD1 3.2Å; N214-N265 PolarHBondContact N-OD1 3.06Å
266	M	98	Very high	96.4	Very high	5 Å²	5	48.3 Å²	48.3	3%	0.025	24%	0.239	C	C	.	.	S	Bend	trans	-67.8	-44.8	169	-175.4	66.6	71.3	0	0	110.8	G212 I213 I282 G285 G286 L289 F303 I308 F312	G212-M266 PolarHBondContact O-N 2.85Å; I213-M266 WeakPolarHBondContact O-CB 3.38Å; I213-M266 PolarHBondContact O-N 3.42Å; M266-I282 HydrophobicContact CG-CG2 3.9Å; M266-G285 CarbonylContact O-C 3.49Å; M266-G285 WeakPolarHBondContact O-CA 3.11Å; M266-G286 VanDerWaalsContact SD-CA 3.59Å; M266-L289 HydrophobicContact CE-CD2 3.41Å; M266-L289 VanDerWaalsContact CE-CD2 3.41Å; M266-L289 HydrophobicContact SD-CB 4.26Å; M266-L289 HydrophobicContact SD-CD2 3.59Å; M266-L289 VanDerWaalsContact SD-CD2 3.59Å; M266-F303 HydrophobicContact CE-CD1 4.23Å; M266-F303 HydrophobicContact CE-CE1 3.84Å; M266-I308 HydrophobicContact CB-CB 4.38Å; M266-I308 HydrophobicContact CB-CD1 4.44Å; M266-I308 HydrophobicContact CB-CG2 4.11Å; M266-I308 HydrophobicContact CE-CB 3.99Å; M266-I308 HydrophobicContact CG-CB 4.33Å; M266-I308 HydrophobicContact CG-CG2 4.17Å; M266-F312 HydrophobicContact CE-CB 3.74Å; M266-F312 HydrophobicContact CE-CD2 3.75Å; M266-F312 HydrophobicContact CE-CG 4.06Å; M266-F312 HydrophobicContact SD-CD2 4.16Å
267	V	98.1	Very high	96.2	Very high	10 Å²	10	47.9 Å²	47.9	6%	0.061	24%	0.235	C	C	.	.			trans	-122.7	132.3	178.3	-179	0	0	0	0	109.6	I213 N214 P215 R269 L277 E281 I282	I213-V267 PolarHBondContact O-N 2.99Å; N214-V267 VanDerWaalsContact CA-O 3.28Å; N214-V267 WeakPolarHBondContact CA-O 3.46Å; N214-V267 HydrophobicContact CB-CB 4.16Å; N214-V267 VanDerWaalsContact CB-O 3.26Å; N214-V267 WeakPolarHBondContact CB-O 3.39Å; P215-V267 WeakPolarHBondContact CD-O 3.49Å; V267-R269 HydrophobicContact CG1-CB 4.25Å; V267-L277 HydrophobicContact CB-CD1 4.35Å; V267-L277 HydrophobicContact CG1-CD2 4.07Å; V267-L277 HydrophobicContact CG2-CD1 4.36Å; V267-E281 HydrophobicContact CG1-CB 4.41Å; V267-I282 HydrophobicContact CG2-CB 4.31Å; V267-I282 HydrophobicContact CG2-CG1 4.03Å
268	E	96.8	Very high	96	Very high	105 Å²	105	42.7 Å²	42.7	49%	0.491	22%	0.216	S	C	.	.			trans	-74	-33.5	-178.4	-174.4	177.2	-172.4	0	0	113.2	T197 P215 T270	T197-E268 WeakPolarHBondContact CB-OE1 3.43Å; T197-E268 HydrophobicContact CG2-CG 3.63Å; T197-E268 VanDerWaalsContact CG2-OE1 3.29Å; T197-E268 WeakPolarHBondContact CG2-OE1 3.34Å; T197-E268 PolarHBondContact OG1-OE1 2.89Å; P215-E268 VanDerWaalsContact CD-O 3.27Å; P215-E268 WeakPolarHBondContact CD-O 3.24Å; P215-E268 WeakPolarHBondContact CG-O 3.17Å; E268-T270 PolarHBondContact O-N 2.93Å
269	R	97.6	Very high	95.7	Very high	92 Å²	92	40.4 Å²	40.4	35%	0.347	22%	0.217	S	C	.	.	S	Bend	trans	-60.9	126.3	-174.8	-175.4	171.2	64.6	86.1	-4.1	112.6	N214 V267 D276 E281	N214-R269 PolarHBondContact ND2-O 2.85Å; V267-R269 HydrophobicContact CG1-CB 4.25Å; R269-D276 PolarHBondContact NH1-O 2.71Å; R269-D276 PolarHBondContact NH2-O 2.92Å; R269-E281 IonicContact CZ-OE1 2.65Å; R269-E281 IonicContact NE-OE1 3.61Å; R269-E281 PolarHBondContact NE-OE1 2.93Å; R269-E281 VanDerWaalsContact NH2-CD 3.31Å; R269-E281 IonicContact NH2-OE1 2.74Å; R269-E281 PolarHBondContact NH2-OE1 3.47Å; R269-E281 IonicContact NH2-OE2 2.65Å; R269-E281 PolarHBondContact NH2-OE2 3.19Å; R269-E281 VanDerWaalsContact NH2-OE2 3.12Å
270	T	98.1	Very high	95.5	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	24%	0.244	C	C	.	.			trans	-71	137.1	177.5	-65	0	0	0	0	112.4	V193 M194 K196 P215 L217 A220 E268	V193-T270 WeakPolarHBondContact O-CG2 3.31Å; M194-T270 HydrophobicContact CG-CG2 4.5Å; K196-T270 VanDerWaalsContact O-CB 3.31Å; K196-T270 WeakPolarHBondContact O-CB 3.4Å; K196-T270 PolarHBondContact O-OG1 3.43Å; P215-T270 VanDerWaalsContact O-CA 3.31Å; P215-T270 WeakPolarHBondContact O-CA 3.25Å; L217-T270 HydrophobicContact CD2-CG2 4.14Å; A220-T270 HydrophobicContact CB-CG2 3.49Å; A220-T270 VanDerWaalsContact CB-CG2 3.49Å; A220-T270 WeakPolarHBondContact CB-OG1 3.36Å; E268-T270 PolarHBondContact O-N 2.93Å
271	T	96.4	Very high	95.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-142.1	165.5	173.8	70.3	0	0	0	0	113.8	N214 P215 G216 L217 G273 D276 L277	N214-T271 PolarHBondContact ND2-N 3Å; N214-T271 PolarHBondContact ND2-OG1 3.44Å; P215-T271 PolarHBondContact O-N 2.88Å; G216-T271 WeakPolarHBondContact CA-O 3.32Å; L217-T271 PolarHBondContact N-O 3.23Å; T271-G273 VanDerWaalsContact C-N 3.3Å; T271-G273 PolarHBondContact OG1-N 3.27Å; T271-G273 PolarHBondContact OG1-O 3.48Å; T271-D276 HydrophobicContact CG2-CB 3.97Å; T271-L277 HydrophobicContact CG2-CD2 3.71Å; T271-L277 HydrophobicContact CG2-CG 4.43Å
272	P	91.8	Very high	95.2	Very high	56 Å²	56	48 Å²	48	36%	0.364	25%	0.248	S	C	.	.	S	Bend	trans	-55.6	-41.2	161.7	-24.9	33.5	0	0	0	113	M194 L217 D276 R349	M194-P272 HydrophobicContact SD-CG 4.31Å; L217-P272 HydrophobicContact CD1-CB 4.42Å; L217-P272 HydrophobicContact CD1-CG 4.29Å; P272-D276 WeakPolarHBondContact CB-OD2 3.44Å; P272-D276 VanDerWaalsContact CD-OD2 3.23Å; P272-D276 WeakPolarHBondContact CD-OD2 3.38Å; P272-R349 VanDerWaalsContact O-CZ 3.28Å; P272-R349 PolarHBondContact O-NH1 2.67Å; P272-R349 PolarHBondContact O-NH2 2.82Å
273	G	88.1	Confident	95	Very high	9 Å²	9	52.9 Å²	52.9	9%	0.093	27%	0.266	C	S	.	.	S	Bend	trans	-165.8	175.7	171.8	0	0	0	0	0	115.9	T271 K275 D276 R349	T271-G273 VanDerWaalsContact C-N 3.3Å; T271-G273 PolarHBondContact OG1-N 3.27Å; T271-G273 PolarHBondContact OG1-O 3.48Å; G273-K275 PolarHBondContact O-N 3.24Å; G273-K275 VanDerWaalsContact O-N 3.09Å; G273-D276 PolarHBondContact N-OD2 3.1Å; G273-D276 WeakPolarHBondContact O-CB 3.11Å; G273-D276 PolarHBondContact O-N 3.18Å; G273-R349 VanDerWaalsContact CA-NH2 3.26Å
274	S	88.8	Confident	95	Very high	57 Å²	57	57.1 Å²	57.1	40%	0.399	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-69.3	-5.9	-173.1	58	0	0	0	0	115.3	D276	S274-D276 VanDerWaalsContact C-N 3.28Å
275	K	91.4	Very high	94.9	Very high	201 Å²	201	57.3 Å²	57.3	87%	0.874	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-77.6	-16.6	169.6	-71.2	-162.7	172	-158.6	0	112.5	G273 L277	G273-K275 PolarHBondContact O-N 3.24Å; G273-K275 VanDerWaalsContact O-N 3.09Å; K275-L277 PolarHBondContact O-N 3.39Å
276	D	93.2	Very high	94.9	Very high	71 Å²	71	56.6 Å²	56.6	38%	0.38	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-92.4	17.8	-176.1	-34.9	-39	0	0	0	111.5	R269 T271 P272 G273 S274	R269-D276 PolarHBondContact NH1-O 2.71Å; R269-D276 PolarHBondContact NH2-O 2.92Å; T271-D276 HydrophobicContact CG2-CB 3.97Å; P272-D276 WeakPolarHBondContact CB-OD2 3.44Å; P272-D276 VanDerWaalsContact CD-OD2 3.23Å; P272-D276 WeakPolarHBondContact CD-OD2 3.38Å; G273-D276 PolarHBondContact N-OD2 3.1Å; G273-D276 WeakPolarHBondContact O-CB 3.11Å; G273-D276 PolarHBondContact O-N 3.18Å; S274-D276 VanDerWaalsContact C-N 3.28Å
277	L	94.7	Very high	94.9	Very high	17 Å²	17	61.7 Å²	61.7	9%	0.089	30%	0.303	C	S	.	.	S	Bend	trans	-116.5	135.8	179.7	-60.2	178.3	0	0	0	109.6	I213 N214 V267 T271 K275 I282	I213-L277 HydrophobicContact CG2-CD1 3.93Å; N214-L277 HydrophobicContact CB-CD1 3.96Å; V267-L277 HydrophobicContact CB-CD1 4.35Å; V267-L277 HydrophobicContact CG1-CD2 4.07Å; V267-L277 HydrophobicContact CG2-CD1 4.36Å; T271-L277 HydrophobicContact CG2-CD2 3.71Å; T271-L277 HydrophobicContact CG2-CG 4.43Å; K275-L277 PolarHBondContact O-N 3.39Å; L277-I282 HydrophobicContact CB-CD1 4.06Å; L277-I282 HydrophobicContact CB-CG1 4.1Å; L277-I282 HydrophobicContact CD1-CD1 4.46Å; L277-I282 HydrophobicContact CD1-CG1 4.29Å
278	S	94.5	Very high	94.9	Very high	52 Å²	52	64.8 Å²	64.8	36%	0.364	32%	0.317	S	S	.	.			trans	-82.6	153.5	175.4	68.6	0	0	0	0	112.6	K280 E281 I282	S278-K280 PolarHBondContact O-N 3.42Å; S278-E281 VanDerWaalsContact CB-OE2 3.3Å; S278-E281 WeakPolarHBondContact CB-OE2 3.3Å; S278-E281 PolarHBondContact N-OE2 2.8Å; S278-E281 PolarHBondContact O-N 3.34Å; S278-E281 VanDerWaalsContact O-N 3.1Å; S278-E281 VanDerWaalsContact OG-CG 3.32Å; S278-E281 WeakPolarHBondContact OG-CG 3.3Å; S278-E281 PolarHBondContact OG-N 2.91Å; S278-E281 PolarHBondContact OG-OE2 3.43Å; S278-I282 PolarHBondContact O-N 3.23Å
279	S	91.1	Very high	95	Very high	86 Å²	86	59.9 Å²	59.9	60%	0.601	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-5.8	171.4	-49.3	0	0	0	0	114	R283	S279-R283 WeakPolarHBondContact O-CG 3.34Å; S279-R283 PolarHBondContact O-NE 2.7Å
280	K	94.2	Very high	95	Very high	160 Å²	160	57 Å²	57	70%	0.696	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-51.3	167.9	-173.9	-179.6	178.7	-176.6	0	110	S278 I282 R283 E284	S278-K280 PolarHBondContact O-N 3.42Å; K280-I282 PolarHBondContact O-N 2.84Å; K280-R283 PolarHBondContact O-N 3.4Å; K280-E284 WeakPolarHBondContact O-CB 3.48Å; K280-E284 PolarHBondContact O-N 2.89Å
281	E	95.9	Very high	95	Very high	56 Å²	56	62.9 Å²	62.9	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-60.6	-39.8	-179.5	-68	163.2	97.4	0	0	113.1	V267 R269 S278 R283 E284 G285	V267-E281 HydrophobicContact CG1-CB 4.41Å; R269-E281 IonicContact CZ-OE1 2.65Å; R269-E281 IonicContact NE-OE1 3.61Å; R269-E281 PolarHBondContact NE-OE1 2.93Å; R269-E281 VanDerWaalsContact NH2-CD 3.31Å; R269-E281 IonicContact NH2-OE1 2.74Å; R269-E281 PolarHBondContact NH2-OE1 3.47Å; R269-E281 IonicContact NH2-OE2 2.65Å; R269-E281 PolarHBondContact NH2-OE2 3.19Å; R269-E281 VanDerWaalsContact NH2-OE2 3.12Å; S278-E281 VanDerWaalsContact CB-OE2 3.3Å; S278-E281 WeakPolarHBondContact CB-OE2 3.3Å; S278-E281 PolarHBondContact N-OE2 2.8Å; S278-E281 PolarHBondContact O-N 3.34Å; S278-E281 VanDerWaalsContact O-N 3.1Å; S278-E281 VanDerWaalsContact OG-CG 3.32Å; S278-E281 WeakPolarHBondContact OG-CG 3.3Å; S278-E281 PolarHBondContact OG-N 2.91Å; S278-E281 PolarHBondContact OG-OE2 3.43Å; E281-R283 VanDerWaalsContact C-N 3.33Å; E281-R283 PolarHBondContact O-N 3.06Å; E281-E284 PolarHBondContact O-N 2.82Å; E281-G285 PolarHBondContact O-N 3.18Å
282	I	95	Very high	95.2	Very high	17 Å²	17	65.6 Å²	65.6	9%	0.087	33%	0.325	C	S	.	.	H	α-helix	trans	-70.9	-30.9	-179.1	-52.4	168.1	0	0	0	111.5	M266 V267 L277 S278 K280 G286 I308 I311	M266-I282 HydrophobicContact CG-CG2 3.9Å; V267-I282 HydrophobicContact CG2-CB 4.31Å; V267-I282 HydrophobicContact CG2-CG1 4.03Å; L277-I282 HydrophobicContact CB-CD1 4.06Å; L277-I282 HydrophobicContact CB-CG1 4.1Å; L277-I282 HydrophobicContact CD1-CD1 4.46Å; L277-I282 HydrophobicContact CD1-CG1 4.29Å; S278-I282 PolarHBondContact O-N 3.23Å; K280-I282 PolarHBondContact O-N 2.84Å; I282-G286 PolarHBondContact O-N 3.35Å; I282-I308 HydrophobicContact CG2-CG2 4.27Å; I282-I311 HydrophobicContact CB-CD1 4.03Å; I282-I311 HydrophobicContact CB-CG2 4.22Å; I282-I311 HydrophobicContact CD1-CD1 3.85Å; I282-I311 HydrophobicContact CG2-CB 4.03Å; I282-I311 HydrophobicContact CG2-CD1 3.7Å; I282-I311 HydrophobicContact CG2-CG1 4.47Å; I282-I311 HydrophobicContact CG2-CG2 3.79Å
283	R	95.9	Very high	95.5	Very high	101 Å²	101	62.9 Å²	62.9	38%	0.381	31%	0.307	S	S	.	.	H	α-helix	trans	-73.9	-39.3	174.1	-73.8	-173.7	-65.6	140.9	-2.9	112.4	S279 K280 E281 G286 R287 I311 E315	S279-R283 WeakPolarHBondContact O-CG 3.34Å; S279-R283 PolarHBondContact O-NE 2.7Å; K280-R283 PolarHBondContact O-N 3.4Å; E281-R283 VanDerWaalsContact C-N 3.33Å; E281-R283 PolarHBondContact O-N 3.06Å; R283-G286 WeakPolarHBondContact O-CA 3.32Å; R283-G286 PolarHBondContact O-N 2.94Å; R283-R287 PolarHBondContact O-N 3.41Å; R283-I311 HydrophobicContact CG-CG2 3.7Å; R283-E315 HydrophobicContact CB-CG 4.11Å; R283-E315 WeakPolarHBondContact CD-OE2 3.04Å; R283-E315 HydrophobicContact CG-CG 4.21Å; R283-E315 IonicContact NH1-OE1 3.17Å
284	E	97.4	Very high	96	Very high	89 Å²	89	65.1 Å²	65.1	42%	0.416	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-49.3	174.7	179.3	50.4	-144.3	0	0	111	K280 E281 G286 R287 Q288	K280-E284 WeakPolarHBondContact O-CB 3.48Å; K280-E284 PolarHBondContact O-N 2.89Å; E281-E284 PolarHBondContact O-N 2.82Å; E284-G286 PolarHBondContact O-N 3.5Å; E284-R287 WeakPolarHBondContact O-CB 3.05Å; E284-R287 PolarHBondContact O-N 3.12Å; E284-Q288 PolarHBondContact O-N 2.82Å; E284-Q288 PolarHBondContact OE1-NE2 2.87Å
285	G	97.8	Very high	96.5	Very high	4 Å²	4	67.8 Å²	67.8	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-56.2	-30.4	170.5	0	0	0	0	0	113.7	M266 E281 Q288 L289	M266-G285 CarbonylContact O-C 3.49Å; M266-G285 WeakPolarHBondContact O-CA 3.11Å; E281-G285 PolarHBondContact O-N 3.18Å; G285-Q288 PolarHBondContact O-N 3.25Å; G285-L289 WeakPolarHBondContact O-CB 3.42Å; G285-L289 PolarHBondContact O-N 3.42Å
286	G	97.8	Very high	96.8	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.4	-39.9	171.6	0	0	0	0	0	114.2	M266 I282 R283 E284 L290 F312	M266-G286 VanDerWaalsContact SD-CA 3.59Å; I282-G286 PolarHBondContact O-N 3.35Å; R283-G286 WeakPolarHBondContact O-CA 3.32Å; R283-G286 PolarHBondContact O-N 2.94Å; E284-G286 PolarHBondContact O-N 3.5Å; G286-L290 PolarHBondContact O-N 2.81Å; G286-F312 WeakPolarHBondContact O-CE2 3.38Å
287	R	97.9	Very high	97.1	Very high	111 Å²	111	62.4 Å²	62.4	42%	0.419	29%	0.292	S	S	.	.	H	α-helix	trans	-68.3	-48.8	174.5	-69.2	-178.2	173.7	68.4	13.6	111.2	R283 E284 L289 L290 E291 E315	R283-R287 PolarHBondContact O-N 3.41Å; E284-R287 WeakPolarHBondContact O-CB 3.05Å; E284-R287 PolarHBondContact O-N 3.12Å; R287-L289 PolarHBondContact O-N 3.23Å; R287-L290 WeakPolarHBondContact O-CB 3.2Å; R287-L290 PolarHBondContact O-N 3.19Å; R287-E291 PolarHBondContact O-N 2.91Å; R287-E291 VanDerWaalsContact O-N 3.07Å; R287-E315 IonicContact CZ-OE1 2.74Å; R287-E315 VanDerWaalsContact CZ-OE1 3.24Å; R287-E315 IonicContact NH1-OE1 3.78Å; R287-E315 PolarHBondContact NH1-OE1 3.46Å; R287-E315 IonicContact NH2-OE1 3.94Å; R287-E315 PolarHBondContact NH2-OE1 3.25Å
288	Q	98.2	Very high	97.3	Very high	76 Å²	76	61.6 Å²	61.6	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-62.8	-31.9	179	-60.5	174.2	13.2	0	0	112.2	E284 G285 K292	E284-Q288 PolarHBondContact O-N 2.82Å; E284-Q288 PolarHBondContact OE1-NE2 2.87Å; G285-Q288 PolarHBondContact O-N 3.25Å; Q288-K292 WeakPolarHBondContact O-CG 3.25Å; Q288-K292 PolarHBondContact O-N 2.94Å
289	L	98.7	Very high	97.5	Very high	1 Å²	1	62 Å²	62	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-72.1	-38.3	172.4	178.9	64.6	0	0	0	112.3	I211 T264 M266 G285 R287 K292 L293 F303 F312	I211-L289 HydrophobicContact CD1-CD1 4.4Å; I211-L289 HydrophobicContact CD1-CD2 4.28Å; I211-L289 HydrophobicContact CG1-CD1 4.27Å; I211-L289 HydrophobicContact CG2-CD1 4.27Å; I211-L289 HydrophobicContact CG2-CD2 3.67Å; T264-L289 HydrophobicContact CG2-CD1 3.64Å; M266-L289 HydrophobicContact CE-CD2 3.41Å; M266-L289 VanDerWaalsContact CE-CD2 3.41Å; M266-L289 HydrophobicContact SD-CB 4.26Å; M266-L289 HydrophobicContact SD-CD2 3.59Å; M266-L289 VanDerWaalsContact SD-CD2 3.59Å; G285-L289 WeakPolarHBondContact O-CB 3.42Å; G285-L289 PolarHBondContact O-N 3.42Å; R287-L289 PolarHBondContact O-N 3.23Å; L289-K292 PolarHBondContact O-N 3.43Å; L289-L293 HydrophobicContact CD1-CD1 4.12Å; L289-L293 HydrophobicContact CD1-CG 4.25Å; L289-L293 HydrophobicContact CD2-CD1 4.4Å; L289-L293 HydrophobicContact CG-CD1 3.81Å; L289-L293 HydrophobicContact CG-CG 4.39Å; L289-L293 WeakPolarHBondContact O-CB 3.4Å; L289-L293 VanDerWaalsContact O-CG 3.3Å; L289-L293 WeakPolarHBondContact O-CG 3.44Å; L289-L293 PolarHBondContact O-N 2.92Å; L289-F303 HydrophobicContact CD2-CE1 3.92Å; L289-F303 HydrophobicContact CD2-CZ 4.49Å; L289-F312 HydrophobicContact CB-CE2 4.34Å; L289-F312 HydrophobicContact CD2-CD2 4Å; L289-F312 HydrophobicContact CD2-CE2 3.88Å; L289-F312 HydrophobicContact CG-CE2 4.14Å
290	L	98.7	Very high	97.8	Very high	31 Å²	31	57.9 Å²	57.9	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-57.9	-49	173.8	172.6	63.1	0	0	0	110.6	G286 R287 K292 L293 Q294 I316 I333 P334	G286-L290 PolarHBondContact O-N 2.81Å; R287-L290 WeakPolarHBondContact O-CB 3.2Å; R287-L290 PolarHBondContact O-N 3.19Å; L290-K292 VanDerWaalsContact C-N 3.33Å; L290-K292 PolarHBondContact O-N 3.42Å; L290-L293 PolarHBondContact O-N 3.33Å; L290-L293 VanDerWaalsContact O-N 3.1Å; L290-Q294 HydrophobicContact CD1-CG 3.83Å; L290-Q294 HydrophobicContact CG-CG 4.32Å; L290-Q294 WeakPolarHBondContact O-CB 3.22Å; L290-Q294 WeakPolarHBondContact O-CG 3.35Å; L290-Q294 PolarHBondContact O-N 3.31Å; L290-I316 HydrophobicContact CB-CD1 4.3Å; L290-I316 HydrophobicContact CD1-CG2 4.26Å; L290-I316 HydrophobicContact CD2-CD1 4.12Å; L290-I316 HydrophobicContact CD2-CG2 4.12Å; L290-I333 HydrophobicContact CD1-CG2 3.5Å; L290-P334 HydrophobicContact CD1-CG 4.33Å
291	E	98.5	Very high	98.1	Very high	126 Å²	126	50.3 Å²	50.3	59%	0.589	22%	0.224	S	C	*	.	H	α-helix	trans	-56	-45	176.7	-67.8	170	-153.7	0	0	112.2	R287 L293 Q294 K295	R287-E291 PolarHBondContact O-N 2.91Å; R287-E291 VanDerWaalsContact O-N 3.07Å; E291-L293 PolarHBondContact O-N 3.5Å; E291-Q294 PolarHBondContact O-N 3.42Å; E291-K295 VanDerWaalsContact O-CB 3.32Å; E291-K295 WeakPolarHBondContact O-CB 3.41Å; E291-K295 PolarHBondContact O-N 3.02Å
292	K	98.7	Very high	98.2	Very high	56 Å²	56	47.6 Å²	47.6	24%	0.243	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-43.1	175.7	-69.7	171.7	-170.1	-174.3	0	111.8	D200 L202 Q288 L289 L290 K295 Y296	D200-K292 WeakPolarHBondContact OD2-CE 3.26Å; D200-K292 IonicContact OD2-NZ 3.91Å; D200-K292 PolarHBondContact OD2-NZ 2.84Å; L202-K292 HydrophobicContact CD1-CD 4.45Å; Q288-K292 WeakPolarHBondContact O-CG 3.25Å; Q288-K292 PolarHBondContact O-N 2.94Å; L289-K292 PolarHBondContact O-N 3.43Å; L290-K292 VanDerWaalsContact C-N 3.33Å; L290-K292 PolarHBondContact O-N 3.42Å; K292-K295 PolarHBondContact O-N 2.98Å; K292-Y296 VanDerWaalsContact O-CD2 3.24Å; K292-Y296 WeakPolarHBondContact O-CD2 3.5Å; K292-Y296 PolarHBondContact O-N 2.75Å
293	L	98.8	Very high	98.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.1	-42	179.5	-71.2	164.8	0	0	0	111.7	L209 I211 L289 L290 E291 K295 K297 P298 A301 F312 I333 T338	L209-L293 HydrophobicContact CD2-CD2 3.84Å; I211-L293 HydrophobicContact CD1-CD1 4.39Å; I211-L293 HydrophobicContact CD1-CD2 4.44Å; L289-L293 HydrophobicContact CD1-CD1 4.12Å; L289-L293 HydrophobicContact CD1-CG 4.25Å; L289-L293 HydrophobicContact CD2-CD1 4.4Å; L289-L293 HydrophobicContact CG-CD1 3.81Å; L289-L293 HydrophobicContact CG-CG 4.39Å; L289-L293 WeakPolarHBondContact O-CB 3.4Å; L289-L293 VanDerWaalsContact O-CG 3.3Å; L289-L293 WeakPolarHBondContact O-CG 3.44Å; L289-L293 PolarHBondContact O-N 2.92Å; L290-L293 PolarHBondContact O-N 3.33Å; L290-L293 VanDerWaalsContact O-N 3.1Å; E291-L293 PolarHBondContact O-N 3.5Å; L293-K295 VanDerWaalsContact C-N 3.31Å; L293-K295 PolarHBondContact O-N 2.83Å; L293-K297 WeakPolarHBondContact O-CA 3.36Å; L293-K297 PolarHBondContact O-N 2.78Å; L293-P298 HydrophobicContact CD2-CG 3.87Å; L293-A301 HydrophobicContact CD1-CB 4.46Å; L293-A301 HydrophobicContact CD2-CB 3.92Å; L293-F312 HydrophobicContact CD1-CZ 4.13Å; L293-I333 HydrophobicContact CB-CG1 4.36Å; L293-I333 HydrophobicContact CB-CG2 3.88Å; L293-I333 HydrophobicContact CD1-CD1 3.71Å; L293-I333 HydrophobicContact CD1-CG1 4.01Å; L293-T338 HydrophobicContact CD2-CG2 4.47Å
294	Q	98.6	Very high	98.5	Very high	55 Å²	55	42.1 Å²	42.1	26%	0.257	19%	0.19	S	C	.	.	H	α-helix	trans	-65.4	-31.9	174.3	-71.4	-175.7	-36.4	0	0	112.8	L290 E291 K297 I333 P334 D335 T336	L290-Q294 HydrophobicContact CD1-CG 3.83Å; L290-Q294 HydrophobicContact CG-CG 4.32Å; L290-Q294 WeakPolarHBondContact O-CB 3.22Å; L290-Q294 WeakPolarHBondContact O-CG 3.35Å; L290-Q294 PolarHBondContact O-N 3.31Å; E291-Q294 PolarHBondContact O-N 3.42Å; Q294-K297 WeakPolarHBondContact O-CE 3.28Å; Q294-K297 VanDerWaalsContact O-CG 3.26Å; Q294-K297 WeakPolarHBondContact O-CG 3.43Å; Q294-I333 HydrophobicContact CG-CG2 4.38Å; Q294-P334 WeakPolarHBondContact CG-O 3.42Å; Q294-P334 PolarHBondContact NE2-O 3.08Å; Q294-D335 PolarHBondContact NE2-OD2 3.14Å; Q294-T336 HydrophobicContact CG-CG2 4.22Å
295	K	98.6	Very high	98.4	Very high	114 Å²	114	38 Å²	38	50%	0.496	17%	0.172	S	C	.	.	H	α-helix	trans	-73.6	-52.7	174.8	-177	179.1	178.6	-171.6	0	113	Y204 E291 K292 L293	Y204-K295 VanDerWaalsContact CE1-O 3.32Å; Y204-K295 WeakPolarHBondContact CE1-O 3.5Å; Y204-K295 VanDerWaalsContact OH-CE 3.28Å; Y204-K295 WeakPolarHBondContact OH-CE 3.49Å; E291-K295 VanDerWaalsContact O-CB 3.32Å; E291-K295 WeakPolarHBondContact O-CB 3.41Å; E291-K295 PolarHBondContact O-N 3.02Å; K292-K295 PolarHBondContact O-N 2.98Å; L293-K295 VanDerWaalsContact C-N 3.31Å; L293-K295 PolarHBondContact O-N 2.83Å
296	Y	98.8	Very high	98.2	Very high	46 Å²	46	41.3 Å²	41.3	18%	0.18	19%	0.185	C	C	.	.	H	α-helix	trans	-92.2	-16.3	-169.6	-64.7	-67.6	0	0	0	114.4	L202 Y204 K292	L202-Y296 HydrophobicContact CB-CD2 4.13Å; L202-Y296 HydrophobicContact CB-CE1 4.4Å; L202-Y296 HydrophobicContact CB-CE2 3.99Å; L202-Y296 HydrophobicContact CB-CG 4.42Å; L202-Y296 HydrophobicContact CD1-CD2 3.93Å; L202-Y296 HydrophobicContact CD1-CE2 3.62Å; L202-Y296 HydrophobicContact CD2-CD2 4.14Å; L202-Y296 HydrophobicContact CG-CD2 4.29Å; L202-Y296 HydrophobicContact CG-CE2 4.27Å; Y204-Y296 HydrophobicContact CD1-CD1 4.12Å; Y204-Y296 HydrophobicContact CD2-CD1 4.32Å; Y204-Y296 HydrophobicContact CD2-CE1 4.49Å; Y204-Y296 AromaticContact CE1-CD1 3.97Å; Y204-Y296 HydrophobicContact CE1-CD1 3.97Å; Y204-Y296 HydrophobicContact CE1-CE1 4.4Å; Y204-Y296 HydrophobicContact CE2-CD1 4.15Å; Y204-Y296 AromaticContact CE2-CE1 3.98Å; Y204-Y296 HydrophobicContact CE2-CE1 3.98Å; Y204-Y296 HydrophobicContact CG-CD1 4.31Å; Y204-Y296 AromaticContact CZ-CD1 3.97Å; Y204-Y296 AromaticContact CZ-CE1 3.94Å; K292-Y296 VanDerWaalsContact O-CD2 3.24Å; K292-Y296 WeakPolarHBondContact O-CD2 3.5Å; K292-Y296 PolarHBondContact O-N 2.75Å
297	K	98.7	Very high	98	Very high	112 Å²	112	43 Å²	43	49%	0.487	20%	0.203	S	C	.	.			trans	41.8	57.2	174.1	-52.9	-160.5	-179.1	-159	0	114.3	L293 Q294 D335 T336	L293-K297 WeakPolarHBondContact O-CA 3.36Å; L293-K297 PolarHBondContact O-N 2.78Å; Q294-K297 WeakPolarHBondContact O-CE 3.28Å; Q294-K297 VanDerWaalsContact O-CG 3.26Å; Q294-K297 WeakPolarHBondContact O-CG 3.43Å; K297-D335 PolarHBondContact NZ-O 2.92Å; K297-T336 HydrophobicContact CD-CG2 3.92Å; K297-T336 HydrophobicContact CG-CG2 3.89Å
298	P	98.8	Very high	97.8	Very high	1 Å²	1	38 Å²	38	1%	0.006	18%	0.184	C	C	.	.			trans	-63.4	156.5	174.2	30.9	-35.9	0	0	0	110.4	L206 L209 L293 T338	L206-P298 HydrophobicContact CB-CB 4.02Å; L206-P298 CarbonylContact O-C 3.57Å; L206-P298 WeakPolarHBondContact O-CA 3.18Å; L209-P298 HydrophobicContact CB-CB 3.93Å; L209-P298 HydrophobicContact CB-CG 3.79Å; L209-P298 HydrophobicContact CD2-CG 4.23Å; L293-P298 HydrophobicContact CD2-CG 3.87Å; P298-T338 HydrophobicContact CG-CG2 3.97Å; P298-T338 VanDerWaalsContact O-CB 3.24Å; P298-T338 WeakPolarHBondContact O-CB 3.37Å; P298-T338 WeakPolarHBondContact O-CG2 3.32Å; P298-T338 PolarHBondContact O-OG1 3.28Å
299	L	98.7	Very high	97.7	Very high	60 Å²	60	34.4 Å²	34.4	31%	0.314	17%	0.167	S	C	.	.	S	Bend	trans	-64.4	-42.8	175.1	-59.1	178.7	0	0	0	111.2	L206 D207 V339 M373 K374	L206-L299 PolarHBondContact O-N 3.43Å; D207-L299 WeakPolarHBondContact O-CB 3.45Å; L299-V339 PolarHBondContact O-N 3.28Å; L299-M373 HydrophobicContact CB-CE 4.11Å; L299-K374 HydrophobicContact CD1-CD 3.58Å; L299-K374 HydrophobicContact CD1-CG 4.36Å
300	I	98.9	Very high	97.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.5	-177.6	-51.9	170.6	0	0	0	111.6	D207 I208 L209 A302 V339 F341 L366 L369 R370 M373	D207-I300 PolarHBondContact O-N 2.87Å; I208-I300 HydrophobicContact CG1-CB 4.46Å; I208-I300 HydrophobicContact CG1-CD1 4.34Å; L209-I300 PolarHBondContact N-O 2.9Å; I300-A302 HydrophobicContact CG2-CB 4.45Å; I300-V339 HydrophobicContact CB-CG2 4.4Å; I300-V339 HydrophobicContact CG1-CG2 3.94Å; I300-V339 HydrophobicContact CG2-CG2 4.34Å; I300-F341 HydrophobicContact CG2-CB 3.59Å; I300-F341 HydrophobicContact CG2-CG 4.49Å; I300-L366 HydrophobicContact CB-CD1 4.45Å; I300-L366 HydrophobicContact CD1-CD1 4Å; I300-L366 HydrophobicContact CG2-CD1 3.73Å; I300-L369 HydrophobicContact CD1-CB 4.35Å; I300-L369 HydrophobicContact CD1-CD2 3.9Å; I300-L369 HydrophobicContact CD1-CG 3.82Å; I300-L369 HydrophobicContact CG1-CD2 4.32Å; I300-L369 HydrophobicContact CG2-CD2 4.48Å; I300-R370 HydrophobicContact CD1-CB 3.9Å; I300-R370 HydrophobicContact CD1-CG 4.43Å; I300-M373 HydrophobicContact CD1-SD 4.23Å; I300-M373 HydrophobicContact CG1-SD 3.9Å
301	A	98.9	Very high	97.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	101.1	166.6	0	0	0	0	0	109.8	I211 L293 F303 I333 T338 V339 F341	I211-A301 HydrophobicContact CD1-CB 3.82Å; L293-A301 HydrophobicContact CD1-CB 4.46Å; L293-A301 HydrophobicContact CD2-CB 3.92Å; A301-F303 HydrophobicContact CB-CE2 3.87Å; A301-F303 WeakPolarHBondContact O-CD2 3.22Å; A301-I333 HydrophobicContact CB-CG1 4.41Å; A301-T338 HydrophobicContact CB-CG2 3.73Å; A301-V339 PolarHBondContact N-O 3.49Å; A301-F341 PolarHBondContact O-N 3.02Å
302	A	98.9	Very high	97.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	96.2	-169.8	0	0	0	0	0	112.4	I208 L209 I210 I211 I300 N304 F341 M343 L366	I208-A302 HydrophobicContact CG2-CB 3.8Å; L209-A302 PolarHBondContact O-N 3.18Å; I210-A302 HydrophobicContact CD1-CB 4.06Å; I211-A302 PolarHBondContact N-O 3.2Å; I300-A302 HydrophobicContact CG2-CB 4.45Å; A302-N304 PolarHBondContact O-N 3.24Å; A302-F341 CarbonylContact C-O 3.36Å; A302-F341 WeakPolarHBondContact CA-O 3.4Å; A302-M343 HydrophobicContact CB-CE 4.09Å; A302-L366 HydrophobicContact CB-CD1 4.24Å; A302-L366 HydrophobicContact CB-CD2 4.11Å
303	F	98.8	Very high	97	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	114.9	-174.9	-66.7	-95.8	0	0	0	112.5	I211 M266 L289 A301 G305 I308 Y309 F312 C340 F341 L342 M343	I211-F303 HydrophobicContact CB-CD1 4.23Å; I211-F303 HydrophobicContact CD1-CD1 4.04Å; I211-F303 HydrophobicContact CD1-CD2 4.12Å; I211-F303 HydrophobicContact CD1-CE1 3.77Å; I211-F303 HydrophobicContact CD1-CE2 3.84Å; I211-F303 HydrophobicContact CD1-CG 4.21Å; I211-F303 HydrophobicContact CD1-CZ 3.66Å; I211-F303 HydrophobicContact CG2-CD1 3.93Å; I211-F303 HydrophobicContact CG2-CE1 4.13Å; M266-F303 HydrophobicContact CE-CD1 4.23Å; M266-F303 HydrophobicContact CE-CE1 3.84Å; L289-F303 HydrophobicContact CD2-CE1 3.92Å; L289-F303 HydrophobicContact CD2-CZ 4.49Å; A301-F303 HydrophobicContact CB-CE2 3.87Å; A301-F303 WeakPolarHBondContact O-CD2 3.22Å; F303-G305 PolarHBondContact O-N 3.06Å; F303-I308 HydrophobicContact CD1-CD1 4.35Å; F303-Y309 HydrophobicContact CB-CD2 4.38Å; F303-Y309 AromaticContact CD1-CD2 3.86Å; F303-Y309 HydrophobicContact CD1-CD2 3.86Å; F303-Y309 AromaticContact CD2-CD2 3.49Å; F303-Y309 HydrophobicContact CD2-CD2 3.49Å; F303-Y309 VanDerWaalsContact CD2-CD2 3.49Å; F303-Y309 AromaticContact CD2-CE2 3.95Å; F303-Y309 HydrophobicContact CD2-CE2 3.95Å; F303-Y309 HydrophobicContact CD2-CG 4.42Å; F303-Y309 AromaticContact CE1-CD2 3.93Å; F303-Y309 HydrophobicContact CE1-CD2 3.93Å; F303-Y309 AromaticContact CE2-CD2 3.58Å; F303-Y309 HydrophobicContact CE2-CD2 3.58Å; F303-Y309 AromaticContact CE2-CE2 3.73Å; F303-Y309 HydrophobicContact CE2-CE2 3.73Å; F303-Y309 AromaticContact CG-CD2 3.64Å; F303-Y309 HydrophobicContact CG-CD2 3.64Å; F303-Y309 HydrophobicContact CG-CG 4.28Å; F303-Y309 AromaticContact CZ-CD2 3.8Å; F303-Y309 HydrophobicContact CZ-CD2 3.8Å; F303-Y309 HydrophobicContact CZ-CE2 4.11Å; F303-F312 HydrophobicContact CE1-CB 4.32Å; F303-F312 HydrophobicContact CE1-CD1 4.09Å; F303-F312 HydrophobicContact CE1-CD2 4.34Å; F303-F312 AromaticContact CE1-CG 3.99Å; F303-F312 HydrophobicContact CE1-CG 3.99Å; F303-F312 AromaticContact CZ-CD1 3.78Å; F303-F312 HydrophobicContact CZ-CD1 3.78Å; F303-F312 AromaticContact CZ-CE1 3.88Å; F303-F312 HydrophobicContact CZ-CE1 3.88Å; F303-F312 HydrophobicContact CZ-CG 4.14Å; F303-F312 HydrophobicContact CZ-CZ 4.31Å; F303-C340 HydrophobicContact CE2-CB 4.11Å; F303-F341 PolarHBondContact N-O 2.77Å; F303-L342 HydrophobicContact CB-CD1 3.73Å; F303-M343 PolarHBondContact O-N 2.82Å
304	N	98.4	Very high	96.8	Very high	2 Å²	2	36 Å²	36	1%	0.011	17%	0.174	C	C	.	.	S	Bend	trans	-86.6	45.7	-175.4	-158.5	-9.6	0	0	0	112.9	I211 Y226 A302 S345 S346	I211-N304 VanDerWaalsContact O-CB 3.25Å; I211-N304 WeakPolarHBondContact O-CB 3.5Å; I211-N304 PolarHBondContact O-N 3.05Å; Y226-N304 VanDerWaalsContact CE1-ND2 3.34Å; Y226-N304 WeakPolarHBondContact CE1-ND2 3.49Å; Y226-N304 PolarHBondContact OH-ND2 3.3Å; A302-N304 PolarHBondContact O-N 3.24Å; N304-S345 VanDerWaalsContact O-CA 3.29Å; N304-S345 WeakPolarHBondContact O-CA 3.17Å; N304-S345 WeakPolarHBondContact O-CB 3.43Å; N304-S345 PolarHBondContact O-OG 2.89Å; N304-S345 VanDerWaalsContact O-OG 3.11Å; N304-S346 PolarHBondContact ND2-OG 3.45Å; N304-S346 VanDerWaalsContact ND2-OG 3.13Å; N304-S346 WeakPolarHBondContact OD1-CB 3.35Å; N304-S346 PolarHBondContact OD1-N 3.37Å; N304-S346 PolarHBondContact OD1-OG 3.34Å
305	G	95.4	Very high	96.7	Very high	4 Å²	4	35.3 Å²	35.3	4%	0.041	17%	0.17	C	C	.	.	S	Bend	trans	159.8	134.5	174.7	0	0	0	0	0	114	F303 G307 I308 M343	F303-G305 PolarHBondContact O-N 3.06Å; G305-G307 PolarHBondContact O-N 3.41Å; G305-I308 WeakPolarHBondContact O-CG1 3.39Å; G305-M343 WeakPolarHBondContact CA-O 3.14Å; G305-M343 PolarHBondContact N-O 3.44Å; G305-M343 VanDerWaalsContact N-O 3.15Å
306	K	94.3	Very high	96.6	Very high	73 Å²	73	31.4 Å²	31.4	32%	0.317	16%	0.155	S	C	.	.	H	α-helix	trans	-53.1	-53.7	-178.3	-177.3	158.9	168.1	163.1	0	114	I308 Y309 E310 L324 F326 L342	K306-I308 VanDerWaalsContact C-N 3.33Å; K306-I308 PolarHBondContact O-N 3.11Å; K306-Y309 PolarHBondContact O-N 2.84Å; K306-E310 WeakPolarHBondContact CE-OE1 3.44Å; K306-E310 HydrophobicContact CG-CG 4.13Å; K306-E310 WeakPolarHBondContact CG-OE1 3.49Å; K306-E310 IonicContact NZ-OE1 3.24Å; K306-E310 PolarHBondContact O-N 3.14Å; K306-L324 HydrophobicContact CD-CD2 4.42Å; K306-L324 HydrophobicContact CG-CD2 3.88Å; K306-L324 PolarHBondContact NZ-O 3.36Å; K306-F326 HydrophobicContact CB-CE1 4.17Å; K306-F326 HydrophobicContact CB-CZ 4.36Å; K306-F326 HydrophobicContact CD-CZ 4.32Å; K306-L342 HydrophobicContact CG-CD2 4.44Å
307	G	92.8	Very high	96.3	Very high	36 Å²	36	31.4 Å²	31.4	37%	0.371	16%	0.156	S	C	.	.	H	α-helix	trans	-60.7	-29	-173.6	0	0	0	0	0	116.7	G305 E310 I311	G305-G307 PolarHBondContact O-N 3.41Å; G307-E310 WeakPolarHBondContact CA-OE2 3.5Å; G307-I311 WeakPolarHBondContact O-CG1 3.42Å; G307-I311 PolarHBondContact O-N 3.27Å
308	I	94.2	Very high	96	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-75.3	-33.9	174	52	166	0	0	0	112	I211 I213 M266 I282 F303 G305 K306 I311 F312	I211-I308 HydrophobicContact CG2-CD1 4.27Å; I213-I308 HydrophobicContact CB-CG2 4.03Å; I213-I308 HydrophobicContact CG1-CD1 3.99Å; I213-I308 HydrophobicContact CG1-CG1 4.19Å; I213-I308 HydrophobicContact CG1-CG2 3.83Å; I213-I308 HydrophobicContact CG2-CG2 3.67Å; M266-I308 HydrophobicContact CB-CB 4.38Å; M266-I308 HydrophobicContact CB-CD1 4.44Å; M266-I308 HydrophobicContact CB-CG2 4.11Å; M266-I308 HydrophobicContact CE-CB 3.99Å; M266-I308 HydrophobicContact CG-CB 4.33Å; M266-I308 HydrophobicContact CG-CG2 4.17Å; I282-I308 HydrophobicContact CG2-CG2 4.27Å; F303-I308 HydrophobicContact CD1-CD1 4.35Å; G305-I308 WeakPolarHBondContact O-CG1 3.39Å; K306-I308 VanDerWaalsContact C-N 3.33Å; K306-I308 PolarHBondContact O-N 3.11Å; I308-I311 PolarHBondContact O-N 3.06Å; I308-F312 VanDerWaalsContact O-CB 3.3Å; I308-F312 WeakPolarHBondContact O-CB 3.28Å; I308-F312 PolarHBondContact O-N 3.33Å
309	Y	96.1	Very high	95.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-74.9	-31.8	175.8	-171	-101.9	0	0	0	112.1	F303 K306 I311 F312 C313 L324 Q329 C340 L342	F303-Y309 HydrophobicContact CB-CD2 4.38Å; F303-Y309 AromaticContact CD1-CD2 3.86Å; F303-Y309 HydrophobicContact CD1-CD2 3.86Å; F303-Y309 AromaticContact CD2-CD2 3.49Å; F303-Y309 HydrophobicContact CD2-CD2 3.49Å; F303-Y309 VanDerWaalsContact CD2-CD2 3.49Å; F303-Y309 AromaticContact CD2-CE2 3.95Å; F303-Y309 HydrophobicContact CD2-CE2 3.95Å; F303-Y309 HydrophobicContact CD2-CG 4.42Å; F303-Y309 AromaticContact CE1-CD2 3.93Å; F303-Y309 HydrophobicContact CE1-CD2 3.93Å; F303-Y309 AromaticContact CE2-CD2 3.58Å; F303-Y309 HydrophobicContact CE2-CD2 3.58Å; F303-Y309 AromaticContact CE2-CE2 3.73Å; F303-Y309 HydrophobicContact CE2-CE2 3.73Å; F303-Y309 AromaticContact CG-CD2 3.64Å; F303-Y309 HydrophobicContact CG-CD2 3.64Å; F303-Y309 HydrophobicContact CG-CG 4.28Å; F303-Y309 AromaticContact CZ-CD2 3.8Å; F303-Y309 HydrophobicContact CZ-CD2 3.8Å; F303-Y309 HydrophobicContact CZ-CE2 4.11Å; K306-Y309 PolarHBondContact O-N 2.84Å; Y309-I311 VanDerWaalsContact C-N 3.3Å; Y309-I311 PolarHBondContact O-N 2.75Å; Y309-F312 HydrophobicContact CD2-CD1 4.42Å; Y309-F312 HydrophobicContact CE2-CD1 4.33Å; Y309-F312 PolarHBondContact O-N 3.31Å; Y309-C313 HydrophobicContact CD1-CB 4.43Å; Y309-C313 HydrophobicContact CE1-CB 4.17Å; Y309-C313 WeakPolarHBondContact O-CB 3.41Å; Y309-C313 PolarHBondContact O-N 2.72Å; Y309-L324 HydrophobicContact CD1-CD1 3.71Å; Y309-L324 HydrophobicContact CD1-CD2 3.86Å; Y309-L324 HydrophobicContact CD1-CG 4.4Å; Y309-L324 HydrophobicContact CE1-CD1 3.74Å; Y309-Q329 HydrophobicContact CE1-CB 4.33Å; Y309-Q329 HydrophobicContact CE1-CG 3.75Å; Y309-Q329 HydrophobicContact CE2-CG 4.5Å; Y309-Q329 VanDerWaalsContact OH-CB 3.3Å; Y309-Q329 WeakPolarHBondContact OH-CB 3.29Å; Y309-C340 HydrophobicContact CE2-CB 3.71Å; Y309-L342 VanDerWaalsContact CB-CD1 3.49Å; Y309-L342 HydrophobicContact CD1-CD1 4.37Å; Y309-L342 HydrophobicContact CD1-CD2 4.06Å; Y309-L342 HydrophobicContact CG-CD1 4.01Å
310	E	94.5	Very high	94.9	Very high	80 Å²	80	36.6 Å²	36.6	37%	0.374	20%	0.198	S	C	.	.	H	α-helix	trans	-58.2	-43	170.7	-69.5	172.7	154.3	0	0	111.7	K306 G307 K314 L324	K306-E310 WeakPolarHBondContact CE-OE1 3.44Å; K306-E310 HydrophobicContact CG-CG 4.13Å; K306-E310 WeakPolarHBondContact CG-OE1 3.49Å; K306-E310 IonicContact NZ-OE1 3.24Å; K306-E310 PolarHBondContact O-N 3.14Å; G307-E310 WeakPolarHBondContact CA-OE2 3.5Å; E310-K314 WeakPolarHBondContact O-CB 3.28Å; E310-K314 PolarHBondContact O-N 3.38Å; E310-L324 HydrophobicContact CB-CD2 4.43Å; E310-L324 HydrophobicContact CG-CD2 3.3Å
311	I	94.7	Very high	93.8	Very high	45 Å²	45	38 Å²	38	23%	0.231	21%	0.21	C	C	.	.	H	α-helix	trans	-73.8	-44.5	178.2	-65.5	167.1	0	0	0	111	I282 R283 G307 I308 Y309 K314 E315	I282-I311 HydrophobicContact CB-CD1 4.03Å; I282-I311 HydrophobicContact CB-CG2 4.22Å; I282-I311 HydrophobicContact CD1-CD1 3.85Å; I282-I311 HydrophobicContact CG2-CB 4.03Å; I282-I311 HydrophobicContact CG2-CD1 3.7Å; I282-I311 HydrophobicContact CG2-CG1 4.47Å; I282-I311 HydrophobicContact CG2-CG2 3.79Å; R283-I311 HydrophobicContact CG-CG2 3.7Å; G307-I311 WeakPolarHBondContact O-CG1 3.42Å; G307-I311 PolarHBondContact O-N 3.27Å; I308-I311 PolarHBondContact O-N 3.06Å; Y309-I311 VanDerWaalsContact C-N 3.3Å; Y309-I311 PolarHBondContact O-N 2.75Å; I311-K314 PolarHBondContact O-N 2.94Å; I311-E315 WeakPolarHBondContact O-CB 3.24Å; I311-E315 PolarHBondContact O-N 3.25Å
312	F	95.9	Very high	92.6	Very high	1 Å²	1	47 Å²	47	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-60.2	-45.9	176.7	-172.6	-93.9	0	0	0	112.3	M266 G286 L289 L293 F303 I308 Y309 K314 E315 I316 F317 I333	M266-F312 HydrophobicContact CE-CB 3.74Å; M266-F312 HydrophobicContact CE-CD2 3.75Å; M266-F312 HydrophobicContact CE-CG 4.06Å; M266-F312 HydrophobicContact SD-CD2 4.16Å; G286-F312 WeakPolarHBondContact O-CE2 3.38Å; L289-F312 HydrophobicContact CB-CE2 4.34Å; L289-F312 HydrophobicContact CD2-CD2 4Å; L289-F312 HydrophobicContact CD2-CE2 3.88Å; L289-F312 HydrophobicContact CG-CE2 4.14Å; L293-F312 HydrophobicContact CD1-CZ 4.13Å; F303-F312 HydrophobicContact CE1-CB 4.32Å; F303-F312 HydrophobicContact CE1-CD1 4.09Å; F303-F312 HydrophobicContact CE1-CD2 4.34Å; F303-F312 AromaticContact CE1-CG 3.99Å; F303-F312 HydrophobicContact CE1-CG 3.99Å; F303-F312 AromaticContact CZ-CD1 3.78Å; F303-F312 HydrophobicContact CZ-CD1 3.78Å; F303-F312 AromaticContact CZ-CE1 3.88Å; F303-F312 HydrophobicContact CZ-CE1 3.88Å; F303-F312 HydrophobicContact CZ-CG 4.14Å; F303-F312 HydrophobicContact CZ-CZ 4.31Å; I308-F312 VanDerWaalsContact O-CB 3.3Å; I308-F312 WeakPolarHBondContact O-CB 3.28Å; I308-F312 PolarHBondContact O-N 3.33Å; Y309-F312 HydrophobicContact CD2-CD1 4.42Å; Y309-F312 HydrophobicContact CE2-CD1 4.33Å; Y309-F312 PolarHBondContact O-N 3.31Å; F312-K314 VanDerWaalsContact C-N 3.34Å; F312-K314 PolarHBondContact O-N 3.01Å; F312-E315 PolarHBondContact O-N 3.25Å; F312-I316 HydrophobicContact CD1-CB 4.49Å; F312-I316 HydrophobicContact CD1-CG1 4.3Å; F312-I316 HydrophobicContact CD2-CG1 3.84Å; F312-I316 HydrophobicContact CE1-CB 4.25Å; F312-I316 HydrophobicContact CE1-CG1 4.13Å; F312-I316 HydrophobicContact CE1-CG2 4.4Å; F312-I316 HydrophobicContact CE2-CG1 3.67Å; F312-I316 HydrophobicContact CG-CG1 4.16Å; F312-I316 HydrophobicContact CZ-CB 4.32Å; F312-I316 HydrophobicContact CZ-CG1 3.82Å; F312-I316 HydrophobicContact CZ-CG2 4.33Å; F312-I316 WeakPolarHBondContact O-CB 3.48Å; F312-I316 WeakPolarHBondContact O-CG1 3.34Å; F312-I316 PolarHBondContact O-N 3.11Å; F312-F317 HydrophobicContact CD1-CE2 4.39Å; F312-F317 HydrophobicContact CE1-CE2 4.31Å; F312-F317 HydrophobicContact CE1-CZ 4.23Å; F312-I333 HydrophobicContact CE1-CD1 3.63Å; F312-I333 HydrophobicContact CZ-CD1 3.75Å
313	C	94.7	Very high	91.7	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-41.5	178.5	-177.4	0	0	0	0	111.7	Y309 F317 G318 V319	Y309-C313 HydrophobicContact CD1-CB 4.43Å; Y309-C313 HydrophobicContact CE1-CB 4.17Å; Y309-C313 WeakPolarHBondContact O-CB 3.41Å; Y309-C313 PolarHBondContact O-N 2.72Å; C313-F317 HydrophobicContact CB-CD2 4.18Å; C313-F317 WeakPolarHBondContact O-CA 3.34Å; C313-F317 WeakPolarHBondContact O-CB 2.9Å; C313-F317 PolarHBondContact O-N 2.76Å; C313-G318 PolarHBondContact O-N 2.73Å; C313-V319 CarbonylContact C-O 3.53Å; C313-V319 PolarHBondContact O-N 3Å
314	K	94.7	Very high	91.2	Very high	122 Å²	122	54.7 Å²	54.7	53%	0.53	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-42.7	174	-167	-159.5	172.6	-162.2	0	112.4	E310 I311 F312 G318 V319	E310-K314 WeakPolarHBondContact O-CB 3.28Å; E310-K314 PolarHBondContact O-N 3.38Å; I311-K314 PolarHBondContact O-N 2.94Å; F312-K314 VanDerWaalsContact C-N 3.34Å; F312-K314 PolarHBondContact O-N 3.01Å; K314-G318 WeakPolarHBondContact O-CA 3.18Å; K314-G318 PolarHBondContact O-N 2.82Å; K314-V319 WeakPolarHBondContact CA-O 3.45Å; K314-V319 PolarHBondContact N-O 3.09Å
315	E	95.6	Very high	91	Very high	40 Å²	40	60.7 Å²	60.7	19%	0.187	32%	0.318	C	S	.	.	H	α-helix	trans	-79.7	-34.3	-172.3	-161.1	69.3	-179.7	0	0	113.2	R283 R287 I311 F312	R283-E315 HydrophobicContact CB-CG 4.11Å; R283-E315 WeakPolarHBondContact CD-OE2 3.04Å; R283-E315 HydrophobicContact CG-CG 4.21Å; R283-E315 IonicContact NH1-OE1 3.17Å; R287-E315 IonicContact CZ-OE1 2.74Å; R287-E315 VanDerWaalsContact CZ-OE1 3.24Å; R287-E315 IonicContact NH1-OE1 3.78Å; R287-E315 PolarHBondContact NH1-OE1 3.46Å; R287-E315 IonicContact NH2-OE1 3.94Å; R287-E315 PolarHBondContact NH2-OE1 3.25Å; I311-E315 WeakPolarHBondContact O-CB 3.24Å; I311-E315 PolarHBondContact O-N 3.25Å; F312-E315 PolarHBondContact O-N 3.25Å
316	I	96.1	Very high	91	Very high	33 Å²	33	63.7 Å²	63.7	17%	0.169	33%	0.33	C	S	.	.	H	α-helix	trans	-100.7	-36.8	-174	-55.1	-49.7	0	0	0	112.5	L290 F312 P334	L290-I316 HydrophobicContact CB-CD1 4.3Å; L290-I316 HydrophobicContact CD1-CG2 4.26Å; L290-I316 HydrophobicContact CD2-CD1 4.12Å; L290-I316 HydrophobicContact CD2-CG2 4.12Å; F312-I316 HydrophobicContact CD1-CB 4.49Å; F312-I316 HydrophobicContact CD1-CG1 4.3Å; F312-I316 HydrophobicContact CD2-CG1 3.84Å; F312-I316 HydrophobicContact CE1-CB 4.25Å; F312-I316 HydrophobicContact CE1-CG1 4.13Å; F312-I316 HydrophobicContact CE1-CG2 4.4Å; F312-I316 HydrophobicContact CE2-CG1 3.67Å; F312-I316 HydrophobicContact CG-CG1 4.16Å; F312-I316 HydrophobicContact CZ-CB 4.32Å; F312-I316 HydrophobicContact CZ-CG1 3.82Å; F312-I316 HydrophobicContact CZ-CG2 4.33Å; F312-I316 WeakPolarHBondContact O-CB 3.48Å; F312-I316 WeakPolarHBondContact O-CG1 3.34Å; F312-I316 PolarHBondContact O-N 3.11Å; I316-P334 HydrophobicContact CG2-CG 4.02Å
317	F	93.6	Very high	91.2	Very high	46 Å²	46	60.8 Å²	60.8	20%	0.202	32%	0.32	C	S	.	.	S	Bend	trans	-101.8	-5.8	178.3	-49.7	-53.1	0	0	0	113.3	F312 C313 V319 Y331 K332 P334	F312-F317 HydrophobicContact CD1-CE2 4.39Å; F312-F317 HydrophobicContact CE1-CE2 4.31Å; F312-F317 HydrophobicContact CE1-CZ 4.23Å; C313-F317 HydrophobicContact CB-CD2 4.18Å; C313-F317 WeakPolarHBondContact O-CA 3.34Å; C313-F317 WeakPolarHBondContact O-CB 2.9Å; C313-F317 PolarHBondContact O-N 2.76Å; F317-V319 HydrophobicContact CB-CG2 4.29Å; F317-V319 PolarHBondContact O-N 3.12Å; F317-Y331 AromaticContact CD2-CD2 3.73Å; F317-Y331 HydrophobicContact CD2-CD2 3.73Å; F317-Y331 HydrophobicContact CD2-CE2 4.49Å; F317-Y331 AromaticContact CD2-CG 3.81Å; F317-Y331 HydrophobicContact CD2-CG 3.81Å; F317-Y331 VanDerWaalsContact CE2-CB 3.48Å; F317-Y331 AromaticContact CE2-CD2 4Å; F317-Y331 HydrophobicContact CE2-CD2 4Å; F317-Y331 AromaticContact CE2-CG 3.95Å; F317-Y331 HydrophobicContact CE2-CG 3.95Å; F317-Y331 HydrophobicContact CG-CD2 4.44Å; F317-Y331 HydrophobicContact CG-CG 4.2Å; F317-Y331 HydrophobicContact CZ-CG 4.4Å; F317-K332 WeakPolarHBondContact CE1-O 3.4Å; F317-K332 WeakPolarHBondContact CZ-O 3.46Å; F317-P334 HydrophobicContact CE1-CG 4.32Å
318	G	92.7	Very high	91.4	Very high	63 Å²	63	63.9 Å²	63.9	65%	0.649	33%	0.328	S	S	*	.			trans	71.9	-3	-173.1	0	0	0	0	0	114.7	C313 K314	C313-G318 PolarHBondContact O-N 2.73Å; K314-G318 WeakPolarHBondContact O-CA 3.18Å; K314-G318 PolarHBondContact O-N 2.82Å
319	V	87.9	Confident	91.6	Very high	51 Å²	51	64.5 Å²	64.5	31%	0.309	33%	0.331	S	S	.	.			trans	-91.7	117.9	-169.7	-179.7	0	0	0	0	111.7	C313 K314 F317 A321	C313-V319 CarbonylContact C-O 3.53Å; C313-V319 PolarHBondContact O-N 3Å; K314-V319 WeakPolarHBondContact CA-O 3.45Å; K314-V319 PolarHBondContact N-O 3.09Å; F317-V319 HydrophobicContact CB-CG2 4.29Å; F317-V319 PolarHBondContact O-N 3.12Å; V319-A321 PolarHBondContact O-N 3.42Å
320	K	86.2	Confident	91.5	Very high	168 Å²	168	69.7 Å²	69.7	73%	0.73	36%	0.364	S	S	*	.			trans	-78	86.2	164.6	-171.2	179.5	-179	-179.8	0	109.6	K322	K320-K322 PolarHBondContact O-N 3.4Å
321	A	75.8	Confident	91.5	Very high	30 Å²	30	69.5 Å²	69.5	25%	0.248	36%	0.361	C	S	.	.			trans	-61.6	97.1	178.7	0	0	0	0	0	111.7	V319 L324	V319-A321 PolarHBondContact O-N 3.42Å; A321-L324 HydrophobicContact CB-CB 4.12Å; A321-L324 HydrophobicContact CB-CD1 4.36Å
322	K	73.3	Confident	91.7	Very high	189 Å²	189	71.8 Å²	71.8	82%	0.822	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-47.2	-177.4	-64.1	-178.4	-178.3	177	0	112.2	K320	K320-K322 PolarHBondContact O-N 3.4Å
323	N	79.9	Confident	91.8	Very high	149 Å²	149	71.8 Å²	71.8	80%	0.797	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	67.8	-178.1	-67.2	-1.4	0	0	0	109.7	E325	N323-E325 PolarHBondContact O-N 2.98Å
324	L	88.3	Confident	91.9	Very high	12 Å²	12	73.9 Å²	73.9	6%	0.063	38%	0.382	C	S	.	.			trans	-75.5	113.6	-178.6	177.1	64.9	0	0	0	111.8	K306 Y309 E310 A321 L342	K306-L324 HydrophobicContact CD-CD2 4.42Å; K306-L324 HydrophobicContact CG-CD2 3.88Å; K306-L324 PolarHBondContact NZ-O 3.36Å; Y309-L324 HydrophobicContact CD1-CD1 3.71Å; Y309-L324 HydrophobicContact CD1-CD2 3.86Å; Y309-L324 HydrophobicContact CD1-CG 4.4Å; Y309-L324 HydrophobicContact CE1-CD1 3.74Å; E310-L324 HydrophobicContact CB-CD2 4.43Å; E310-L324 HydrophobicContact CG-CD2 3.3Å; A321-L324 HydrophobicContact CB-CB 4.12Å; A321-L324 HydrophobicContact CB-CD1 4.36Å; L324-L342 HydrophobicContact CD1-CD2 3.88Å; L324-L342 HydrophobicContact CD2-CD2 3.62Å; L324-L342 HydrophobicContact CG-CD2 3.61Å
325	E	93.7	Very high	92.1	Very high	128 Å²	128	74.1 Å²	74.1	60%	0.598	39%	0.39	S	S	*	.			trans	-92.6	161.4	177.7	-59.8	-166.5	165.6	0	0	112.6	N323 Q329	N323-E325 PolarHBondContact O-N 2.98Å; E325-Q329 PolarHBondContact O-NE2 3.05Å
326	F	96.9	Very high	92.2	Very high	67 Å²	67	73 Å²	73	29%	0.294	39%	0.385	S	S	.	.	S	Bend	trans	-85.4	154.5	175.1	-66.4	-71.7	0	0	0	111.3	K306 L342 P344 F353 F362	K306-F326 HydrophobicContact CB-CE1 4.17Å; K306-F326 HydrophobicContact CB-CZ 4.36Å; K306-F326 HydrophobicContact CD-CZ 4.32Å; F326-L342 HydrophobicContact CD1-CD2 4.3Å; F326-L342 HydrophobicContact CD1-CG 3.96Å; F326-L342 HydrophobicContact CE1-CG 4.38Å; F326-P344 HydrophobicContact CE1-CB 4Å; F326-P344 VanDerWaalsContact CE1-N 3.35Å; F326-P344 HydrophobicContact CZ-CB 4.07Å; F326-F353 HydrophobicContact CD2-CZ 4.36Å; F326-F353 AromaticContact CE2-CE2 3.72Å; F326-F353 HydrophobicContact CE2-CE2 3.72Å; F326-F353 AromaticContact CE2-CZ 3.87Å; F326-F353 HydrophobicContact CE2-CZ 3.87Å; F326-F353 AromaticContact CZ-CE2 3.94Å; F326-F353 HydrophobicContact CZ-CE2 3.94Å; F326-F362 HydrophobicContact CB-CD1 3.76Å; F326-F362 HydrophobicContact CB-CE1 3.43Å; F326-F362 VanDerWaalsContact CB-CE1 3.43Å; F326-F362 HydrophobicContact CB-CZ 4.27Å; F326-F362 HydrophobicContact CD2-CE1 4.23Å; F326-F362 HydrophobicContact CD2-CZ 4.27Å; F326-F362 HydrophobicContact CG-CD1 4.44Å; F326-F362 AromaticContact CG-CE1 3.97Å; F326-F362 HydrophobicContact CG-CE1 3.97Å; F326-F362 HydrophobicContact CG-CZ 4.37Å
327	G	97.8	Very high	92.3	Very high	12 Å²	12	78.1 Å²	78.1	12%	0.124	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	105.4	-159.1	-176	0	0	0	0	0	113	Q329 F341 L342	G327-Q329 PolarHBondContact O-NE2 2.74Å; G327-F341 VanDerWaalsContact C-CD2 3.47Å; G327-F341 WeakPolarHBondContact O-CA 3.24Å; G327-L342 PolarHBondContact N-O 3Å; G327-L342 PolarHBondContact O-N 3.47Å
328	L	97.9	Very high	92.5	Very high	100 Å²	100	76 Å²	76	52%	0.524	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	137.7	176.5	177	62.8	0	0	0	110.6	V339 F341 L369	L328-V339 HydrophobicContact CD1-CB 3.85Å; L328-V339 HydrophobicContact CD1-CG1 4.45Å; L328-V339 HydrophobicContact CD1-CG2 3.97Å; L328-F341 HydrophobicContact CB-CD2 4.3Å; L328-F341 VanDerWaalsContact N-CD2 3.34Å; L328-L369 HydrophobicContact CB-CD2 4.39Å; L328-L369 HydrophobicContact CD1-CD2 3.99Å; L328-L369 HydrophobicContact CD2-CD1 4.27Å
329	Q	97.3	Very high	92.8	Very high	19 Å²	19	74 Å²	74	9%	0.089	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	152.4	-178	-55.7	-65.1	-58.1	0	0	110.5	Y309 E325 G327 Y331 C340 L342	Y309-Q329 HydrophobicContact CE1-CB 4.33Å; Y309-Q329 HydrophobicContact CE1-CG 3.75Å; Y309-Q329 HydrophobicContact CE2-CG 4.5Å; Y309-Q329 VanDerWaalsContact OH-CB 3.3Å; Y309-Q329 WeakPolarHBondContact OH-CB 3.29Å; E325-Q329 PolarHBondContact O-NE2 3.05Å; G327-Q329 PolarHBondContact O-NE2 2.74Å; Q329-Y331 PolarHBondContact O-N 3.35Å; Q329-C340 HydrophobicContact CB-CB 3.92Å; Q329-C340 WeakPolarHBondContact CB-O 3.43Å; Q329-C340 HydrophobicContact CG-CB 4.13Å; Q329-C340 WeakPolarHBondContact CG-O 3.46Å; Q329-C340 PolarHBondContact N-O 3.49Å; Q329-L342 HydrophobicContact CG-CB 4.28Å
330	P	94.8	Very high	93.3	Very high	109 Å²	109	71.5 Å²	71.5	71%	0.708	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	12.3	-177.8	32.2	-37.4	0	0	0	114.3
331	Y	94.2	Very high	93.9	Very high	75 Å²	75	63.7 Å²	63.7	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.5	-175.6	-50.8	-59	0	0	0	111.3	F317 Q329 C340	F317-Y331 AromaticContact CD2-CD2 3.73Å; F317-Y331 HydrophobicContact CD2-CD2 3.73Å; F317-Y331 HydrophobicContact CD2-CE2 4.49Å; F317-Y331 AromaticContact CD2-CG 3.81Å; F317-Y331 HydrophobicContact CD2-CG 3.81Å; F317-Y331 VanDerWaalsContact CE2-CB 3.48Å; F317-Y331 AromaticContact CE2-CD2 4Å; F317-Y331 HydrophobicContact CE2-CD2 4Å; F317-Y331 AromaticContact CE2-CG 3.95Å; F317-Y331 HydrophobicContact CE2-CG 3.95Å; F317-Y331 HydrophobicContact CG-CD2 4.44Å; F317-Y331 HydrophobicContact CG-CG 4.2Å; F317-Y331 HydrophobicContact CZ-CG 4.4Å; Q329-Y331 PolarHBondContact O-N 3.35Å; Y331-C340 WeakPolarHBondContact O-CB 3.23Å; Y331-C340 PolarHBondContact O-N 3.27Å; Y331-C340 PolarHBondContact O-SG 2.93Å
332	K	97.8	Very high	95	Very high	94 Å²	94	62.3 Å²	62.3	41%	0.409	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	157.6	163.5	-73.6	172.5	168.7	179.1	0	109.8	F317 E337 T338 V339	F317-K332 WeakPolarHBondContact CE1-O 3.4Å; F317-K332 WeakPolarHBondContact CZ-O 3.46Å; K332-E337 IonicContact NZ-OE1 2.84Å; K332-E337 PolarHBondContact NZ-OE1 3.18Å; K332-E337 IonicContact NZ-OE2 2.75Å; K332-E337 PolarHBondContact NZ-OE2 3.27Å; K332-T338 CarbonylContact C-O 3.49Å; K332-T338 VanDerWaalsContact CA-O 3.22Å; K332-T338 WeakPolarHBondContact CA-O 3.35Å; K332-V339 HydrophobicContact CG-CG1 4.17Å
333	I	98.4	Very high	96.2	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-68.9	133.7	170.5	-55.5	-61.6	0	0	0	109.1	L290 L293 Q294 A301 F312 T336 T338 C340	L290-I333 HydrophobicContact CD1-CG2 3.5Å; L293-I333 HydrophobicContact CB-CG1 4.36Å; L293-I333 HydrophobicContact CB-CG2 3.88Å; L293-I333 HydrophobicContact CD1-CD1 3.71Å; L293-I333 HydrophobicContact CD1-CG1 4.01Å; Q294-I333 HydrophobicContact CG-CG2 4.38Å; A301-I333 HydrophobicContact CB-CG1 4.41Å; F312-I333 HydrophobicContact CE1-CD1 3.63Å; F312-I333 HydrophobicContact CZ-CD1 3.75Å; I333-T336 WeakPolarHBondContact CB-OG1 2.81Å; I333-T336 HydrophobicContact CG2-CG2 4.49Å; I333-T336 PolarHBondContact O-N 2.8Å; I333-T336 PolarHBondContact O-OG1 3.22Å; I333-T338 HydrophobicContact CB-CG2 4.48Å; I333-T338 HydrophobicContact CG1-CG2 3.77Å; I333-T338 PolarHBondContact N-O 2.98Å; I333-C340 WeakPolarHBondContact CD1-SG 3.39Å
334	P	98	Very high	97.1	Very high	43 Å²	43	46.3 Å²	46.3	28%	0.279	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	143.1	-178.3	-26.1	35.7	0	0	0	112.6	L290 Q294 I316 F317 T336	L290-P334 HydrophobicContact CD1-CG 4.33Å; Q294-P334 WeakPolarHBondContact CG-O 3.42Å; Q294-P334 PolarHBondContact NE2-O 3.08Å; I316-P334 HydrophobicContact CG2-CG 4.02Å; F317-P334 HydrophobicContact CE1-CG 4.32Å; P334-T336 PolarHBondContact O-N 3.17Å
335	D	97.4	Very high	97.5	Very high	128 Å²	128	46.9 Å²	46.9	68%	0.684	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	21	179.6	-42.6	-52.9	0	0	0	114.8	Q294 K297	Q294-D335 PolarHBondContact NE2-OD2 3.14Å; K297-D335 PolarHBondContact NZ-O 2.92Å
336	T	98.4	Very high	97.7	Very high	16 Å²	16	40.9 Å²	40.9	10%	0.098	22%	0.215	C	C	.	.	S	Bend	trans	-145.4	165.3	177.9	77.7	0	0	0	0	112.7	Q294 K297 I333 P334 T338	Q294-T336 HydrophobicContact CG-CG2 4.22Å; K297-T336 HydrophobicContact CD-CG2 3.92Å; K297-T336 HydrophobicContact CG-CG2 3.89Å; I333-T336 WeakPolarHBondContact CB-OG1 2.81Å; I333-T336 HydrophobicContact CG2-CG2 4.49Å; I333-T336 PolarHBondContact O-N 2.8Å; I333-T336 PolarHBondContact O-OG1 3.22Å; P334-T336 PolarHBondContact O-N 3.17Å; T336-T338 VanDerWaalsContact C-N 3.34Å; T336-T338 WeakPolarHBondContact OG1-CB 3.45Å; T336-T338 PolarHBondContact OG1-N 3.48Å; T336-T338 VanDerWaalsContact OG1-N 3.13Å; T336-T338 PolarHBondContact OG1-OG1 3.21Å
337	E	98.2	Very high	97.7	Very high	140 Å²	140	38.8 Å²	38.8	65%	0.654	21%	0.208	S	C	*	.			trans	-88.1	0.6	167.7	-72	-65.8	98.7	0	0	113.6	K332 V339	K332-E337 IonicContact NZ-OE1 2.84Å; K332-E337 PolarHBondContact NZ-OE1 3.18Å; K332-E337 IonicContact NZ-OE2 2.75Å; K332-E337 PolarHBondContact NZ-OE2 3.27Å; E337-V339 PolarHBondContact O-N 2.86Å
338	T	98.8	Very high	97.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-62.2	116.7	-176.1	-60.2	0	0	0	0	111.3	L293 P298 A301 K332 I333 T336	L293-T338 HydrophobicContact CD2-CG2 4.47Å; P298-T338 HydrophobicContact CG-CG2 3.97Å; P298-T338 VanDerWaalsContact O-CB 3.24Å; P298-T338 WeakPolarHBondContact O-CB 3.37Å; P298-T338 WeakPolarHBondContact O-CG2 3.32Å; P298-T338 PolarHBondContact O-OG1 3.28Å; A301-T338 HydrophobicContact CB-CG2 3.73Å; K332-T338 CarbonylContact C-O 3.49Å; K332-T338 VanDerWaalsContact CA-O 3.22Å; K332-T338 WeakPolarHBondContact CA-O 3.35Å; I333-T338 HydrophobicContact CB-CG2 4.48Å; I333-T338 HydrophobicContact CG1-CG2 3.77Å; I333-T338 PolarHBondContact N-O 2.98Å; T336-T338 VanDerWaalsContact C-N 3.34Å; T336-T338 WeakPolarHBondContact OG1-CB 3.45Å; T336-T338 PolarHBondContact OG1-N 3.48Å; T336-T338 VanDerWaalsContact OG1-N 3.13Å; T336-T338 PolarHBondContact OG1-OG1 3.21Å
339	V	98.7	Very high	97.2	Very high	20 Å²	20	43.8 Å²	43.8	12%	0.121	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	145.1	176.9	-59.4	0	0	0	0	111.6	L299 I300 A301 L328 K332 E337 L369 M373	L299-V339 PolarHBondContact O-N 3.28Å; I300-V339 HydrophobicContact CB-CG2 4.4Å; I300-V339 HydrophobicContact CG1-CG2 3.94Å; I300-V339 HydrophobicContact CG2-CG2 4.34Å; A301-V339 PolarHBondContact N-O 3.49Å; L328-V339 HydrophobicContact CD1-CB 3.85Å; L328-V339 HydrophobicContact CD1-CG1 4.45Å; L328-V339 HydrophobicContact CD1-CG2 3.97Å; K332-V339 HydrophobicContact CG-CG1 4.17Å; E337-V339 PolarHBondContact O-N 2.86Å; V339-L369 HydrophobicContact CG2-CD2 4.21Å; V339-M373 HydrophobicContact CG1-CE 4.22Å; V339-M373 HydrophobicContact CG2-CE 4.01Å; V339-M373 HydrophobicContact CG2-SD 3.75Å
340	C	98.6	Very high	97.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	133.6	174	-63.3	0	0	0	0	111.2	F303 Y309 Q329 Y331 I333	F303-C340 HydrophobicContact CE2-CB 4.11Å; Y309-C340 HydrophobicContact CE2-CB 3.71Å; Q329-C340 HydrophobicContact CB-CB 3.92Å; Q329-C340 WeakPolarHBondContact CB-O 3.43Å; Q329-C340 HydrophobicContact CG-CB 4.13Å; Q329-C340 WeakPolarHBondContact CG-O 3.46Å; Q329-C340 PolarHBondContact N-O 3.49Å; Y331-C340 WeakPolarHBondContact O-CB 3.23Å; Y331-C340 PolarHBondContact O-N 3.27Å; Y331-C340 PolarHBondContact O-SG 2.93Å; I333-C340 WeakPolarHBondContact CD1-SG 3.39Å
341	F	98.7	Very high	96.9	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	130.1	174.9	-170.5	-85.4	0	0	0	110.6	I300 A301 A302 F303 G327 L328 M343 F362 K365 L366 L369	I300-F341 HydrophobicContact CG2-CB 3.59Å; I300-F341 HydrophobicContact CG2-CG 4.49Å; A301-F341 PolarHBondContact O-N 3.02Å; A302-F341 CarbonylContact C-O 3.36Å; A302-F341 WeakPolarHBondContact CA-O 3.4Å; F303-F341 PolarHBondContact N-O 2.77Å; G327-F341 VanDerWaalsContact C-CD2 3.47Å; G327-F341 WeakPolarHBondContact O-CA 3.24Å; L328-F341 HydrophobicContact CB-CD2 4.3Å; L328-F341 VanDerWaalsContact N-CD2 3.34Å; F341-M343 HydrophobicContact CD1-CG 3.89Å; F341-M343 HydrophobicContact CE1-CG 3.74Å; F341-M343 HydrophobicContact CE1-SD 4.42Å; F341-F362 WeakPolarHBondContact CE1-O 3.46Å; F341-F362 WeakPolarHBondContact CZ-O 3.28Å; F341-K365 HydrophobicContact CE2-CB 4.45Å; F341-K365 HydrophobicContact CZ-CB 4Å; F341-L366 HydrophobicContact CB-CD1 4.36Å; F341-L366 HydrophobicContact CD1-CB 4.24Å; F341-L366 HydrophobicContact CD1-CD1 3.92Å; F341-L366 HydrophobicContact CE1-CB 3.77Å; F341-L366 HydrophobicContact CE1-CD1 4.32Å; F341-L366 HydrophobicContact CG-CD1 4.03Å; F341-L366 HydrophobicContact CZ-CB 3.97Å; F341-L369 HydrophobicContact CD2-CD2 3.55Å; F341-L369 HydrophobicContact CE2-CD2 4.15Å; F341-L369 HydrophobicContact CG-CD2 4.41Å
342	L	98.4	Very high	96.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.9	-173.5	-172.3	59.8	0	0	0	113.1	F303 K306 Y309 L324 F326 G327 Q329	F303-L342 HydrophobicContact CB-CD1 3.73Å; K306-L342 HydrophobicContact CG-CD2 4.44Å; Y309-L342 VanDerWaalsContact CB-CD1 3.49Å; Y309-L342 HydrophobicContact CD1-CD1 4.37Å; Y309-L342 HydrophobicContact CD1-CD2 4.06Å; Y309-L342 HydrophobicContact CG-CD1 4.01Å; L324-L342 HydrophobicContact CD1-CD2 3.88Å; L324-L342 HydrophobicContact CD2-CD2 3.62Å; L324-L342 HydrophobicContact CG-CD2 3.61Å; F326-L342 HydrophobicContact CD1-CD2 4.3Å; F326-L342 HydrophobicContact CD1-CG 3.96Å; F326-L342 HydrophobicContact CE1-CG 4.38Å; G327-L342 PolarHBondContact N-O 3Å; G327-L342 PolarHBondContact O-N 3.47Å; Q329-L342 HydrophobicContact CG-CB 4.28Å
343	M	98.3	Very high	96.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.			trans	-119.7	153	176.9	-63.5	-173.3	-68.7	0	0	112.5	I210 A302 F303 G305 F341 F362 Y363 L366	I210-M343 HydrophobicContact CD1-CE 4.25Å; A302-M343 HydrophobicContact CB-CE 4.09Å; F303-M343 PolarHBondContact O-N 2.82Å; G305-M343 WeakPolarHBondContact CA-O 3.14Å; G305-M343 PolarHBondContact N-O 3.44Å; G305-M343 VanDerWaalsContact N-O 3.15Å; F341-M343 HydrophobicContact CD1-CG 3.89Å; F341-M343 HydrophobicContact CE1-CG 3.74Å; F341-M343 HydrophobicContact CE1-SD 4.42Å; M343-F362 HydrophobicContact CG-CB 4.15Å; M343-Y363 HydrophobicContact SD-CD2 3.85Å; M343-Y363 HydrophobicContact SD-CE1 4.41Å; M343-Y363 HydrophobicContact SD-CE2 3.63Å; M343-Y363 HydrophobicContact SD-CG 4.3Å; M343-L366 HydrophobicContact CE-CD2 4.17Å; M343-L366 HydrophobicContact SD-CD2 3.91Å
344	P	97.6	Very high	96.4	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.013	22%	0.216	C	C	.	.			trans	-66.1	144.4	164.6	30.6	-36	0	0	0	110	F326 S346 F353 K359 F362	F326-P344 HydrophobicContact CE1-CB 4Å; F326-P344 VanDerWaalsContact CE1-N 3.35Å; F326-P344 HydrophobicContact CZ-CB 4.07Å; P344-S346 PolarHBondContact O-N 3.08Å; P344-F353 HydrophobicContact CB-CD2 3.38Å; P344-F353 HydrophobicContact CB-CE2 3.62Å; P344-F353 HydrophobicContact CB-CG 4.01Å; P344-F353 HydrophobicContact CB-CZ 4.4Å; P344-F353 HydrophobicContact CG-CD2 4.09Å; P344-F353 HydrophobicContact CG-CE2 4.25Å; P344-F353 HydrophobicContact CG-CG 4.31Å; P344-K359 HydrophobicContact CG-CB 4.39Å; P344-K359 HydrophobicContact CG-CG 4.11Å; P344-F362 HydrophobicContact CG-CD2 3.4Å; P344-F362 VanDerWaalsContact CG-CD2 3.4Å; P344-F362 HydrophobicContact CG-CE2 3.6Å; P344-F362 HydrophobicContact CG-CG 4.15Å; P344-F362 HydrophobicContact CG-CZ 4.47Å
345	S	97.9	Very high	96.2	Very high	25 Å²	25	40.3 Å²	40.3	18%	0.175	21%	0.209	C	C	.	.			trans	-62.4	128	-173.2	-170.2	0	0	0	0	112.2	N304 S347 K359	N304-S345 VanDerWaalsContact O-CA 3.29Å; N304-S345 WeakPolarHBondContact O-CA 3.17Å; N304-S345 WeakPolarHBondContact O-CB 3.43Å; N304-S345 PolarHBondContact O-OG 2.89Å; N304-S345 VanDerWaalsContact O-OG 3.11Å; S345-S347 PolarHBondContact O-N 3.36Å; S345-K359 WeakPolarHBondContact O-CE 3.21Å; S345-K359 PolarHBondContact O-NZ 3.12Å
346	S	98.1	Very high	96.1	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.014	18%	0.181	C	C	.	.	S	Bend	trans	-51.3	-25.5	176.1	60.1	0	0	0	0	114.3	N231 H232 N304 P344 K359	N231-S346 PolarHBondContact ND2-OG 3.28Å; N231-S346 VanDerWaalsContact OD1-CB 3.3Å; N231-S346 WeakPolarHBondContact OD1-CB 3.18Å; N231-S346 PolarHBondContact OD1-OG 3.38Å; H232-S346 WeakPolarHBondContact CB-O 3.49Å; H232-S346 PolarHBondContact N-O 3.38Å; N304-S346 PolarHBondContact ND2-OG 3.45Å; N304-S346 VanDerWaalsContact ND2-OG 3.13Å; N304-S346 WeakPolarHBondContact OD1-CB 3.35Å; N304-S346 PolarHBondContact OD1-N 3.37Å; N304-S346 PolarHBondContact OD1-OG 3.34Å; P344-S346 PolarHBondContact O-N 3.08Å; S346-K359 PolarHBondContact O-NZ 2.84Å
347	S	96	Very high	95.9	Very high	22 Å²	22	37.3 Å²	37.3	15%	0.154	19%	0.192	C	C	.	.	S	Bend	trans	-54.1	139.9	178	-176.8	0	0	0	0	113.8	N231 S345 R349 C350 K359	N231-S347 PolarHBondContact ND2-N 3.47Å; S345-S347 PolarHBondContact O-N 3.36Å; S347-R349 PolarHBondContact O-N 3.46Å; S347-R349 VanDerWaalsContact O-N 3.15Å; S347-R349 PolarHBondContact OG-N 2.77Å; S347-C350 WeakPolarHBondContact O-CB 3.38Å; S347-C350 PolarHBondContact O-N 3.03Å; S347-K359 PolarHBondContact O-NZ 3.49Å
348	P	93.2	Very high	95.7	Very high	56 Å²	56	30.7 Å²	30.7	36%	0.364	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-9.4	173.9	30.3	-34.3	0	0	0	112.7	G230 C350	G230-P348 VanDerWaalsContact O-CB 3.28Å; G230-P348 WeakPolarHBondContact O-CB 3.5Å; G230-P348 VanDerWaalsContact O-CD 3.28Å; G230-P348 WeakPolarHBondContact O-CD 3.33Å; G230-P348 VanDerWaalsContact O-CG 3.24Å; G230-P348 WeakPolarHBondContact O-CG 3.43Å; P348-C350 PolarHBondContact O-N 3.45Å
349	R	92.9	Very high	95.7	Very high	161 Å²	161	30.6 Å²	30.6	61%	0.608	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-6.2	174.5	-60.8	-172	-71	-134	1.7	113.5	P272 G273 S347 A351	P272-R349 VanDerWaalsContact O-CZ 3.28Å; P272-R349 PolarHBondContact O-NH1 2.67Å; P272-R349 PolarHBondContact O-NH2 2.82Å; G273-R349 VanDerWaalsContact CA-NH2 3.26Å; S347-R349 PolarHBondContact O-N 3.46Å; S347-R349 VanDerWaalsContact O-N 3.15Å; S347-R349 PolarHBondContact OG-N 2.77Å; R349-A351 PolarHBondContact O-N 3.21Å
350	C	93.8	Very high	95.6	Very high	17 Å²	17	30.5 Å²	30.5	12%	0.115	16%	0.16	C	C	.	.			trans	-73.7	91.8	174.5	-175.2	0	0	0	0	110.1	S347 P348 Q352 F353	S347-C350 WeakPolarHBondContact O-CB 3.38Å; S347-C350 PolarHBondContact O-N 3.03Å; P348-C350 PolarHBondContact O-N 3.45Å; C350-Q352 PolarHBondContact O-N 3.15Å; C350-F353 CarbonylContact O-C 3.35Å; C350-F353 PolarHBondContact O-N 3.13Å; C350-F353 VanDerWaalsContact O-N 3.13Å
351	A	91.8	Very high	95.6	Very high	60 Å²	60	31.7 Å²	31.7	50%	0.496	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-16	-173.9	0	0	0	0	0	114.5	R349 K395	R349-A351 PolarHBondContact O-N 3.21Å; A351-K395 WeakPolarHBondContact O-CE 3.4Å
352	Q	93	Very high	95.6	Very high	122 Å²	122	33 Å²	33	57%	0.57	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-33.5	172.8	-59.8	85.9	-12	0	0	112.3	C350 P354 F389 L391	C350-Q352 PolarHBondContact O-N 3.15Å; Q352-P354 WeakPolarHBondContact O-CD 3.39Å; Q352-F389 WeakPolarHBondContact O-CZ 3.29Å; Q352-L391 VanDerWaalsContact O-CD1 3.29Å; Q352-L391 WeakPolarHBondContact O-CD1 3.25Å
353	F	95.1	Very high	95.6	Very high	25 Å²	25	33 Å²	33	11%	0.11	17%	0.171	C	C	.	.	S	Bend	trans	-127.8	77.2	-176.3	-62.4	-82.5	0	0	0	109.4	F326 P344 C350 R355 D358 K359 F362 F389	F326-F353 HydrophobicContact CD2-CZ 4.36Å; F326-F353 AromaticContact CE2-CE2 3.72Å; F326-F353 HydrophobicContact CE2-CE2 3.72Å; F326-F353 AromaticContact CE2-CZ 3.87Å; F326-F353 HydrophobicContact CE2-CZ 3.87Å; F326-F353 AromaticContact CZ-CE2 3.94Å; F326-F353 HydrophobicContact CZ-CE2 3.94Å; P344-F353 HydrophobicContact CB-CD2 3.38Å; P344-F353 HydrophobicContact CB-CE2 3.62Å; P344-F353 HydrophobicContact CB-CG 4.01Å; P344-F353 HydrophobicContact CB-CZ 4.4Å; P344-F353 HydrophobicContact CG-CD2 4.09Å; P344-F353 HydrophobicContact CG-CE2 4.25Å; P344-F353 HydrophobicContact CG-CG 4.31Å; C350-F353 CarbonylContact O-C 3.35Å; C350-F353 PolarHBondContact O-N 3.13Å; C350-F353 VanDerWaalsContact O-N 3.13Å; F353-R355 PolarHBondContact O-N 3.12Å; F353-D358 HydrophobicContact CB-CB 4.2Å; F353-D358 HydrophobicContact CD1-CB 4.21Å; F353-D358 WeakPolarHBondContact CD1-O 3.47Å; F353-K359 HydrophobicContact CB-CD 4.34Å; F353-K359 HydrophobicContact CB-CG 3.77Å; F353-K359 HydrophobicContact CG-CG 4.48Å; F353-K359 WeakPolarHBondContact O-CE 3.48Å; F353-F362 HydrophobicContact CD1-CE2 4.36Å; F353-F362 AromaticContact CE1-CE2 3.82Å; F353-F362 HydrophobicContact CE1-CE2 3.82Å; F353-F362 HydrophobicContact CE1-CZ 4.06Å; F353-F362 HydrophobicContact CZ-CE2 4.14Å; F353-F362 HydrophobicContact CZ-CZ 4.1Å; F353-F389 AromaticContact CD1-CE1 3.89Å; F353-F389 HydrophobicContact CD1-CE1 3.89Å; F353-F389 AromaticContact CD1-CZ 3.8Å; F353-F389 HydrophobicContact CD1-CZ 3.8Å; F353-F389 HydrophobicContact CE1-CE1 4.05Å; F353-F389 HydrophobicContact CE1-CZ 4.25Å
354	P	91.9	Very high	95.5	Very high	7 Å²	7	34.4 Å²	34.4	5%	0.045	18%	0.179	C	C	.	.			trans	-71.5	-21.2	-164.8	26.8	-35.4	0	0	0	115.3	H232 Q352 D358 L391 A394 K395 L398	H232-P354 PolarHBondContact CE1-O 3.22Å; Q352-P354 WeakPolarHBondContact O-CD 3.39Å; P354-D358 WeakPolarHBondContact CD-OD2 3.29Å; P354-D358 WeakPolarHBondContact CG-OD2 3.17Å; P354-L391 HydrophobicContact CG-CD1 4.24Å; P354-A394 HydrophobicContact CG-CB 3.68Å; P354-K395 HydrophobicContact CB-CG 4.25Å; P354-K395 HydrophobicContact CG-CG 4.22Å; P354-L398 HydrophobicContact CB-CD2 4.21Å
355	R	94.2	Very high	95.6	Very high	37 Å²	37	36.5 Å²	36.5	14%	0.14	19%	0.187	C	C	.	.	S	Bend	trans	-115.9	170.4	-177.3	-50.1	172.5	-65.1	-165	3.8	111.4	H232 F353 Q357 D358 A394 L398	H232-R355 PolarHBondContact CE1-O 3.22Å; H232-R355 VanDerWaalsContact ND1-C 3.25Å; H232-R355 PolarHBondContact ND1-O 3.02Å; F353-R355 PolarHBondContact O-N 3.12Å; R355-Q357 HydrophobicContact CB-CG 3.95Å; R355-D358 WeakPolarHBondContact CA-OD2 3.45Å; R355-D358 WeakPolarHBondContact CB-OD2 3.42Å; R355-D358 WeakPolarHBondContact CG-OD2 3.36Å; R355-D358 IonicContact CZ-OD1 2.75Å; R355-D358 PolarHBondContact N-OD2 3.37Å; R355-D358 IonicContact NE-OD1 3.12Å; R355-D358 PolarHBondContact NE-OD1 3.2Å; R355-D358 IonicContact NE-OD2 3.92Å; R355-D358 PolarHBondContact NE-OD2 3.22Å; R355-D358 IonicContact NH2-OD1 2.83Å; R355-D358 PolarHBondContact NH2-OD1 3.41Å; R355-A394 VanDerWaalsContact CZ-CB 3.45Å; R355-L398 HydrophobicContact CG-CD1 4.44Å
356	A	94.5	Very high	95.6	Very high	12 Å²	12	35.4 Å²	35.4	10%	0.099	18%	0.179	C	C	.	.	S	Bend	trans	-73.1	-37.7	174.5	0	0	0	0	0	112	H232 K235 C236 D358 K359 V360	H232-A356 HydrophobicContact CB-CB 3.97Å; H232-A356 WeakPolarHBondContact ND1-CA 3.3Å; H232-A356 PolarHBondContact ND1-N 3.44Å; K235-A356 HydrophobicContact CD-CB 3.96Å; K235-A356 HydrophobicContact CG-CB 4.13Å; C236-A356 PolarHBondContact SG-O 3.11Å; C236-A356 VanDerWaalsContact SG-O 3.37Å; A356-D358 PolarHBondContact O-N 3.33Å; A356-K359 PolarHBondContact O-N 3.33Å; A356-V360 PolarHBondContact O-N 2.97Å; A356-V360 VanDerWaalsContact O-N 3.14Å
357	Q	93.8	Very high	95.6	Very high	70 Å²	70	38.3 Å²	38.3	33%	0.327	19%	0.192	S	C	.	.	H	α-helix	trans	-60.8	-32.1	174.4	67.7	-165.3	72.4	0	0	112.3	R355 K359 V360	R355-Q357 HydrophobicContact CB-CG 3.95Å; Q357-K359 PolarHBondContact O-N 3.24Å; Q357-K359 VanDerWaalsContact O-N 3.11Å; Q357-V360 WeakPolarHBondContact O-CG1 3.36Å; Q357-V360 PolarHBondContact O-N 2.85Å
358	D	94.9	Very high	95.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.1	-10.6	178	-46.1	-23	0	0	0	112.8	F353 P354 R355 A356 Y387 F389	F353-D358 HydrophobicContact CB-CB 4.2Å; F353-D358 HydrophobicContact CD1-CB 4.21Å; F353-D358 WeakPolarHBondContact CD1-O 3.47Å; P354-D358 WeakPolarHBondContact CD-OD2 3.29Å; P354-D358 WeakPolarHBondContact CG-OD2 3.17Å; R355-D358 WeakPolarHBondContact CA-OD2 3.45Å; R355-D358 WeakPolarHBondContact CB-OD2 3.42Å; R355-D358 WeakPolarHBondContact CG-OD2 3.36Å; R355-D358 IonicContact CZ-OD1 2.75Å; R355-D358 PolarHBondContact N-OD2 3.37Å; R355-D358 IonicContact NE-OD1 3.12Å; R355-D358 PolarHBondContact NE-OD1 3.2Å; R355-D358 IonicContact NE-OD2 3.92Å; R355-D358 PolarHBondContact NE-OD2 3.22Å; R355-D358 IonicContact NH2-OD1 2.83Å; R355-D358 PolarHBondContact NH2-OD1 3.41Å; A356-D358 PolarHBondContact O-N 3.33Å; D358-Y387 PolarHBondContact OD1-OH 3.2Å; D358-F389 HydrophobicContact CB-CD1 4.46Å; D358-F389 HydrophobicContact CB-CE1 4.04Å; D358-F389 HydrophobicContact CB-CE2 4.27Å; D358-F389 HydrophobicContact CB-CZ 3.94Å
359	K	98	Very high	95.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-115.8	-16	-178.6	-57.3	-179.6	-165.9	175.9	0	113.6	H232 P344 S345 S346 S347 F353 A356 Q357 H361 F362 Y363	H232-K359 HydrophobicContact CB-CD 4.37Å; H232-K359 WeakPolarHBondContact ND1-CE 3.33Å; H232-K359 PolarHBondContact ND1-NZ 3.47Å; P344-K359 HydrophobicContact CG-CB 4.39Å; P344-K359 HydrophobicContact CG-CG 4.11Å; S345-K359 WeakPolarHBondContact O-CE 3.21Å; S345-K359 PolarHBondContact O-NZ 3.12Å; S346-K359 PolarHBondContact O-NZ 2.84Å; S347-K359 PolarHBondContact O-NZ 3.49Å; F353-K359 HydrophobicContact CB-CD 4.34Å; F353-K359 HydrophobicContact CB-CG 3.77Å; F353-K359 HydrophobicContact CG-CG 4.48Å; F353-K359 WeakPolarHBondContact O-CE 3.48Å; A356-K359 PolarHBondContact O-N 3.33Å; Q357-K359 PolarHBondContact O-N 3.24Å; Q357-K359 VanDerWaalsContact O-N 3.11Å; K359-H361 PolarHBondContact O-N 3.45Å; K359-F362 PolarHBondContact O-N 3.46Å; K359-Y363 WeakPolarHBondContact O-CD2 3.19Å
360	V	97.9	Very high	96	Very high	18 Å²	18	32.8 Å²	32.8	11%	0.109	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-34	-172.7	75.7	0	0	0	0	112.2	L239 A356 Q357 F362 Y363 I364	L239-V360 HydrophobicContact CB-CG2 3.63Å; A356-V360 PolarHBondContact O-N 2.97Å; A356-V360 VanDerWaalsContact O-N 3.14Å; Q357-V360 WeakPolarHBondContact O-CG1 3.36Å; Q357-V360 PolarHBondContact O-N 2.85Å; V360-F362 VanDerWaalsContact C-N 3.27Å; V360-F362 PolarHBondContact O-N 3.33Å; V360-Y363 CarbonylContact O-C 3.59Å; V360-Y363 WeakPolarHBondContact O-CA 3.37Å; V360-Y363 WeakPolarHBondContact O-CB 3.49Å; V360-Y363 PolarHBondContact O-N 2.85Å; V360-I364 HydrophobicContact CG1-CD1 4.32Å; V360-I364 HydrophobicContact CG2-CD1 4.27Å; V360-I364 HydrophobicContact CG2-CG1 4.4Å; V360-I364 WeakPolarHBondContact O-CG1 3.46Å; V360-I364 PolarHBondContact O-N 3.39Å
361	H	97.4	Very high	96.2	Very high	26 Å²	26	32.9 Å²	32.9	12%	0.12	16%	0.163	C	C	.	.	H	α-helix	trans	-49.4	-45	176	-173.4	67.6	0	0	0	113	K359 Y363 I364 K365 E384 Y387	K359-H361 PolarHBondContact O-N 3.45Å; H361-Y363 VanDerWaalsContact C-N 3.3Å; H361-Y363 PolarHBondContact O-N 3.41Å; H361-I364 WeakPolarHBondContact O-CB 3.17Å; H361-I364 PolarHBondContact O-N 3.29Å; H361-K365 PolarHBondContact O-N 3.21Å; H361-E384 IonicContact CE1-OE1 3.13Å; H361-E384 IonicContact CG-OE1 3.02Å; H361-E384 IonicContact ND1-OE1 2.79Å; H361-E384 PolarHBondContact ND1-OE1 2.82Å; H361-Y387 HydrophobicContact CB-CG 4.3Å
362	F	98.3	Very high	96.3	Very high	30 Å²	30	37.2 Å²	37.2	13%	0.132	17%	0.173	C	C	.	.	H	α-helix	trans	-70.3	-26.9	179.9	-53.2	-75.4	0	0	0	113	F326 F341 M343 P344 F353 K359 V360 L366	F326-F362 HydrophobicContact CB-CD1 3.76Å; F326-F362 HydrophobicContact CB-CE1 3.43Å; F326-F362 VanDerWaalsContact CB-CE1 3.43Å; F326-F362 HydrophobicContact CB-CZ 4.27Å; F326-F362 HydrophobicContact CD2-CE1 4.23Å; F326-F362 HydrophobicContact CD2-CZ 4.27Å; F326-F362 HydrophobicContact CG-CD1 4.44Å; F326-F362 AromaticContact CG-CE1 3.97Å; F326-F362 HydrophobicContact CG-CE1 3.97Å; F326-F362 HydrophobicContact CG-CZ 4.37Å; F341-F362 WeakPolarHBondContact CE1-O 3.46Å; F341-F362 WeakPolarHBondContact CZ-O 3.28Å; M343-F362 HydrophobicContact CG-CB 4.15Å; P344-F362 HydrophobicContact CG-CD2 3.4Å; P344-F362 VanDerWaalsContact CG-CD2 3.4Å; P344-F362 HydrophobicContact CG-CE2 3.6Å; P344-F362 HydrophobicContact CG-CG 4.15Å; P344-F362 HydrophobicContact CG-CZ 4.47Å; F353-F362 HydrophobicContact CD1-CE2 4.36Å; F353-F362 AromaticContact CE1-CE2 3.82Å; F353-F362 HydrophobicContact CE1-CE2 3.82Å; F353-F362 HydrophobicContact CE1-CZ 4.06Å; F353-F362 HydrophobicContact CZ-CE2 4.14Å; F353-F362 HydrophobicContact CZ-CZ 4.1Å; K359-F362 PolarHBondContact O-N 3.46Å; V360-F362 VanDerWaalsContact C-N 3.27Å; V360-F362 PolarHBondContact O-N 3.33Å; F362-L366 VanDerWaalsContact O-CB 3.32Å; F362-L366 WeakPolarHBondContact O-CB 3.13Å; F362-L366 PolarHBondContact O-N 3.28Å
363	Y	98.7	Very high	96.5	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-79.4	-31	174.5	-71.6	-119	0	0	0	110.8	F233 C236 S240 L242 M343 K359 V360 H361 K367	F233-Y363 AromaticContact CD2-CE1 3.86Å; F233-Y363 HydrophobicContact CD2-CE1 3.86Å; F233-Y363 HydrophobicContact CE2-CE1 4.03Å; C236-Y363 HydrophobicContact CB-CD1 3.7Å; C236-Y363 HydrophobicContact CB-CD2 3.75Å; C236-Y363 HydrophobicContact CB-CE1 3.76Å; C236-Y363 HydrophobicContact CB-CE2 3.84Å; C236-Y363 HydrophobicContact CB-CG 3.72Å; S240-Y363 WeakPolarHBondContact OG-CB 3.36Å; L242-Y363 HydrophobicContact CD1-CD1 4.2Å; M343-Y363 HydrophobicContact SD-CD2 3.85Å; M343-Y363 HydrophobicContact SD-CE1 4.41Å; M343-Y363 HydrophobicContact SD-CE2 3.63Å; M343-Y363 HydrophobicContact SD-CG 4.3Å; K359-Y363 WeakPolarHBondContact O-CD2 3.19Å; V360-Y363 CarbonylContact O-C 3.59Å; V360-Y363 WeakPolarHBondContact O-CA 3.37Å; V360-Y363 WeakPolarHBondContact O-CB 3.49Å; V360-Y363 PolarHBondContact O-N 2.85Å; H361-Y363 VanDerWaalsContact C-N 3.3Å; H361-Y363 PolarHBondContact O-N 3.41Å; Y363-K367 PolarHBondContact O-N 2.78Å
364	I	97.6	Very high	96.5	Very high	31 Å²	31	38.5 Å²	38.5	16%	0.159	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-47.3	169.6	-65.1	166.5	0	0	0	109.6	V360 H361 L366 K367 E368	V360-I364 HydrophobicContact CG1-CD1 4.32Å; V360-I364 HydrophobicContact CG2-CD1 4.27Å; V360-I364 HydrophobicContact CG2-CG1 4.4Å; V360-I364 WeakPolarHBondContact O-CG1 3.46Å; V360-I364 PolarHBondContact O-N 3.39Å; H361-I364 WeakPolarHBondContact O-CB 3.17Å; H361-I364 PolarHBondContact O-N 3.29Å; I364-L366 VanDerWaalsContact C-N 3.33Å; I364-L366 PolarHBondContact O-N 3.49Å; I364-K367 WeakPolarHBondContact O-CA 2.96Å; I364-K367 WeakPolarHBondContact O-CB 3.23Å; I364-K367 PolarHBondContact O-N 2.71Å; I364-K367 VanDerWaalsContact O-N 3.09Å; I364-E368 WeakPolarHBondContact CG2-OE1 3.45Å; I364-E368 WeakPolarHBondContact O-CG 3.29Å; I364-E368 PolarHBondContact O-N 3.05Å
365	K	97.8	Very high	96.6	Very high	46 Å²	46	41.2 Å²	41.2	20%	0.2	21%	0.209	C	C	.	.	H	α-helix	trans	-66.6	-30.4	175.9	-64.2	-45.9	-175	-168.4	0	113.9	F341 H361 E368 L369 E384	F341-K365 HydrophobicContact CE2-CB 4.45Å; F341-K365 HydrophobicContact CZ-CB 4Å; H361-K365 PolarHBondContact O-N 3.21Å; K365-E368 WeakPolarHBondContact CD-OE2 3.07Å; K365-E368 WeakPolarHBondContact CE-OE2 3.47Å; K365-E368 IonicContact NZ-OE1 2.73Å; K365-E368 PolarHBondContact NZ-OE1 2.99Å; K365-E368 IonicContact NZ-OE2 3.12Å; K365-E368 PolarHBondContact NZ-OE2 3.29Å; K365-L369 WeakPolarHBondContact O-CB 3.38Å; K365-L369 PolarHBondContact O-N 2.83Å; K365-E384 WeakPolarHBondContact CE-O 3.3Å; K365-E384 PolarHBondContact NZ-O 3.12Å
366	L	98.6	Very high	96.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-65.4	-40.2	169.2	179.7	59	0	0	0	111.8	I208 I210 L242 I300 A302 F341 M343 F362 I364 R370	I208-L366 HydrophobicContact CD1-CD1 4.18Å; I208-L366 HydrophobicContact CD1-CD2 4.17Å; I208-L366 HydrophobicContact CD1-CG 3.89Å; I208-L366 HydrophobicContact CG1-CD1 4.33Å; I208-L366 HydrophobicContact CG2-CD1 4.49Å; I208-L366 HydrophobicContact CG2-CD2 4.21Å; I210-L366 HydrophobicContact CD1-CD2 4.4Å; L242-L366 HydrophobicContact CD1-CD2 4.31Å; I300-L366 HydrophobicContact CB-CD1 4.45Å; I300-L366 HydrophobicContact CD1-CD1 4Å; I300-L366 HydrophobicContact CG2-CD1 3.73Å; A302-L366 HydrophobicContact CB-CD1 4.24Å; A302-L366 HydrophobicContact CB-CD2 4.11Å; F341-L366 HydrophobicContact CB-CD1 4.36Å; F341-L366 HydrophobicContact CD1-CB 4.24Å; F341-L366 HydrophobicContact CD1-CD1 3.92Å; F341-L366 HydrophobicContact CE1-CB 3.77Å; F341-L366 HydrophobicContact CE1-CD1 4.32Å; F341-L366 HydrophobicContact CG-CD1 4.03Å; F341-L366 HydrophobicContact CZ-CB 3.97Å; M343-L366 HydrophobicContact CE-CD2 4.17Å; M343-L366 HydrophobicContact SD-CD2 3.91Å; F362-L366 VanDerWaalsContact O-CB 3.32Å; F362-L366 WeakPolarHBondContact O-CB 3.13Å; F362-L366 PolarHBondContact O-N 3.28Å; I364-L366 VanDerWaalsContact C-N 3.33Å; I364-L366 PolarHBondContact O-N 3.49Å; L366-R370 WeakPolarHBondContact O-CB 3.37Å; L366-R370 PolarHBondContact O-N 3.43Å
367	K	97.8	Very high	95.4	Very high	63 Å²	63	48.7 Å²	48.7	27%	0.274	25%	0.254	S	S	.	.	H	α-helix	trans	-64.1	-49.2	173.7	-175.5	-174.7	177.5	-63.9	0	111.8	S240 G241 L242 Y363 I364 L369 R370 D371	S240-K367 WeakPolarHBondContact O-CD 3.37Å; G241-K367 WeakPolarHBondContact O-CD 3.5Å; G241-K367 WeakPolarHBondContact O-CE 3.48Å; L242-K367 HydrophobicContact CD2-CB 3.66Å; L242-K367 HydrophobicContact CD2-CG 4.01Å; L242-K367 HydrophobicContact CG-CB 3.98Å; L242-K367 HydrophobicContact CG-CG 4.48Å; Y363-K367 PolarHBondContact O-N 2.78Å; I364-K367 WeakPolarHBondContact O-CA 2.96Å; I364-K367 WeakPolarHBondContact O-CB 3.23Å; I364-K367 PolarHBondContact O-N 2.71Å; I364-K367 VanDerWaalsContact O-N 3.09Å; K367-L369 PolarHBondContact O-N 3.23Å; K367-R370 WeakPolarHBondContact O-CB 3.43Å; K367-R370 PolarHBondContact O-N 2.79Å; K367-D371 IonicContact NZ-OD2 3.63Å; K367-D371 PolarHBondContact NZ-OD2 2.79Å; K367-D371 WeakPolarHBondContact O-CB 3.42Å; K367-D371 PolarHBondContact O-N 3.21Å
368	E	96	Very high	94.2	Very high	62 Å²	62	50.7 Å²	50.7	29%	0.29	27%	0.273	S	S	.	.	H	α-helix	trans	-56.9	-47.4	178.1	-72.5	173.7	-151.3	0	0	111.5	I364 K365 R370 D371 Q372	I364-E368 WeakPolarHBondContact CG2-OE1 3.45Å; I364-E368 WeakPolarHBondContact O-CG 3.29Å; I364-E368 PolarHBondContact O-N 3.05Å; K365-E368 WeakPolarHBondContact CD-OE2 3.07Å; K365-E368 WeakPolarHBondContact CE-OE2 3.47Å; K365-E368 IonicContact NZ-OE1 2.73Å; K365-E368 PolarHBondContact NZ-OE1 2.99Å; K365-E368 IonicContact NZ-OE2 3.12Å; K365-E368 PolarHBondContact NZ-OE2 3.29Å; E368-R370 PolarHBondContact O-N 3.47Å; E368-D371 PolarHBondContact O-N 3.25Å; E368-Q372 VanDerWaalsContact O-CB 3.29Å; E368-Q372 WeakPolarHBondContact O-CB 3.43Å; E368-Q372 PolarHBondContact O-N 2.9Å
369	L	97.6	Very high	92.9	Very high	18 Å²	18	58.7 Å²	58.7	9%	0.094	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-44.6	175.9	176.1	63.1	0	0	0	111.9	I300 L328 V339 F341 K365 K367 Q372 M373	I300-L369 HydrophobicContact CD1-CB 4.35Å; I300-L369 HydrophobicContact CD1-CD2 3.9Å; I300-L369 HydrophobicContact CD1-CG 3.82Å; I300-L369 HydrophobicContact CG1-CD2 4.32Å; I300-L369 HydrophobicContact CG2-CD2 4.48Å; L328-L369 HydrophobicContact CB-CD2 4.39Å; L328-L369 HydrophobicContact CD1-CD2 3.99Å; L328-L369 HydrophobicContact CD2-CD1 4.27Å; V339-L369 HydrophobicContact CG2-CD2 4.21Å; F341-L369 HydrophobicContact CD2-CD2 3.55Å; F341-L369 HydrophobicContact CE2-CD2 4.15Å; F341-L369 HydrophobicContact CG-CD2 4.41Å; K365-L369 WeakPolarHBondContact O-CB 3.38Å; K365-L369 PolarHBondContact O-N 2.83Å; K367-L369 PolarHBondContact O-N 3.23Å; L369-Q372 PolarHBondContact O-N 3.24Å; L369-M373 HydrophobicContact CD1-CG 4.11Å; L369-M373 HydrophobicContact CD1-SD 3.93Å; L369-M373 HydrophobicContact CG-SD 4.04Å; L369-M373 WeakPolarHBondContact O-CB 3.35Å; L369-M373 VanDerWaalsContact O-CG 3.3Å; L369-M373 WeakPolarHBondContact O-CG 3.38Å; L369-M373 PolarHBondContact O-N 2.91Å
370	R	98.1	Very high	91.1	Very high	44 Å²	44	61.3 Å²	61.3	17%	0.166	34%	0.343	C	S	.	.	H	α-helix	trans	-59.5	-54.3	176.9	-167.8	-70.4	-60.8	-101.1	-1.4	110.3	D207 I208 I300 L366 K367 E368 Q372 M373 K374	D207-R370 HydrophobicContact CB-CG 3.78Å; D207-R370 WeakPolarHBondContact OD2-CD 3.19Å; D207-R370 IonicContact OD2-CZ 3.82Å; D207-R370 IonicContact OD2-NE 3.77Å; D207-R370 IonicContact OD2-NH1 2.9Å; D207-R370 PolarHBondContact OD2-NH1 3.42Å; I208-R370 HydrophobicContact CD1-CB 4.37Å; I208-R370 HydrophobicContact CD1-CG 4.18Å; I208-R370 HydrophobicContact CG1-CG 4.21Å; I300-R370 HydrophobicContact CD1-CB 3.9Å; I300-R370 HydrophobicContact CD1-CG 4.43Å; L366-R370 WeakPolarHBondContact O-CB 3.37Å; L366-R370 PolarHBondContact O-N 3.43Å; K367-R370 WeakPolarHBondContact O-CB 3.43Å; K367-R370 PolarHBondContact O-N 2.79Å; E368-R370 PolarHBondContact O-N 3.47Å; R370-Q372 VanDerWaalsContact C-N 3.3Å; R370-Q372 PolarHBondContact O-N 3.08Å; R370-M373 PolarHBondContact O-N 2.88Å; R370-M373 VanDerWaalsContact O-N 3.13Å; R370-K374 VanDerWaalsContact O-CG 3.32Å; R370-K374 WeakPolarHBondContact O-CG 3.15Å; R370-K374 PolarHBondContact O-N 3.32Å
371	D	96.3	Very high	89.6	Confident	18 Å²	18	70.4 Å²	70.4	10%	0.096	38%	0.384	C	S	.	.	H	α-helix	trans	-58.5	-43.8	-177.4	-66.3	-9	0	0	0	110.8	K367 E368 K374 G375 L376	K367-D371 IonicContact NZ-OD2 3.63Å; K367-D371 PolarHBondContact NZ-OD2 2.79Å; K367-D371 WeakPolarHBondContact O-CB 3.42Å; K367-D371 PolarHBondContact O-N 3.21Å; E368-D371 PolarHBondContact O-N 3.25Å; D371-K374 CarbonylContact O-C 3.52Å; D371-K374 PolarHBondContact O-N 3.1Å; D371-G375 PolarHBondContact O-N 3.37Å; D371-L376 HydrophobicContact CB-CB 4.08Å; D371-L376 HydrophobicContact CB-CD1 4.49Å; D371-L376 PolarHBondContact O-N 3.28Å
372	Q	95.7	Very high	88.2	Confident	151 Å²	151	75.4 Å²	75.4	71%	0.706	42%	0.416	S	S	*	.	H	α-helix	trans	-57.9	-49.4	172.5	-178	-175.8	-6.2	0	0	112.4	E368 L369 R370 K374 G375	E368-Q372 VanDerWaalsContact O-CB 3.29Å; E368-Q372 WeakPolarHBondContact O-CB 3.43Å; E368-Q372 PolarHBondContact O-N 2.9Å; L369-Q372 PolarHBondContact O-N 3.24Å; R370-Q372 VanDerWaalsContact C-N 3.3Å; R370-Q372 PolarHBondContact O-N 3.08Å; Q372-K374 PolarHBondContact O-N 3.21Å; Q372-G375 PolarHBondContact O-N 3.31Å
373	M	96.4	Very high	87.3	Confident	75 Å²	75	79.4 Å²	79.4	37%	0.369	44%	0.438	S	S	.	.	H	α-helix	trans	-65.6	-21	178.7	-72	-180	74.8	0	0	113.4	L299 I300 V339 L369 R370	L299-M373 HydrophobicContact CB-CE 4.11Å; I300-M373 HydrophobicContact CD1-SD 4.23Å; I300-M373 HydrophobicContact CG1-SD 3.9Å; V339-M373 HydrophobicContact CG1-CE 4.22Å; V339-M373 HydrophobicContact CG2-CE 4.01Å; V339-M373 HydrophobicContact CG2-SD 3.75Å; L369-M373 HydrophobicContact CD1-CG 4.11Å; L369-M373 HydrophobicContact CD1-SD 3.93Å; L369-M373 HydrophobicContact CG-SD 4.04Å; L369-M373 WeakPolarHBondContact O-CB 3.35Å; L369-M373 VanDerWaalsContact O-CG 3.3Å; L369-M373 WeakPolarHBondContact O-CG 3.38Å; L369-M373 PolarHBondContact O-N 2.91Å; R370-M373 PolarHBondContact O-N 2.88Å; R370-M373 VanDerWaalsContact O-N 3.13Å
374	K	96.1	Very high	86.5	Confident	99 Å²	99	80.8 Å²	80.8	43%	0.43	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-0.6	174.3	-62.8	-71.2	-76.3	-148.4	0	113.3	D207 L299 R370 D371 Q372 L376	D207-K374 WeakPolarHBondContact OD1-CD 3.45Å; D207-K374 WeakPolarHBondContact OD1-CE 3.33Å; D207-K374 IonicContact OD1-NZ 2.7Å; D207-K374 PolarHBondContact OD1-NZ 3.41Å; D207-K374 IonicContact OD2-NZ 3.8Å; L299-K374 HydrophobicContact CD1-CD 3.58Å; L299-K374 HydrophobicContact CD1-CG 4.36Å; R370-K374 VanDerWaalsContact O-CG 3.32Å; R370-K374 WeakPolarHBondContact O-CG 3.15Å; R370-K374 PolarHBondContact O-N 3.32Å; D371-K374 CarbonylContact O-C 3.52Å; D371-K374 PolarHBondContact O-N 3.1Å; Q372-K374 PolarHBondContact O-N 3.21Å; K374-L376 HydrophobicContact CB-CD1 4.08Å; K374-L376 HydrophobicContact CB-CG 3.85Å; K374-L376 PolarHBondContact O-N 3.02Å
375	G	93.3	Very high	85.6	Confident	65 Å²	65	84.8 Å²	84.8	67%	0.67	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	17	-174.4	0	0	0	0	0	114.3	D371 Q372 T377	D371-G375 PolarHBondContact O-N 3.37Å; Q372-G375 PolarHBondContact O-N 3.31Å; G375-T377 PolarHBondContact O-N 3.02Å
376	L	88.8	Confident	84.8	Confident	87 Å²	87	88.1 Å²	88.1	46%	0.455	48%	0.482	S	S	.	.			trans	-77.1	123	179.4	-61.7	176.5	0	0	0	109.9	D371 K374	D371-L376 HydrophobicContact CB-CB 4.08Å; D371-L376 HydrophobicContact CB-CD1 4.49Å; D371-L376 PolarHBondContact O-N 3.28Å; K374-L376 HydrophobicContact CB-CD1 4.08Å; K374-L376 HydrophobicContact CB-CG 3.85Å; K374-L376 PolarHBondContact O-N 3.02Å
377	T	75.1	Confident	84.3	Confident	119 Å²	119	90.4 Å²	90.4	73%	0.73	49%	0.491	S	S	*	.			trans	-64.5	131.1	177.5	-42.1	0	0	0	0	110.7	G375 N379	G375-T377 PolarHBondContact O-N 3.02Å; T377-N379 PolarHBondContact O-N 3.13Å
378	P	68.7	Low	83.5	Confident	111 Å²	111	91.2 Å²	91.2	72%	0.721	50%	0.504	S	S	*	.			trans	-64.9	101.7	174.1	-23.6	35.1	0	0	0	112.1	G380	P378-G380 VanDerWaalsContact C-N 3.28Å; P378-G380 PolarHBondContact O-N 3.11Å
379	N	66	Low	83.1	Confident	169 Å²	169	90.9 Å²	90.9	90%	0.904	50%	0.502	S	S	*	.			trans	-69.9	83.7	166.1	-83	-14.2	0	0	0	109.6	T377	T377-N379 PolarHBondContact O-N 3.13Å
380	G	61.8	Low	82.8	Confident	55 Å²	55	94.6 Å²	94.6	57%	0.567	52%	0.522	S	S	*	.			trans	-171.9	113	179.1	0	0	0	0	0	115.4	P378 V382	P378-G380 VanDerWaalsContact C-N 3.28Å; P378-G380 PolarHBondContact O-N 3.11Å; G380-V382 PolarHBondContact O-N 3.37Å
381	E	65.9	Low	82.2	Confident	208 Å²	208	95.3 Å²	95.3	97%	0.972	53%	0.529	S	S	*	.	S	Bend	trans	-66.4	-12.1	163.6	-57.8	170.3	132.7	0	0	112.5
382	V	67.4	Low	81.6	Confident	131 Å²	131	100.7 Å²	100.7	79%	0.794	55%	0.553	S	S	*	*			trans	-126.7	113	-174.9	-177.9	0	0	0	0	110.1	G380	G380-V382 PolarHBondContact O-N 3.37Å
383	L	80.4	Confident	81	Confident	115 Å²	115	99.1 Å²	99.1	60%	0.602	55%	0.549	S	S	*	.			trans	-106.7	131.2	177	-179.2	65.2	0	0	0	110.7	T385	L383-T385 HydrophobicContact CD2-CG2 4.4Å; L383-T385 HydrophobicContact CG-CG2 4.44Å; L383-T385 PolarHBondContact O-N 2.94Å
384	E	80.7	Confident	80.2	Confident	29 Å²	29	95.6 Å²	95.6	14%	0.136	53%	0.532	C	S	.	.			trans	-83.4	97.4	174.9	-170.2	172.3	106	0	0	110.5	R29 H361 K365	R29-E384 IonicContact CZ-OE2 2.71Å; R29-E384 IonicContact NH1-OE2 2.69Å; R29-E384 IonicContact NH2-OE2 3.23Å; R29-E384 PolarHBondContact NH2-OE2 2.95Å; H361-E384 IonicContact CE1-OE1 3.13Å; H361-E384 IonicContact CG-OE1 3.02Å; H361-E384 IonicContact ND1-OE1 2.79Å; H361-E384 PolarHBondContact ND1-OE1 2.82Å; K365-E384 WeakPolarHBondContact CE-O 3.3Å; K365-E384 PolarHBondContact NZ-O 3.12Å
385	T	79.4	Confident	79.4	Confident	114 Å²	114	93.4 Å²	93.4	70%	0.699	52%	0.522	S	S	*	.			trans	-77.9	-46	-174.3	53.6	0	0	0	0	113.6	L383	L383-T385 HydrophobicContact CD2-CG2 4.4Å; L383-T385 HydrophobicContact CG-CG2 4.44Å; L383-T385 PolarHBondContact O-N 2.94Å
386	R	81.1	Confident	78.2	Confident	116 Å²	116	91.8 Å²	91.8	44%	0.438	51%	0.506	S	S	.	.			trans	-143.7	141.8	-177.7	-177.9	175.3	178.4	171.4	0.3	111.1
387	Y	87.7	Confident	77.4	Confident	50 Å²	50	90.5 Å²	90.5	20%	0.196	50%	0.502	C	S	.	.			trans	-114.9	143.5	167.6	-174.1	-100	0	0	0	110.5	Y45 D358 H361 F389	Y45-Y387 PolarHBondContact OH-O 3.22Å; Y45-Y387 VanDerWaalsContact OH-O 3.12Å; D358-Y387 PolarHBondContact OD1-OH 3.2Å; H361-Y387 HydrophobicContact CB-CG 4.3Å; Y387-F389 HydrophobicContact CD1-CD1 4.04Å; Y387-F389 HydrophobicContact CE1-CB 4.23Å; Y387-F389 AromaticContact CE1-CD1 3.45Å; Y387-F389 HydrophobicContact CE1-CD1 3.45Å; Y387-F389 VanDerWaalsContact CE1-CD1 3.45Å; Y387-F389 HydrophobicContact CE1-CE1 4.15Å; Y387-F389 HydrophobicContact CE1-CG 4.14Å
388	S	81.1	Confident	77	Confident	79 Å²	79	87.4 Å²	87.4	55%	0.552	48%	0.48	S	S	*	.			trans	-151.2	157.7	172.9	58.2	0	0	0	0	110.4
389	F	88.3	Confident	77	Confident	55 Å²	55	90.9 Å²	90.9	24%	0.241	48%	0.479	C	S	.	.			trans	-161	150.6	-179.2	64.2	-77.1	0	0	0	111.2	Q352 F353 D358 Y387 L391 A394	Q352-F389 WeakPolarHBondContact O-CZ 3.29Å; F353-F389 AromaticContact CD1-CE1 3.89Å; F353-F389 HydrophobicContact CD1-CE1 3.89Å; F353-F389 AromaticContact CD1-CZ 3.8Å; F353-F389 HydrophobicContact CD1-CZ 3.8Å; F353-F389 HydrophobicContact CE1-CE1 4.05Å; F353-F389 HydrophobicContact CE1-CZ 4.25Å; D358-F389 HydrophobicContact CB-CD1 4.46Å; D358-F389 HydrophobicContact CB-CE1 4.04Å; D358-F389 HydrophobicContact CB-CE2 4.27Å; D358-F389 HydrophobicContact CB-CZ 3.94Å; Y387-F389 HydrophobicContact CD1-CD1 4.04Å; Y387-F389 HydrophobicContact CE1-CB 4.23Å; Y387-F389 AromaticContact CE1-CD1 3.45Å; Y387-F389 HydrophobicContact CE1-CD1 3.45Å; Y387-F389 VanDerWaalsContact CE1-CD1 3.45Å; Y387-F389 HydrophobicContact CE1-CE1 4.15Å; Y387-F389 HydrophobicContact CE1-CG 4.14Å; F389-L391 HydrophobicContact CE2-CD1 3.93Å; F389-A394 HydrophobicContact CD2-CB 3.81Å; F389-A394 HydrophobicContact CE2-CB 4.22Å
390	D	89.9	Confident	77	Confident	96 Å²	96	88.5 Å²	88.5	51%	0.513	46%	0.462	S	S	.	.			trans	-76.1	129.7	166.9	179.8	-88.1	0	0	0	111.1	Q392 L393 A394	D390-Q392 WeakPolarHBondContact OD1-CA 3.45Å; D390-Q392 PolarHBondContact OD1-N 3.42Å; D390-L393 HydrophobicContact CB-CB 4.06Å; D390-L393 WeakPolarHBondContact OD1-CB 3.44Å; D390-L393 PolarHBondContact OD1-N 2.77Å; D390-A394 WeakPolarHBondContact O-CB 3.36Å; D390-A394 PolarHBondContact O-N 2.96Å
391	L	86.3	Confident	77.3	Confident	60 Å²	60	89.2 Å²	89.2	31%	0.314	46%	0.456	S	S	.	.	H	α-helix	trans	-75.5	-31.7	-173.5	-176.6	59	0	0	0	113.3	Q352 P354 F389 K395	Q352-L391 VanDerWaalsContact O-CD1 3.29Å; Q352-L391 WeakPolarHBondContact O-CD1 3.25Å; P354-L391 HydrophobicContact CG-CD1 4.24Å; F389-L391 HydrophobicContact CE2-CD1 3.93Å; L391-K395 HydrophobicContact CD1-CD 4.42Å; L391-K395 HydrophobicContact CG-CD 4.26Å; L391-K395 WeakPolarHBondContact O-CB 3.44Å; L391-K395 WeakPolarHBondContact O-CD 3.32Å; L391-K395 WeakPolarHBondContact O-CG 3.31Å; L391-K395 PolarHBondContact O-N 3.48Å; L391-K395 VanDerWaalsContact O-N 3.11Å
392	Q	84.3	Confident	77	Confident	130 Å²	130	84.6 Å²	84.6	61%	0.607	43%	0.433	S	S	*	.	H	α-helix	trans	-79.3	-42.3	-178.6	-58.2	-63.8	9.1	0	0	110.9	D390 K395 G396	D390-Q392 WeakPolarHBondContact OD1-CA 3.45Å; D390-Q392 PolarHBondContact OD1-N 3.42Å; Q392-K395 CarbonylContact O-C 3.58Å; Q392-K395 PolarHBondContact O-N 3.27Å; Q392-G396 PolarHBondContact O-N 2.96Å
393	L	82.4	Confident	75.9	Confident	119 Å²	119	80 Å²	80	62%	0.623	41%	0.411	S	S	*	.	H	α-helix	trans	-59.1	-47.2	170.6	-177	61	0	0	0	110.6	D390 K395 G396 T397	D390-L393 HydrophobicContact CB-CB 4.06Å; D390-L393 WeakPolarHBondContact OD1-CB 3.44Å; D390-L393 PolarHBondContact OD1-N 2.77Å; L393-K395 VanDerWaalsContact C-N 3.34Å; L393-K395 PolarHBondContact O-N 3.16Å; L393-G396 CarbonylContact O-C 3.56Å; L393-G396 WeakPolarHBondContact O-CA 3.39Å; L393-G396 PolarHBondContact O-N 2.83Å; L393-T397 PolarHBondContact O-N 3.14Å; L393-T397 PolarHBondContact O-OG1 3.5Å
394	A	80	Confident	74.3	Confident	0 Å²	0	79 Å²	79	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-60.5	-40.6	176.8	0	0	0	0	0	112.9	P354 R355 F389 D390 L398	P354-A394 HydrophobicContact CG-CB 3.68Å; R355-A394 VanDerWaalsContact CZ-CB 3.45Å; F389-A394 HydrophobicContact CD2-CB 3.81Å; F389-A394 HydrophobicContact CE2-CB 4.22Å; D390-A394 WeakPolarHBondContact O-CB 3.36Å; D390-A394 PolarHBondContact O-N 2.96Å; A394-L398 WeakPolarHBondContact O-CB 3.34Å; A394-L398 PolarHBondContact O-N 3.13Å
395	K	78.4	Confident	72.7	Confident	53 Å²	53	87 Å²	87	23%	0.23	43%	0.432	C	S	.	.	H	α-helix	trans	-65.8	-35.2	170.7	-73.7	166.1	-176.8	168.4	0	112.1	A351 P354 L391 Q392 L393 R399	A351-K395 WeakPolarHBondContact O-CE 3.4Å; P354-K395 HydrophobicContact CB-CG 4.25Å; P354-K395 HydrophobicContact CG-CG 4.22Å; L391-K395 HydrophobicContact CD1-CD 4.42Å; L391-K395 HydrophobicContact CG-CD 4.26Å; L391-K395 WeakPolarHBondContact O-CB 3.44Å; L391-K395 WeakPolarHBondContact O-CD 3.32Å; L391-K395 WeakPolarHBondContact O-CG 3.31Å; L391-K395 PolarHBondContact O-N 3.48Å; L391-K395 VanDerWaalsContact O-N 3.11Å; Q392-K395 CarbonylContact O-C 3.58Å; Q392-K395 PolarHBondContact O-N 3.27Å; L393-K395 VanDerWaalsContact C-N 3.34Å; L393-K395 PolarHBondContact O-N 3.16Å; K395-R399 WeakPolarHBondContact O-CG 3.43Å; K395-R399 PolarHBondContact O-N 3Å; K395-R399 VanDerWaalsContact O-N 3.14Å
396	G	68.4	Low	71	Confident	32 Å²	32	90.8 Å²	90.8	33%	0.33	44%	0.439	S	S	.	.	H	α-helix	trans	-65.5	-52.3	176.5	0	0	0	0	0	112.5	Q392 L393 L398 R399 H400	Q392-G396 PolarHBondContact O-N 2.96Å; L393-G396 CarbonylContact O-C 3.56Å; L393-G396 WeakPolarHBondContact O-CA 3.39Å; L393-G396 PolarHBondContact O-N 2.83Å; G396-L398 PolarHBondContact O-N 2.82Å; G396-R399 PolarHBondContact O-N 3.39Å; G396-R399 VanDerWaalsContact O-N 3.13Å; G396-H400 PolarHBondContact O-N 3.3Å
397	T	71.4	Confident	69	Low	59 Å²	59	93.5 Å²	93.5	36%	0.362	45%	0.454	S	S	.	.	H	α-helix	trans	-54.3	-43.5	174.8	-41.9	0	0	0	0	111	L393 R399 H400 V401	L393-T397 PolarHBondContact O-N 3.14Å; L393-T397 PolarHBondContact O-OG1 3.5Å; T397-R399 PolarHBondContact O-N 2.78Å; T397-H400 PolarHBondContact O-N 3.11Å; T397-V401 HydrophobicContact CG2-CG2 4.47Å; T397-V401 WeakPolarHBondContact O-CG2 3.45Å; T397-V401 PolarHBondContact O-N 2.73Å
398	L	67.4	Low	66.6	Low	54 Å²	54	93.8 Å²	93.8	28%	0.283	46%	0.462	S	S	.	.	H	α-helix	trans	-60.4	-46.6	178.5	-166.6	76.6	0	0	0	111.9	P354 R355 A394 G396 H400 F402	P354-L398 HydrophobicContact CB-CD2 4.21Å; R355-L398 HydrophobicContact CG-CD1 4.44Å; A394-L398 WeakPolarHBondContact O-CB 3.34Å; A394-L398 PolarHBondContact O-N 3.13Å; G396-L398 PolarHBondContact O-N 2.82Å; L398-H400 PolarHBondContact O-N 3Å; L398-F402 HydrophobicContact CD1-CD2 4.32Å; L398-F402 HydrophobicContact CD1-CE2 3.73Å; L398-F402 HydrophobicContact CD2-CE2 4.32Å; L398-F402 HydrophobicContact CG-CD2 3.97Å; L398-F402 HydrophobicContact CG-CE2 3.75Å; L398-F402 WeakPolarHBondContact O-CD2 3.46Å; L398-F402 PolarHBondContact O-N 2.84Å; L398-F402 VanDerWaalsContact O-N 3.12Å
399	R	69.6	Low	65	Low	185 Å²	185	93.1 Å²	93.1	70%	0.698	46%	0.458	S	S	*	.	H	α-helix	trans	-61.5	-42.3	175.6	-68.9	179.6	-145.2	-153.8	10.2	111.8	K395 G396 T397 F402 G403	K395-R399 WeakPolarHBondContact O-CG 3.43Å; K395-R399 PolarHBondContact O-N 3Å; K395-R399 VanDerWaalsContact O-N 3.14Å; G396-R399 PolarHBondContact O-N 3.39Å; G396-R399 VanDerWaalsContact O-N 3.13Å; T397-R399 PolarHBondContact O-N 2.78Å; R399-F402 PolarHBondContact O-N 3Å; R399-G403 PolarHBondContact O-N 3.39Å
400	H	65.7	Low	63.1	Low	118 Å²	118	96 Å²	96	55%	0.546	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-46.3	-179.5	-176	83.5	0	0	0	111.9	G396 T397 L398 F402 G403 H404	G396-H400 PolarHBondContact O-N 3.3Å; T397-H400 PolarHBondContact O-N 3.11Å; L398-H400 PolarHBondContact O-N 3Å; H400-F402 PolarHBondContact O-N 3.49Å; H400-G403 PolarHBondContact O-N 2.9Å; H400-G403 VanDerWaalsContact O-N 3.12Å; H400-H404 AromaticContact CD2-CD2 3.83Å; H400-H404 AromaticContact CE1-CD2 3.51Å; H400-H404 AromaticContact CE1-NE2 3.31Å; H400-H404 PolarHBondContact CE1-NE2 3.38Å; H400-H404 VanDerWaalsContact CE1-NE2 3.31Å; H400-H404 AromaticContact NE2-CD2 3.28Å; H400-H404 PolarHBondContact NE2-CD2 2.84Å; H400-H404 VanDerWaalsContact NE2-CD2 3.28Å; H400-H404 AromaticContact NE2-NE2 3.41Å; H400-H404 PolarHBondContact NE2-NE2 2.83Å; H400-H404 PolarHBondContact O-N 3.38Å
401	V	66.7	Low	60.9	Low	71 Å²	71	97.8 Å²	97.8	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-61	-43.2	176.2	170.8	0	0	0	0	112	T397 R405	T397-V401 HydrophobicContact CG2-CG2 4.47Å; T397-V401 WeakPolarHBondContact O-CG2 3.45Å; T397-V401 PolarHBondContact O-N 2.73Å; V401-R405 WeakPolarHBondContact O-CG 3.49Å; V401-R405 PolarHBondContact O-N 3.02Å
402	F	59.8	Low	58.8	Low	111 Å²	111	100.7 Å²	100.7	49%	0.487	50%	0.5	S	S	.	.	H	α-helix	trans	-71.8	-28.4	174.4	-74.1	-57.6	0	0	0	113.3	L398 R399 H400 K406	L398-F402 HydrophobicContact CD1-CD2 4.32Å; L398-F402 HydrophobicContact CD1-CE2 3.73Å; L398-F402 HydrophobicContact CD2-CE2 4.32Å; L398-F402 HydrophobicContact CG-CD2 3.97Å; L398-F402 HydrophobicContact CG-CE2 3.75Å; L398-F402 WeakPolarHBondContact O-CD2 3.46Å; L398-F402 PolarHBondContact O-N 2.84Å; L398-F402 VanDerWaalsContact O-N 3.12Å; R399-F402 PolarHBondContact O-N 3Å; H400-F402 PolarHBondContact O-N 3.49Å; F402-K406 PolarHBondContact O-N 2.86Å
403	G	43.9	Very low	56.9	Low	33 Å²	33	100.6 Å²	100.6	34%	0.34	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-49.3	174.5	0	0	0	0	0	112.3	R399 H400 K406 K407	R399-G403 PolarHBondContact O-N 3.39Å; H400-G403 PolarHBondContact O-N 2.9Å; H400-G403 VanDerWaalsContact O-N 3.12Å; G403-K406 PolarHBondContact O-N 3.27Å; G403-K406 VanDerWaalsContact O-N 3.11Å; G403-K407 PolarHBondContact O-N 3.3Å
404	H	47.7	Very low	55.1	Low	95 Å²	95	99 Å²	99	44%	0.44	49%	0.489	S	S	.	.	H	α-helix	trans	-63.6	-40.4	175.1	-86.5	-60.3	0	0	0	112.4	H400 K406 K407 C408	H400-H404 AromaticContact CD2-CD2 3.83Å; H400-H404 AromaticContact CE1-CD2 3.51Å; H400-H404 AromaticContact CE1-NE2 3.31Å; H400-H404 PolarHBondContact CE1-NE2 3.38Å; H400-H404 VanDerWaalsContact CE1-NE2 3.31Å; H400-H404 AromaticContact NE2-CD2 3.28Å; H400-H404 PolarHBondContact NE2-CD2 2.84Å; H400-H404 VanDerWaalsContact NE2-CD2 3.28Å; H400-H404 AromaticContact NE2-NE2 3.41Å; H400-H404 PolarHBondContact NE2-NE2 2.83Å; H400-H404 PolarHBondContact O-N 3.38Å; H404-K406 PolarHBondContact O-N 2.85Å; H404-K407 PolarHBondContact O-N 3.23Å; H404-C408 PolarHBondContact O-N 2.79Å; H404-C408 PolarHBondContact O-SG 3Å; H404-C408 VanDerWaalsContact O-SG 3.37Å
405	R	47.6	Very low	53.3	Low	198 Å²	198	106.9 Å²	106.9	75%	0.747	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-16.6	173	-76.8	-175.7	178	-151.7	-0.9	114.8	V401	V401-R405 WeakPolarHBondContact O-CG 3.49Å; V401-R405 PolarHBondContact O-N 3.02Å
406	K	42.9	Very low	51.7	Low	192 Å²	192	110.9 Å²	110.9	84%	0.835	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-9.7	172.7	-74.9	-171.3	174.1	-171.6	0	114.5	F402 G403 H404	F402-K406 PolarHBondContact O-N 2.86Å; G403-K406 PolarHBondContact O-N 3.27Å; G403-K406 VanDerWaalsContact O-N 3.11Å; H404-K406 PolarHBondContact O-N 2.85Å
407	K	39.7	Very low	50.4	Low	174 Å²	174	114.7 Å²	114.7	76%	0.757	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	-27.6	-174.6	-73.3	-168.5	172.9	-170.4	0	114.4	G403 H404 S409	G403-K407 PolarHBondContact O-N 3.3Å; H404-K407 PolarHBondContact O-N 3.23Å; K407-S409 PolarHBondContact O-N 3.35Å; K407-S409 VanDerWaalsContact O-N 3.1Å
408	C	37.9	Very low	49.4	Very low	55 Å²	55	117.9 Å²	117.9	37%	0.372	56%	0.564	S	S	.	*			trans	-69.4	107.5	178.7	-65	0	0	0	0	110.9	H404	H404-C408 PolarHBondContact O-N 2.79Å; H404-C408 PolarHBondContact O-SG 3Å; H404-C408 VanDerWaalsContact O-SG 3.37Å
409	S	47.4	Very low	48.1	Very low	66 Å²	66	119.9 Å²	119.9	46%	0.462	58%	0.575	S	S	.	*			trans	-65.3	155.9	151.5	69.1	0	0	0	0	109.1	K407 L411 Q412	K407-S409 PolarHBondContact O-N 3.35Å; K407-S409 VanDerWaalsContact O-N 3.1Å; S409-L411 PolarHBondContact O-N 2.98Å; S409-Q412 PolarHBondContact O-N 3.37Å; S409-Q412 VanDerWaalsContact O-N 3.08Å
410	V	46.9	Very low	46.7	Very low	114 Å²	114	117.7 Å²	117.7	69%	0.691	59%	0.588	S	S	*	*	H	α-helix	trans	-58.1	-35.5	-177.9	-179.7	0	0	0	0	111.5	Q412 F413 I414	V410-Q412 PolarHBondContact O-N 3.21Å; V410-F413 PolarHBondContact O-N 3.41Å; V410-I414 HydrophobicContact CG1-CD1 3.97Å; V410-I414 WeakPolarHBondContact O-CG1 3.42Å; V410-I414 PolarHBondContact O-N 2.85Å
411	L	44	Very low	45.8	Very low	134 Å²	134	117.7 Å²	117.7	70%	0.702	59%	0.59	S	S	*	*	H	α-helix	trans	-59.8	-41	175.9	-90.7	66.5	0	0	0	113.2	S409 F413 I414 Y415	S409-L411 PolarHBondContact O-N 2.98Å; L411-F413 VanDerWaalsContact C-N 3.31Å; L411-F413 PolarHBondContact O-N 2.98Å; L411-I414 PolarHBondContact O-N 2.97Å; L411-Y415 WeakPolarHBondContact O-CB 3.44Å; L411-Y415 PolarHBondContact O-N 3.42Å
412	Q	43.1	Very low	44.7	Very low	121 Å²	121	120.1 Å²	120.1	57%	0.565	60%	0.598	S	S	*	*	H	α-helix	trans	-68.3	-30.7	-178.9	-91.7	-179.4	-28.4	0	0	112.9	S409 V410 F416	S409-Q412 PolarHBondContact O-N 3.37Å; S409-Q412 VanDerWaalsContact O-N 3.08Å; V410-Q412 PolarHBondContact O-N 3.21Å; Q412-F416 PolarHBondContact O-N 3.12Å
413	F	43	Very low	43.8	Very low	128 Å²	128	120.6 Å²	120.6	56%	0.561	60%	0.604	S	S	*	*	H	α-helix	trans	-73.8	-37.2	175.7	-161.1	-103.9	0	0	0	111.6	V410 L411 L417	V410-F413 PolarHBondContact O-N 3.41Å; L411-F413 VanDerWaalsContact C-N 3.31Å; L411-F413 PolarHBondContact O-N 2.98Å; F413-L417 HydrophobicContact CD1-CD1 3.81Å; F413-L417 HydrophobicContact CE1-CD1 3.63Å; F413-L417 HydrophobicContact CE1-CG 4.49Å; F413-L417 HydrophobicContact CZ-CD1 4.45Å; F413-L417 PolarHBondContact O-N 3.31Å
414	I	46	Very low	43.8	Very low	86 Å²	86	125.8 Å²	125.8	44%	0.441	62%	0.62	S	S	.	*	H	α-helix	trans	-65.2	-43.5	172.6	-66.9	168.8	0	0	0	110.8	V410 L411 F416 L417 I418	V410-I414 HydrophobicContact CG1-CD1 3.97Å; V410-I414 WeakPolarHBondContact O-CG1 3.42Å; V410-I414 PolarHBondContact O-N 2.85Å; L411-I414 PolarHBondContact O-N 2.97Å; I414-F416 VanDerWaalsContact C-N 3.32Å; I414-F416 PolarHBondContact O-N 3.14Å; I414-L417 PolarHBondContact O-N 3.48Å; I414-I418 HydrophobicContact CG2-CD1 3.65Å; I414-I418 WeakPolarHBondContact O-CG1 3.44Å; I414-I418 PolarHBondContact O-N 3.26Å
415	Y	41.7	Very low	43.6	Very low	165 Å²	165	127.7 Å²	127.7	65%	0.647	63%	0.631	S	S	*	*	H	α-helix	trans	-60.9	-39.9	179.6	-163.1	-83.2	0	0	0	112.3	L411 I418 N419	L411-Y415 WeakPolarHBondContact O-CB 3.44Å; L411-Y415 PolarHBondContact O-N 3.42Å; Y415-I418 PolarHBondContact O-N 3.03Å; Y415-N419 PolarHBondContact O-N 3.4Å; Y415-N419 PolarHBondContact O-ND2 3.07Å
416	F	43.8	Very low	43.3	Very low	137 Å²	137	123 Å²	123	60%	0.601	62%	0.623	S	S	*	*	H	α-helix	trans	-65.8	-42.8	176.2	-166.3	-95.8	0	0	0	112	Q412 I414 I418 N419 S420	Q412-F416 PolarHBondContact O-N 3.12Å; I414-F416 VanDerWaalsContact C-N 3.32Å; I414-F416 PolarHBondContact O-N 3.14Å; F416-I418 PolarHBondContact O-N 3.41Å; F416-N419 PolarHBondContact O-N 2.96Å; F416-S420 PolarHBondContact O-N 2.91Å
417	L	41.7	Very low	43.3	Very low	113 Å²	113	118.1 Å²	118.1	59%	0.592	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-5.1	178.3	-74.3	171.6	0	0	0	115.3	F413 I414	F413-L417 HydrophobicContact CD1-CD1 3.81Å; F413-L417 HydrophobicContact CE1-CD1 3.63Å; F413-L417 HydrophobicContact CE1-CG 4.49Å; F413-L417 HydrophobicContact CZ-CD1 4.45Å; F413-L417 PolarHBondContact O-N 3.31Å; I414-L417 PolarHBondContact O-N 3.48Å
418	I	51.7	Low	43.6	Very low	125 Å²	125	113.8 Å²	113.8	64%	0.641	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-15.3	175.4	-69.4	171.6	0	0	0	111.4	I414 Y415 F416	I414-I418 HydrophobicContact CG2-CD1 3.65Å; I414-I418 WeakPolarHBondContact O-CG1 3.44Å; I414-I418 PolarHBondContact O-N 3.26Å; Y415-I418 PolarHBondContact O-N 3.03Å; F416-I418 PolarHBondContact O-N 3.41Å
419	N	39.8	Very low	44.1	Very low	97 Å²	97	118.7 Å²	118.7	52%	0.519	62%	0.616	S	S	.	*			trans	-125.2	30.9	-172.7	-64.1	-91	0	0	0	112.1	Y415 F416	Y415-N419 PolarHBondContact O-N 3.4Å; Y415-N419 PolarHBondContact O-ND2 3.07Å; F416-N419 PolarHBondContact O-N 2.96Å
420	S	40.3	Very low	43.8	Very low	138 Å²	138	123.5 Å²	123.5	97%	0.965	63%	0.63	S	S	*	*			trans	-157.3	0	176.8	-68.8	0	0	0	0	110.5	F416	F416-S420 PolarHBondContact O-N 2.91Å

Retrieved 420 of 420 residues in 103.8 ms (Link to these results)

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