A0A087X827_POEFO Loading...

DNA-directed primase/polymerase protein

AlphaFold DB , UniProt , Accession A0A087X827, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 525 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	51.5	Low	73	Confident	220 Å²	220	136.9 Å²	136.9	100%	1.084	65%	0.647	S	S	*	*				0	-36.7	0	-75.7	-170.9	-95.6	0	0	113.8	R3 W4	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.03Å; M1-W4 PolarHBondContact O-N 2.67Å
2	S	58.1	Low	74	Confident	92 Å²	92	134.1 Å²	134.1	64%	0.643	63%	0.634	S	S	*	*	H	α-helix	trans	-55.5	-39.4	-178.8	-150.6	0	0	0	0	115.3	W4 G5 E6	S2-W4 VanDerWaalsContact C-N 3.27Å; S2-W4 PolarHBondContact O-N 3.34Å; S2-G5 PolarHBondContact O-N 2.85Å; S2-E6 PolarHBondContact O-N 2.81Å; S2-E6 VanDerWaalsContact O-N 3.16Å
3	R	61.1	Low	74.4	Confident	207 Å²	207	136.6 Å²	136.6	78%	0.781	63%	0.633	S	S	*	*	H	α-helix	trans	-65.8	-25	-177.5	-133.5	175.7	-175.8	-175.3	0.7	114.6	M1 R7	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.03Å; R3-R7 PolarHBondContact O-N 2.99Å
4	W	67.9	Low	74	Confident	188 Å²	188	132.6 Å²	132.6	71%	0.712	62%	0.618	S	S	*	*	H	α-helix	trans	-80.9	-39.5	176.2	-90.3	95.9	0	0	0	111.5	M1 S2 E6 R7 L8	M1-W4 PolarHBondContact O-N 2.67Å; S2-W4 VanDerWaalsContact C-N 3.27Å; S2-W4 PolarHBondContact O-N 3.34Å; W4-E6 VanDerWaalsContact C-N 3.34Å; W4-E6 PolarHBondContact O-N 3.29Å; W4-R7 PolarHBondContact O-N 3.38Å; W4-L8 PolarHBondContact O-N 3.26Å
5	G	79.3	Confident	74	Confident	39 Å²	39	127.1 Å²	127.1	40%	0.402	60%	0.604	S	S	.	*	H	α-helix	trans	-63	-39.3	175	0	0	0	0	0	112.7	S2 L8 K9	S2-G5 PolarHBondContact O-N 2.85Å; G5-L8 PolarHBondContact O-N 3.47Å; G5-K9 WeakPolarHBondContact O-CG 3.43Å; G5-K9 PolarHBondContact O-N 3.04Å
6	E	80.7	Confident	73.9	Confident	121 Å²	121	126.3 Å²	126.3	57%	0.565	60%	0.6	S	S	*	*	H	α-helix	trans	-67	-39.3	174.5	-74.7	170.5	-168.3	0	0	112.9	S2 W4 K10	S2-E6 PolarHBondContact O-N 2.81Å; S2-E6 VanDerWaalsContact O-N 3.16Å; W4-E6 VanDerWaalsContact C-N 3.34Å; W4-E6 PolarHBondContact O-N 3.29Å; E6-K10 WeakPolarHBondContact O-CB 3.47Å; E6-K10 PolarHBondContact O-N 3.37Å
7	R	73.9	Confident	73.6	Confident	171 Å²	171	121.9 Å²	121.9	65%	0.645	59%	0.586	S	S	*	*	H	α-helix	trans	-63.5	-43.5	173.4	-89	-177.7	163.2	-175	-5	111.6	R3 W4 K10 V11	R3-R7 PolarHBondContact O-N 2.99Å; W4-R7 PolarHBondContact O-N 3.38Å; R7-K10 PolarHBondContact O-N 3.45Å; R7-V11 WeakPolarHBondContact O-CG2 3.36Å; R7-V11 PolarHBondContact O-N 2.93Å
8	L	81.9	Confident	73	Confident	102 Å²	102	120.6 Å²	120.6	53%	0.534	58%	0.577	S	S	.	*	H	α-helix	trans	-60.6	-48.6	177.8	-149.2	89.2	0	0	0	110.8	W4 G5 K10 V11 E12	W4-L8 PolarHBondContact O-N 3.26Å; G5-L8 PolarHBondContact O-N 3.47Å; L8-K10 PolarHBondContact O-N 3.33Å; L8-V11 PolarHBondContact O-N 2.75Å; L8-V11 VanDerWaalsContact O-N 3.1Å; L8-E12 WeakPolarHBondContact O-CG 3.46Å; L8-E12 PolarHBondContact O-N 2.85Å
9	K	84.1	Confident	72.7	Confident	138 Å²	138	122.8 Å²	122.8	60%	0.6	59%	0.587	S	S	*	*	H	α-helix	trans	-61.5	-30.5	175.7	-74.8	-178.7	178.4	-176.5	0	113.5	G5 R13	G5-K9 WeakPolarHBondContact O-CG 3.43Å; G5-K9 PolarHBondContact O-N 3.04Å; K9-R13 WeakPolarHBondContact O-CB 3.24Å; K9-R13 WeakPolarHBondContact O-CG 3.13Å; K9-R13 PolarHBondContact O-N 2.91Å; K9-R13 VanDerWaalsContact O-N 3.16Å; K9-R13 PolarHBondContact O-NE 2.8Å
10	K	82	Confident	72.5	Confident	133 Å²	133	124.3 Å²	124.3	58%	0.578	59%	0.593	S	S	*	*	H	α-helix	trans	-74.2	-40.5	175	-168.8	175.8	-179.3	178.5	0	111	E6 R7 L8 L14	E6-K10 WeakPolarHBondContact O-CB 3.47Å; E6-K10 PolarHBondContact O-N 3.37Å; R7-K10 PolarHBondContact O-N 3.45Å; L8-K10 PolarHBondContact O-N 3.33Å; K10-L14 HydrophobicContact CG-CD1 4.29Å; K10-L14 WeakPolarHBondContact O-CB 3.46Å; K10-L14 VanDerWaalsContact O-CG 3.31Å; K10-L14 WeakPolarHBondContact O-CG 3.47Å; K10-L14 PolarHBondContact O-N 2.81Å
11	V	82.9	Confident	71.5	Confident	95 Å²	95	123.3 Å²	123.3	58%	0.576	59%	0.591	S	S	*	*	H	α-helix	trans	-65.8	-42.9	175.2	171.9	0	0	0	0	111.1	R7 L8 L14 A15	R7-V11 WeakPolarHBondContact O-CG2 3.36Å; R7-V11 PolarHBondContact O-N 2.93Å; L8-V11 PolarHBondContact O-N 2.75Å; L8-V11 VanDerWaalsContact O-N 3.1Å; V11-L14 PolarHBondContact O-N 2.73Å; V11-A15 WeakPolarHBondContact O-CB 3.28Å; V11-A15 PolarHBondContact O-N 3.33Å
12	E	84.6	Confident	71.7	Confident	103 Å²	103	116.3 Å²	116.3	48%	0.481	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-43.1	175.9	-74.6	170	168.9	0	0	112	L8 A15 Q16	L8-E12 WeakPolarHBondContact O-CG 3.46Å; L8-E12 PolarHBondContact O-N 2.85Å; E12-A15 PolarHBondContact O-N 2.97Å; E12-Q16 PolarHBondContact O-N 3.08Å
13	R	79.5	Confident	71	Confident	167 Å²	167	118.8 Å²	118.8	63%	0.63	57%	0.568	S	S	*	*	H	α-helix	trans	-63.3	-40.3	173.4	-84	-173.7	-70.9	167.9	-5	112.6	K9 S17	K9-R13 WeakPolarHBondContact O-CB 3.24Å; K9-R13 WeakPolarHBondContact O-CG 3.13Å; K9-R13 PolarHBondContact O-N 2.91Å; K9-R13 VanDerWaalsContact O-N 3.16Å; K9-R13 PolarHBondContact O-NE 2.8Å; R13-S17 VanDerWaalsContact O-CB 3.29Å; R13-S17 WeakPolarHBondContact O-CB 3.23Å; R13-S17 PolarHBondContact O-N 2.69Å
14	L	68.9	Low	70	Confident	80 Å²	80	114.1 Å²	114.1	42%	0.419	56%	0.562	S	S	.	*	H	α-helix	trans	-65.7	-40.9	174.5	-77.5	165.9	0	0	0	111.2	K10 V11 S17 F18	K10-L14 HydrophobicContact CG-CD1 4.29Å; K10-L14 WeakPolarHBondContact O-CB 3.46Å; K10-L14 VanDerWaalsContact O-CG 3.31Å; K10-L14 WeakPolarHBondContact O-CG 3.47Å; K10-L14 PolarHBondContact O-N 2.81Å; V11-L14 PolarHBondContact O-N 2.73Å; L14-S17 CarbonylContact O-C 3.57Å; L14-S17 WeakPolarHBondContact O-CB 3.38Å; L14-S17 PolarHBondContact O-N 2.94Å; L14-F18 HydrophobicContact CB-CD2 4.43Å; L14-F18 HydrophobicContact CB-CE2 4.23Å; L14-F18 HydrophobicContact CD2-CE2 4.45Å; L14-F18 WeakPolarHBondContact O-CB 3.33Å; L14-F18 WeakPolarHBondContact O-CD2 3.47Å; L14-F18 WeakPolarHBondContact O-CG 3.45Å; L14-F18 PolarHBondContact O-N 3.26Å
15	A	73	Confident	68.9	Low	50 Å²	50	110.4 Å²	110.4	41%	0.413	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-42.5	176.6	0	0	0	0	0	112.1	V11 E12 F18 Q19	V11-A15 WeakPolarHBondContact O-CB 3.28Å; V11-A15 PolarHBondContact O-N 3.33Å; E12-A15 PolarHBondContact O-N 2.97Å; A15-F18 PolarHBondContact O-N 3.34Å; A15-Q19 PolarHBondContact O-N 3.27Å
16	Q	72.4	Confident	67.3	Low	115 Å²	115	113.1 Å²	113.1	54%	0.537	57%	0.571	S	S	.	*	H	α-helix	trans	-62.7	-42.7	171.6	-78.5	178.7	-14.9	0	0	111.6	E12 F18 Q19 Q20	E12-Q16 PolarHBondContact O-N 3.08Å; Q16-F18 VanDerWaalsContact C-N 3.3Å; Q16-F18 PolarHBondContact O-N 3Å; Q16-Q19 PolarHBondContact O-N 3.4Å; Q16-Q20 WeakPolarHBondContact O-CB 3.38Å; Q16-Q20 WeakPolarHBondContact O-CG 3.31Å; Q16-Q20 PolarHBondContact O-N 3.18Å
17	S	68.9	Low	65.4	Low	51 Å²	51	116.6 Å²	116.6	36%	0.357	58%	0.58	S	S	.	*	H	α-helix	trans	-61.2	-38	174.6	-176	0	0	0	0	112	R13 L14 N21	R13-S17 VanDerWaalsContact O-CB 3.29Å; R13-S17 WeakPolarHBondContact O-CB 3.23Å; R13-S17 PolarHBondContact O-N 2.69Å; L14-S17 CarbonylContact O-C 3.57Å; L14-S17 WeakPolarHBondContact O-CB 3.38Å; L14-S17 PolarHBondContact O-N 2.94Å; S17-N21 WeakPolarHBondContact O-CA 3.31Å; S17-N21 WeakPolarHBondContact O-CB 3.44Å; S17-N21 PolarHBondContact O-N 3.18Å
18	F	63.1	Low	64.1	Low	99 Å²	99	112.5 Å²	112.5	43%	0.434	57%	0.567	S	S	.	*	H	α-helix	trans	-76.5	-28.2	176.6	-73.4	-51.7	0	0	0	113.2	L14 A15 Q16 N21 P22 L23	L14-F18 HydrophobicContact CB-CD2 4.43Å; L14-F18 HydrophobicContact CB-CE2 4.23Å; L14-F18 HydrophobicContact CD2-CE2 4.45Å; L14-F18 WeakPolarHBondContact O-CB 3.33Å; L14-F18 WeakPolarHBondContact O-CD2 3.47Å; L14-F18 WeakPolarHBondContact O-CG 3.45Å; L14-F18 PolarHBondContact O-N 3.26Å; A15-F18 PolarHBondContact O-N 3.34Å; Q16-F18 VanDerWaalsContact C-N 3.3Å; Q16-F18 PolarHBondContact O-N 3Å; F18-N21 CarbonylContact O-C 3.42Å; F18-P22 VanDerWaalsContact O-CA 3.23Å; F18-P22 WeakPolarHBondContact O-CA 3.38Å; F18-P22 VanDerWaalsContact O-N 3.15Å; F18-L23 HydrophobicContact CD1-CD1 3.98Å; F18-L23 HydrophobicContact CD1-CG 3.82Å; F18-L23 HydrophobicContact CE1-CD1 3.26Å; F18-L23 HydrophobicContact CE1-CD2 4.16Å; F18-L23 HydrophobicContact CE1-CG 3.49Å; F18-L23 VanDerWaalsContact CE1-CG 3.49Å; F18-L23 HydrophobicContact CZ-CD1 3.99Å
19	Q	66.9	Low	62.1	Low	163 Å²	163	111.8 Å²	111.8	76%	0.762	57%	0.569	S	S	*	*	H	α-helix	trans	-69.9	-37.1	170.3	-83.7	-178.3	-34.3	0	0	111.8	A15 Q16	A15-Q19 PolarHBondContact O-N 3.27Å; Q16-Q19 PolarHBondContact O-N 3.4Å
20	Q	68.3	Low	60.4	Low	151 Å²	151	111.5 Å²	111.5	71%	0.706	56%	0.564	S	S	*	*	H	α-helix	trans	-80.1	-33.5	178.1	-69.5	178.2	-0.3	0	0	112.4	Q16	Q16-Q20 WeakPolarHBondContact O-CB 3.38Å; Q16-Q20 WeakPolarHBondContact O-CG 3.31Å; Q16-Q20 PolarHBondContact O-N 3.18Å
21	N	52.1	Low	58.8	Low	104 Å²	104	107.7 Å²	107.7	56%	0.556	55%	0.549	S	S	*	.	S	Bend	trans	-131.8	75.3	-179.4	-57.3	-57.6	0	0	0	110.1	S17 F18 L23	S17-N21 WeakPolarHBondContact O-CA 3.31Å; S17-N21 WeakPolarHBondContact O-CB 3.44Å; S17-N21 PolarHBondContact O-N 3.18Å; F18-N21 CarbonylContact O-C 3.42Å; N21-L23 PolarHBondContact O-N 3.39Å
22	P	55.3	Low	56.9	Low	74 Å²	74	111.1 Å²	111.1	48%	0.481	55%	0.552	S	S	.	*			trans	-63.4	121	179	23.8	-31.2	0	0	0	110.1	F18 T24	F18-P22 VanDerWaalsContact O-CA 3.23Å; F18-P22 WeakPolarHBondContact O-CA 3.38Å; F18-P22 VanDerWaalsContact O-N 3.15Å; P22-T24 PolarHBondContact O-N 3.29Å
23	L	43.9	Very low	54.7	Low	144 Å²	144	112 Å²	112	75%	0.754	57%	0.567	S	S	*	*	S	Bend	trans	-60.1	-18.2	-179	-71.1	175.7	0	0	0	113.9	F18 N21	F18-L23 HydrophobicContact CD1-CD1 3.98Å; F18-L23 HydrophobicContact CD1-CG 3.82Å; F18-L23 HydrophobicContact CE1-CD1 3.26Å; F18-L23 HydrophobicContact CE1-CD2 4.16Å; F18-L23 HydrophobicContact CE1-CG 3.49Å; F18-L23 VanDerWaalsContact CE1-CG 3.49Å; F18-L23 HydrophobicContact CZ-CD1 3.99Å; N21-L23 PolarHBondContact O-N 3.39Å
24	T	40.9	Very low	53	Low	109 Å²	109	109.1 Å²	109.1	67%	0.669	57%	0.571	S	S	*	*	S	Bend	trans	-139.6	139.5	-179.9	55.8	0	0	0	0	107.9	P22	P22-T24 PolarHBondContact O-N 3.29Å
25	T	44.8	Very low	51.9	Low	110 Å²	110	107.5 Å²	107.5	68%	0.675	56%	0.561	S	S	*	*			trans	-49	132.1	167.7	41.8	0	0	0	0	109.6	Y27	T25-Y27 PolarHBondContact O-N 2.76Å
26	P	45	Very low	50.8	Low	96 Å²	96	107.7 Å²	107.7	62%	0.623	56%	0.558	S	S	*	*			trans	-48.9	128	177.8	-25.7	31.9	0	0	0	110	K28	P26-K28 PolarHBondContact O-N 3.12Å
27	Y	40.1	Very low	49.8	Very low	193 Å²	193	104.5 Å²	104.5	76%	0.757	55%	0.549	S	S	*	.			trans	-58	107.2	178	173.1	-101.9	0	0	0	109.1	T25 P29	T25-Y27 PolarHBondContact O-N 2.76Å; Y27-P29 HydrophobicContact CE1-CB 3.98Å; Y27-P29 WeakPolarHBondContact O-CD 3.23Å
28	K	46.7	Very low	49.7	Very low	86 Å²	86	103.8 Å²	103.8	37%	0.374	54%	0.544	S	S	.	.			trans	-90.6	107.7	172.6	-75.7	-173.4	179	-173.5	0	107.8	P26 R30 S38	P26-K28 PolarHBondContact O-N 3.12Å; K28-R30 PolarHBondContact O-N 3.1Å; K28-S38 WeakPolarHBondContact CB-OG 3.29Å; K28-S38 PolarHBondContact O-OG 3.27Å
29	P	41.3	Very low	50.3	Low	86 Å²	86	99.4 Å²	99.4	56%	0.558	53%	0.525	S	S	*	.			trans	-57	138.8	-179.4	21.5	-30.5	0	0	0	110.1	Y27 L31	Y27-P29 HydrophobicContact CE1-CB 3.98Å; Y27-P29 WeakPolarHBondContact O-CD 3.23Å; P29-L31 PolarHBondContact O-N 2.91Å
30	R	48.4	Very low	50.9	Low	132 Å²	132	93 Å²	93	50%	0.498	49%	0.494	S	S	.	.			trans	-59.9	136.8	176.8	-59.1	-177.8	-172.4	-148.8	2.9	109	K28 W32 Q35	K28-R30 PolarHBondContact O-N 3.1Å; R30-W32 WeakPolarHBondContact CB-O 3.37Å; R30-W32 PolarHBondContact O-N 2.68Å; R30-Q35 WeakPolarHBondContact CD-O 3.35Å; R30-Q35 PolarHBondContact NH1-O 2.8Å
31	L	48.6	Very low	51.5	Low	53 Å²	53	89.3 Å²	89.3	28%	0.277	48%	0.476	S	S	.	.	S	Bend	trans	-60.7	-30.9	176.7	-63.4	172.5	0	0	0	111.3	P29 E84 H87	P29-L31 PolarHBondContact O-N 2.91Å; L31-E84 HydrophobicContact CD1-CG 4.35Å; L31-H87 HydrophobicContact CD1-CB 3.47Å; L31-H87 VanDerWaalsContact CD1-CB 3.47Å; L31-H87 WeakPolarHBondContact CD2-NE2 3.31Å
32	W	42.5	Very low	53	Low	168 Å²	168	84.8 Å²	84.8	64%	0.636	45%	0.451	S	S	*	.	S	Bend	trans	-143.2	147.1	173.3	-82.2	71.7	0	0	0	111.4	R30 C34 Q35	R30-W32 WeakPolarHBondContact CB-O 3.37Å; R30-W32 PolarHBondContact O-N 2.68Å; W32-C34 PolarHBondContact O-N 3.15Å; W32-C34 VanDerWaalsContact O-N 3.11Å; W32-Q35 HydrophobicContact CB-CB 4.47Å; W32-Q35 HydrophobicContact CB-CG 4.02Å; W32-Q35 PolarHBondContact O-N 3.39Å; W32-Q35 VanDerWaalsContact O-N 3.09Å
33	P	38.4	Very low	54.3	Low	122 Å²	122	82.1 Å²	82.1	79%	0.792	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.3	-178.1	-24.6	33.7	0	0	0	115.1
34	C	43.2	Very low	56	Low	106 Å²	106	77.8 Å²	77.8	72%	0.716	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	2.1	-179.3	54.9	0	0	0	0	114.3	W32	W32-C34 PolarHBondContact O-N 3.15Å; W32-C34 VanDerWaalsContact O-N 3.11Å
35	Q	46.8	Very low	57.8	Low	45 Å²	45	80.5 Å²	80.5	21%	0.21	41%	0.411	C	S	.	.	S	Bend	trans	-88.4	153.8	179.1	-79.1	-174.2	-9.3	0	0	112.6	R30 W32	R30-Q35 WeakPolarHBondContact CD-O 3.35Å; R30-Q35 PolarHBondContact NH1-O 2.8Å; W32-Q35 HydrophobicContact CB-CB 4.47Å; W32-Q35 HydrophobicContact CB-CG 4.02Å; W32-Q35 PolarHBondContact O-N 3.39Å; W32-Q35 VanDerWaalsContact O-N 3.09Å
36	P	48.9	Very low	59.8	Low	54 Å²	54	77.2 Å²	77.2	35%	0.351	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-50.8	164.7	167.7	16.4	-28.3	0	0	0	113	E58	P36-E58 WeakPolarHBondContact CA-OE1 3.17Å; P36-E58 HydrophobicContact CB-CB 3.87Å; P36-E58 HydrophobicContact CB-CG 3.79Å; P36-E58 WeakPolarHBondContact CB-OE1 3.49Å; P36-E58 WeakPolarHBondContact CB-OE2 3.45Å
37	S	52.1	Low	61.4	Low	48 Å²	48	77 Å²	77	34%	0.336	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-52.8	145.5	170.4	61.9	0	0	0	0	110.8	V39 E58	S37-V39 WeakPolarHBondContact O-CG2 3.43Å; S37-V39 PolarHBondContact O-N 2.9Å; S37-E58 PolarHBondContact N-OE1 3.36Å; S37-E58 PolarHBondContact N-OE2 2.8Å; S37-E58 PolarHBondContact OG-OE2 3.35Å
38	S	65.5	Low	63.1	Low	37 Å²	37	70.2 Å²	70.2	26%	0.259	36%	0.358	S	S	.	.			trans	-69	114.8	179.3	44.9	0	0	0	0	109.5	K28 E84	K28-S38 WeakPolarHBondContact CB-OG 3.29Å; K28-S38 PolarHBondContact O-OG 3.27Å; S38-E84 WeakPolarHBondContact CA-OE1 3.35Å; S38-E84 WeakPolarHBondContact CB-OE1 3.38Å
39	V	75.6	Confident	65	Low	7 Å²	7	66.1 Å²	66.1	4%	0.042	34%	0.34	C	S	.	.			trans	-113.1	110.3	179.4	-171.7	0	0	0	0	107.5	S37 F52 F56 V60 T80 E84	S37-V39 WeakPolarHBondContact O-CG2 3.43Å; S37-V39 PolarHBondContact O-N 2.9Å; V39-F52 HydrophobicContact CG1-CE1 4.1Å; V39-F52 HydrophobicContact CG1-CZ 4.47Å; V39-F56 HydrophobicContact CB-CE1 4.37Å; V39-F56 HydrophobicContact CB-CZ 4.36Å; V39-F56 HydrophobicContact CG1-CE1 4.43Å; V39-F56 HydrophobicContact CG1-CE2 4.27Å; V39-F56 HydrophobicContact CG1-CZ 4.23Å; V39-F56 HydrophobicContact CG2-CD1 3.94Å; V39-F56 HydrophobicContact CG2-CE1 3.15Å; V39-F56 HydrophobicContact CG2-CE2 4.04Å; V39-F56 HydrophobicContact CG2-CZ 3.2Å; V39-V60 HydrophobicContact CB-CG1 4.09Å; V39-V60 HydrophobicContact CG1-CG1 4.13Å; V39-V60 HydrophobicContact CG2-CG1 4.12Å; V39-T80 WeakPolarHBondContact O-CA 3.39Å; V39-T80 WeakPolarHBondContact O-CB 3.31Å; V39-T80 PolarHBondContact O-OG1 3.03Å; V39-E84 PolarHBondContact N-OE1 3Å; V39-E84 PolarHBondContact N-OE2 2.74Å; V39-E84 VanDerWaalsContact O-OE2 3.05Å
40	W	80.1	Confident	67	Low	27 Å²	27	63 Å²	63	10%	0.102	32%	0.319	C	S	.	.			trans	-138.5	81.1	175.9	-166.5	-82.5	0	0	0	109.1	L78 T80 E84 L85 Y88 L96 M462	W40-L78 HydrophobicContact CD2-CD1 3.69Å; W40-L78 HydrophobicContact CD2-CD2 4.36Å; W40-L78 HydrophobicContact CE3-CD1 4.23Å; W40-L78 HydrophobicContact CE3-CD2 4.34Å; W40-L78 HydrophobicContact CG-CD1 3.91Å; W40-L78 HydrophobicContact CH2-CD2 3.54Å; W40-L78 HydrophobicContact CZ2-CD1 4.07Å; W40-L78 HydrophobicContact CZ2-CD2 3.53Å; W40-L78 HydrophobicContact CZ2-CG 4.47Å; W40-L78 HydrophobicContact CZ3-CD2 3.95Å; W40-T80 HydrophobicContact CE3-CG2 4.2Å; W40-T80 HydrophobicContact CZ3-CG2 4.09Å; W40-E84 HydrophobicContact CE3-CG 4.12Å; W40-E84 HydrophobicContact CZ3-CG 4.5Å; W40-L85 HydrophobicContact CH2-CD1 4.26Å; W40-Y88 HydrophobicContact CD2-CD2 4.31Å; W40-Y88 AromaticContact CE3-CD2 3.52Å; W40-Y88 HydrophobicContact CE3-CD2 3.52Å; W40-Y88 AromaticContact CE3-CE2 4Å; W40-Y88 HydrophobicContact CE3-CE2 4Å; W40-Y88 HydrophobicContact CE3-CG 4.39Å; W40-Y88 AromaticContact CH2-CD2 3.97Å; W40-Y88 HydrophobicContact CH2-CD2 3.97Å; W40-Y88 HydrophobicContact CH2-CG 4.08Å; W40-Y88 AromaticContact CZ3-CD2 3.32Å; W40-Y88 HydrophobicContact CZ3-CD2 3.32Å; W40-Y88 HydrophobicContact CZ3-CE2 4.25Å; W40-Y88 AromaticContact CZ3-CG 3.89Å; W40-Y88 HydrophobicContact CZ3-CG 3.89Å; W40-L96 HydrophobicContact CH2-CD1 3.77Å; W40-L96 HydrophobicContact CZ2-CD1 4.1Å; W40-L96 HydrophobicContact CZ2-CD2 4.23Å; W40-M462 HydrophobicContact CH2-SD 4.43Å; W40-M462 HydrophobicContact CZ2-CE 4.16Å; W40-M462 HydrophobicContact CZ2-SD 3.33Å; W40-M462 WeakPolarHBondContact CZ2-SD 3.35Å; W40-M462 PolarHBondContact NE1-SD 3.17Å
41	K	82.3	Confident	68.3	Low	75 Å²	75	60.3 Å²	60.3	33%	0.326	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	136.1	-177.9	-66	-152.5	-171.2	177.1	0	111.6	F43 F52 L78 V79	K41-F43 HydrophobicContact CB-CE2 3.7Å; K41-F43 HydrophobicContact CB-CZ 4.05Å; K41-F43 HydrophobicContact CD-CZ 4.41Å; K41-F52 HydrophobicContact CB-CE1 4.11Å; K41-F52 HydrophobicContact CD-CE1 3.8Å; K41-F52 HydrophobicContact CD-CE2 3.79Å; K41-F52 HydrophobicContact CD-CZ 3.39Å; K41-F52 HydrophobicContact CG-CE1 4.09Å; K41-F52 HydrophobicContact CG-CZ 4.09Å; K41-L78 CarbonylContact O-C 3.55Å; K41-L78 WeakPolarHBondContact O-CA 3.37Å; K41-V79 PolarHBondContact N-O 2.73Å; K41-V79 VanDerWaalsContact N-O 3.12Å; K41-V79 PolarHBondContact O-N 3.47Å
42	L	82.6	Confident	69.8	Low	8 Å²	8	58.4 Å²	58.4	4%	0.042	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.2	-178.1	-69.4	164.7	0	0	0	110.7	L65 I76 Y77 L78 I468	L42-L65 HydrophobicContact CD2-CD1 3.92Å; L42-I76 HydrophobicContact CD2-CD1 4.08Å; L42-Y77 CarbonylContact C-O 3.5Å; L42-Y77 WeakPolarHBondContact CA-O 3.23Å; L42-L78 HydrophobicContact CD2-CB 3.73Å; L42-L78 HydrophobicContact CD2-CD1 3.84Å; L42-L78 HydrophobicContact CD2-CG 4.35Å; L42-L78 HydrophobicContact CG-CD1 4.25Å; L42-I468 HydrophobicContact CD1-CB 4.4Å; L42-I468 HydrophobicContact CD1-CD1 4.34Å; L42-I468 HydrophobicContact CD1-CG1 4.23Å; L42-I468 HydrophobicContact CD1-CG2 3.38Å; L42-I468 HydrophobicContact CD2-CD1 4.44Å
43	F	82.1	Confident	71.8	Confident	18 Å²	18	50.7 Å²	50.7	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.2	-177.4	-60.5	-91.7	0	0	0	110.7	K41 R45 L48 A49 F52 Y77 V79	K41-F43 HydrophobicContact CB-CE2 3.7Å; K41-F43 HydrophobicContact CB-CZ 4.05Å; K41-F43 HydrophobicContact CD-CZ 4.41Å; F43-R45 VanDerWaalsContact C-N 3.33Å; F43-L48 HydrophobicContact CB-CB 4.42Å; F43-L48 HydrophobicContact CD1-CB 3.9Å; F43-L48 HydrophobicContact CG-CB 4.43Å; F43-A49 HydrophobicContact CB-CB 3.98Å; F43-A49 HydrophobicContact CD2-CB 3.7Å; F43-A49 HydrophobicContact CG-CB 3.97Å; F43-F52 HydrophobicContact CE1-CB 4.03Å; F43-F52 HydrophobicContact CE1-CG 4.25Å; F43-F52 HydrophobicContact CE2-CB 3.97Å; F43-F52 AromaticContact CE2-CD1 3.68Å; F43-F52 HydrophobicContact CE2-CD1 3.68Å; F43-F52 HydrophobicContact CE2-CE1 4.47Å; F43-F52 AromaticContact CE2-CG 3.89Å; F43-F52 HydrophobicContact CE2-CG 3.89Å; F43-F52 HydrophobicContact CZ-CB 3.45Å; F43-F52 VanDerWaalsContact CZ-CB 3.45Å; F43-F52 AromaticContact CZ-CD1 3.59Å; F43-F52 HydrophobicContact CZ-CD1 3.59Å; F43-F52 AromaticContact CZ-CD2 3.91Å; F43-F52 HydrophobicContact CZ-CD2 3.91Å; F43-F52 HydrophobicContact CZ-CE1 4.38Å; F43-F52 AromaticContact CZ-CG 3.33Å; F43-F52 HydrophobicContact CZ-CG 3.33Å; F43-Y77 PolarHBondContact N-O 2.98Å; F43-Y77 PolarHBondContact O-N 3.35Å; F43-V79 HydrophobicContact CD2-CG2 3.88Å; F43-V79 HydrophobicContact CE2-CB 4.15Å; F43-V79 HydrophobicContact CE2-CG2 3.63Å
44	P	79.9	Confident	73.5	Confident	54 Å²	54	46.8 Å²	46.8	35%	0.351	25%	0.253	S	S	.	.	S	Bend	trans	-70.8	-29	174	25.3	-30.8	0	0	0	112.7	A459 Y460	P44-A459 HydrophobicContact CG-CB 4.4Å; P44-Y460 HydrophobicContact CB-CE2 4.07Å
45	R	79.9	Confident	74.7	Confident	165 Å²	165	42 Å²	42	62%	0.623	22%	0.221	S	C	*	.	S	Bend	trans	-121.5	141.3	-173.3	-58.3	-177.9	175	178.2	-0.3	111.5	F43 N47 L48 A49 Y77	F43-R45 VanDerWaalsContact C-N 3.33Å; R45-N47 WeakPolarHBondContact CB-OD1 3.5Å; R45-N47 PolarHBondContact O-N 3.01Å; R45-L48 HydrophobicContact CB-CD1 4.06Å; R45-L48 HydrophobicContact CB-CG 4.18Å; R45-L48 HydrophobicContact CG-CD1 4.41Å; R45-L48 PolarHBondContact O-N 3Å; R45-A49 PolarHBondContact O-N 3.06Å; R45-Y77 VanDerWaalsContact C-CD2 3.43Å
46	Q	86.8	Confident	75.8	Confident	41 Å²	41	41.8 Å²	41.8	19%	0.192	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-42	-176.3	-166.1	178	-93.4	0	0	112.5	L48 A49 I50 Y77 V102 N267	Q46-L48 VanDerWaalsContact C-N 3.32Å; Q46-L48 PolarHBondContact O-N 3.16Å; Q46-A49 PolarHBondContact O-N 3.04Å; Q46-I50 HydrophobicContact CG-CD1 3.82Å; Q46-I50 HydrophobicContact CG-CG1 4.34Å; Q46-I50 VanDerWaalsContact O-CG1 3.32Å; Q46-I50 WeakPolarHBondContact O-CG1 3.34Å; Q46-I50 PolarHBondContact O-N 2.73Å; Q46-Y77 HydrophobicContact CB-CD1 3.92Å; Q46-Y77 HydrophobicContact CB-CD2 4.11Å; Q46-Y77 HydrophobicContact CB-CE1 3.52Å; Q46-Y77 HydrophobicContact CB-CE2 3.75Å; Q46-Y77 HydrophobicContact CB-CG 4.19Å; Q46-Y77 VanDerWaalsContact CB-CZ 3.44Å; Q46-Y77 HydrophobicContact CG-CD1 3.73Å; Q46-Y77 HydrophobicContact CG-CE1 3.44Å; Q46-Y77 VanDerWaalsContact CG-CE1 3.44Å; Q46-Y77 HydrophobicContact CG-CG 4.4Å; Q46-Y77 VanDerWaalsContact N-CD2 3.28Å; Q46-Y77 VanDerWaalsContact N-CE2 3.28Å; Q46-V102 HydrophobicContact CG-CG1 4.39Å; Q46-N267 PolarHBondContact OE1-ND2 3.35Å
47	N	78	Confident	76.6	Confident	93 Å²	93	43.8 Å²	43.8	50%	0.497	22%	0.222	S	C	.	.	H	α-helix	trans	-61.9	-40.9	-178.9	62.5	-32.5	0	0	0	111.5	R45 I50 S51	R45-N47 WeakPolarHBondContact CB-OD1 3.5Å; R45-N47 PolarHBondContact O-N 3.01Å; N47-I50 PolarHBondContact O-N 2.86Å; N47-S51 WeakPolarHBondContact O-CB 3.08Å; N47-S51 PolarHBondContact O-N 3.49Å; N47-S51 PolarHBondContact O-OG 3.04Å; N47-S51 VanDerWaalsContact O-OG 3.07Å
48	L	76.3	Confident	77.5	Confident	49 Å²	49	43.5 Å²	43.5	26%	0.257	22%	0.216	S	C	.	.	H	α-helix	trans	-62.1	-45.3	175.5	-63.3	175.7	0	0	0	111.4	F43 R45 Q46 I50 S51 F52	F43-L48 HydrophobicContact CB-CB 4.42Å; F43-L48 HydrophobicContact CD1-CB 3.9Å; F43-L48 HydrophobicContact CG-CB 4.43Å; R45-L48 HydrophobicContact CB-CD1 4.06Å; R45-L48 HydrophobicContact CB-CG 4.18Å; R45-L48 HydrophobicContact CG-CD1 4.41Å; R45-L48 PolarHBondContact O-N 3Å; Q46-L48 VanDerWaalsContact C-N 3.32Å; Q46-L48 PolarHBondContact O-N 3.16Å; L48-I50 PolarHBondContact O-N 3.44Å; L48-S51 PolarHBondContact O-N 3.38Å; L48-F52 WeakPolarHBondContact O-CB 3.29Å; L48-F52 PolarHBondContact O-N 3.14Å
49	A	85.9	Confident	78.2	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-41.4	175.9	0	0	0	0	0	112.7	F43 R45 Q46 F52 A53 V62 Y77 V79	F43-A49 HydrophobicContact CB-CB 3.98Å; F43-A49 HydrophobicContact CD2-CB 3.7Å; F43-A49 HydrophobicContact CG-CB 3.97Å; R45-A49 PolarHBondContact O-N 3.06Å; Q46-A49 PolarHBondContact O-N 3.04Å; A49-F52 PolarHBondContact O-N 3.45Å; A49-A53 WeakPolarHBondContact O-CB 3.45Å; A49-A53 PolarHBondContact O-N 3Å; A49-V62 HydrophobicContact CB-CG1 3.75Å; A49-V62 HydrophobicContact CB-CG2 4.37Å; A49-Y77 HydrophobicContact CB-CG 4.4Å; A49-V79 HydrophobicContact CB-CG2 3.75Å; A49-V79 WeakPolarHBondContact O-CG2 3.49Å
50	I	83.5	Confident	78.7	Confident	20 Å²	20	43.1 Å²	43.1	10%	0.103	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-47	177	-70.9	171.3	0	0	0	110.4	Q46 N47 L48 F52 A53 H54 V62 V102	Q46-I50 HydrophobicContact CG-CD1 3.82Å; Q46-I50 HydrophobicContact CG-CG1 4.34Å; Q46-I50 VanDerWaalsContact O-CG1 3.32Å; Q46-I50 WeakPolarHBondContact O-CG1 3.34Å; Q46-I50 PolarHBondContact O-N 2.73Å; N47-I50 PolarHBondContact O-N 2.86Å; L48-I50 PolarHBondContact O-N 3.44Å; I50-F52 VanDerWaalsContact C-N 3.31Å; I50-F52 PolarHBondContact O-N 3.46Å; I50-A53 PolarHBondContact O-N 2.83Å; I50-H54 WeakPolarHBondContact CG2-CE1 3.45Å; I50-H54 PolarHBondContact O-CD2 3.38Å; I50-H54 PolarHBondContact O-N 2.89Å; I50-V62 HydrophobicContact CG1-CG2 4.02Å; I50-V102 HydrophobicContact CD1-CG1 4.46Å
51	S	76.1	Confident	79.4	Confident	76 Å²	76	42.6 Å²	42.6	53%	0.531	21%	0.213	S	C	.	.	H	α-helix	trans	-58.9	-43.4	176.1	-63.7	0	0	0	0	111.5	N47 L48 H54 S55	N47-S51 WeakPolarHBondContact O-CB 3.08Å; N47-S51 PolarHBondContact O-N 3.49Å; N47-S51 PolarHBondContact O-OG 3.04Å; N47-S51 VanDerWaalsContact O-OG 3.07Å; L48-S51 PolarHBondContact O-N 3.38Å; S51-H54 PolarHBondContact O-N 2.93Å; S51-S55 WeakPolarHBondContact O-CB 3.46Å; S51-S55 PolarHBondContact O-N 2.77Å; S51-S55 PolarHBondContact O-OG 2.92Å
52	F	80.3	Confident	79.9	Confident	13 Å²	13	39.4 Å²	39.4	6%	0.057	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-38.9	175.8	-179.8	-97.6	0	0	0	113	V39 K41 F43 L48 A49 I50 S55 F56 V79 L451	V39-F52 HydrophobicContact CG1-CE1 4.1Å; V39-F52 HydrophobicContact CG1-CZ 4.47Å; K41-F52 HydrophobicContact CB-CE1 4.11Å; K41-F52 HydrophobicContact CD-CE1 3.8Å; K41-F52 HydrophobicContact CD-CE2 3.79Å; K41-F52 HydrophobicContact CD-CZ 3.39Å; K41-F52 HydrophobicContact CG-CE1 4.09Å; K41-F52 HydrophobicContact CG-CZ 4.09Å; F43-F52 HydrophobicContact CE1-CB 4.03Å; F43-F52 HydrophobicContact CE1-CG 4.25Å; F43-F52 HydrophobicContact CE2-CB 3.97Å; F43-F52 AromaticContact CE2-CD1 3.68Å; F43-F52 HydrophobicContact CE2-CD1 3.68Å; F43-F52 HydrophobicContact CE2-CE1 4.47Å; F43-F52 AromaticContact CE2-CG 3.89Å; F43-F52 HydrophobicContact CE2-CG 3.89Å; F43-F52 HydrophobicContact CZ-CB 3.45Å; F43-F52 VanDerWaalsContact CZ-CB 3.45Å; F43-F52 AromaticContact CZ-CD1 3.59Å; F43-F52 HydrophobicContact CZ-CD1 3.59Å; F43-F52 AromaticContact CZ-CD2 3.91Å; F43-F52 HydrophobicContact CZ-CD2 3.91Å; F43-F52 HydrophobicContact CZ-CE1 4.38Å; F43-F52 AromaticContact CZ-CG 3.33Å; F43-F52 HydrophobicContact CZ-CG 3.33Å; L48-F52 WeakPolarHBondContact O-CB 3.29Å; L48-F52 PolarHBondContact O-N 3.14Å; A49-F52 PolarHBondContact O-N 3.45Å; I50-F52 VanDerWaalsContact C-N 3.31Å; I50-F52 PolarHBondContact O-N 3.46Å; F52-S55 VanDerWaalsContact CA-OG 3.3Å; F52-S55 WeakPolarHBondContact CA-OG 3.41Å; F52-S55 PolarHBondContact O-N 2.66Å; F52-S55 PolarHBondContact O-OG 2.98Å; F52-F56 AromaticContact CE1-CD2 3.98Å; F52-F56 HydrophobicContact CE1-CD2 3.98Å; F52-F56 HydrophobicContact CE2-CD2 4.13Å; F52-F56 AromaticContact CZ-CD2 3.44Å; F52-F56 HydrophobicContact CZ-CD2 3.44Å; F52-F56 VanDerWaalsContact CZ-CD2 3.44Å; F52-F56 AromaticContact CZ-CE2 3.9Å; F52-F56 HydrophobicContact CZ-CE2 3.9Å; F52-F56 HydrophobicContact CZ-CG 4.39Å; F52-F56 PolarHBondContact O-N 3.47Å; F52-V79 HydrophobicContact CD1-CB 3.77Å; F52-V79 HydrophobicContact CD1-CG1 3.67Å; F52-V79 HydrophobicContact CD1-CG2 3.97Å; F52-V79 HydrophobicContact CE1-CB 4.12Å; F52-V79 HydrophobicContact CE1-CG1 3.9Å; F52-L451 HydrophobicContact CD2-CD1 4.24Å; F52-L451 HydrophobicContact CD2-CD2 4.22Å; F52-L451 HydrophobicContact CE2-CD1 4.18Å
53	A	83.8	Confident	80.6	Confident	6 Å²	6	39 Å²	39	5%	0.05	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-38	178.2	0	0	0	0	0	112.1	A49 I50 S55 V60 V62 V79	A49-A53 WeakPolarHBondContact O-CB 3.45Å; A49-A53 PolarHBondContact O-N 3Å; I50-A53 PolarHBondContact O-N 2.83Å; A53-S55 PolarHBondContact O-N 2.67Å; A53-V60 HydrophobicContact CB-CG2 4.06Å; A53-V62 HydrophobicContact CB-CG2 3.57Å; A53-V79 HydrophobicContact CB-CG1 3.8Å; A53-V79 HydrophobicContact CB-CG2 4.39Å
54	H	74.9	Confident	81.2	Confident	40 Å²	40	38.1 Å²	38.1	19%	0.185	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-24	174	-67.1	172.1	0	0	0	112.7	I50 S51 Y357	I50-H54 WeakPolarHBondContact CG2-CE1 3.45Å; I50-H54 PolarHBondContact O-CD2 3.38Å; I50-H54 PolarHBondContact O-N 2.89Å; S51-H54 PolarHBondContact O-N 2.93Å; H54-Y357 HydrophobicContact CB-CE1 4.18Å; H54-Y357 PolarHBondContact CD2-OH 3.36Å; H54-Y357 VanDerWaalsContact CD2-OH 3.3Å; H54-Y357 AromaticContact CE1-CZ 3.8Å; H54-Y357 PolarHBondContact CE1-OH 3.38Å; H54-Y357 AromaticContact CG-CE1 3.9Å; H54-Y357 VanDerWaalsContact CG-OH 3.3Å; H54-Y357 AromaticContact ND1-CE1 3.47Å; H54-Y357 WeakPolarHBondContact ND1-CE1 3.21Å; H54-Y357 AromaticContact ND1-CZ 3.65Å; H54-Y357 PolarHBondContact ND1-OH 3.03Å; H54-Y357 VanDerWaalsContact ND1-OH 3.11Å; H54-Y357 PolarHBondContact NE2-OH 3.45Å; H54-Y357 VanDerWaalsContact NE2-OH 3.12Å
55	S	67.6	Low	81.8	Confident	6 Å²	6	35.9 Å²	35.9	4%	0.042	18%	0.179	C	C	.	.	H	α-helix	trans	-94.5	-9	-175.4	64.9	0	0	0	0	115.8	S51 F52 A53 V447 L451	S51-S55 WeakPolarHBondContact O-CB 3.46Å; S51-S55 PolarHBondContact O-N 2.77Å; S51-S55 PolarHBondContact O-OG 2.92Å; F52-S55 VanDerWaalsContact CA-OG 3.3Å; F52-S55 WeakPolarHBondContact CA-OG 3.41Å; F52-S55 PolarHBondContact O-N 2.66Å; F52-S55 PolarHBondContact O-OG 2.98Å; A53-S55 PolarHBondContact O-N 2.67Å; S55-V447 VanDerWaalsContact CA-CB 3.41Å; S55-L451 WeakPolarHBondContact OG-CD1 3.35Å; S55-L451 WeakPolarHBondContact OG-CD2 3.23Å; S55-L451 VanDerWaalsContact OG-CG 3.31Å; S55-L451 WeakPolarHBondContact OG-CG 3.47Å
56	F	69.9	Low	82.2	Confident	40 Å²	40	29.4 Å²	29.4	18%	0.175	16%	0.156	C	C	.	.			trans	-87.6	125.1	-174.8	-154.3	-94	0	0	0	111	V39 F52 E58 V60 Q387	V39-F56 HydrophobicContact CB-CE1 4.37Å; V39-F56 HydrophobicContact CB-CZ 4.36Å; V39-F56 HydrophobicContact CG1-CE1 4.43Å; V39-F56 HydrophobicContact CG1-CE2 4.27Å; V39-F56 HydrophobicContact CG1-CZ 4.23Å; V39-F56 HydrophobicContact CG2-CD1 3.94Å; V39-F56 HydrophobicContact CG2-CE1 3.15Å; V39-F56 HydrophobicContact CG2-CE2 4.04Å; V39-F56 HydrophobicContact CG2-CZ 3.2Å; F52-F56 AromaticContact CE1-CD2 3.98Å; F52-F56 HydrophobicContact CE1-CD2 3.98Å; F52-F56 HydrophobicContact CE2-CD2 4.13Å; F52-F56 AromaticContact CZ-CD2 3.44Å; F52-F56 HydrophobicContact CZ-CD2 3.44Å; F52-F56 VanDerWaalsContact CZ-CD2 3.44Å; F52-F56 AromaticContact CZ-CE2 3.9Å; F52-F56 HydrophobicContact CZ-CE2 3.9Å; F52-F56 HydrophobicContact CZ-CG 4.39Å; F52-F56 PolarHBondContact O-N 3.47Å; F56-E58 HydrophobicContact CD1-CB 3.89Å; F56-E58 HydrophobicContact CE1-CB 3.79Å; F56-E58 HydrophobicContact CE1-CG 4.05Å; F56-E58 PolarHBondContact O-N 3.15Å; F56-E58 VanDerWaalsContact O-N 3.1Å; F56-V60 HydrophobicContact CB-CG2 3.57Å; F56-V60 HydrophobicContact CD1-CG1 3.69Å; F56-V60 HydrophobicContact CD1-CG2 4.26Å; F56-V60 HydrophobicContact CE1-CG1 4.34Å; F56-V60 HydrophobicContact CG-CG1 4.28Å; F56-V60 HydrophobicContact CG-CG2 4.14Å; F56-Q387 PolarHBondContact O-NE2 2.81Å; F56-Q387 VanDerWaalsContact O-NE2 3.13Å; F56-Q387 PolarHBondContact O-OE1 3.42Å
57	K	64.8	Low	81.8	Confident	97 Å²	97	30.4 Å²	30.4	42%	0.422	16%	0.16	S	C	.	.	S	Bend	trans	-58.4	-25.5	-177.5	-61.7	-168.5	177.7	-152.1	0	113.9	K418 E420	K57-K418 VanDerWaalsContact O-CA 3.31Å; K57-K418 WeakPolarHBondContact O-CA 3.49Å; K57-K418 WeakPolarHBondContact O-CB 3.25Å; K57-K418 WeakPolarHBondContact O-CD 3.47Å; K57-K418 WeakPolarHBondContact O-CE 3.31Å; K57-K418 WeakPolarHBondContact O-CG 2.99Å; K57-E420 VanDerWaalsContact CE-OE2 3.29Å; K57-E420 WeakPolarHBondContact CE-OE2 3.33Å; K57-E420 IonicContact NZ-OE1 3.84Å; K57-E420 IonicContact NZ-OE2 2.71Å; K57-E420 PolarHBondContact NZ-OE2 3.42Å
58	E	72.6	Confident	81.5	Confident	42 Å²	42	32 Å²	32	20%	0.196	16%	0.164	C	C	.	.	S	Bend	trans	-99.1	149.8	178.9	-57	174.6	141.3	0	0	110	P36 S37 F56 V60 Q387	P36-E58 WeakPolarHBondContact CA-OE1 3.17Å; P36-E58 HydrophobicContact CB-CB 3.87Å; P36-E58 HydrophobicContact CB-CG 3.79Å; P36-E58 WeakPolarHBondContact CB-OE1 3.49Å; P36-E58 WeakPolarHBondContact CB-OE2 3.45Å; S37-E58 PolarHBondContact N-OE1 3.36Å; S37-E58 PolarHBondContact N-OE2 2.8Å; S37-E58 PolarHBondContact OG-OE2 3.35Å; F56-E58 HydrophobicContact CD1-CB 3.89Å; F56-E58 HydrophobicContact CE1-CB 3.79Å; F56-E58 HydrophobicContact CE1-CG 4.05Å; F56-E58 PolarHBondContact O-N 3.15Å; F56-E58 VanDerWaalsContact O-N 3.1Å; E58-V60 VanDerWaalsContact C-N 3.35Å; E58-V60 PolarHBondContact O-N 2.91Å; E58-Q387 PolarHBondContact O-NE2 3.13Å
59	A	78.8	Confident	81	Confident	29 Å²	29	39.7 Å²	39.7	24%	0.24	20%	0.196	C	C	.	.			trans	-61.5	87.9	-178.7	0	0	0	0	0	112.8	V385	A59-V385 WeakPolarHBondContact CB-O 3.44Å
60	V	87.6	Confident	80.2	Confident	6 Å²	6	41.5 Å²	41.5	4%	0.036	21%	0.21	C	C	.	.			trans	-109.3	156.6	176.7	-61.1	0	0	0	0	111.3	V39 A53 F56 E58 V79 T80	V39-V60 HydrophobicContact CB-CG1 4.09Å; V39-V60 HydrophobicContact CG1-CG1 4.13Å; V39-V60 HydrophobicContact CG2-CG1 4.12Å; A53-V60 HydrophobicContact CB-CG2 4.06Å; F56-V60 HydrophobicContact CB-CG2 3.57Å; F56-V60 HydrophobicContact CD1-CG1 3.69Å; F56-V60 HydrophobicContact CD1-CG2 4.26Å; F56-V60 HydrophobicContact CE1-CG1 4.34Å; F56-V60 HydrophobicContact CG-CG1 4.28Å; F56-V60 HydrophobicContact CG-CG2 4.14Å; E58-V60 VanDerWaalsContact C-N 3.35Å; E58-V60 PolarHBondContact O-N 2.91Å; V60-V79 HydrophobicContact CB-CG1 3.78Å; V60-V79 HydrophobicContact CG2-CG1 3.56Å; V60-T80 WeakPolarHBondContact CA-O 3.31Å
61	H	93.1	Very high	79.3	Confident	17 Å²	17	44.3 Å²	44.3	8%	0.079	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	155.6	-174	-54.8	81.1	0	0	0	109.6	F63 V79 T80 Y82	H61-F63 HydrophobicContact CB-CE2 3.78Å; H61-F63 HydrophobicContact CB-CZ 3.72Å; H61-F63 WeakPolarHBondContact O-CE2 3.3Å; H61-V79 WeakPolarHBondContact O-CA 3.32Å; H61-T80 PolarHBondContact N-O 2.95Å; H61-T80 PolarHBondContact O-N 3.44Å; H61-Y82 HydrophobicContact CB-CD1 4.4Å; H61-Y82 HydrophobicContact CB-CE1 3.8Å; H61-Y82 AromaticContact CD2-CE1 3.72Å; H61-Y82 AromaticContact CD2-CE2 3.78Å; H61-Y82 AromaticContact CD2-CZ 3.24Å; H61-Y82 PolarHBondContact CD2-OH 3.45Å; H61-Y82 AromaticContact CE1-CD2 3.61Å; H61-Y82 AromaticContact CE1-CE2 3.34Å; H61-Y82 WeakPolarHBondContact CE1-CE2 3.21Å; H61-Y82 AromaticContact CE1-CZ 3.58Å; H61-Y82 AromaticContact CG-CE1 3.41Å; H61-Y82 VanDerWaalsContact CG-CE1 3.41Å; H61-Y82 AromaticContact CG-CZ 3.45Å; H61-Y82 VanDerWaalsContact CG-CZ 3.45Å; H61-Y82 AromaticContact ND1-CD1 3.81Å; H61-Y82 AromaticContact ND1-CD2 3.92Å; H61-Y82 AromaticContact ND1-CE1 3.64Å; H61-Y82 AromaticContact ND1-CE2 3.79Å; H61-Y82 AromaticContact ND1-CG 3.93Å; H61-Y82 AromaticContact ND1-CZ 3.65Å; H61-Y82 AromaticContact NE2-CE2 3.3Å; H61-Y82 VanDerWaalsContact NE2-CE2 3.3Å; H61-Y82 WeakPolarHBondContact NE2-CE2 3.26Å; H61-Y82 AromaticContact NE2-CZ 3.31Å; H61-Y82 VanDerWaalsContact NE2-CZ 3.31Å; H61-Y82 PolarHBondContact NE2-OH 3.48Å
62	V	94.3	Very high	78.7	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129.8	-179.7	-172.7	0	0	0	0	109.9	A49 I50 A53 Y77 L78 V79 V102	A49-V62 HydrophobicContact CB-CG1 3.75Å; A49-V62 HydrophobicContact CB-CG2 4.37Å; I50-V62 HydrophobicContact CG1-CG2 4.02Å; A53-V62 HydrophobicContact CB-CG2 3.57Å; V62-Y77 HydrophobicContact CG1-CD1 4.27Å; V62-L78 CarbonylContact C-O 3.38Å; V62-L78 WeakPolarHBondContact CA-O 3.39Å; V62-V79 HydrophobicContact CG2-CG2 4.22Å; V62-V102 HydrophobicContact CB-CB 4.11Å; V62-V102 HydrophobicContact CB-CG2 4.37Å; V62-V102 HydrophobicContact CG1-CB 4.15Å; V62-V102 HydrophobicContact CG1-CG2 3.9Å; V62-V102 WeakPolarHBondContact O-CB 3.28Å; V62-V102 PolarHBondContact O-N 2.91Å; V62-V102 VanDerWaalsContact O-N 3.1Å
63	F	96.3	Very high	77.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.4	174.6	-55.3	-82.5	0	0	0	109.5	H61 Y77 L78 T80 Y82 L85 Y100 L270 L309	H61-F63 HydrophobicContact CB-CE2 3.78Å; H61-F63 HydrophobicContact CB-CZ 3.72Å; H61-F63 WeakPolarHBondContact O-CE2 3.3Å; F63-Y77 CarbonylContact O-C 3.55Å; F63-Y77 VanDerWaalsContact O-CA 3.28Å; F63-Y77 WeakPolarHBondContact O-CA 3.44Å; F63-L78 HydrophobicContact CB-CB 4.37Å; F63-L78 PolarHBondContact N-O 2.81Å; F63-L78 PolarHBondContact O-N 3Å; F63-T80 HydrophobicContact CD2-CG2 3.99Å; F63-T80 HydrophobicContact CE2-CG2 3.88Å; F63-Y82 HydrophobicContact CE1-CD1 4.34Å; F63-Y82 HydrophobicContact CE1-CE1 4.16Å; F63-Y82 AromaticContact CZ-CD1 3.65Å; F63-Y82 HydrophobicContact CZ-CD1 3.65Å; F63-Y82 AromaticContact CZ-CE1 3.68Å; F63-Y82 HydrophobicContact CZ-CE1 3.68Å; F63-L85 HydrophobicContact CD1-CD2 3.45Å; F63-L85 VanDerWaalsContact CD1-CD2 3.45Å; F63-L85 HydrophobicContact CD2-CD2 3.79Å; F63-L85 HydrophobicContact CE1-CD2 3.25Å; F63-L85 HydrophobicContact CE2-CB 4.39Å; F63-L85 HydrophobicContact CE2-CD2 3.6Å; F63-L85 HydrophobicContact CG-CD2 3.71Å; F63-L85 HydrophobicContact CZ-CD2 3.33Å; F63-Y100 CarbonylContact C-O 3.45Å; F63-Y100 VanDerWaalsContact CA-O 3.24Å; F63-Y100 WeakPolarHBondContact CA-O 3.25Å; F63-L270 HydrophobicContact CD1-CD1 4.16Å; F63-L309 HydrophobicContact CE1-CD2 4.2Å
64	A	95.1	Very high	77.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	129.9	173.8	0	0	0	0	0	109.3	R75 I76 Y77 C99 Y100 V102 N267	A64-R75 HydrophobicContact CB-CB 4.29Å; A64-R75 HydrophobicContact CB-CG 4.45Å; A64-I76 CarbonylContact C-O 3.51Å; A64-I76 WeakPolarHBondContact CA-O 3.42Å; A64-Y77 HydrophobicContact CB-CD1 3.82Å; A64-Y77 HydrophobicContact CB-CE1 3.68Å; A64-C99 WeakPolarHBondContact O-CA 3.32Å; A64-Y100 PolarHBondContact N-O 2.98Å; A64-Y100 PolarHBondContact O-N 3.02Å; A64-V102 HydrophobicContact CB-CG2 3.98Å; A64-N267 VanDerWaalsContact CB-OD1 3.32Å; A64-N267 WeakPolarHBondContact CB-OD1 3.25Å
65	L	92.3	Very high	78.4	Confident	7 Å²	7	56.5 Å²	56.5	4%	0.037	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.3	178.3	-49.6	177.4	0	0	0	108.7	L42 R75 I76 L78 L96 C99 I468	L42-L65 HydrophobicContact CD2-CD1 3.92Å; L65-R75 VanDerWaalsContact O-CA 3.29Å; L65-R75 WeakPolarHBondContact O-CA 3.47Å; L65-I76 HydrophobicContact CB-CD1 4.45Å; L65-I76 HydrophobicContact CB-CG1 3.84Å; L65-I76 HydrophobicContact CD1-CD1 4.31Å; L65-I76 HydrophobicContact CD1-CG1 4.37Å; L65-I76 HydrophobicContact CG-CG1 4.49Å; L65-I76 PolarHBondContact N-O 3.44Å; L65-I76 PolarHBondContact O-N 2.79Å; L65-L78 HydrophobicContact CD1-CB 4Å; L65-L78 HydrophobicContact CD1-CD2 4.4Å; L65-L78 HydrophobicContact CG-CB 4.27Å; L65-L96 HydrophobicContact CD1-CD2 3.94Å; L65-L96 HydrophobicContact CD2-CD2 3.92Å; L65-C99 HydrophobicContact CD2-CB 3.96Å; L65-C99 WeakPolarHBondContact CD2-SG 3.49Å; L65-I468 HydrophobicContact CD1-CD1 3.42Å; L65-I468 VanDerWaalsContact CD1-CD1 3.42Å
66	E	89.1	Confident	79.4	Confident	29 Å²	29	56.7 Å²	56.7	14%	0.136	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.7	176.8	-158.2	-176.1	176.1	0	0	109.3	R75 H98 Y100 V276	E66-R75 HydrophobicContact CB-CG 4.34Å; E66-R75 HydrophobicContact CG-CG 4.38Å; E66-H98 HydrophobicContact CB-CB 3.94Å; E66-H98 PolarHBondContact N-O 3.29Å; E66-H98 WeakPolarHBondContact O-CB 3.33Å; E66-Y100 HydrophobicContact CB-CE2 4.06Å; E66-Y100 WeakPolarHBondContact OE2-CE2 3.26Å; E66-Y100 PolarHBondContact OE2-OH 3.35Å; E66-V276 HydrophobicContact CB-CG2 3.68Å; E66-V276 HydrophobicContact CG-CB 4.29Å; E66-V276 HydrophobicContact CG-CG2 3.49Å; E66-V276 VanDerWaalsContact CG-CG2 3.49Å
67	K	78.1	Confident	80.4	Confident	61 Å²	61	56.2 Å²	56.2	27%	0.265	29%	0.29	S	S	.	.			trans	-95.6	136.5	-177.2	-68.9	-162.4	-174.8	-168.8	0	111.6	K69 A70 I76 I468	K67-K69 VanDerWaalsContact C-N 3.31Å; K67-K69 PolarHBondContact O-N 2.83Å; K67-A70 HydrophobicContact CB-CB 3.84Å; K67-A70 PolarHBondContact O-N 3.03Å; K67-I76 VanDerWaalsContact CE-CD1 3.44Å; K67-I468 PolarHBondContact NZ-O 2.7Å
68	E	71.5	Confident	81.7	Confident	126 Å²	126	51.6 Å²	51.6	59%	0.589	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-31.9	177.4	-64.3	-174.2	156	0	0	114	H98 V276	E68-H98 IonicContact OE1-NE2 2.66Å; E68-H98 PolarHBondContact OE1-NE2 2.93Å; E68-V276 HydrophobicContact CG-CG1 4.39Å
69	K	66.5	Low	82.5	Confident	212 Å²	212	49.6 Å²	49.6	92%	0.922	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	4.6	-176.7	-61.9	-178.7	-178	174.7	0	114.2	K67	K67-K69 VanDerWaalsContact C-N 3.31Å; K67-K69 PolarHBondContact O-N 2.83Å
70	A	67.6	Low	83.1	Confident	37 Å²	37	48.2 Å²	48.2	31%	0.306	25%	0.249	S	C	.	.	S	Bend	trans	-95.4	172	-179.9	0	0	0	0	0	111.6	K67 Q74	K67-A70 HydrophobicContact CB-CB 3.84Å; K67-A70 PolarHBondContact O-N 3.03Å; A70-Q74 HydrophobicContact CB-CB 4.15Å
71	S	64.8	Low	83.2	Confident	79 Å²	79	48.5 Å²	48.5	55%	0.552	25%	0.251	S	S	*	.	S	Bend	trans	-57.6	143.8	170.5	61.5	0	0	0	0	110.7	G73 Q74	S71-G73 PolarHBondContact O-N 2.77Å; S71-Q74 WeakPolarHBondContact O-CB 3.42Å; S71-Q74 PolarHBondContact O-N 2.79Å; S71-Q74 WeakPolarHBondContact OG-CB 3.49Å; S71-Q74 PolarHBondContact OG-OE1 3.47Å
72	L	63.8	Low	83.1	Confident	181 Å²	181	48.5 Å²	48.5	95%	0.948	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	121.7	-175	-89.7	150	0	0	0	111.5	Q74	L72-Q74 VanDerWaalsContact C-N 3.31Å; L72-Q74 PolarHBondContact O-N 3.13Å
73	G	64.5	Low	82.7	Confident	40 Å²	40	49.9 Å²	49.9	41%	0.412	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	2.5	178.3	0	0	0	0	0	115.6	S71	S71-G73 PolarHBondContact O-N 2.77Å
74	Q	80	Confident	82.2	Confident	98 Å²	98	50.1 Å²	50.1	46%	0.458	26%	0.262	S	S	.	.			trans	-70	130.4	173.1	-172.1	175.3	10.5	0	0	110.6	A70 S71 L72	A70-Q74 HydrophobicContact CB-CB 4.15Å; S71-Q74 WeakPolarHBondContact O-CB 3.42Å; S71-Q74 PolarHBondContact O-N 2.79Å; S71-Q74 WeakPolarHBondContact OG-CB 3.49Å; S71-Q74 PolarHBondContact OG-OE1 3.47Å; L72-Q74 VanDerWaalsContact C-N 3.31Å; L72-Q74 PolarHBondContact O-N 3.13Å
75	R	88.1	Confident	82	Confident	72 Å²	72	50.1 Å²	50.1	27%	0.272	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.1	-177.9	-63.7	-178.4	-176	117.5	8.6	111.2	A64 L65 E66 Y77 N267	A64-R75 HydrophobicContact CB-CB 4.29Å; A64-R75 HydrophobicContact CB-CG 4.45Å; L65-R75 VanDerWaalsContact O-CA 3.29Å; L65-R75 WeakPolarHBondContact O-CA 3.47Å; E66-R75 HydrophobicContact CB-CG 4.34Å; E66-R75 HydrophobicContact CG-CG 4.38Å; R75-Y77 HydrophobicContact CB-CE2 4.46Å; R75-N267 VanDerWaalsContact CD-OD1 3.25Å; R75-N267 WeakPolarHBondContact CD-OD1 3.21Å; R75-N267 PolarHBondContact NH1-OD1 3.05Å; R75-N267 VanDerWaalsContact NH1-OD1 3.11Å
76	I	89.9	Confident	82	Confident	10 Å²	10	50.1 Å²	50.1	5%	0.051	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	159.5	161	61.5	171.9	0	0	0	108.5	L42 A64 L65 K67 Y460 I468	L42-I76 HydrophobicContact CD2-CD1 4.08Å; A64-I76 CarbonylContact C-O 3.51Å; A64-I76 WeakPolarHBondContact CA-O 3.42Å; L65-I76 HydrophobicContact CB-CD1 4.45Å; L65-I76 HydrophobicContact CB-CG1 3.84Å; L65-I76 HydrophobicContact CD1-CD1 4.31Å; L65-I76 HydrophobicContact CD1-CG1 4.37Å; L65-I76 HydrophobicContact CG-CG1 4.49Å; L65-I76 PolarHBondContact N-O 3.44Å; L65-I76 PolarHBondContact O-N 2.79Å; K67-I76 VanDerWaalsContact CE-CD1 3.44Å; I76-Y460 HydrophobicContact CG2-CD2 4.47Å; I76-Y460 HydrophobicContact CG2-CE2 4.11Å; I76-I468 HydrophobicContact CD1-CB 4.41Å; I76-I468 HydrophobicContact CD1-CD1 4.24Å; I76-I468 HydrophobicContact CD1-CG2 3.5Å; I76-I468 VanDerWaalsContact CD1-CG2 3.5Å
77	Y	90.3	Very high	81.8	Confident	31 Å²	31	51.5 Å²	51.5	12%	0.122	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119.3	-171.8	-59.8	-87.6	0	0	0	110.5	L42 F43 R45 Q46 A49 V62 F63 A64 R75 V102	L42-Y77 CarbonylContact C-O 3.5Å; L42-Y77 WeakPolarHBondContact CA-O 3.23Å; F43-Y77 PolarHBondContact N-O 2.98Å; F43-Y77 PolarHBondContact O-N 3.35Å; R45-Y77 VanDerWaalsContact C-CD2 3.43Å; Q46-Y77 HydrophobicContact CB-CD1 3.92Å; Q46-Y77 HydrophobicContact CB-CD2 4.11Å; Q46-Y77 HydrophobicContact CB-CE1 3.52Å; Q46-Y77 HydrophobicContact CB-CE2 3.75Å; Q46-Y77 HydrophobicContact CB-CG 4.19Å; Q46-Y77 VanDerWaalsContact CB-CZ 3.44Å; Q46-Y77 HydrophobicContact CG-CD1 3.73Å; Q46-Y77 HydrophobicContact CG-CE1 3.44Å; Q46-Y77 VanDerWaalsContact CG-CE1 3.44Å; Q46-Y77 HydrophobicContact CG-CG 4.4Å; Q46-Y77 VanDerWaalsContact N-CD2 3.28Å; Q46-Y77 VanDerWaalsContact N-CE2 3.28Å; A49-Y77 HydrophobicContact CB-CG 4.4Å; V62-Y77 HydrophobicContact CG1-CD1 4.27Å; F63-Y77 CarbonylContact O-C 3.55Å; F63-Y77 VanDerWaalsContact O-CA 3.28Å; F63-Y77 WeakPolarHBondContact O-CA 3.44Å; A64-Y77 HydrophobicContact CB-CD1 3.82Å; A64-Y77 HydrophobicContact CB-CE1 3.68Å; R75-Y77 HydrophobicContact CB-CE2 4.46Å; Y77-V102 HydrophobicContact CD1-CG2 4.27Å; Y77-V102 HydrophobicContact CE1-CG2 4.42Å
78	L	91.8	Very high	82	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	133.2	176.4	172.5	65.2	0	0	0	109.9	W40 K41 L42 V62 F63 L65 T80 L85	W40-L78 HydrophobicContact CD2-CD1 3.69Å; W40-L78 HydrophobicContact CD2-CD2 4.36Å; W40-L78 HydrophobicContact CE3-CD1 4.23Å; W40-L78 HydrophobicContact CE3-CD2 4.34Å; W40-L78 HydrophobicContact CG-CD1 3.91Å; W40-L78 HydrophobicContact CH2-CD2 3.54Å; W40-L78 HydrophobicContact CZ2-CD1 4.07Å; W40-L78 HydrophobicContact CZ2-CD2 3.53Å; W40-L78 HydrophobicContact CZ2-CG 4.47Å; W40-L78 HydrophobicContact CZ3-CD2 3.95Å; K41-L78 CarbonylContact O-C 3.55Å; K41-L78 WeakPolarHBondContact O-CA 3.37Å; L42-L78 HydrophobicContact CD2-CB 3.73Å; L42-L78 HydrophobicContact CD2-CD1 3.84Å; L42-L78 HydrophobicContact CD2-CG 4.35Å; L42-L78 HydrophobicContact CG-CD1 4.25Å; V62-L78 CarbonylContact C-O 3.38Å; V62-L78 WeakPolarHBondContact CA-O 3.39Å; F63-L78 HydrophobicContact CB-CB 4.37Å; F63-L78 PolarHBondContact N-O 2.81Å; F63-L78 PolarHBondContact O-N 3Å; L65-L78 HydrophobicContact CD1-CB 4Å; L65-L78 HydrophobicContact CD1-CD2 4.4Å; L65-L78 HydrophobicContact CG-CB 4.27Å; L78-T80 HydrophobicContact CD1-CG2 4.44Å; L78-T80 HydrophobicContact CD2-CG2 3.84Å; L78-T80 HydrophobicContact CG-CG2 3.92Å; L78-L85 HydrophobicContact CD2-CD1 4.06Å
79	V	89.9	Confident	82.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.8	167.9	-174.7	0	0	0	0	109.2	K41 F43 A49 F52 A53 V60 H61 V62	K41-V79 PolarHBondContact N-O 2.73Å; K41-V79 VanDerWaalsContact N-O 3.12Å; K41-V79 PolarHBondContact O-N 3.47Å; F43-V79 HydrophobicContact CD2-CG2 3.88Å; F43-V79 HydrophobicContact CE2-CB 4.15Å; F43-V79 HydrophobicContact CE2-CG2 3.63Å; A49-V79 HydrophobicContact CB-CG2 3.75Å; A49-V79 WeakPolarHBondContact O-CG2 3.49Å; F52-V79 HydrophobicContact CD1-CB 3.77Å; F52-V79 HydrophobicContact CD1-CG1 3.67Å; F52-V79 HydrophobicContact CD1-CG2 3.97Å; F52-V79 HydrophobicContact CE1-CB 4.12Å; F52-V79 HydrophobicContact CE1-CG1 3.9Å; A53-V79 HydrophobicContact CB-CG1 3.8Å; A53-V79 HydrophobicContact CB-CG2 4.39Å; V60-V79 HydrophobicContact CB-CG1 3.78Å; V60-V79 HydrophobicContact CG2-CG1 3.56Å; H61-V79 WeakPolarHBondContact O-CA 3.32Å; V62-V79 HydrophobicContact CG2-CG2 4.22Å
80	T	90.1	Very high	83.5	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	170.6	179.7	-171.8	0	0	0	0	110.8	V39 W40 V60 H61 F63 L78 E84 L85	V39-T80 WeakPolarHBondContact O-CA 3.39Å; V39-T80 WeakPolarHBondContact O-CB 3.31Å; V39-T80 PolarHBondContact O-OG1 3.03Å; W40-T80 HydrophobicContact CE3-CG2 4.2Å; W40-T80 HydrophobicContact CZ3-CG2 4.09Å; V60-T80 WeakPolarHBondContact CA-O 3.31Å; H61-T80 PolarHBondContact N-O 2.95Å; H61-T80 PolarHBondContact O-N 3.44Å; F63-T80 HydrophobicContact CD2-CG2 3.99Å; F63-T80 HydrophobicContact CE2-CG2 3.88Å; L78-T80 HydrophobicContact CD1-CG2 4.44Å; L78-T80 HydrophobicContact CD2-CG2 3.84Å; L78-T80 HydrophobicContact CG-CG2 3.92Å; T80-E84 WeakPolarHBondContact OG1-CB 3.34Å; T80-E84 WeakPolarHBondContact OG1-CG 3.4Å; T80-E84 PolarHBondContact OG1-OE2 3.45Å; T80-L85 HydrophobicContact CG2-CB 3.74Å; T80-L85 HydrophobicContact CG2-CD1 4.46Å
81	S	89.4	Confident	83.9	Confident	12 Å²	12	42.5 Å²	42.5	8%	0.084	22%	0.221	C	C	.	.			trans	-77.9	159.6	172.4	74.3	0	0	0	0	111.7	S83 E84 L85	S81-S83 VanDerWaalsContact C-N 3.29Å; S81-S83 PolarHBondContact O-N 3.4Å; S81-E84 PolarHBondContact O-N 2.84Å; S81-E84 VanDerWaalsContact OG-CB 3.25Å; S81-E84 WeakPolarHBondContact OG-CB 3.19Å; S81-E84 PolarHBondContact OG-N 3.36Å; S81-L85 WeakPolarHBondContact O-CB 3.32Å; S81-L85 PolarHBondContact O-N 2.82Å
82	Y	91.9	Very high	84.6	Confident	16 Å²	16	41.6 Å²	41.6	6%	0.063	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-38.5	175.5	-67.7	-40.3	0	0	0	113.2	H61 F63 W86 L306 L309 N312 V385	H61-Y82 HydrophobicContact CB-CD1 4.4Å; H61-Y82 HydrophobicContact CB-CE1 3.8Å; H61-Y82 AromaticContact CD2-CE1 3.72Å; H61-Y82 AromaticContact CD2-CE2 3.78Å; H61-Y82 AromaticContact CD2-CZ 3.24Å; H61-Y82 PolarHBondContact CD2-OH 3.45Å; H61-Y82 AromaticContact CE1-CD2 3.61Å; H61-Y82 AromaticContact CE1-CE2 3.34Å; H61-Y82 WeakPolarHBondContact CE1-CE2 3.21Å; H61-Y82 AromaticContact CE1-CZ 3.58Å; H61-Y82 AromaticContact CG-CE1 3.41Å; H61-Y82 VanDerWaalsContact CG-CE1 3.41Å; H61-Y82 AromaticContact CG-CZ 3.45Å; H61-Y82 VanDerWaalsContact CG-CZ 3.45Å; H61-Y82 AromaticContact ND1-CD1 3.81Å; H61-Y82 AromaticContact ND1-CD2 3.92Å; H61-Y82 AromaticContact ND1-CE1 3.64Å; H61-Y82 AromaticContact ND1-CE2 3.79Å; H61-Y82 AromaticContact ND1-CG 3.93Å; H61-Y82 AromaticContact ND1-CZ 3.65Å; H61-Y82 AromaticContact NE2-CE2 3.3Å; H61-Y82 VanDerWaalsContact NE2-CE2 3.3Å; H61-Y82 WeakPolarHBondContact NE2-CE2 3.26Å; H61-Y82 AromaticContact NE2-CZ 3.31Å; H61-Y82 VanDerWaalsContact NE2-CZ 3.31Å; H61-Y82 PolarHBondContact NE2-OH 3.48Å; F63-Y82 HydrophobicContact CE1-CD1 4.34Å; F63-Y82 HydrophobicContact CE1-CE1 4.16Å; F63-Y82 AromaticContact CZ-CD1 3.65Å; F63-Y82 HydrophobicContact CZ-CD1 3.65Å; F63-Y82 AromaticContact CZ-CE1 3.68Å; F63-Y82 HydrophobicContact CZ-CE1 3.68Å; Y82-W86 WeakPolarHBondContact O-CB 3.24Å; Y82-W86 PolarHBondContact O-N 2.89Å; Y82-L306 HydrophobicContact CD2-CD2 4.4Å; Y82-L306 HydrophobicContact CG-CD2 4.35Å; Y82-L309 HydrophobicContact CD1-CD1 3.33Å; Y82-L309 HydrophobicContact CD1-CD2 4.38Å; Y82-L309 HydrophobicContact CD1-CG 4.45Å; Y82-L309 HydrophobicContact CD2-CD1 4.1Å; Y82-L309 HydrophobicContact CE1-CD1 3.4Å; Y82-L309 HydrophobicContact CE1-CD2 3.91Å; Y82-L309 HydrophobicContact CE1-CG 4.15Å; Y82-L309 HydrophobicContact CE2-CD1 4.11Å; Y82-L309 HydrophobicContact CG-CD1 3.72Å; Y82-N312 HydrophobicContact CE2-CB 3.83Å; Y82-V385 HydrophobicContact CE2-CG2 4.24Å
83	S	86.3	Confident	85.2	Confident	36 Å²	36	36.7 Å²	36.7	25%	0.252	19%	0.185	S	C	.	.	H	α-helix	trans	-67.5	-42.7	-179	-54.4	0	0	0	0	111.6	S81 W86 H87	S81-S83 VanDerWaalsContact C-N 3.29Å; S81-S83 PolarHBondContact O-N 3.4Å; S83-W86 PolarHBondContact O-N 3.17Å; S83-H87 PolarHBondContact O-N 2.97Å
84	E	86	Confident	85.8	Confident	6 Å²	6	42.9 Å²	42.9	3%	0.028	20%	0.203	C	C	.	.	H	α-helix	trans	-72.1	-41.9	179.2	-174	172.6	-169.1	0	0	111.4	L31 S38 V39 W40 T80 S81 W86 H87 Y88	L31-E84 HydrophobicContact CD1-CG 4.35Å; S38-E84 WeakPolarHBondContact CA-OE1 3.35Å; S38-E84 WeakPolarHBondContact CB-OE1 3.38Å; V39-E84 PolarHBondContact N-OE1 3Å; V39-E84 PolarHBondContact N-OE2 2.74Å; V39-E84 VanDerWaalsContact O-OE2 3.05Å; W40-E84 HydrophobicContact CE3-CG 4.12Å; W40-E84 HydrophobicContact CZ3-CG 4.5Å; T80-E84 WeakPolarHBondContact OG1-CB 3.34Å; T80-E84 WeakPolarHBondContact OG1-CG 3.4Å; T80-E84 PolarHBondContact OG1-OE2 3.45Å; S81-E84 PolarHBondContact O-N 2.84Å; S81-E84 VanDerWaalsContact OG-CB 3.25Å; S81-E84 WeakPolarHBondContact OG-CB 3.19Å; S81-E84 PolarHBondContact OG-N 3.36Å; E84-W86 VanDerWaalsContact C-N 3.34Å; E84-W86 PolarHBondContact O-N 3.47Å; E84-H87 PolarHBondContact O-N 3.43Å; E84-Y88 HydrophobicContact CG-CD2 3.86Å; E84-Y88 HydrophobicContact CG-CE2 3.71Å; E84-Y88 VanDerWaalsContact O-CD2 3.31Å; E84-Y88 WeakPolarHBondContact O-CD2 3.22Å; E84-Y88 PolarHBondContact O-N 2.84Å; E84-Y88 VanDerWaalsContact O-N 3.15Å
85	L	91.1	Very high	85.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-53.1	-54.4	168.5	179.8	60.9	0	0	0	110.2	W40 F63 L78 T80 S81 H87 Y88 Y89 L270 F305	W40-L85 HydrophobicContact CH2-CD1 4.26Å; F63-L85 HydrophobicContact CD1-CD2 3.45Å; F63-L85 VanDerWaalsContact CD1-CD2 3.45Å; F63-L85 HydrophobicContact CD2-CD2 3.79Å; F63-L85 HydrophobicContact CE1-CD2 3.25Å; F63-L85 HydrophobicContact CE2-CB 4.39Å; F63-L85 HydrophobicContact CE2-CD2 3.6Å; F63-L85 HydrophobicContact CG-CD2 3.71Å; F63-L85 HydrophobicContact CZ-CD2 3.33Å; L78-L85 HydrophobicContact CD2-CD1 4.06Å; T80-L85 HydrophobicContact CG2-CB 3.74Å; T80-L85 HydrophobicContact CG2-CD1 4.46Å; S81-L85 WeakPolarHBondContact O-CB 3.32Å; S81-L85 PolarHBondContact O-N 2.82Å; L85-H87 VanDerWaalsContact C-N 3.27Å; L85-H87 PolarHBondContact O-N 3.1Å; L85-Y88 PolarHBondContact O-N 3.24Å; L85-Y89 WeakPolarHBondContact O-CA 3.35Å; L85-Y89 WeakPolarHBondContact O-CB 3.23Å; L85-Y89 PolarHBondContact O-N 3.38Å; L85-L270 HydrophobicContact CD2-CD1 4.06Å; L85-F305 HydrophobicContact CD2-CZ 3.91Å; L85-F305 HydrophobicContact CG-CZ 4.29Å
86	W	90.8	Very high	85.5	Confident	6 Å²	6	37 Å²	37	2%	0.023	18%	0.184	C	C	.	.	H	α-helix	trans	-58	-39.6	-176.9	-179.3	-117.6	0	0	0	113	Y82 S83 E84 Y89 R90 E301 E302 F305	Y82-W86 WeakPolarHBondContact O-CB 3.24Å; Y82-W86 PolarHBondContact O-N 2.89Å; S83-W86 PolarHBondContact O-N 3.17Å; E84-W86 VanDerWaalsContact C-N 3.34Å; E84-W86 PolarHBondContact O-N 3.47Å; W86-Y89 AromaticContact CE3-CD1 3.98Å; W86-Y89 HydrophobicContact CE3-CD1 3.98Å; W86-Y89 AromaticContact CZ3-CD1 3.86Å; W86-Y89 HydrophobicContact CZ3-CD1 3.86Å; W86-Y89 HydrophobicContact CZ3-CE1 4.29Å; W86-R90 WeakPolarHBondContact O-CB 3.42Å; W86-R90 PolarHBondContact O-N 3Å; W86-R90 VanDerWaalsContact O-N 3.1Å; W86-E301 HydrophobicContact CH2-CB 4.38Å; W86-E301 HydrophobicContact CH2-CG 3.61Å; W86-E301 HydrophobicContact CZ2-CB 4.01Å; W86-E301 HydrophobicContact CZ2-CG 3.72Å; W86-E302 VanDerWaalsContact CD1-CG 3.44Å; W86-E302 HydrophobicContact CG-CG 4.07Å; W86-E302 HydrophobicContact CZ2-CB 4.4Å; W86-E302 VanDerWaalsContact NE1-CB 3.31Å; W86-F305 HydrophobicContact CB-CD1 3.98Å; W86-F305 HydrophobicContact CB-CE1 3.83Å; W86-F305 HydrophobicContact CD2-CB 4.24Å; W86-F305 AromaticContact CD2-CD1 3.94Å; W86-F305 HydrophobicContact CD2-CD1 3.94Å; W86-F305 HydrophobicContact CD2-CG 4.06Å; W86-F305 HydrophobicContact CE3-CB 3.65Å; W86-F305 AromaticContact CE3-CD1 3.61Å; W86-F305 HydrophobicContact CE3-CD1 3.61Å; W86-F305 AromaticContact CE3-CD2 3.68Å; W86-F305 HydrophobicContact CE3-CD2 3.68Å; W86-F305 HydrophobicContact CE3-CE1 4.17Å; W86-F305 HydrophobicContact CE3-CE2 4.22Å; W86-F305 AromaticContact CE3-CG 3.34Å; W86-F305 HydrophobicContact CE3-CG 3.34Å; W86-F305 HydrophobicContact CE3-CZ 4.44Å; W86-F305 HydrophobicContact CG-CD1 4.11Å; W86-F305 HydrophobicContact CG-CE1 4.44Å; W86-F305 HydrophobicContact CH2-CB 4.19Å; W86-F305 HydrophobicContact CZ3-CB 3.63Å; W86-F305 HydrophobicContact CZ3-CD1 4.43Å; W86-F305 AromaticContact CZ3-CD2 3.9Å; W86-F305 HydrophobicContact CZ3-CD2 3.9Å; W86-F305 AromaticContact CZ3-CG 3.73Å; W86-F305 HydrophobicContact CZ3-CG 3.73Å
87	H	84.9	Confident	85.3	Confident	58 Å²	58	38.8 Å²	38.8	27%	0.269	19%	0.192	S	C	.	.	H	α-helix	trans	-57.7	-57.6	176	178.5	85.9	0	0	0	111.4	L31 S83 E84 L85 R90 V91	L31-H87 HydrophobicContact CD1-CB 3.47Å; L31-H87 VanDerWaalsContact CD1-CB 3.47Å; L31-H87 WeakPolarHBondContact CD2-NE2 3.31Å; S83-H87 PolarHBondContact O-N 2.97Å; E84-H87 PolarHBondContact O-N 3.43Å; L85-H87 VanDerWaalsContact C-N 3.27Å; L85-H87 PolarHBondContact O-N 3.1Å; H87-R90 PolarHBondContact O-N 3.48Å; H87-V91 VanDerWaalsContact O-CG2 3.27Å; H87-V91 WeakPolarHBondContact O-CG2 3.19Å; H87-V91 PolarHBondContact O-N 2.99Å
88	Y	82.8	Confident	85.4	Confident	43 Å²	43	37.8 Å²	37.8	17%	0.169	19%	0.189	C	C	.	.	H	α-helix	trans	-70.8	-33.5	-177.1	-71	-59.6	0	0	0	112.8	W40 E84 L85 R90 V91 Y92	W40-Y88 HydrophobicContact CD2-CD2 4.31Å; W40-Y88 AromaticContact CE3-CD2 3.52Å; W40-Y88 HydrophobicContact CE3-CD2 3.52Å; W40-Y88 AromaticContact CE3-CE2 4Å; W40-Y88 HydrophobicContact CE3-CE2 4Å; W40-Y88 HydrophobicContact CE3-CG 4.39Å; W40-Y88 AromaticContact CH2-CD2 3.97Å; W40-Y88 HydrophobicContact CH2-CD2 3.97Å; W40-Y88 HydrophobicContact CH2-CG 4.08Å; W40-Y88 AromaticContact CZ3-CD2 3.32Å; W40-Y88 HydrophobicContact CZ3-CD2 3.32Å; W40-Y88 HydrophobicContact CZ3-CE2 4.25Å; W40-Y88 AromaticContact CZ3-CG 3.89Å; W40-Y88 HydrophobicContact CZ3-CG 3.89Å; E84-Y88 HydrophobicContact CG-CD2 3.86Å; E84-Y88 HydrophobicContact CG-CE2 3.71Å; E84-Y88 VanDerWaalsContact O-CD2 3.31Å; E84-Y88 WeakPolarHBondContact O-CD2 3.22Å; E84-Y88 PolarHBondContact O-N 2.84Å; E84-Y88 VanDerWaalsContact O-N 3.15Å; L85-Y88 PolarHBondContact O-N 3.24Å; Y88-R90 VanDerWaalsContact C-N 3.28Å; Y88-R90 PolarHBondContact O-N 3.38Å; Y88-V91 PolarHBondContact O-N 2.91Å; Y88-Y92 AromaticContact CD1-CD2 3.92Å; Y88-Y92 HydrophobicContact CD1-CD2 3.92Å; Y88-Y92 AromaticContact CD1-CE2 3.61Å; Y88-Y92 HydrophobicContact CD1-CE2 3.61Å; Y88-Y92 HydrophobicContact CE1-CE2 4.15Å; Y88-Y92 PolarHBondContact O-N 2.92Å
89	Y	84.8	Confident	85.6	Confident	13 Å²	13	37.8 Å²	37.8	5%	0.051	19%	0.189	C	C	.	.	H	α-helix	trans	-62.7	-34.8	177	-169.9	-108.2	0	0	0	112.4	L85 W86 L96 C99 L270 Y271 K272 S273	L85-Y89 WeakPolarHBondContact O-CA 3.35Å; L85-Y89 WeakPolarHBondContact O-CB 3.23Å; L85-Y89 PolarHBondContact O-N 3.38Å; W86-Y89 AromaticContact CE3-CD1 3.98Å; W86-Y89 HydrophobicContact CE3-CD1 3.98Å; W86-Y89 AromaticContact CZ3-CD1 3.86Å; W86-Y89 HydrophobicContact CZ3-CD1 3.86Å; W86-Y89 HydrophobicContact CZ3-CE1 4.29Å; Y89-L96 HydrophobicContact CD2-CB 3.69Å; Y89-L96 HydrophobicContact CD2-CD1 4.46Å; Y89-L96 HydrophobicContact CE2-CB 4.22Å; Y89-L96 WeakPolarHBondContact CE2-O 3.5Å; Y89-C99 HydrophobicContact CE2-CB 3.85Å; Y89-L270 HydrophobicContact CE2-CD1 4.5Å; Y89-Y271 WeakPolarHBondContact CE1-O 3.48Å; Y89-Y271 PolarHBondContact OH-O 3.11Å; Y89-K272 HydrophobicContact CE1-CB 4.09Å; Y89-S273 WeakPolarHBondContact OH-CA 3.24Å; Y89-S273 WeakPolarHBondContact OH-CB 3.35Å; Y89-S273 PolarHBondContact OH-N 3.15Å; Y89-S273 PolarHBondContact OH-OG 3.21Å
90	R	83.8	Confident	85.9	Confident	121 Å²	121	38.4 Å²	38.4	46%	0.457	19%	0.191	S	C	.	.	H	α-helix	trans	-77.7	-34.7	173.8	-175.6	176	62.9	-145.9	-2.9	113	W86 H87 Y88	W86-R90 WeakPolarHBondContact O-CB 3.42Å; W86-R90 PolarHBondContact O-N 3Å; W86-R90 VanDerWaalsContact O-N 3.1Å; H87-R90 PolarHBondContact O-N 3.48Å; Y88-R90 VanDerWaalsContact C-N 3.28Å; Y88-R90 PolarHBondContact O-N 3.38Å
91	V	77.3	Confident	86.2	Confident	71 Å²	71	38.6 Å²	38.6	43%	0.43	19%	0.192	S	C	.	.	H	α-helix	trans	-78.2	-39	-177.1	175.1	0	0	0	0	111.6	H87 Y88 P93	H87-V91 VanDerWaalsContact O-CG2 3.27Å; H87-V91 WeakPolarHBondContact O-CG2 3.19Å; H87-V91 PolarHBondContact O-N 2.99Å; Y88-V91 PolarHBondContact O-N 2.91Å; V91-P93 WeakPolarHBondContact O-CD 3.13Å
92	Y	79.3	Confident	86.6	Confident	59 Å²	59	38.2 Å²	38.2	23%	0.231	19%	0.189	C	C	.	.			trans	-118.7	63	-175.5	-54.7	-72.8	0	0	0	111.9	Y88 Q94 S95 L96 M462 D464 T465	Y88-Y92 AromaticContact CD1-CD2 3.92Å; Y88-Y92 HydrophobicContact CD1-CD2 3.92Å; Y88-Y92 AromaticContact CD1-CE2 3.61Å; Y88-Y92 HydrophobicContact CD1-CE2 3.61Å; Y88-Y92 HydrophobicContact CE1-CE2 4.15Å; Y88-Y92 PolarHBondContact O-N 2.92Å; Y92-Q94 PolarHBondContact O-N 2.84Å; Y92-S95 PolarHBondContact O-N 3.36Å; Y92-L96 PolarHBondContact O-N 2.89Å; Y92-M462 HydrophobicContact CD2-CE 3.77Å; Y92-M462 HydrophobicContact CE2-CE 4.29Å; Y92-M462 HydrophobicContact CG-CE 4.2Å; Y92-D464 PolarHBondContact OH-O 3.44Å; Y92-T465 WeakPolarHBondContact CD1-O 3.43Å; Y92-T465 WeakPolarHBondContact CE1-O 3.09Å
93	P	76.8	Confident	86.9	Confident	79 Å²	79	37.5 Å²	37.5	51%	0.513	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.6	-173.7	26	-34.9	0	0	0	113.2	V91 M97	V91-P93 WeakPolarHBondContact O-CD 3.13Å; P93-M97 VanDerWaalsContact O-CA 3.3Å; P93-M97 WeakPolarHBondContact O-CA 3.43Å; P93-M97 WeakPolarHBondContact O-CB 3.38Å; P93-M97 PolarHBondContact O-N 2.89Å; P93-M97 VanDerWaalsContact O-N 3.14Å
94	Q	76.8	Confident	87.1	Confident	170 Å²	170	36.6 Å²	36.6	79%	0.794	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-46.2	177.3	-68.4	178.9	-16.3	0	0	111.4	Y92 L96	Y92-Q94 PolarHBondContact O-N 2.84Å; Q94-L96 VanDerWaalsContact C-N 3.33Å; Q94-L96 PolarHBondContact O-N 3.32Å
95	S	78.3	Confident	87.3	Confident	45 Å²	45	40.2 Å²	40.2	32%	0.315	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-31.1	-177.3	-52.7	0	0	0	0	113.6	Y92 G466	Y92-S95 PolarHBondContact O-N 3.36Å; S95-G466 WeakPolarHBondContact CB-O 3.31Å; S95-G466 PolarHBondContact OG-O 2.69Å
96	L	84	Confident	87.1	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	16.6	-177.4	-60.1	171.5	0	0	0	112.7	W40 L65 Y89 Y92 Q94 H98 C99 M462 I468	W40-L96 HydrophobicContact CH2-CD1 3.77Å; W40-L96 HydrophobicContact CZ2-CD1 4.1Å; W40-L96 HydrophobicContact CZ2-CD2 4.23Å; L65-L96 HydrophobicContact CD1-CD2 3.94Å; L65-L96 HydrophobicContact CD2-CD2 3.92Å; Y89-L96 HydrophobicContact CD2-CB 3.69Å; Y89-L96 HydrophobicContact CD2-CD1 4.46Å; Y89-L96 HydrophobicContact CE2-CB 4.22Å; Y89-L96 WeakPolarHBondContact CE2-O 3.5Å; Y92-L96 PolarHBondContact O-N 2.89Å; Q94-L96 VanDerWaalsContact C-N 3.33Å; Q94-L96 PolarHBondContact O-N 3.32Å; L96-H98 PolarHBondContact O-N 3.47Å; L96-H98 VanDerWaalsContact O-N 3.12Å; L96-C99 WeakPolarHBondContact O-CB 3.42Å; L96-M462 HydrophobicContact CD1-CE 4.49Å; L96-I468 HydrophobicContact CD2-CD1 4.36Å
97	M	85.6	Confident	87.2	Confident	48 Å²	48	40.2 Å²	40.2	24%	0.236	20%	0.199	C	C	.	.	S	Bend	trans	-59.7	-27	-176.1	-165.3	163.5	67.1	0	0	113.8	P93 S273 S274	P93-M97 VanDerWaalsContact O-CA 3.3Å; P93-M97 WeakPolarHBondContact O-CA 3.43Å; P93-M97 WeakPolarHBondContact O-CB 3.38Å; P93-M97 PolarHBondContact O-N 2.89Å; P93-M97 VanDerWaalsContact O-N 3.14Å; M97-S273 CarbonylContact O-C 3.59Å; M97-S273 WeakPolarHBondContact O-CA 3.47Å; M97-S273 VanDerWaalsContact O-CB 3.29Å; M97-S273 WeakPolarHBondContact O-CB 3.17Å; M97-S273 PolarHBondContact O-OG 2.87Å; M97-S274 PolarHBondContact O-N 3.18Å
98	H	92	Very high	87.7	Confident	9 Å²	9	37.5 Å²	37.5	4%	0.042	19%	0.186	C	C	.	.	S	Bend	trans	-113.6	58.5	-171.8	-53	-51.9	0	0	0	111.4	E66 E68 L96 S274 K275 V276	E66-H98 HydrophobicContact CB-CB 3.94Å; E66-H98 PolarHBondContact N-O 3.29Å; E66-H98 WeakPolarHBondContact O-CB 3.33Å; E68-H98 IonicContact OE1-NE2 2.66Å; E68-H98 PolarHBondContact OE1-NE2 2.93Å; L96-H98 PolarHBondContact O-N 3.47Å; L96-H98 VanDerWaalsContact O-N 3.12Å; H98-S274 WeakPolarHBondContact CA-O 3.19Å; H98-S274 PolarHBondContact CE1-OG 3.3Å; H98-S274 PolarHBondContact ND1-O 2.74Å; H98-S274 PolarHBondContact ND1-OG 3.44Å; H98-K275 PolarHBondContact CE1-O 3.38Å; H98-K275 VanDerWaalsContact CE1-O 3.3Å; H98-K275 PolarHBondContact ND1-O 3.5Å; H98-V276 HydrophobicContact CB-CG2 3.89Å; H98-V276 WeakPolarHBondContact CD2-CG2 3.34Å; H98-V276 PolarHBondContact ND1-N 3.18Å
99	C	94.8	Very high	88.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	141.2	-173.2	-165.5	0	0	0	0	112	A64 L65 Y89 L96 L270 S273	A64-C99 WeakPolarHBondContact O-CA 3.32Å; L65-C99 HydrophobicContact CD2-CB 3.96Å; L65-C99 WeakPolarHBondContact CD2-SG 3.49Å; Y89-C99 HydrophobicContact CE2-CB 3.85Å; L96-C99 WeakPolarHBondContact O-CB 3.42Å; C99-L270 HydrophobicContact CB-CD1 3.79Å; C99-L270 HydrophobicContact CB-CG 4.4Å; C99-L270 PolarHBondContact O-N 2.8Å; C99-L270 VanDerWaalsContact O-N 3.09Å; C99-L270 WeakPolarHBondContact SG-CD1 3.48Å; C99-S273 WeakPolarHBondContact CA-OG 3.38Å; C99-S273 WeakPolarHBondContact CB-OG 3.36Å; C99-S273 PolarHBondContact N-OG 3.45Å; C99-S273 VanDerWaalsContact O-CB 3.28Å; C99-S273 WeakPolarHBondContact O-CB 3.42Å; C99-S273 PolarHBondContact O-OG 3.46Å
100	Y	96.9	Very high	89	Confident	13 Å²	13	35.4 Å²	35.4	5%	0.051	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.4	-179.1	-57.4	-102.8	0	0	0	109.5	F63 A64 E66 N267 F268 R269 K275	F63-Y100 CarbonylContact C-O 3.45Å; F63-Y100 VanDerWaalsContact CA-O 3.24Å; F63-Y100 WeakPolarHBondContact CA-O 3.25Å; A64-Y100 PolarHBondContact N-O 2.98Å; A64-Y100 PolarHBondContact O-N 3.02Å; E66-Y100 HydrophobicContact CB-CE2 4.06Å; E66-Y100 WeakPolarHBondContact OE2-CE2 3.26Å; E66-Y100 PolarHBondContact OE2-OH 3.35Å; Y100-N267 HydrophobicContact CD1-CB 4.45Å; Y100-N267 HydrophobicContact CG-CB 4.45Å; Y100-F268 CarbonylContact C-O 3.47Å; Y100-F268 WeakPolarHBondContact CA-O 3.26Å; Y100-R269 HydrophobicContact CD1-CB 3.66Å; Y100-R269 HydrophobicContact CD1-CG 4.17Å; Y100-R269 HydrophobicContact CE1-CB 3.67Å; Y100-R269 HydrophobicContact CE1-CG 3.95Å; Y100-K275 WeakPolarHBondContact OH-CG 3.45Å
101	E	97.8	Very high	89.7	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.023	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	130.6	163.4	-177.2	176.8	-160.6	0	0	108.6	I103 N267 F268 L270 L309 V310 C311	E101-I103 HydrophobicContact CG-CG1 4.41Å; E101-N267 CarbonylContact O-C 3.51Å; E101-N267 VanDerWaalsContact O-CA 3.3Å; E101-N267 WeakPolarHBondContact O-CA 3.47Å; E101-F268 PolarHBondContact N-O 3.35Å; E101-F268 PolarHBondContact O-N 3.43Å; E101-L270 HydrophobicContact CB-CD2 3.7Å; E101-L309 HydrophobicContact CB-CD2 4.32Å; E101-L309 HydrophobicContact CG-CD2 4.21Å; E101-L309 WeakPolarHBondContact OE2-CA 3.11Å; E101-V310 PolarHBondContact OE1-N 3.5Å; E101-V310 PolarHBondContact OE2-N 2.67Å; E101-C311 WeakPolarHBondContact OE1-CB 3.42Å; E101-C311 PolarHBondContact OE1-N 3.42Å
102	V	97.6	Very high	90.7	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.024	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	109.6	165.6	-178.5	0	0	0	0	107.2	Q46 I50 V62 A64 Y77 P104 N265	Q46-V102 HydrophobicContact CG-CG1 4.39Å; I50-V102 HydrophobicContact CD1-CG1 4.46Å; V62-V102 HydrophobicContact CB-CB 4.11Å; V62-V102 HydrophobicContact CB-CG2 4.37Å; V62-V102 HydrophobicContact CG1-CB 4.15Å; V62-V102 HydrophobicContact CG1-CG2 3.9Å; V62-V102 WeakPolarHBondContact O-CB 3.28Å; V62-V102 PolarHBondContact O-N 2.91Å; V62-V102 VanDerWaalsContact O-N 3.1Å; A64-V102 HydrophobicContact CB-CG2 3.98Å; Y77-V102 HydrophobicContact CD1-CG2 4.27Å; Y77-V102 HydrophobicContact CE1-CG2 4.42Å; V102-P104 WeakPolarHBondContact O-CD 3.26Å; V102-N265 HydrophobicContact CG1-CB 4.34Å
103	I	96.6	Very high	91.6	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	101.5	176	-61.9	170.8	0	0	0	107.8	E101 Y112 N182 N265 R266 F268 V310	E101-I103 HydrophobicContact CG-CG1 4.41Å; I103-Y112 HydrophobicContact CD1-CE1 4.11Å; I103-Y112 HydrophobicContact CD1-CE2 4.25Å; I103-N182 HydrophobicContact CG2-CB 4.11Å; I103-N265 CarbonylContact O-C 3.57Å; I103-N265 WeakPolarHBondContact O-CA 3.43Å; I103-N265 PolarHBondContact O-N 3.24Å; I103-R266 HydrophobicContact CB-CB 4.46Å; I103-R266 WeakPolarHBondContact CB-O 3.26Å; I103-R266 HydrophobicContact CD1-CB 4.44Å; I103-R266 PolarHBondContact N-O 2.79Å; I103-R266 PolarHBondContact O-N 3.33Å; I103-F268 HydrophobicContact CD1-CB 3.76Å; I103-F268 HydrophobicContact CD1-CG 4.27Å; I103-F268 HydrophobicContact CG1-CB 4.33Å; I103-V310 HydrophobicContact CD1-CB 3.94Å; I103-V310 HydrophobicContact CD1-CG1 3.76Å; I103-V310 HydrophobicContact CD1-CG2 4.17Å; I103-V310 HydrophobicContact CG1-CB 4.17Å; I103-V310 HydrophobicContact CG1-CG1 4.19Å
104	P	91.8	Very high	92.7	Very high	18 Å²	18	20.5 Å²	20.5	12%	0.117	11%	0.105	C	C	.	.			trans	-66.9	146.5	-170.6	-17.7	33.5	0	0	0	111.5	V102 G106 A107 C311	V102-P104 WeakPolarHBondContact O-CD 3.26Å; P104-G106 PolarHBondContact O-N 3.16Å; P104-A107 HydrophobicContact CB-CB 4.11Å; P104-A107 HydrophobicContact CG-CB 4.28Å; P104-A107 WeakPolarHBondContact O-CB 3.39Å; P104-A107 PolarHBondContact O-N 3.04Å; P104-C311 VanDerWaalsContact CD-SG 3.56Å
105	E	89.4	Confident	93.7	Very high	81 Å²	81	12.4 Å²	12.4	38%	0.379	7%	0.067	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	130.2	172.5	178.1	174.7	-176.8	0	0	111.2	A107 K264 N265	E105-A107 PolarHBondContact O-N 3.32Å; E105-K264 HydrophobicContact CB-CB 4.37Å; E105-K264 HydrophobicContact CG-CB 4.5Å; E105-K264 HydrophobicContact CG-CD 4.44Å; E105-K264 HydrophobicContact CG-CG 4.14Å; E105-K264 WeakPolarHBondContact OE1-CE 3.3Å; E105-K264 IonicContact OE1-NZ 3.85Å; E105-K264 PolarHBondContact OE1-NZ 3.49Å; E105-K264 WeakPolarHBondContact OE2-CD 3.5Å; E105-K264 IonicContact OE2-NZ 3.05Å; E105-N265 PolarHBondContact N-OD1 2.91Å
106	G	88.3	Confident	94.6	Very high	7 Å²	7	13.1 Å²	13.1	7%	0.072	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	-0.3	177.1	0	0	0	0	0	115.3	P104	P104-G106 PolarHBondContact O-N 3.16Å
107	A	91.4	Very high	95.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.068	C	C	.	.	B	Isolated β-bridge	trans	-73.8	132	174.2	0	0	0	0	0	111.2	P104 E105 C109 K180 D181 Y382 A384	P104-A107 HydrophobicContact CB-CB 4.11Å; P104-A107 HydrophobicContact CG-CB 4.28Å; P104-A107 WeakPolarHBondContact O-CB 3.39Å; P104-A107 PolarHBondContact O-N 3.04Å; E105-A107 PolarHBondContact O-N 3.32Å; A107-C109 PolarHBondContact O-N 3.49Å; A107-K180 CarbonylContact C-O 3.32Å; A107-D181 WeakPolarHBondContact O-CA 3.23Å; A107-Y382 HydrophobicContact CB-CD1 4.09Å; A107-A384 HydrophobicContact CB-CB 4.42Å
108	V	95.2	Very high	95.8	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.065	C	C	.	.			trans	-57.4	130.5	170.1	172	0	0	0	0	109	A178 F179 K180 V313 I320 N381 Y382 F383	V108-A178 HydrophobicContact CG1-CB 3.55Å; V108-F179 WeakPolarHBondContact CA-O 3.17Å; V108-F179 WeakPolarHBondContact CG1-O 3.47Å; V108-K180 VanDerWaalsContact CA-O 3.31Å; V108-K180 WeakPolarHBondContact CA-O 3.44Å; V108-K180 PolarHBondContact N-O 2.68Å; V108-V313 HydrophobicContact CG1-CB 4.42Å; V108-V313 HydrophobicContact CG1-CG1 4.01Å; V108-I320 HydrophobicContact CG1-CD1 3.99Å; V108-I320 HydrophobicContact CG2-CD1 4.16Å; V108-N381 HydrophobicContact CG2-CB 3.99Å; V108-Y382 WeakPolarHBondContact CB-O 3.42Å; V108-Y382 VanDerWaalsContact CG2-O 3.32Å; V108-Y382 WeakPolarHBondContact CG2-O 3.39Å; V108-Y382 PolarHBondContact N-O 3.19Å; V108-F383 HydrophobicContact CB-CD1 4.18Å; V108-F383 HydrophobicContact CB-CE1 4.28Å; V108-F383 HydrophobicContact CG1-CD1 4.18Å; V108-F383 HydrophobicContact CG1-CE1 3.96Å; V108-F383 HydrophobicContact CG2-CD1 4.29Å; V108-F383 HydrophobicContact CG2-CE1 4.12Å; V108-F383 HydrophobicContact CG2-CE2 4.46Å; V108-F383 HydrophobicContact CG2-CZ 4.2Å
109	C	97.4	Very high	96	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.078	C	C	.	.	B	Isolated β-bridge	trans	-139	161.4	-172.2	77.9	0	0	0	0	113.1	A107 F179 D181 N182 V310	A107-C109 PolarHBondContact O-N 3.49Å; C109-F179 PolarHBondContact N-O 3.17Å; C109-F179 PolarHBondContact O-N 3.41Å; C109-D181 VanDerWaalsContact SG-C 3.5Å; C109-N182 PolarHBondContact SG-N 3.22Å; C109-N182 VanDerWaalsContact SG-N 3.39Å; C109-V310 HydrophobicContact CB-CG1 3.86Å
110	K	98	Very high	96	Very high	13 Å²	13	19.2 Å²	19.2	6%	0.057	10%	0.097	C	C	.	.			trans	-69.3	159.6	169	-62.7	168.3	-173.9	166.9	0	110.1	I171 M173 L306 A307 L309 V310 N312 V313	K110-I171 HydrophobicContact CB-CG2 4.15Å; K110-I171 HydrophobicContact CD-CG2 3.66Å; K110-M173 HydrophobicContact CD-SD 3.7Å; K110-M173 VanDerWaalsContact CE-SD 3.54Å; K110-L306 PolarHBondContact NZ-O 2.88Å; K110-A307 PolarHBondContact NZ-O 3.29Å; K110-L309 WeakPolarHBondContact CE-O 3.3Å; K110-L309 PolarHBondContact NZ-O 3.15Å; K110-V310 WeakPolarHBondContact CG-O 3.36Å; K110-V310 PolarHBondContact N-O 2.96Å; K110-N312 WeakPolarHBondContact CE-O 3.37Å; K110-N312 PolarHBondContact NZ-O 3.19Å; K110-V313 HydrophobicContact CG-CG2 3.78Å
111	L	98.4	Very high	95.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	129.3	163.8	164.7	64.1	0	0	0	108.4	F113 V138 L142 F172 F179 V185 I189	L111-F113 HydrophobicContact CD1-CD2 4.42Å; L111-F113 HydrophobicContact CD1-CE2 3.71Å; L111-F113 HydrophobicContact CD1-CZ 4.14Å; L111-F113 HydrophobicContact CD2-CE2 4.2Å; L111-F113 HydrophobicContact CG-CE2 3.93Å; L111-V138 HydrophobicContact CD2-CG1 3.8Å; L111-L142 HydrophobicContact CD2-CD1 3.96Å; L111-L142 HydrophobicContact CD2-CD2 4.26Å; L111-L142 HydrophobicContact CD2-CG 4.49Å; L111-F172 HydrophobicContact CB-CB 3.94Å; L111-F172 HydrophobicContact CB-CG 4.33Å; L111-F172 HydrophobicContact CD2-CB 4.22Å; L111-F172 HydrophobicContact CD2-CD1 3.87Å; L111-F172 HydrophobicContact CD2-CD2 4.11Å; L111-F172 HydrophobicContact CD2-CE1 4.25Å; L111-F172 HydrophobicContact CD2-CE2 4.48Å; L111-F172 HydrophobicContact CD2-CG 3.81Å; L111-F172 HydrophobicContact CG-CB 4.12Å; L111-F172 HydrophobicContact CG-CD2 3.94Å; L111-F172 HydrophobicContact CG-CG 3.95Å; L111-F172 WeakPolarHBondContact O-CB 3.45Å; L111-F172 PolarHBondContact O-N 2.93Å; L111-F179 HydrophobicContact CB-CD2 3.96Å; L111-F179 HydrophobicContact CB-CE2 3.77Å; L111-F179 HydrophobicContact CD2-CE2 4.37Å; L111-F179 HydrophobicContact CG-CE2 4.46Å; L111-V185 HydrophobicContact CD1-CG1 3.51Å; L111-I189 HydrophobicContact CD1-CD1 3.97Å; L111-I189 HydrophobicContact CD1-CG1 4.28Å
112	Y	98.8	Very high	95.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	158.4	-179.6	69.5	-81.2	0	0	0	111.3	I103 L170 N182 V261 Y262 F268 V310	I103-Y112 HydrophobicContact CD1-CE1 4.11Å; I103-Y112 HydrophobicContact CD1-CE2 4.25Å; Y112-L170 CarbonylContact C-O 3.54Å; Y112-L170 WeakPolarHBondContact CA-O 3.36Å; Y112-N182 HydrophobicContact CE1-CB 3.96Å; Y112-N182 PolarHBondContact OH-ND2 3.42Å; Y112-V261 HydrophobicContact CD2-CG2 4.46Å; Y112-V261 HydrophobicContact CE2-CB 4.21Å; Y112-V261 HydrophobicContact CE2-CG2 3.72Å; Y112-V261 PolarHBondContact OH-O 2.93Å; Y112-Y262 HydrophobicContact CE1-CD1 4.35Å; Y112-Y262 HydrophobicContact CE1-CE1 4.32Å; Y112-Y262 HydrophobicContact CE2-CD1 4.48Å; Y112-Y262 HydrophobicContact CE2-CE1 4.22Å; Y112-Y262 AromaticContact CZ-CD1 3.98Å; Y112-Y262 PolarHBondContact O-OH 3.49Å; Y112-F268 HydrophobicContact CD2-CD2 4.15Å; Y112-F268 HydrophobicContact CD2-CE1 4.18Å; Y112-F268 AromaticContact CD2-CE2 3.65Å; Y112-F268 HydrophobicContact CD2-CE2 3.65Å; Y112-F268 AromaticContact CD2-CZ 3.65Å; Y112-F268 HydrophobicContact CD2-CZ 3.65Å; Y112-F268 AromaticContact CE2-CD2 3.98Å; Y112-F268 HydrophobicContact CE2-CD2 3.98Å; Y112-F268 AromaticContact CE2-CE2 3.84Å; Y112-F268 HydrophobicContact CE2-CE2 3.84Å; Y112-F268 HydrophobicContact CE2-CZ 4.31Å; Y112-V310 HydrophobicContact CD1-CB 4.48Å; Y112-V310 HydrophobicContact CD1-CG1 3.45Å; Y112-V310 VanDerWaalsContact CD1-CG1 3.45Å; Y112-V310 HydrophobicContact CD1-CG2 4.16Å; Y112-V310 HydrophobicContact CD2-CG2 4.44Å; Y112-V310 HydrophobicContact CE1-CG1 3.73Å; Y112-V310 HydrophobicContact CG-CG1 4.13Å; Y112-V310 HydrophobicContact CG-CG2 3.97Å
113	F	98.8	Very high	95.5	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145	175.7	-66.1	-101.9	0	0	0	110.4	L111 L115 L134 V138 H169 L170 F172 I189 V257	L111-F113 HydrophobicContact CD1-CD2 4.42Å; L111-F113 HydrophobicContact CD1-CE2 3.71Å; L111-F113 HydrophobicContact CD1-CZ 4.14Å; L111-F113 HydrophobicContact CD2-CE2 4.2Å; L111-F113 HydrophobicContact CG-CE2 3.93Å; F113-L115 HydrophobicContact CB-CD2 3.9Å; F113-L115 HydrophobicContact CB-CG 4.16Å; F113-L115 HydrophobicContact CD1-CD2 4.36Å; F113-L134 HydrophobicContact CD1-CD2 4.34Å; F113-V138 HydrophobicContact CE1-CG2 4.33Å; F113-V138 HydrophobicContact CE2-CG1 4.2Å; F113-V138 HydrophobicContact CE2-CG2 4.29Å; F113-V138 HydrophobicContact CZ-CB 4.46Å; F113-V138 HydrophobicContact CZ-CG1 4.08Å; F113-V138 HydrophobicContact CZ-CG2 3.6Å; F113-H169 WeakPolarHBondContact O-CA 3.4Å; F113-L170 HydrophobicContact CB-CB 4.17Å; F113-L170 HydrophobicContact CD2-CB 4.33Å; F113-L170 PolarHBondContact N-O 3.1Å; F113-L170 PolarHBondContact O-N 3.23Å; F113-F172 HydrophobicContact CD2-CD2 4.21Å; F113-F172 AromaticContact CD2-CE2 3.66Å; F113-F172 HydrophobicContact CD2-CE2 3.66Å; F113-F172 HydrophobicContact CE2-CD2 4.15Å; F113-F172 AromaticContact CE2-CE2 3.51Å; F113-F172 HydrophobicContact CE2-CE2 3.51Å; F113-F172 HydrophobicContact CE2-CZ 4.02Å; F113-I189 HydrophobicContact CE1-CD1 3.61Å; F113-I189 HydrophobicContact CE1-CG1 4.02Å; F113-I189 HydrophobicContact CE1-CG2 4.07Å; F113-I189 HydrophobicContact CE2-CD1 4.26Å; F113-I189 HydrophobicContact CZ-CD1 3.28Å; F113-I189 HydrophobicContact CZ-CG1 4.07Å; F113-V257 HydrophobicContact CD1-CG1 3.75Å; F113-V257 HydrophobicContact CD1-CG2 4.31Å; F113-V257 HydrophobicContact CE1-CG1 4.27Å
114	D	98.6	Very high	95.1	Very high	15 Å²	15	33.8 Å²	33.8	8%	0.08	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.4	160.7	-167.5	0.1	0	0	0	107.8	H169 D258 V261 F268	D114-H169 IonicContact OD1-CD2 2.98Å; D114-H169 PolarHBondContact OD1-CD2 3.07Å; D114-H169 IonicContact OD1-NE2 2.74Å; D114-H169 IonicContact OD2-NE2 3.43Å; D114-D258 HydrophobicContact CB-CB 4.24Å; D114-D258 PolarHBondContact O-N 3.3Å; D114-V261 HydrophobicContact CB-CG1 3.54Å; D114-F268 HydrophobicContact CB-CE2 4.24Å
115	L	98.5	Very high	95.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.1	-172.4	-55.7	-178.4	0	0	0	109.3	F113 V131 L134 S167 R168 L170 F256 V257	F113-L115 HydrophobicContact CB-CD2 3.9Å; F113-L115 HydrophobicContact CB-CG 4.16Å; F113-L115 HydrophobicContact CD1-CD2 4.36Å; L115-V131 HydrophobicContact CD1-CG2 3.88Å; L115-L134 HydrophobicContact CD1-CD2 4.03Å; L115-L134 HydrophobicContact CD2-CD2 3.59Å; L115-L134 HydrophobicContact CG-CD2 4.48Å; L115-S167 CarbonylContact O-C 3.48Å; L115-S167 VanDerWaalsContact O-CA 3.28Å; L115-S167 WeakPolarHBondContact O-CA 3.04Å; L115-R168 HydrophobicContact CB-CB 4.31Å; L115-R168 PolarHBondContact N-O 3.32Å; L115-R168 PolarHBondContact O-N 3.06Å; L115-L170 HydrophobicContact CD1-CD1 3.61Å; L115-L170 HydrophobicContact CD1-CD2 4.49Å; L115-L170 HydrophobicContact CD1-CG 3.77Å; L115-F256 WeakPolarHBondContact CA-O 3.32Å; L115-F256 HydrophobicContact CB-CD2 4.42Å; L115-F256 HydrophobicContact CB-CE1 4.24Å; L115-F256 HydrophobicContact CB-CE2 3.83Å; L115-F256 HydrophobicContact CB-CZ 3.74Å; L115-F256 HydrophobicContact CD1-CE1 3.85Å; L115-F256 HydrophobicContact CD1-CZ 3.89Å; L115-F256 HydrophobicContact CD2-CD1 4.39Å; L115-F256 HydrophobicContact CD2-CE1 4.27Å; L115-F256 HydrophobicContact CG-CE1 4.36Å; L115-F256 HydrophobicContact CG-CZ 4.3Å; L115-V257 HydrophobicContact CD2-CB 4.25Å; L115-V257 HydrophobicContact CD2-CG1 4.47Å; L115-V257 HydrophobicContact CD2-CG2 3.74Å
116	E	97.1	Very high	95.4	Very high	60 Å²	60	35.1 Å²	35.1	28%	0.28	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	149.9	-179.7	54.7	175.5	-103.2	0	0	114.7	K165 F166 F256	E116-K165 IonicContact OE1-NZ 2.79Å; E116-K165 PolarHBondContact OE1-NZ 3.41Å; E116-K165 VanDerWaalsContact OE2-CE 3.26Å; E116-K165 WeakPolarHBondContact OE2-CE 3.44Å; E116-K165 IonicContact OE2-NZ 3.65Å; E116-K165 PolarHBondContact OE2-NZ 2.76Å; E116-F166 VanDerWaalsContact CA-O 3.24Å; E116-F166 WeakPolarHBondContact CA-O 3.44Å; E116-F166 WeakPolarHBondContact CB-O 3.04Å; E116-F256 PolarHBondContact N-O 3.5Å
117	F	97.3	Very high	95.7	Very high	14 Å²	14	35 Å²	35	6%	0.061	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	161.8	164.2	64.5	-95	0	0	0	111.6	K119 N122 M130 F166 V246 F256	F117-K119 HydrophobicContact CE2-CG 4.06Å; F117-K119 PolarHBondContact O-N 3.07Å; F117-N122 HydrophobicContact CD2-CB 3.73Å; F117-N122 HydrophobicContact CE2-CB 3.97Å; F117-M130 HydrophobicContact CE1-SD 4.23Å; F117-F166 HydrophobicContact CD1-CB 3.67Å; F117-F166 AromaticContact CD1-CD1 3.84Å; F117-F166 HydrophobicContact CD1-CD1 3.84Å; F117-F166 AromaticContact CD1-CG 3.85Å; F117-F166 HydrophobicContact CD1-CG 3.85Å; F117-F166 HydrophobicContact CD2-CB 4.06Å; F117-F166 HydrophobicContact CE1-CB 3.44Å; F117-F166 VanDerWaalsContact CE1-CB 3.44Å; F117-F166 AromaticContact CE1-CD1 3.59Å; F117-F166 HydrophobicContact CE1-CD1 3.59Å; F117-F166 AromaticContact CE1-CD2 3.83Å; F117-F166 HydrophobicContact CE1-CD2 3.83Å; F117-F166 HydrophobicContact CE1-CE1 4.25Å; F117-F166 HydrophobicContact CE1-CE2 4.44Å; F117-F166 AromaticContact CE1-CG 3.32Å; F117-F166 HydrophobicContact CE1-CG 3.32Å; F117-F166 HydrophobicContact CE2-CB 3.85Å; F117-F166 HydrophobicContact CG-CB 3.99Å; F117-F166 HydrophobicContact CZ-CB 3.54Å; F117-F166 HydrophobicContact CZ-CD1 4.42Å; F117-F166 AromaticContact CZ-CD2 3.92Å; F117-F166 HydrophobicContact CZ-CD2 3.92Å; F117-F166 AromaticContact CZ-CG 3.71Å; F117-F166 HydrophobicContact CZ-CG 3.71Å; F117-F166 PolarHBondContact N-O 3.38Å; F117-F166 PolarHBondContact O-N 2.55Å; F117-V246 HydrophobicContact CB-CB 3.76Å; F117-V246 HydrophobicContact CB-CG1 3.79Å; F117-V246 HydrophobicContact CB-CG2 3.95Å; F117-V246 HydrophobicContact CD1-CG1 4.22Å; F117-V246 HydrophobicContact CG-CG1 4.11Å; F117-F256 AromaticContact CD1-CD2 3.63Å; F117-F256 HydrophobicContact CD1-CD2 3.63Å; F117-F256 AromaticContact CD1-CE2 3.57Å; F117-F256 HydrophobicContact CD1-CE2 3.57Å; F117-F256 HydrophobicContact CE1-CD2 4.26Å; F117-F256 AromaticContact CE1-CE2 3.85Å; F117-F256 HydrophobicContact CE1-CE2 3.85Å
118	H	96.9	Very high	96	Very high	37 Å²	37	39.3 Å²	39.3	17%	0.171	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	112.7	175.7	-176.3	-119.6	0	0	0	110.5	S121 N122 E164 K249	H118-S121 PolarHBondContact ND1-N 3.03Å; H118-S121 PolarHBondContact ND1-OG 3.36Å; H118-S121 PolarHBondContact O-N 3.32Å; H118-N122 PolarHBondContact O-N 3.23Å; H118-N122 PolarHBondContact O-ND2 3.23Å; H118-E164 PolarHBondContact CD2-O 2.8Å; H118-E164 VanDerWaalsContact CD2-O 3.32Å; H118-K249 HydrophobicContact CB-CG 4.31Å
119	K	96.1	Very high	96	Very high	71 Å²	71	42 Å²	42	31%	0.309	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-60.2	-45.2	-174.5	-70.3	176.7	174	-178.6	0	113.1	F117 S121 N122 K123 T162 E163 E164 F166	F117-K119 HydrophobicContact CE2-CG 4.06Å; F117-K119 PolarHBondContact O-N 3.07Å; K119-S121 VanDerWaalsContact C-N 3.26Å; K119-S121 PolarHBondContact O-N 3.3Å; K119-N122 CarbonylContact O-C 3.51Å; K119-N122 PolarHBondContact O-N 3.29Å; K119-K123 PolarHBondContact O-N 2.8Å; K119-T162 WeakPolarHBondContact CD-O 3.04Å; K119-T162 VanDerWaalsContact CE-O 3.3Å; K119-T162 WeakPolarHBondContact CE-O 3.49Å; K119-T162 PolarHBondContact NZ-O 3.09Å; K119-E163 WeakPolarHBondContact CD-O 3.42Å; K119-E164 PolarHBondContact N-O 2.92Å; K119-F166 HydrophobicContact CG-CB 4.18Å
120	P	96	Very high	96	Very high	64 Å²	64	42.6 Å²	42.6	42%	0.416	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-60.9	-31.6	178.9	-24.2	32.8	0	0	0	114.4	N122 E164	P120-N122 VanDerWaalsContact C-N 3.29Å; P120-E164 WeakPolarHBondContact CD-O 3.47Å
121	S	95.3	Very high	96.1	Very high	37 Å²	37	42 Å²	42	26%	0.259	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-78.4	-12.8	176.2	-61.6	0	0	0	0	113.2	H118 K119 N248	H118-S121 PolarHBondContact ND1-N 3.03Å; H118-S121 PolarHBondContact ND1-OG 3.36Å; H118-S121 PolarHBondContact O-N 3.32Å; K119-S121 VanDerWaalsContact C-N 3.26Å; K119-S121 PolarHBondContact O-N 3.3Å; S121-N248 WeakPolarHBondContact CB-O 3.17Å; S121-N248 PolarHBondContact OG-O 3.45Å
122	N	95.5	Very high	96	Very high	16 Å²	16	45.5 Å²	45.5	9%	0.086	26%	0.264	C	S	.	.			trans	-132.9	49.3	-169.9	-64.6	-81.2	0	0	0	111.4	F117 H118 K119 P120 G124 S125 V246 K247	F117-N122 HydrophobicContact CD2-CB 3.73Å; F117-N122 HydrophobicContact CE2-CB 3.97Å; H118-N122 PolarHBondContact O-N 3.23Å; H118-N122 PolarHBondContact O-ND2 3.23Å; K119-N122 CarbonylContact O-C 3.51Å; K119-N122 PolarHBondContact O-N 3.29Å; P120-N122 VanDerWaalsContact C-N 3.29Å; N122-G124 PolarHBondContact O-N 3.24Å; N122-G124 VanDerWaalsContact O-N 3.13Å; N122-S125 WeakPolarHBondContact O-CB 3.39Å; N122-S125 PolarHBondContact O-N 2.9Å; N122-V246 WeakPolarHBondContact OD1-CA 3.38Å; N122-K247 PolarHBondContact ND2-N 2.85Å; N122-K247 PolarHBondContact ND2-O 3.29Å; N122-K247 PolarHBondContact OD1-N 3.44Å
123	K	90.4	Very high	95.9	Very high	191 Å²	191	50 Å²	50	83%	0.83	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.8	-173.7	-64.3	-176.6	-179.3	179.1	0	114.7	K119	K119-K123 PolarHBondContact O-N 2.8Å
124	G	88.6	Confident	95.9	Very high	84 Å²	84	50 Å²	50	87%	0.866	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.8	177.9	0	0	0	0	0	114.5	N122	N122-G124 PolarHBondContact O-N 3.24Å; N122-G124 VanDerWaalsContact O-N 3.13Å
125	S	92.3	Very high	95.8	Very high	42 Å²	42	49.6 Å²	49.6	29%	0.294	29%	0.285	S	S	.	.			trans	-86.9	118.9	-175	-61.1	0	0	0	0	111.1	N122 G127	N122-S125 WeakPolarHBondContact O-CB 3.39Å; N122-S125 PolarHBondContact O-N 2.9Å; S125-G127 PolarHBondContact O-N 2.77Å
126	D	95.1	Very high	95.8	Very high	85 Å²	85	54.7 Å²	54.7	46%	0.455	31%	0.309	S	S	.	.			trans	-86.8	96.3	169.4	178.5	3.5	0	0	0	110.5	K128 S129 M130	D126-K128 VanDerWaalsContact C-N 3.28Å; D126-K128 PolarHBondContact O-N 2.9Å; D126-K128 PolarHBondContact OD1-N 3.5Å; D126-S129 PolarHBondContact O-N 3.02Å; D126-S129 PolarHBondContact OD1-N 3.22Å; D126-S129 WeakPolarHBondContact OD2-CB 3.38Å; D126-S129 PolarHBondContact OD2-OG 2.88Å; D126-M130 VanDerWaalsContact O-CG 3.29Å; D126-M130 WeakPolarHBondContact O-CG 3.48Å; D126-M130 PolarHBondContact O-N 3.26Å
127	G	95.2	Very high	95.8	Very high	6 Å²	6	52.8 Å²	52.8	6%	0.062	30%	0.299	C	S	.	.	H	α-helix	trans	-60.2	-31.8	-179.6	0	0	0	0	0	114.3	S125 V131	S125-G127 PolarHBondContact O-N 2.77Å; G127-V131 WeakPolarHBondContact O-CG2 3.27Å; G127-V131 PolarHBondContact O-N 3.25Å
128	K	96.3	Very high	95.8	Very high	89 Å²	89	52.1 Å²	52.1	39%	0.387	30%	0.297	S	S	.	.	H	α-helix	trans	-68.4	-45	177.2	-70.4	-174.6	176.6	-177.8	0	110	D126 V131 S132 E286	D126-K128 VanDerWaalsContact C-N 3.28Å; D126-K128 PolarHBondContact O-N 2.9Å; D126-K128 PolarHBondContact OD1-N 3.5Å; K128-V131 PolarHBondContact O-N 3.32Å; K128-S132 PolarHBondContact O-N 2.92Å; K128-S132 VanDerWaalsContact O-N 3.07Å; K128-E286 IonicContact NZ-OE2 3.83Å; K128-E286 PolarHBondContact NZ-OE2 3.35Å
129	S	96.6	Very high	95.8	Very high	57 Å²	57	50.6 Å²	50.6	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-42.2	174.9	-70	0	0	0	0	112.5	D126 V131 S132 L133	D126-S129 PolarHBondContact O-N 3.02Å; D126-S129 PolarHBondContact OD1-N 3.22Å; D126-S129 WeakPolarHBondContact OD2-CB 3.38Å; D126-S129 PolarHBondContact OD2-OG 2.88Å; S129-V131 VanDerWaalsContact C-N 3.33Å; S129-V131 PolarHBondContact O-N 3.09Å; S129-S132 PolarHBondContact O-N 2.95Å; S129-L133 WeakPolarHBondContact O-CB 3.26Å; S129-L133 WeakPolarHBondContact O-CG 3.35Å; S129-L133 PolarHBondContact O-N 3.13Å
130	M	97.4	Very high	95.8	Very high	12 Å²	12	49.4 Å²	49.4	6%	0.059	29%	0.287	C	S	.	.	H	α-helix	trans	-59.1	-42.8	176.3	-69.6	168.1	74.8	0	0	112.2	F117 D126 L134 F243 V246 F256	F117-M130 HydrophobicContact CE1-SD 4.23Å; D126-M130 VanDerWaalsContact O-CG 3.29Å; D126-M130 WeakPolarHBondContact O-CG 3.48Å; D126-M130 PolarHBondContact O-N 3.26Å; M130-L134 VanDerWaalsContact O-CB 3.31Å; M130-L134 WeakPolarHBondContact O-CB 3.07Å; M130-L134 PolarHBondContact O-N 3.23Å; M130-F243 WeakPolarHBondContact CE-O 3.31Å; M130-V246 HydrophobicContact CE-CG1 3.59Å; M130-F256 HydrophobicContact CB-CD1 4.2Å; M130-F256 HydrophobicContact CB-CE1 3.82Å; M130-F256 HydrophobicContact CB-CZ 4.3Å; M130-F256 HydrophobicContact CE-CB 3.78Å; M130-F256 HydrophobicContact CE-CD1 3.84Å; M130-F256 HydrophobicContact CE-CD2 3.93Å; M130-F256 HydrophobicContact CE-CE1 4.37Å; M130-F256 HydrophobicContact CE-CE2 4.45Å; M130-F256 HydrophobicContact CE-CG 3.57Å
131	V	98.1	Very high	95.8	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-47.2	175.4	169.8	0	0	0	0	111.3	L115 G127 K128 S129 L133 L134 I135 F166 L170 F256	L115-V131 HydrophobicContact CD1-CG2 3.88Å; G127-V131 WeakPolarHBondContact O-CG2 3.27Å; G127-V131 PolarHBondContact O-N 3.25Å; K128-V131 PolarHBondContact O-N 3.32Å; S129-V131 VanDerWaalsContact C-N 3.33Å; S129-V131 PolarHBondContact O-N 3.09Å; V131-L133 PolarHBondContact O-N 3.4Å; V131-L134 PolarHBondContact O-N 2.81Å; V131-I135 HydrophobicContact CG1-CD1 3.75Å; V131-I135 HydrophobicContact CG1-CG1 4.4Å; V131-I135 VanDerWaalsContact O-CG1 3.32Å; V131-I135 WeakPolarHBondContact O-CG1 3.41Å; V131-I135 PolarHBondContact O-N 2.82Å; V131-F166 HydrophobicContact CG2-CE1 4.28Å; V131-F166 HydrophobicContact CG2-CZ 3.88Å; V131-L170 HydrophobicContact CG1-CD1 4.2Å; V131-L170 HydrophobicContact CG1-CD2 3.98Å; V131-F256 HydrophobicContact CG2-CE1 4.11Å; V131-F256 HydrophobicContact CG2-CZ 3.84Å
132	S	97.2	Very high	95.8	Very high	73 Å²	73	45.9 Å²	45.9	51%	0.51	26%	0.26	S	S	.	.	H	α-helix	trans	-60	-46.7	179.4	-173.5	0	0	0	0	111.9	K128 S129 L134 I135 Q136	K128-S132 PolarHBondContact O-N 2.92Å; K128-S132 VanDerWaalsContact O-N 3.07Å; S129-S132 PolarHBondContact O-N 2.95Å; S132-L134 PolarHBondContact O-N 2.85Å; S132-I135 PolarHBondContact O-N 3.43Å; S132-Q136 PolarHBondContact O-N 3.2Å
133	L	96.9	Very high	95.8	Very high	94 Å²	94	48.5 Å²	48.5	49%	0.492	28%	0.277	S	S	.	.	H	α-helix	trans	-63.6	-40.7	176.7	-69.8	173.3	0	0	0	112.2	S129 V131 Q136 Y137 F243	S129-L133 WeakPolarHBondContact O-CB 3.26Å; S129-L133 WeakPolarHBondContact O-CG 3.35Å; S129-L133 PolarHBondContact O-N 3.13Å; V131-L133 PolarHBondContact O-N 3.4Å; L133-Q136 PolarHBondContact O-N 3.2Å; L133-Y137 WeakPolarHBondContact O-CB 3.48Å; L133-Y137 PolarHBondContact O-N 3.48Å; L133-F243 HydrophobicContact CB-CD2 3.94Å; L133-F243 HydrophobicContact CB-CE1 4.44Å; L133-F243 HydrophobicContact CB-CE2 3.49Å; L133-F243 VanDerWaalsContact CB-CE2 3.49Å; L133-F243 HydrophobicContact CB-CZ 3.79Å; L133-F243 HydrophobicContact CD1-CB 4.5Å; L133-F243 HydrophobicContact CD1-CD2 4.06Å; L133-F243 HydrophobicContact CD1-CE2 4.46Å; L133-F243 HydrophobicContact CD1-CG 4.15Å
134	L	97.9	Very high	96	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-46.7	175.6	177.3	63.4	0	0	0	111.3	F113 L115 M130 V131 S132 Q136 Y137 V138 F243 L244 V257	F113-L134 HydrophobicContact CD1-CD2 4.34Å; L115-L134 HydrophobicContact CD1-CD2 4.03Å; L115-L134 HydrophobicContact CD2-CD2 3.59Å; L115-L134 HydrophobicContact CG-CD2 4.48Å; M130-L134 VanDerWaalsContact O-CB 3.31Å; M130-L134 WeakPolarHBondContact O-CB 3.07Å; M130-L134 PolarHBondContact O-N 3.23Å; V131-L134 PolarHBondContact O-N 2.81Å; S132-L134 PolarHBondContact O-N 2.85Å; L134-Q136 VanDerWaalsContact C-N 3.33Å; L134-Q136 PolarHBondContact O-N 2.84Å; L134-Y137 PolarHBondContact O-N 3.06Å; L134-V138 HydrophobicContact CD1-CG2 3.9Å; L134-V138 HydrophobicContact CG-CG2 4.31Å; L134-V138 WeakPolarHBondContact O-CB 3.49Å; L134-V138 VanDerWaalsContact O-CG2 3.23Å; L134-V138 WeakPolarHBondContact O-CG2 3.49Å; L134-V138 PolarHBondContact O-N 3.43Å; L134-F243 HydrophobicContact CB-CE2 4.36Å; L134-L244 HydrophobicContact CB-CD2 4.32Å; L134-L244 HydrophobicContact CD1-CD1 4.37Å; L134-L244 HydrophobicContact CD1-CD2 4.09Å; L134-V257 HydrophobicContact CD1-CG2 4.3Å; L134-V257 HydrophobicContact CD2-CG2 3.76Å
135	I	97.9	Very high	96.3	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.036	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-47.8	177.4	-71.3	169.3	0	0	0	110.1	V131 S132 Y137 V138 C139 V152 V155 L170 F172	V131-I135 HydrophobicContact CG1-CD1 3.75Å; V131-I135 HydrophobicContact CG1-CG1 4.4Å; V131-I135 VanDerWaalsContact O-CG1 3.32Å; V131-I135 WeakPolarHBondContact O-CG1 3.41Å; V131-I135 PolarHBondContact O-N 2.82Å; S132-I135 PolarHBondContact O-N 3.43Å; I135-Y137 PolarHBondContact O-N 3.48Å; I135-V138 PolarHBondContact O-N 3.22Å; I135-C139 WeakPolarHBondContact O-CB 3.46Å; I135-C139 PolarHBondContact O-N 2.94Å; I135-C139 PolarHBondContact O-SG 3.29Å; I135-V152 HydrophobicContact CD1-CG2 4.36Å; I135-V152 HydrophobicContact CG2-CB 4.18Å; I135-V152 HydrophobicContact CG2-CG2 4.41Å; I135-V155 HydrophobicContact CD1-CB 4.3Å; I135-V155 HydrophobicContact CD1-CG1 4Å; I135-V155 HydrophobicContact CG1-CG1 4.33Å; I135-V155 HydrophobicContact CG2-CG2 3.99Å; I135-L170 HydrophobicContact CD1-CD1 4.04Å; I135-L170 HydrophobicContact CD1-CD2 4.32Å; I135-L170 HydrophobicContact CG1-CD1 3.73Å; I135-F172 HydrophobicContact CG1-CZ 4.39Å
136	Q	96.8	Very high	96.4	Very high	106 Å²	106	42.4 Å²	42.4	50%	0.495	23%	0.227	S	C	.	.	H	α-helix	trans	-60.5	-46.3	178.6	-173.4	61.5	50.5	0	0	111.6	S132 L133 L134 V138 C139 D140	S132-Q136 PolarHBondContact O-N 3.2Å; L133-Q136 PolarHBondContact O-N 3.2Å; L134-Q136 VanDerWaalsContact C-N 3.33Å; L134-Q136 PolarHBondContact O-N 2.84Å; Q136-V138 VanDerWaalsContact C-N 3.35Å; Q136-V138 PolarHBondContact O-N 3.03Å; Q136-C139 PolarHBondContact O-N 3.21Å; Q136-D140 PolarHBondContact NE2-OD1 3.39Å; Q136-D140 PolarHBondContact O-N 3.05Å
137	Y	97.1	Very high	96.3	Very high	20 Å²	20	41 Å²	41	8%	0.078	23%	0.233	C	C	.	.	H	α-helix	trans	-59.5	-44.8	177.6	177.6	-108.6	0	0	0	112.3	L133 L134 I135 D140 K141 I192 L193 L241	L133-Y137 WeakPolarHBondContact O-CB 3.48Å; L133-Y137 PolarHBondContact O-N 3.48Å; L134-Y137 PolarHBondContact O-N 3.06Å; I135-Y137 PolarHBondContact O-N 3.48Å; Y137-D140 PolarHBondContact O-N 2.72Å; Y137-K141 HydrophobicContact CE1-CG 4.08Å; Y137-K141 HydrophobicContact CE2-CD 4.46Å; Y137-K141 HydrophobicContact CE2-CG 4.07Å; Y137-K141 WeakPolarHBondContact O-CG 3.45Å; Y137-K141 PolarHBondContact O-N 2.91Å; Y137-K141 VanDerWaalsContact OH-CE 3.23Å; Y137-K141 WeakPolarHBondContact OH-CE 3.43Å; Y137-I192 HydrophobicContact CE1-CB 4.23Å; Y137-I192 HydrophobicContact CE1-CD1 4.23Å; Y137-I192 HydrophobicContact CE1-CG1 4.22Å; Y137-I192 PolarHBondContact OH-O 2.78Å; Y137-L193 HydrophobicContact CE1-CD2 3.99Å; Y137-L241 HydrophobicContact CD1-CD2 4.14Å; Y137-L241 HydrophobicContact CD2-CD2 4.03Å; Y137-L241 HydrophobicContact CE1-CD1 4.24Å; Y137-L241 HydrophobicContact CE1-CD2 3.98Å; Y137-L241 HydrophobicContact CE2-CD2 3.87Å; Y137-L241 HydrophobicContact CG-CD2 4.15Å
138	V	97.4	Very high	96.3	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-67.5	-41.3	179.6	172.7	0	0	0	0	111.1	L111 F113 L134 I135 Q136 D140 K141 L142 F172 I192	L111-V138 HydrophobicContact CD2-CG1 3.8Å; F113-V138 HydrophobicContact CE1-CG2 4.33Å; F113-V138 HydrophobicContact CE2-CG1 4.2Å; F113-V138 HydrophobicContact CE2-CG2 4.29Å; F113-V138 HydrophobicContact CZ-CB 4.46Å; F113-V138 HydrophobicContact CZ-CG1 4.08Å; F113-V138 HydrophobicContact CZ-CG2 3.6Å; L134-V138 HydrophobicContact CD1-CG2 3.9Å; L134-V138 HydrophobicContact CG-CG2 4.31Å; L134-V138 WeakPolarHBondContact O-CB 3.49Å; L134-V138 VanDerWaalsContact O-CG2 3.23Å; L134-V138 WeakPolarHBondContact O-CG2 3.49Å; L134-V138 PolarHBondContact O-N 3.43Å; I135-V138 PolarHBondContact O-N 3.22Å; Q136-V138 VanDerWaalsContact C-N 3.35Å; Q136-V138 PolarHBondContact O-N 3.03Å; V138-D140 VanDerWaalsContact C-N 3.35Å; V138-D140 PolarHBondContact O-N 2.87Å; V138-K141 PolarHBondContact O-N 3.3Å; V138-L142 HydrophobicContact CG1-CD1 4.16Å; V138-L142 HydrophobicContact CG1-CG 4.37Å; V138-L142 WeakPolarHBondContact O-CG 3.19Å; V138-L142 PolarHBondContact O-N 3.03Å; V138-F172 HydrophobicContact CB-CE1 4.38Å; V138-F172 HydrophobicContact CB-CZ 4.2Å; V138-F172 HydrophobicContact CG1-CE1 3.77Å; V138-F172 HydrophobicContact CG1-CZ 3.81Å; V138-I192 HydrophobicContact CG2-CD1 4.19Å
139	C	96.8	Very high	96.1	Very high	4 Å²	4	45 Å²	45	3%	0.027	25%	0.252	C	S	.	.	H	α-helix	trans	-58.1	-46.5	173.7	-72	0	0	0	0	111.5	I135 Q136 K141 L142 V143 C150	I135-C139 WeakPolarHBondContact O-CB 3.46Å; I135-C139 PolarHBondContact O-N 2.94Å; I135-C139 PolarHBondContact O-SG 3.29Å; Q136-C139 PolarHBondContact O-N 3.21Å; C139-K141 VanDerWaalsContact C-N 3.29Å; C139-K141 PolarHBondContact O-N 3.21Å; C139-L142 PolarHBondContact O-N 2.71Å; C139-V143 WeakPolarHBondContact O-CG2 3.46Å; C139-V143 PolarHBondContact O-N 2.66Å; C139-V143 VanDerWaalsContact O-N 3.1Å; C139-C150 WeakPolarHBondContact CB-O 3.32Å; C139-C150 PolarHBondContact SG-O 2.86Å
140	D	96.1	Very high	96	Very high	46 Å²	46	43.3 Å²	43.3	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-40.5	177.2	-65.2	-10.1	0	0	0	111	Q136 Y137 V138 V143 E144 R239	Q136-D140 PolarHBondContact NE2-OD1 3.39Å; Q136-D140 PolarHBondContact O-N 3.05Å; Y137-D140 PolarHBondContact O-N 2.72Å; V138-D140 VanDerWaalsContact C-N 3.35Å; V138-D140 PolarHBondContact O-N 2.87Å; D140-V143 PolarHBondContact O-N 3.21Å; D140-E144 WeakPolarHBondContact O-CB 3.28Å; D140-E144 PolarHBondContact O-N 2.87Å; D140-R239 IonicContact OD2-CZ 3.64Å; D140-R239 IonicContact OD2-NH1 2.77Å; D140-R239 PolarHBondContact OD2-NH1 2.61Å; D140-R239 IonicContact OD2-NH2 3.12Å; D140-R239 PolarHBondContact OD2-NH2 3.42Å
141	K	95.9	Very high	95.9	Very high	27 Å²	27	45 Å²	45	12%	0.117	25%	0.252	C	S	.	.	H	α-helix	trans	-70.1	-33.6	176.9	-70.8	-64.7	175.7	-162.5	0	114	Y137 V138 C139 V143 E144 V145 F188 I192	Y137-K141 HydrophobicContact CE1-CG 4.08Å; Y137-K141 HydrophobicContact CE2-CD 4.46Å; Y137-K141 HydrophobicContact CE2-CG 4.07Å; Y137-K141 WeakPolarHBondContact O-CG 3.45Å; Y137-K141 PolarHBondContact O-N 2.91Å; Y137-K141 VanDerWaalsContact OH-CE 3.23Å; Y137-K141 WeakPolarHBondContact OH-CE 3.43Å; V138-K141 PolarHBondContact O-N 3.3Å; C139-K141 VanDerWaalsContact C-N 3.29Å; C139-K141 PolarHBondContact O-N 3.21Å; K141-V143 VanDerWaalsContact C-N 3.33Å; K141-E144 WeakPolarHBondContact CD-OE2 3.34Å; K141-E144 VanDerWaalsContact NZ-CD 3.28Å; K141-E144 IonicContact NZ-OE1 3.4Å; K141-E144 PolarHBondContact NZ-OE1 2.79Å; K141-E144 VanDerWaalsContact NZ-OE1 3.1Å; K141-E144 IonicContact NZ-OE2 3.1Å; K141-E144 PolarHBondContact NZ-OE2 3.42Å; K141-E144 PolarHBondContact O-N 3.03Å; K141-V145 VanDerWaalsContact O-CB 3.31Å; K141-V145 WeakPolarHBondContact O-CB 3.31Å; K141-V145 VanDerWaalsContact O-CG2 3.31Å; K141-V145 WeakPolarHBondContact O-CG2 3.4Å; K141-V145 PolarHBondContact O-N 2.98Å; K141-F188 HydrophobicContact CB-CZ 4.19Å; K141-I192 HydrophobicContact CB-CD1 4.33Å; K141-I192 HydrophobicContact CB-CG2 4.03Å; K141-I192 HydrophobicContact CD-CB 4.43Å; K141-I192 HydrophobicContact CD-CG2 4.11Å; K141-I192 HydrophobicContact CG-CB 4.14Å; K141-I192 HydrophobicContact CG-CD1 4.44Å; K141-I192 HydrophobicContact CG-CG2 4Å
142	L	96	Very high	95.8	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.9	-39	173.2	-73.9	169.7	0	0	0	111.4	L111 V138 C139 Y146 G147 V148 C150 F172 L174 F179 F188	L111-L142 HydrophobicContact CD2-CD1 3.96Å; L111-L142 HydrophobicContact CD2-CD2 4.26Å; L111-L142 HydrophobicContact CD2-CG 4.49Å; V138-L142 HydrophobicContact CG1-CD1 4.16Å; V138-L142 HydrophobicContact CG1-CG 4.37Å; V138-L142 WeakPolarHBondContact O-CG 3.19Å; V138-L142 PolarHBondContact O-N 3.03Å; C139-L142 PolarHBondContact O-N 2.71Å; L142-Y146 HydrophobicContact CD2-CD2 4.09Å; L142-Y146 CarbonylContact O-C 3.44Å; L142-Y146 WeakPolarHBondContact O-CA 3.09Å; L142-Y146 WeakPolarHBondContact O-CB 3.49Å; L142-Y146 PolarHBondContact O-N 3.37Å; L142-G147 PolarHBondContact O-N 2.78Å; L142-V148 CarbonylContact C-O 3.51Å; L142-V148 PolarHBondContact O-N 3.39Å; L142-C150 HydrophobicContact CD1-CB 4.2Å; L142-F172 HydrophobicContact CD1-CD1 4.24Å; L142-F172 HydrophobicContact CD1-CE1 4.44Å; L142-L174 HydrophobicContact CD1-CD2 3.87Å; L142-F179 HydrophobicContact CD2-CE2 4.35Å; L142-F179 HydrophobicContact CD2-CZ 4.26Å; L142-F188 HydrophobicContact CD2-CE1 3.93Å; L142-F188 HydrophobicContact CD2-CZ 3.9Å; L142-F188 HydrophobicContact CG-CE1 4.46Å; L142-F188 HydrophobicContact CG-CZ 4.26Å
143	V	95.7	Very high	95.7	Very high	71 Å²	71	50.2 Å²	50.2	43%	0.43	27%	0.269	S	S	.	.	H	α-helix	trans	-68.2	-48	173.6	176.8	0	0	0	0	110.7	C139 D140 K141 V145 G147 V148 E149	C139-V143 WeakPolarHBondContact O-CG2 3.46Å; C139-V143 PolarHBondContact O-N 2.66Å; C139-V143 VanDerWaalsContact O-N 3.1Å; D140-V143 PolarHBondContact O-N 3.21Å; K141-V143 VanDerWaalsContact C-N 3.33Å; V143-V145 PolarHBondContact O-N 3.46Å; V143-G147 WeakPolarHBondContact O-CA 3.25Å; V143-G147 PolarHBondContact O-N 2.84Å; V143-V148 VanDerWaalsContact CG2-O 3.3Å; V143-V148 WeakPolarHBondContact CG2-O 3.17Å; V143-V148 PolarHBondContact N-O 2.77Å; V143-E149 HydrophobicContact CG2-CG 4.44Å
144	E	94.8	Very high	95.6	Very high	112 Å²	112	47.3 Å²	47.3	52%	0.523	26%	0.255	S	S	.	.	H	α-helix	trans	-59.2	-47.2	-179.6	-178.6	-175.7	146.9	0	0	112.7	D140 K141	D140-E144 WeakPolarHBondContact O-CB 3.28Å; D140-E144 PolarHBondContact O-N 2.87Å; K141-E144 WeakPolarHBondContact CD-OE2 3.34Å; K141-E144 VanDerWaalsContact NZ-CD 3.28Å; K141-E144 IonicContact NZ-OE1 3.4Å; K141-E144 PolarHBondContact NZ-OE1 2.79Å; K141-E144 VanDerWaalsContact NZ-OE1 3.1Å; K141-E144 IonicContact NZ-OE2 3.1Å; K141-E144 PolarHBondContact NZ-OE2 3.42Å; K141-E144 PolarHBondContact O-N 3.03Å
145	V	94.5	Very high	95.6	Very high	55 Å²	55	47.4 Å²	47.4	33%	0.333	26%	0.255	S	S	.	.	H	α-helix	trans	-86.1	-44.3	-172.8	175.5	0	0	0	0	111.8	K141 V143 F188 W323	K141-V145 VanDerWaalsContact O-CB 3.31Å; K141-V145 WeakPolarHBondContact O-CB 3.31Å; K141-V145 VanDerWaalsContact O-CG2 3.31Å; K141-V145 WeakPolarHBondContact O-CG2 3.4Å; K141-V145 PolarHBondContact O-N 2.98Å; V143-V145 PolarHBondContact O-N 3.46Å; V145-F188 HydrophobicContact CB-CE2 4.38Å; V145-F188 HydrophobicContact CG2-CE2 4.21Å; V145-W323 HydrophobicContact CB-CZ3 4.49Å; V145-W323 HydrophobicContact CG1-CE3 4.07Å; V145-W323 HydrophobicContact CG1-CZ3 3.59Å; V145-W323 HydrophobicContact CG2-CZ3 4.07Å
146	Y	94.3	Very high	95.6	Very high	22 Å²	22	47.1 Å²	47.1	9%	0.086	25%	0.253	C	S	.	.	H	α-helix	trans	-113.6	-11.3	-169.2	-61.2	-64.7	0	0	0	113.6	L142 V148 F179 F188 R319 L321 T322	L142-Y146 HydrophobicContact CD2-CD2 4.09Å; L142-Y146 CarbonylContact O-C 3.44Å; L142-Y146 WeakPolarHBondContact O-CA 3.09Å; L142-Y146 WeakPolarHBondContact O-CB 3.49Å; L142-Y146 PolarHBondContact O-N 3.37Å; Y146-V148 PolarHBondContact O-N 3.49Å; Y146-F179 HydrophobicContact CE2-CE1 4.19Å; Y146-F179 HydrophobicContact CE2-CZ 4.04Å; Y146-F188 HydrophobicContact CD2-CE2 4.39Å; Y146-F188 AromaticContact CE2-CD2 3.71Å; Y146-F188 HydrophobicContact CE2-CD2 3.71Å; Y146-F188 AromaticContact CE2-CE2 3.77Å; Y146-F188 HydrophobicContact CE2-CE2 3.77Å; Y146-F188 HydrophobicContact CE2-CG 4.22Å; Y146-F188 HydrophobicContact CE2-CZ 4.34Å; Y146-R319 PolarHBondContact O-NH1 3.26Å; Y146-L321 HydrophobicContact CD1-CB 4.42Å; Y146-L321 HydrophobicContact CD1-CD2 3.93Å; Y146-L321 HydrophobicContact CD2-CD1 4.12Å; Y146-L321 HydrophobicContact CE1-CB 4.24Å; Y146-L321 HydrophobicContact CG-CD1 4.24Å; Y146-L321 HydrophobicContact CG-CD2 3.97Å; Y146-T322 VanDerWaalsContact CE1-O 3.26Å; Y146-T322 WeakPolarHBondContact CE1-O 3.39Å; Y146-T322 PolarHBondContact OH-O 3.26Å
147	G	93.8	Very high	95.7	Very high	56 Å²	56	42.3 Å²	42.3	58%	0.577	23%	0.231	S	C	*	.			trans	64	28.2	-170	0	0	0	0	0	112.3	L142 V143	L142-G147 PolarHBondContact O-N 2.78Å; V143-G147 WeakPolarHBondContact O-CA 3.25Å; V143-G147 PolarHBondContact O-N 2.84Å
148	V	94.3	Very high	95.8	Very high	12 Å²	12	41.4 Å²	41.4	7%	0.073	23%	0.228	C	C	.	.			trans	-99.1	112.3	179.3	175.7	0	0	0	0	108.9	L142 V143 Y146 L174 A177 L321	L142-V148 CarbonylContact C-O 3.51Å; L142-V148 PolarHBondContact O-N 3.39Å; V143-V148 VanDerWaalsContact CG2-O 3.3Å; V143-V148 WeakPolarHBondContact CG2-O 3.17Å; V143-V148 PolarHBondContact N-O 2.77Å; Y146-V148 PolarHBondContact O-N 3.49Å; V148-L174 HydrophobicContact CG1-CB 4.46Å; V148-L174 HydrophobicContact CG1-CD1 4.42Å; V148-L174 HydrophobicContact CG1-CD2 4.29Å; V148-A177 HydrophobicContact CG1-CB 4.23Å; V148-A177 HydrophobicContact CG2-CB 4.09Å; V148-L321 HydrophobicContact CG2-CD1 4.36Å; V148-L321 HydrophobicContact CG2-CD2 4.14Å
149	E	93.3	Very high	95.8	Very high	168 Å²	168	42.9 Å²	42.9	79%	0.785	24%	0.236	S	C	*	.			trans	-73.2	132.5	175.1	-65.5	-177.7	-179.3	0	0	111.1	V143	V143-E149 HydrophobicContact CG2-CG 4.44Å
150	C	93.8	Very high	95.8	Very high	20 Å²	20	43.2 Å²	43.2	14%	0.135	24%	0.238	C	C	.	.			trans	-149.9	151.3	178.6	-176.1	0	0	0	0	109.4	C139 L142 L174	C139-C150 WeakPolarHBondContact CB-O 3.32Å; C139-C150 PolarHBondContact SG-O 2.86Å; L142-C150 HydrophobicContact CD1-CB 4.2Å; C150-L174 HydrophobicContact CB-CD2 3.9Å
151	S	94.7	Very high	95.8	Very high	47 Å²	47	42.6 Å²	42.6	33%	0.329	24%	0.237	S	C	.	.			trans	-137	171.5	176.3	73.1	0	0	0	0	110.7	K153 N154	S151-K153 PolarHBondContact O-N 2.67Å; S151-K153 VanDerWaalsContact O-N 3.1Å; S151-K153 PolarHBondContact OG-N 3.44Å; S151-N154 PolarHBondContact N-OD1 3.08Å; S151-N154 WeakPolarHBondContact O-CB 3.18Å; S151-N154 PolarHBondContact O-N 2.61Å; S151-N154 PolarHBondContact O-OD1 3.09Å; S151-N154 PolarHBondContact OG-OD1 3.41Å
152	V	95.6	Very high	95.8	Very high	45 Å²	45	44.1 Å²	44.1	27%	0.273	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-55.5	-27	173.9	66.4	0	0	0	0	113.3	I135 N154 V155 Q289	I135-V152 HydrophobicContact CD1-CG2 4.36Å; I135-V152 HydrophobicContact CG2-CB 4.18Å; I135-V152 HydrophobicContact CG2-CG2 4.41Å; V152-N154 PolarHBondContact O-N 2.79Å; V152-V155 PolarHBondContact O-N 2.74Å; V152-Q289 HydrophobicContact CG1-CB 4.42Å; V152-Q289 VanDerWaalsContact CG1-OE1 3.27Å; V152-Q289 HydrophobicContact CG2-CB 4.33Å; V152-Q289 HydrophobicContact CG2-CG 4.35Å
153	K	95.4	Very high	95.7	Very high	140 Å²	140	53 Å²	53	61%	0.609	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-69.8	-12.9	176.3	-61.3	-179.5	179.8	178	0	113.3	S151 Q289 F290	S151-K153 PolarHBondContact O-N 2.67Å; S151-K153 VanDerWaalsContact O-N 3.1Å; S151-K153 PolarHBondContact OG-N 3.44Å; K153-Q289 HydrophobicContact CG-CB 4.5Å; K153-F290 WeakPolarHBondContact O-CA 3.3Å; K153-F290 WeakPolarHBondContact O-CD2 3.12Å
154	N	95.4	Very high	95.6	Very high	34 Å²	34	54.5 Å²	54.5	18%	0.182	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-98.6	2.2	177.2	-55.9	98.8	0	0	0	112.2	S151 V152 M173	S151-N154 PolarHBondContact N-OD1 3.08Å; S151-N154 WeakPolarHBondContact O-CB 3.18Å; S151-N154 PolarHBondContact O-N 2.61Å; S151-N154 PolarHBondContact O-OD1 3.09Å; S151-N154 PolarHBondContact OG-OD1 3.41Å; V152-N154 PolarHBondContact O-N 2.79Å; N154-M173 WeakPolarHBondContact O-CB 3.47Å; N154-M173 PolarHBondContact O-N 2.92Å
155	V	97.9	Very high	95.6	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	111.8	-175.1	-173.9	0	0	0	0	109.8	I135 V152 N157 L170 F172 N288 F290	I135-V155 HydrophobicContact CD1-CB 4.3Å; I135-V155 HydrophobicContact CD1-CG1 4Å; I135-V155 HydrophobicContact CG1-CG1 4.33Å; I135-V155 HydrophobicContact CG2-CG2 3.99Å; V152-V155 PolarHBondContact O-N 2.74Å; V155-N157 PolarHBondContact O-N 3.33Å; V155-L170 HydrophobicContact CG1-CB 3.91Å; V155-L170 HydrophobicContact CG1-CD2 4.22Å; V155-L170 HydrophobicContact CG1-CG 4.46Å; V155-F172 HydrophobicContact CG1-CD2 4.01Å; V155-F172 HydrophobicContact CG1-CE2 3.84Å; V155-F172 HydrophobicContact CG1-CZ 4.27Å; V155-F172 HydrophobicContact CG2-CD1 3.67Å; V155-F172 HydrophobicContact CG2-CD2 4.16Å; V155-F172 HydrophobicContact CG2-CE1 3.57Å; V155-F172 HydrophobicContact CG2-CE2 4.06Å; V155-F172 HydrophobicContact CG2-CG 3.96Å; V155-F172 HydrophobicContact CG2-CZ 3.77Å; V155-N288 PolarHBondContact O-OD1 2.88Å; V155-F290 WeakPolarHBondContact O-CB 3.4Å
156	L	98.3	Very high	95.8	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	122.4	168.8	175.9	64.6	0	0	0	108.6	L158 L170 I171 F290 V304 A307	L156-L158 HydrophobicContact CD1-CD2 4.02Å; L156-L158 HydrophobicContact CD2-CD2 4.2Å; L156-L158 HydrophobicContact CD2-CG 4.4Å; L156-L158 HydrophobicContact CG-CD2 4.02Å; L156-L158 HydrophobicContact CG-CG 4.22Å; L156-L170 WeakPolarHBondContact O-CA 3.38Å; L156-I171 HydrophobicContact CB-CB 4.4Å; L156-I171 HydrophobicContact CD2-CD1 4.46Å; L156-I171 PolarHBondContact N-O 3.05Å; L156-I171 PolarHBondContact O-N 3.27Å; L156-F290 HydrophobicContact CB-CD1 3.89Å; L156-F290 HydrophobicContact CB-CE1 4.36Å; L156-F290 HydrophobicContact CB-CG 4.25Å; L156-F290 HydrophobicContact CD1-CD1 3.83Å; L156-F290 HydrophobicContact CD1-CE1 4.41Å; L156-F290 HydrophobicContact CG-CD1 4.41Å; L156-V304 HydrophobicContact CD1-CG1 4.23Å; L156-V304 HydrophobicContact CD2-CG1 4.44Å; L156-A307 HydrophobicContact CD2-CB 4.07Å
157	N	98.3	Very high	95.9	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.027	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	116	-179.9	-172	-4.9	0	0	0	110.2	V155 R168 L170 A285 N288	V155-N157 PolarHBondContact O-N 3.33Å; N157-R168 PolarHBondContact ND2-NH1 3.43Å; N157-R168 WeakPolarHBondContact OD1-CD 3.48Å; N157-L170 HydrophobicContact CB-CD2 3.91Å; N157-L170 WeakPolarHBondContact OD1-CD2 3.32Å; N157-A285 HydrophobicContact CB-CB 4.15Å; N157-A285 WeakPolarHBondContact O-CB 3.3Å; N157-A285 PolarHBondContact O-N 2.87Å; N157-N288 HydrophobicContact CB-CB 4.11Å; N157-N288 PolarHBondContact N-OD1 2.92Å
158	L	98.5	Very high	96.2	Very high	2 Å²	2	46.9 Å²	46.9	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	138.6	178.4	-55.6	-180	0	0	0	110.7	L156 R168 H169 I171 Y271 F282 T283 V284	L156-L158 HydrophobicContact CD1-CD2 4.02Å; L156-L158 HydrophobicContact CD2-CD2 4.2Å; L156-L158 HydrophobicContact CD2-CG 4.4Å; L156-L158 HydrophobicContact CG-CD2 4.02Å; L156-L158 HydrophobicContact CG-CG 4.22Å; L158-R168 CarbonylContact O-C 3.51Å; L158-R168 WeakPolarHBondContact O-CA 3.26Å; L158-R168 WeakPolarHBondContact O-CB 3.35Å; L158-H169 HydrophobicContact CB-CB 4.24Å; L158-H169 PolarHBondContact N-O 3.34Å; L158-H169 PolarHBondContact O-N 3.23Å; L158-I171 HydrophobicContact CD1-CD1 4.01Å; L158-I171 HydrophobicContact CG-CD1 4.34Å; L158-Y271 HydrophobicContact CD1-CD2 4.43Å; L158-Y271 HydrophobicContact CD2-CD2 3.84Å; L158-Y271 HydrophobicContact CD2-CE2 4.32Å; L158-F282 HydrophobicContact CB-CB 4.37Å; L158-F282 HydrophobicContact CB-CD1 3.84Å; L158-F282 HydrophobicContact CB-CG 4.39Å; L158-T283 CarbonylContact C-O 3.46Å; L158-T283 WeakPolarHBondContact CA-O 3.23Å; L158-V284 HydrophobicContact CD2-CG2 4.21Å
159	D	98.3	Very high	96.4	Very high	32 Å²	32	46.6 Å²	46.6	17%	0.171	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.5	-177.7	-154.4	-45.9	0	0	0	110.9	S161 R168 F282 T283 A285	D159-S161 WeakPolarHBondContact OD1-CA 3.36Å; D159-S161 WeakPolarHBondContact OD1-CB 3.18Å; D159-S161 PolarHBondContact OD1-N 2.9Å; D159-S161 PolarHBondContact OD1-OG 3.18Å; D159-R168 HydrophobicContact CB-CG 4.46Å; D159-R168 IonicContact OD2-CZ 2.82Å; D159-R168 IonicContact OD2-NE 3.68Å; D159-R168 PolarHBondContact OD2-NE 2.85Å; D159-R168 IonicContact OD2-NH2 2.71Å; D159-R168 PolarHBondContact OD2-NH2 2.9Å; D159-F282 WeakPolarHBondContact O-CA 3.23Å; D159-T283 PolarHBondContact N-O 3.14Å; D159-T283 PolarHBondContact O-N 3.28Å; D159-A285 HydrophobicContact CB-CB 3.94Å
160	S	97.4	Very high	96.6	Very high	10 Å²	10	38.6 Å²	38.6	7%	0.07	20%	0.2	C	C	.	.			trans	-133.2	25.2	171.5	172.7	0	0	0	0	110.1	S167 R269 A280	S160-S167 PolarHBondContact N-O 2.89Å; S160-R269 PolarHBondContact OG-NH2 2.92Å; S160-A280 PolarHBondContact OG-O 3.25Å; S160-A280 VanDerWaalsContact OG-O 3.13Å
161	S	96.6	Very high	96.9	Very high	33 Å²	33	37.7 Å²	37.7	23%	0.231	19%	0.193	C	C	.	.			trans	-65.3	143.6	-177.6	-56.9	0	0	0	0	111.4	D159 K165 S167	D159-S161 WeakPolarHBondContact OD1-CA 3.36Å; D159-S161 WeakPolarHBondContact OD1-CB 3.18Å; D159-S161 PolarHBondContact OD1-N 2.9Å; D159-S161 PolarHBondContact OD1-OG 3.18Å; S161-K165 CarbonylContact C-O 3.59Å; S161-K165 VanDerWaalsContact CA-O 3.26Å; S161-K165 WeakPolarHBondContact CA-O 3.46Å; S161-K165 WeakPolarHBondContact CB-O 3.48Å; S161-S167 PolarHBondContact N-O 3.46Å; S161-S167 PolarHBondContact OG-N 3.05Å; S161-S167 VanDerWaalsContact OG-N 3.08Å; S161-S167 PolarHBondContact OG-O 3.36Å
162	T	95.4	Very high	97	Very high	60 Å²	60	35.5 Å²	35.5	37%	0.368	18%	0.178	S	C	.	.			trans	-114.7	-177.8	171.4	66.4	0	0	0	0	109.7	K119 E164 K165 A280	K119-T162 WeakPolarHBondContact CD-O 3.04Å; K119-T162 VanDerWaalsContact CE-O 3.3Å; K119-T162 WeakPolarHBondContact CE-O 3.49Å; K119-T162 PolarHBondContact NZ-O 3.09Å; T162-E164 PolarHBondContact O-N 3.33Å; T162-E164 PolarHBondContact OG1-N 3.11Å; T162-K165 PolarHBondContact N-O 3.3Å; T162-K165 PolarHBondContact OG1-N 3.09Å; T162-K165 VanDerWaalsContact OG1-N 3.09Å; T162-A280 HydrophobicContact CG2-CB 3.64Å
163	E	92.9	Very high	97	Very high	185 Å²	185	35.9 Å²	35.9	86%	0.864	18%	0.177	S	C	*	.	S	Bend	trans	-61.7	-33.8	171.9	-62.8	-178.6	173.6	0	0	112.1	K119	K119-E163 WeakPolarHBondContact CD-O 3.42Å
164	E	93.8	Very high	96.9	Very high	104 Å²	104	30.3 Å²	30.3	49%	0.486	15%	0.154	S	C	.	.	S	Bend	trans	-88.1	-30.8	-178.5	-63.2	-171.5	165	0	0	113.9	H118 K119 P120 T162	H118-E164 PolarHBondContact CD2-O 2.8Å; H118-E164 VanDerWaalsContact CD2-O 3.32Å; K119-E164 PolarHBondContact N-O 2.92Å; P120-E164 WeakPolarHBondContact CD-O 3.47Å; T162-E164 PolarHBondContact O-N 3.33Å; T162-E164 PolarHBondContact OG1-N 3.11Å
165	K	95.5	Very high	96.5	Very high	64 Å²	64	35.1 Å²	35.1	28%	0.278	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	129.7	-168	-180	166.9	172.9	160.2	0	111.3	E116 S161 T162	E116-K165 IonicContact OE1-NZ 2.79Å; E116-K165 PolarHBondContact OE1-NZ 3.41Å; E116-K165 VanDerWaalsContact OE2-CE 3.26Å; E116-K165 WeakPolarHBondContact OE2-CE 3.44Å; E116-K165 IonicContact OE2-NZ 3.65Å; E116-K165 PolarHBondContact OE2-NZ 2.76Å; S161-K165 CarbonylContact C-O 3.59Å; S161-K165 VanDerWaalsContact CA-O 3.26Å; S161-K165 WeakPolarHBondContact CA-O 3.46Å; S161-K165 WeakPolarHBondContact CB-O 3.48Å; T162-K165 PolarHBondContact N-O 3.3Å; T162-K165 PolarHBondContact OG1-N 3.09Å; T162-K165 VanDerWaalsContact OG1-N 3.09Å
166	F	97.8	Very high	96	Very high	11 Å²	11	40.4 Å²	40.4	5%	0.048	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	131.9	162.1	-176.4	-82.6	0	0	0	108.1	E116 F117 K119 V131 R168 F256	E116-F166 VanDerWaalsContact CA-O 3.24Å; E116-F166 WeakPolarHBondContact CA-O 3.44Å; E116-F166 WeakPolarHBondContact CB-O 3.04Å; F117-F166 HydrophobicContact CD1-CB 3.67Å; F117-F166 AromaticContact CD1-CD1 3.84Å; F117-F166 HydrophobicContact CD1-CD1 3.84Å; F117-F166 AromaticContact CD1-CG 3.85Å; F117-F166 HydrophobicContact CD1-CG 3.85Å; F117-F166 HydrophobicContact CD2-CB 4.06Å; F117-F166 HydrophobicContact CE1-CB 3.44Å; F117-F166 VanDerWaalsContact CE1-CB 3.44Å; F117-F166 AromaticContact CE1-CD1 3.59Å; F117-F166 HydrophobicContact CE1-CD1 3.59Å; F117-F166 AromaticContact CE1-CD2 3.83Å; F117-F166 HydrophobicContact CE1-CD2 3.83Å; F117-F166 HydrophobicContact CE1-CE1 4.25Å; F117-F166 HydrophobicContact CE1-CE2 4.44Å; F117-F166 AromaticContact CE1-CG 3.32Å; F117-F166 HydrophobicContact CE1-CG 3.32Å; F117-F166 HydrophobicContact CE2-CB 3.85Å; F117-F166 HydrophobicContact CG-CB 3.99Å; F117-F166 HydrophobicContact CZ-CB 3.54Å; F117-F166 HydrophobicContact CZ-CD1 4.42Å; F117-F166 AromaticContact CZ-CD2 3.92Å; F117-F166 HydrophobicContact CZ-CD2 3.92Å; F117-F166 AromaticContact CZ-CG 3.71Å; F117-F166 HydrophobicContact CZ-CG 3.71Å; F117-F166 PolarHBondContact N-O 3.38Å; F117-F166 PolarHBondContact O-N 2.55Å; K119-F166 HydrophobicContact CG-CB 4.18Å; V131-F166 HydrophobicContact CG2-CE1 4.28Å; V131-F166 HydrophobicContact CG2-CZ 3.88Å; F166-R168 HydrophobicContact CE1-CB 4.14Å; F166-R168 HydrophobicContact CE1-CG 3.8Å; F166-R168 VanDerWaalsContact CZ-CD 3.45Å; F166-R168 HydrophobicContact CZ-CG 3.79Å; F166-F256 AromaticContact CD1-CE2 3.61Å; F166-F256 HydrophobicContact CD1-CE2 3.61Å; F166-F256 HydrophobicContact CD1-CZ 4.14Å; F166-F256 AromaticContact CE1-CE2 3.44Å; F166-F256 HydrophobicContact CE1-CE2 3.44Å; F166-F256 VanDerWaalsContact CE1-CE2 3.44Å; F166-F256 AromaticContact CE1-CZ 3.47Å; F166-F256 HydrophobicContact CE1-CZ 3.47Å; F166-F256 VanDerWaalsContact CE1-CZ 3.47Å; F166-F256 HydrophobicContact CZ-CE2 4.39Å; F166-F256 HydrophobicContact CZ-CZ 4.12Å
167	S	97.9	Very high	95.8	Very high	8 Å²	8	40.8 Å²	40.8	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	118.3	179.6	-177.3	0	0	0	0	110.5	L115 S160 S161	L115-S167 CarbonylContact O-C 3.48Å; L115-S167 VanDerWaalsContact O-CA 3.28Å; L115-S167 WeakPolarHBondContact O-CA 3.04Å; S160-S167 PolarHBondContact N-O 2.89Å; S161-S167 PolarHBondContact N-O 3.46Å; S161-S167 PolarHBondContact OG-N 3.05Å; S161-S167 VanDerWaalsContact OG-N 3.08Å; S161-S167 PolarHBondContact OG-O 3.36Å
168	R	98.4	Very high	95.7	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	145	177	-72.6	-171.8	176.4	-158.1	-11.4	112.4	L115 N157 L158 D159 F166 D287	L115-R168 HydrophobicContact CB-CB 4.31Å; L115-R168 PolarHBondContact N-O 3.32Å; L115-R168 PolarHBondContact O-N 3.06Å; N157-R168 PolarHBondContact ND2-NH1 3.43Å; N157-R168 WeakPolarHBondContact OD1-CD 3.48Å; L158-R168 CarbonylContact O-C 3.51Å; L158-R168 WeakPolarHBondContact O-CA 3.26Å; L158-R168 WeakPolarHBondContact O-CB 3.35Å; D159-R168 HydrophobicContact CB-CG 4.46Å; D159-R168 IonicContact OD2-CZ 2.82Å; D159-R168 IonicContact OD2-NE 3.68Å; D159-R168 PolarHBondContact OD2-NE 2.85Å; D159-R168 IonicContact OD2-NH2 2.71Å; D159-R168 PolarHBondContact OD2-NH2 2.9Å; F166-R168 HydrophobicContact CE1-CB 4.14Å; F166-R168 HydrophobicContact CE1-CG 3.8Å; F166-R168 VanDerWaalsContact CZ-CD 3.45Å; F166-R168 HydrophobicContact CZ-CG 3.79Å; R168-D287 IonicContact CZ-OD1 2.81Å; R168-D287 IonicContact CZ-OD2 2.61Å; R168-D287 IonicContact NH1-OD1 3.29Å; R168-D287 PolarHBondContact NH1-OD1 3.42Å; R168-D287 IonicContact NH1-OD2 2.88Å; R168-D287 PolarHBondContact NH1-OD2 2.82Å; R168-D287 IonicContact NH2-OD1 3.39Å; R168-D287 PolarHBondContact NH2-OD1 2.92Å; R168-D287 IonicContact NH2-OD2 3.39Å
169	H	98.7	Very high	95.6	Very high	6 Å²	6	40.6 Å²	40.6	3%	0.028	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	132.9	164.4	-70.1	-178.9	0	0	0	109.5	F113 D114 L158 I171 F268 F282	F113-H169 WeakPolarHBondContact O-CA 3.4Å; D114-H169 IonicContact OD1-CD2 2.98Å; D114-H169 PolarHBondContact OD1-CD2 3.07Å; D114-H169 IonicContact OD1-NE2 2.74Å; D114-H169 IonicContact OD2-NE2 3.43Å; L158-H169 HydrophobicContact CB-CB 4.24Å; L158-H169 PolarHBondContact N-O 3.34Å; L158-H169 PolarHBondContact O-N 3.23Å; H169-I171 HydrophobicContact CB-CD1 4.05Å; H169-F268 HydrophobicContact CB-CE1 4.31Å; H169-F268 HydrophobicContact CB-CZ 4.02Å; H169-F268 AromaticContact CD2-CZ 3.72Å; H169-F268 AromaticContact CE1-CE1 3.66Å; H169-F268 AromaticContact CE1-CE2 3.61Å; H169-F268 AromaticContact CE1-CZ 3.39Å; H169-F268 WeakPolarHBondContact CE1-CZ 3.35Å; H169-F268 AromaticContact CG-CE1 3.87Å; H169-F268 AromaticContact CG-CZ 3.44Å; H169-F268 VanDerWaalsContact CG-CZ 3.44Å; H169-F268 AromaticContact ND1-CE1 3.3Å; H169-F268 VanDerWaalsContact ND1-CE1 3.3Å; H169-F268 WeakPolarHBondContact ND1-CE1 3.47Å; H169-F268 AromaticContact ND1-CE2 3.96Å; H169-F268 AromaticContact ND1-CZ 3.25Å; H169-F268 WeakPolarHBondContact ND1-CZ 3.49Å; H169-F268 AromaticContact NE2-CE2 3.72Å; H169-F268 AromaticContact NE2-CZ 3.72Å; H169-F282 HydrophobicContact CB-CE1 4.3Å; H169-F282 HydrophobicContact CB-CZ 4.44Å; H169-F282 AromaticContact CD2-CE1 3.88Å; H169-F282 AromaticContact CD2-CE2 3.82Å; H169-F282 AromaticContact CD2-CZ 3.26Å; H169-F282 WeakPolarHBondContact CD2-CZ 3.42Å; H169-F282 AromaticContact CE1-CE2 3.18Å; H169-F282 WeakPolarHBondContact CE1-CE2 3.49Å; H169-F282 AromaticContact CE1-CZ 3.5Å; H169-F282 AromaticContact CG-CE1 3.84Å; H169-F282 AromaticContact CG-CE2 3.88Å; H169-F282 AromaticContact CG-CZ 3.52Å; H169-F282 AromaticContact ND1-CD2 3.99Å; H169-F282 AromaticContact ND1-CE2 3.48Å; H169-F282 WeakPolarHBondContact ND1-CE2 3.5Å; H169-F282 AromaticContact ND1-CZ 3.64Å; H169-F282 AromaticContact NE2-CE2 3.36Å; H169-F282 WeakPolarHBondContact NE2-CE2 3.46Å; H169-F282 AromaticContact NE2-CZ 3.23Å; H169-F282 WeakPolarHBondContact NE2-CZ 3.46Å
170	L	98.8	Very high	95.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.6	169.4	-55.1	-177.3	0	0	0	109.2	Y112 F113 L115 V131 I135 V155 L156 N157 F172	Y112-L170 CarbonylContact C-O 3.54Å; Y112-L170 WeakPolarHBondContact CA-O 3.36Å; F113-L170 HydrophobicContact CB-CB 4.17Å; F113-L170 HydrophobicContact CD2-CB 4.33Å; F113-L170 PolarHBondContact N-O 3.1Å; F113-L170 PolarHBondContact O-N 3.23Å; L115-L170 HydrophobicContact CD1-CD1 3.61Å; L115-L170 HydrophobicContact CD1-CD2 4.49Å; L115-L170 HydrophobicContact CD1-CG 3.77Å; V131-L170 HydrophobicContact CG1-CD1 4.2Å; V131-L170 HydrophobicContact CG1-CD2 3.98Å; I135-L170 HydrophobicContact CD1-CD1 4.04Å; I135-L170 HydrophobicContact CD1-CD2 4.32Å; I135-L170 HydrophobicContact CG1-CD1 3.73Å; V155-L170 HydrophobicContact CG1-CB 3.91Å; V155-L170 HydrophobicContact CG1-CD2 4.22Å; V155-L170 HydrophobicContact CG1-CG 4.46Å; L156-L170 WeakPolarHBondContact O-CA 3.38Å; N157-L170 HydrophobicContact CB-CD2 3.91Å; N157-L170 WeakPolarHBondContact OD1-CD2 3.32Å; L170-F172 HydrophobicContact CB-CE2 4.15Å
171	I	98.6	Very high	95.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.3	176.3	-56.6	91.5	0	0	0	108.8	K110 L156 L158 H169	K110-I171 HydrophobicContact CB-CG2 4.15Å; K110-I171 HydrophobicContact CD-CG2 3.66Å; L156-I171 HydrophobicContact CB-CB 4.4Å; L156-I171 HydrophobicContact CD2-CD1 4.46Å; L156-I171 PolarHBondContact N-O 3.05Å; L156-I171 PolarHBondContact O-N 3.27Å; L158-I171 HydrophobicContact CD1-CD1 4.01Å; L158-I171 HydrophobicContact CG-CD1 4.34Å; H169-I171 HydrophobicContact CB-CD1 4.05Å
172	F	97.9	Very high	95.4	Very high	1 Å²	1	39.3 Å²	39.3	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	119.9	-174.9	-75.7	-119	0	0	0	110.8	L111 F113 I135 V138 L142 V155 L170 L174	L111-F172 HydrophobicContact CB-CB 3.94Å; L111-F172 HydrophobicContact CB-CG 4.33Å; L111-F172 HydrophobicContact CD2-CB 4.22Å; L111-F172 HydrophobicContact CD2-CD1 3.87Å; L111-F172 HydrophobicContact CD2-CD2 4.11Å; L111-F172 HydrophobicContact CD2-CE1 4.25Å; L111-F172 HydrophobicContact CD2-CE2 4.48Å; L111-F172 HydrophobicContact CD2-CG 3.81Å; L111-F172 HydrophobicContact CG-CB 4.12Å; L111-F172 HydrophobicContact CG-CD2 3.94Å; L111-F172 HydrophobicContact CG-CG 3.95Å; L111-F172 WeakPolarHBondContact O-CB 3.45Å; L111-F172 PolarHBondContact O-N 2.93Å; F113-F172 HydrophobicContact CD2-CD2 4.21Å; F113-F172 AromaticContact CD2-CE2 3.66Å; F113-F172 HydrophobicContact CD2-CE2 3.66Å; F113-F172 HydrophobicContact CE2-CD2 4.15Å; F113-F172 AromaticContact CE2-CE2 3.51Å; F113-F172 HydrophobicContact CE2-CE2 3.51Å; F113-F172 HydrophobicContact CE2-CZ 4.02Å; I135-F172 HydrophobicContact CG1-CZ 4.39Å; V138-F172 HydrophobicContact CB-CE1 4.38Å; V138-F172 HydrophobicContact CB-CZ 4.2Å; V138-F172 HydrophobicContact CG1-CE1 3.77Å; V138-F172 HydrophobicContact CG1-CZ 3.81Å; L142-F172 HydrophobicContact CD1-CD1 4.24Å; L142-F172 HydrophobicContact CD1-CE1 4.44Å; V155-F172 HydrophobicContact CG1-CD2 4.01Å; V155-F172 HydrophobicContact CG1-CE2 3.84Å; V155-F172 HydrophobicContact CG1-CZ 4.27Å; V155-F172 HydrophobicContact CG2-CD1 3.67Å; V155-F172 HydrophobicContact CG2-CD2 4.16Å; V155-F172 HydrophobicContact CG2-CE1 3.57Å; V155-F172 HydrophobicContact CG2-CE2 4.06Å; V155-F172 HydrophobicContact CG2-CG 3.96Å; V155-F172 HydrophobicContact CG2-CZ 3.77Å; L170-F172 HydrophobicContact CB-CE2 4.15Å; F172-L174 HydrophobicContact CB-CD2 4.2Å; F172-L174 HydrophobicContact CB-CG 4.33Å; F172-L174 HydrophobicContact CD1-CD2 4.36Å; F172-L174 PolarHBondContact O-N 2.78Å
173	M	95	Very high	95.4	Very high	54 Å²	54	38.7 Å²	38.7	27%	0.266	19%	0.188	S	C	.	.			trans	-94.1	74	176.3	-58.8	-60.3	-70.2	0	0	109.8	K110 N154 F290 A307	K110-M173 HydrophobicContact CD-SD 3.7Å; K110-M173 VanDerWaalsContact CE-SD 3.54Å; N154-M173 WeakPolarHBondContact O-CB 3.47Å; N154-M173 PolarHBondContact O-N 2.92Å; M173-F290 HydrophobicContact CB-CE2 3.97Å; M173-F290 HydrophobicContact CG-CD2 4.28Å; M173-F290 HydrophobicContact CG-CE2 3.61Å; M173-F290 HydrophobicContact CG-CZ 3.88Å; M173-A307 HydrophobicContact CE-CB 4.43Å; M173-A307 HydrophobicContact SD-CB 4.44Å
174	L	93.4	Very high	95.6	Very high	22 Å²	22	30.3 Å²	30.3	12%	0.115	15%	0.149	C	C	.	.			trans	-69.1	134.3	179.6	-55.3	-179	0	0	0	110.8	L142 V148 C150 F172 A177 F179 L321	L142-L174 HydrophobicContact CD1-CD2 3.87Å; V148-L174 HydrophobicContact CG1-CB 4.46Å; V148-L174 HydrophobicContact CG1-CD1 4.42Å; V148-L174 HydrophobicContact CG1-CD2 4.29Å; C150-L174 HydrophobicContact CB-CD2 3.9Å; F172-L174 HydrophobicContact CB-CD2 4.2Å; F172-L174 HydrophobicContact CB-CG 4.33Å; F172-L174 HydrophobicContact CD1-CD2 4.36Å; F172-L174 PolarHBondContact O-N 2.78Å; L174-A177 HydrophobicContact CB-CB 4.14Å; L174-A177 HydrophobicContact CD1-CB 4.46Å; L174-F179 HydrophobicContact CD1-CE2 4.35Å; L174-L321 HydrophobicContact CD1-CD1 4.12Å
175	Q	87.3	Confident	95.8	Very high	135 Å²	135	25.4 Å²	25.4	63%	0.631	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	127.3	176.2	-63.9	-172.7	15.3	0	0	109.8	A177	Q175-A177 PolarHBondContact O-N 3.48Å
176	N	87.2	Confident	95.9	Very high	113 Å²	113	22.5 Å²	22.5	60%	0.604	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	24.5	177.4	-54.9	-37.3	0	0	0	114.5	Q318 R319	N176-Q318 CarbonylContact O-C 3.55Å; N176-Q318 WeakPolarHBondContact O-CA 3.42Å; N176-R319 PolarHBondContact O-N 2.84Å
177	A	94.1	Very high	95.8	Very high	10 Å²	10	27.7 Å²	27.7	8%	0.083	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	146.6	177.2	0	0	0	0	0	111.3	V148 L174 Q175 R319 L321	V148-A177 HydrophobicContact CG1-CB 4.23Å; V148-A177 HydrophobicContact CG2-CB 4.09Å; L174-A177 HydrophobicContact CB-CB 4.14Å; L174-A177 HydrophobicContact CD1-CB 4.46Å; Q175-A177 PolarHBondContact O-N 3.48Å; A177-R319 VanDerWaalsContact CA-O 3.26Å; A177-R319 WeakPolarHBondContact CA-O 3.3Å; A177-L321 HydrophobicContact CB-CD1 4.2Å; A177-L321 HydrophobicContact CB-CD2 4.36Å; A177-L321 HydrophobicContact CB-CG 4.27Å
178	A	96	Very high	95.8	Very high	2 Å²	2	27.3 Å²	27.3	2%	0.017	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157	172.9	0	0	0	0	0	109.2	V108 V313 R319 I320 L321	V108-A178 HydrophobicContact CG1-CB 3.55Å; A178-V313 HydrophobicContact CB-CG1 3.85Å; A178-R319 PolarHBondContact N-O 2.8Å; A178-I320 HydrophobicContact CB-CD1 4.49Å; A178-I320 CarbonylContact O-C 3.35Å; A178-I320 WeakPolarHBondContact O-CA 3.49Å; A178-L321 PolarHBondContact O-N 3.01Å
179	F	96.8	Very high	95.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	145.4	174.5	-81.3	-98.8	0	0	0	110.3	V108 C109 L111 L142 Y146 L174 D181 H184 V185 F188 L321	V108-F179 WeakPolarHBondContact CA-O 3.17Å; V108-F179 WeakPolarHBondContact CG1-O 3.47Å; C109-F179 PolarHBondContact N-O 3.17Å; C109-F179 PolarHBondContact O-N 3.41Å; L111-F179 HydrophobicContact CB-CD2 3.96Å; L111-F179 HydrophobicContact CB-CE2 3.77Å; L111-F179 HydrophobicContact CD2-CE2 4.37Å; L111-F179 HydrophobicContact CG-CE2 4.46Å; L142-F179 HydrophobicContact CD2-CE2 4.35Å; L142-F179 HydrophobicContact CD2-CZ 4.26Å; Y146-F179 HydrophobicContact CE2-CE1 4.19Å; Y146-F179 HydrophobicContact CE2-CZ 4.04Å; L174-F179 HydrophobicContact CD1-CE2 4.35Å; F179-D181 PolarHBondContact O-N 3.47Å; F179-H184 HydrophobicContact CD1-CB 4.39Å; F179-V185 HydrophobicContact CB-CG2 3.46Å; F179-V185 VanDerWaalsContact CB-CG2 3.46Å; F179-V185 HydrophobicContact CD1-CB 4.5Å; F179-V185 HydrophobicContact CD1-CG2 3.87Å; F179-V185 HydrophobicContact CD2-CG2 3.96Å; F179-V185 HydrophobicContact CG-CG2 3.48Å; F179-V185 VanDerWaalsContact CG-CG2 3.48Å; F179-F188 HydrophobicContact CE1-CB 3.89Å; F179-F188 HydrophobicContact CE1-CD1 4.04Å; F179-F188 HydrophobicContact CE1-CG 4.06Å; F179-F188 HydrophobicContact CZ-CB 4.4Å; F179-F188 AromaticContact CZ-CD1 3.67Å; F179-F188 HydrophobicContact CZ-CD1 3.67Å; F179-F188 HydrophobicContact CZ-CE1 4.15Å; F179-F188 HydrophobicContact CZ-CG 4.09Å; F179-L321 HydrophobicContact CD1-CB 4.06Å; F179-L321 HydrophobicContact CD2-CB 4.41Å; F179-L321 HydrophobicContact CD2-CD1 4.16Å; F179-L321 HydrophobicContact CE1-CB 4.13Å; F179-L321 HydrophobicContact CE2-CB 4.46Å; F179-L321 HydrophobicContact CE2-CD1 3.74Å; F179-L321 HydrophobicContact CG-CB 4.21Å; F179-L321 HydrophobicContact CZ-CB 4.33Å; F179-L321 HydrophobicContact CZ-CD1 4.01Å
180	K	94.6	Very high	95.6	Very high	31 Å²	31	30.4 Å²	30.4	14%	0.135	15%	0.146	C	C	.	.	S	Bend	trans	-51.8	-44.5	178.8	175.5	172.7	166.6	-169.2	0	112.5	A107 V108 I320 L321 T322	A107-K180 CarbonylContact C-O 3.32Å; V108-K180 VanDerWaalsContact CA-O 3.31Å; V108-K180 WeakPolarHBondContact CA-O 3.44Å; V108-K180 PolarHBondContact N-O 2.68Å; K180-I320 HydrophobicContact CB-CG2 3.65Å; K180-I320 HydrophobicContact CG-CG2 4.4Å; K180-L321 PolarHBondContact N-O 2.63Å; K180-T322 HydrophobicContact CB-CG2 3.81Å; K180-T322 HydrophobicContact CD-CG2 3.78Å; K180-T322 HydrophobicContact CG-CG2 4.42Å
181	D	95.3	Very high	95.4	Very high	16 Å²	16	31.7 Å²	31.7	9%	0.086	16%	0.156	C	C	.	.			trans	-162.7	175.5	173.1	57.6	47	0	0	0	109.4	A107 C109 F179 I183 H184 V185	A107-D181 WeakPolarHBondContact O-CA 3.23Å; C109-D181 VanDerWaalsContact SG-C 3.5Å; F179-D181 PolarHBondContact O-N 3.47Å; D181-I183 PolarHBondContact O-N 3.39Å; D181-I183 WeakPolarHBondContact OD1-CA 3.37Å; D181-I183 VanDerWaalsContact OD1-CB 3.24Å; D181-I183 WeakPolarHBondContact OD1-CB 3.44Å; D181-I183 PolarHBondContact OD1-N 3.21Å; D181-H184 PolarHBondContact O-N 2.82Å; D181-H184 IonicContact OD1-CE1 2.77Å; D181-H184 IonicContact OD1-CG 3.24Å; D181-H184 PolarHBondContact OD1-N 2.87Å; D181-H184 IonicContact OD1-ND1 3.88Å; D181-H184 PolarHBondContact OD1-ND1 2.92Å; D181-H184 IonicContact OD2-CE1 2.66Å; D181-H184 PolarHBondContact OD2-CE1 2.86Å; D181-H184 VanDerWaalsContact OD2-CE1 3.29Å; D181-H184 IonicContact OD2-ND1 3.53Å; D181-H184 PolarHBondContact OD2-ND1 3.29Å; D181-V185 PolarHBondContact O-N 2.65Å
182	N	97.3	Very high	95.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-68.5	-19.8	-179.3	74.6	-30.7	0	0	0	113.7	I103 C109 Y112 V185 G186 T263	I103-N182 HydrophobicContact CG2-CB 4.11Å; C109-N182 PolarHBondContact SG-N 3.22Å; C109-N182 VanDerWaalsContact SG-N 3.39Å; Y112-N182 HydrophobicContact CE1-CB 3.96Å; Y112-N182 PolarHBondContact OH-ND2 3.42Å; N182-V185 WeakPolarHBondContact O-CB 3.43Å; N182-V185 PolarHBondContact O-N 2.98Å; N182-G186 PolarHBondContact O-N 3.01Å; N182-T263 PolarHBondContact ND2-O 2.84Å
183	I	96.3	Very high	95.1	Very high	47 Å²	47	32.1 Å²	32.1	24%	0.241	16%	0.159	C	C	.	.	H	α-helix	trans	-70.5	-40.4	174.1	-52.8	-54.5	0	0	0	109.9	D181 V185 G186 R187 Y262	D181-I183 PolarHBondContact O-N 3.39Å; D181-I183 WeakPolarHBondContact OD1-CA 3.37Å; D181-I183 VanDerWaalsContact OD1-CB 3.24Å; D181-I183 WeakPolarHBondContact OD1-CB 3.44Å; D181-I183 PolarHBondContact OD1-N 3.21Å; I183-V185 VanDerWaalsContact C-N 3.32Å; I183-G186 PolarHBondContact O-N 3.39Å; I183-R187 WeakPolarHBondContact O-CG 3.02Å; I183-R187 PolarHBondContact O-N 2.92Å; I183-Y262 WeakPolarHBondContact CD1-O 3.46Å
184	H	96.4	Very high	95	Very high	10 Å²	10	33.4 Å²	33.4	5%	0.046	16%	0.164	C	C	.	.	H	α-helix	trans	-67.7	-33.9	174.4	-65.7	74.2	0	0	0	111.6	F179 D181 R187 F188	F179-H184 HydrophobicContact CD1-CB 4.39Å; D181-H184 PolarHBondContact O-N 2.82Å; D181-H184 IonicContact OD1-CE1 2.77Å; D181-H184 IonicContact OD1-CG 3.24Å; D181-H184 PolarHBondContact OD1-N 2.87Å; D181-H184 IonicContact OD1-ND1 3.88Å; D181-H184 PolarHBondContact OD1-ND1 2.92Å; D181-H184 IonicContact OD2-CE1 2.66Å; D181-H184 PolarHBondContact OD2-CE1 2.86Å; D181-H184 VanDerWaalsContact OD2-CE1 3.29Å; D181-H184 IonicContact OD2-ND1 3.53Å; D181-H184 PolarHBondContact OD2-ND1 3.29Å; H184-R187 PolarHBondContact O-N 3.19Å; H184-F188 WeakPolarHBondContact O-CB 3.25Å; H184-F188 PolarHBondContact O-N 2.91Å
185	V	98.1	Very high	94.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.5	-53.9	168	178.9	0	0	0	0	109.9	L111 F179 D181 N182 I183 R187 F188 I189 Y262	L111-V185 HydrophobicContact CD1-CG1 3.51Å; F179-V185 HydrophobicContact CB-CG2 3.46Å; F179-V185 VanDerWaalsContact CB-CG2 3.46Å; F179-V185 HydrophobicContact CD1-CB 4.5Å; F179-V185 HydrophobicContact CD1-CG2 3.87Å; F179-V185 HydrophobicContact CD2-CG2 3.96Å; F179-V185 HydrophobicContact CG-CG2 3.48Å; F179-V185 VanDerWaalsContact CG-CG2 3.48Å; D181-V185 PolarHBondContact O-N 2.65Å; N182-V185 WeakPolarHBondContact O-CB 3.43Å; N182-V185 PolarHBondContact O-N 2.98Å; I183-V185 VanDerWaalsContact C-N 3.32Å; V185-R187 VanDerWaalsContact C-N 3.33Å; V185-R187 PolarHBondContact O-N 3.32Å; V185-F188 PolarHBondContact O-N 3.36Å; V185-F188 VanDerWaalsContact O-N 3.16Å; V185-I189 HydrophobicContact CG1-CG1 4.2Å; V185-I189 WeakPolarHBondContact O-CG1 3.38Å; V185-I189 PolarHBondContact O-N 2.91Å; V185-Y262 HydrophobicContact CB-CD1 4.13Å; V185-Y262 HydrophobicContact CB-CE1 4.2Å; V185-Y262 HydrophobicContact CG1-CD1 3.86Å; V185-Y262 HydrophobicContact CG1-CE1 3.42Å; V185-Y262 VanDerWaalsContact CG1-CE1 3.42Å
186	G	97.4	Very high	95.2	Very high	3 Å²	3	29.1 Å²	29.1	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-56.1	-44.8	179.7	0	0	0	0	0	112.9	N182 I183 F188 I189 H190 Y262	N182-G186 PolarHBondContact O-N 3.01Å; I183-G186 PolarHBondContact O-N 3.39Å; G186-F188 PolarHBondContact O-N 3.41Å; G186-I189 PolarHBondContact O-N 2.79Å; G186-H190 WeakPolarHBondContact O-CB 3.44Å; G186-H190 PolarHBondContact O-CD2 2.93Å; G186-H190 PolarHBondContact O-N 2.93Å; G186-Y262 VanDerWaalsContact CA-CD2 3.46Å
187	R	96.4	Very high	95.4	Very high	120 Å²	120	24.6 Å²	24.6	45%	0.453	12%	0.124	S	C	.	.	H	α-helix	trans	-60.7	-45.3	176.6	-71.9	175	179.9	176.9	1	112.7	I183 H184 V185 H190 A191 W323	I183-R187 WeakPolarHBondContact O-CG 3.02Å; I183-R187 PolarHBondContact O-N 2.92Å; H184-R187 PolarHBondContact O-N 3.19Å; V185-R187 VanDerWaalsContact C-N 3.33Å; V185-R187 PolarHBondContact O-N 3.32Å; R187-H190 PolarHBondContact O-N 2.74Å; R187-A191 WeakPolarHBondContact O-CB 3.44Å; R187-A191 PolarHBondContact O-N 3.24Å; R187-W323 HydrophobicContact CB-CB 4.07Å; R187-W323 HydrophobicContact CB-CG 4.08Å; R187-W323 WeakPolarHBondContact CD-O 3.12Å
188	F	97	Very high	95.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.7	-48.1	175.7	167.7	-112.5	0	0	0	111.3	K141 L142 V145 Y146 F179 H184 V185 G186 A191 I192 W323	K141-F188 HydrophobicContact CB-CZ 4.19Å; L142-F188 HydrophobicContact CD2-CE1 3.93Å; L142-F188 HydrophobicContact CD2-CZ 3.9Å; L142-F188 HydrophobicContact CG-CE1 4.46Å; L142-F188 HydrophobicContact CG-CZ 4.26Å; V145-F188 HydrophobicContact CB-CE2 4.38Å; V145-F188 HydrophobicContact CG2-CE2 4.21Å; Y146-F188 HydrophobicContact CD2-CE2 4.39Å; Y146-F188 AromaticContact CE2-CD2 3.71Å; Y146-F188 HydrophobicContact CE2-CD2 3.71Å; Y146-F188 AromaticContact CE2-CE2 3.77Å; Y146-F188 HydrophobicContact CE2-CE2 3.77Å; Y146-F188 HydrophobicContact CE2-CG 4.22Å; Y146-F188 HydrophobicContact CE2-CZ 4.34Å; F179-F188 HydrophobicContact CE1-CB 3.89Å; F179-F188 HydrophobicContact CE1-CD1 4.04Å; F179-F188 HydrophobicContact CE1-CG 4.06Å; F179-F188 HydrophobicContact CZ-CB 4.4Å; F179-F188 AromaticContact CZ-CD1 3.67Å; F179-F188 HydrophobicContact CZ-CD1 3.67Å; F179-F188 HydrophobicContact CZ-CE1 4.15Å; F179-F188 HydrophobicContact CZ-CG 4.09Å; H184-F188 WeakPolarHBondContact O-CB 3.25Å; H184-F188 PolarHBondContact O-N 2.91Å; V185-F188 PolarHBondContact O-N 3.36Å; V185-F188 VanDerWaalsContact O-N 3.16Å; G186-F188 PolarHBondContact O-N 3.41Å; F188-A191 WeakPolarHBondContact O-CB 3.44Å; F188-A191 PolarHBondContact O-N 3.22Å; F188-A191 VanDerWaalsContact O-N 3.15Å; F188-I192 HydrophobicContact CD2-CG2 3.98Å; F188-I192 HydrophobicContact CE1-CD1 4.02Å; F188-I192 HydrophobicContact CE2-CG2 3.58Å; F188-I192 HydrophobicContact CZ-CD1 3.99Å; F188-I192 HydrophobicContact CZ-CG2 4.05Å; F188-I192 PolarHBondContact O-N 2.87Å; F188-W323 HydrophobicContact CB-CB 4.22Å; F188-W323 HydrophobicContact CB-CD2 4.46Å; F188-W323 HydrophobicContact CB-CE3 4.29Å; F188-W323 HydrophobicContact CB-CG 4.44Å; F188-W323 AromaticContact CD2-CE3 3.74Å; F188-W323 HydrophobicContact CD2-CE3 3.74Å; F188-W323 AromaticContact CD2-CZ3 3.96Å; F188-W323 HydrophobicContact CD2-CZ3 3.96Å
189	I	97.6	Very high	94.7	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.3	-44.7	178.8	-62.9	-48.1	0	0	0	111.5	L111 F113 V185 G186 A191 I192 L193 V257 L259 Y262	L111-I189 HydrophobicContact CD1-CD1 3.97Å; L111-I189 HydrophobicContact CD1-CG1 4.28Å; F113-I189 HydrophobicContact CE1-CD1 3.61Å; F113-I189 HydrophobicContact CE1-CG1 4.02Å; F113-I189 HydrophobicContact CE1-CG2 4.07Å; F113-I189 HydrophobicContact CE2-CD1 4.26Å; F113-I189 HydrophobicContact CZ-CD1 3.28Å; F113-I189 HydrophobicContact CZ-CG1 4.07Å; V185-I189 HydrophobicContact CG1-CG1 4.2Å; V185-I189 WeakPolarHBondContact O-CG1 3.38Å; V185-I189 PolarHBondContact O-N 2.91Å; G186-I189 PolarHBondContact O-N 2.79Å; I189-A191 VanDerWaalsContact C-N 3.28Å; I189-A191 PolarHBondContact O-N 3.33Å; I189-I192 HydrophobicContact CD1-CD1 3.86Å; I189-I192 WeakPolarHBondContact O-CG1 3.41Å; I189-I192 PolarHBondContact O-N 2.84Å; I189-L193 HydrophobicContact CG2-CD1 3.69Å; I189-L193 HydrophobicContact CG2-CG 4.28Å; I189-L193 VanDerWaalsContact O-CB 3.31Å; I189-L193 WeakPolarHBondContact O-CB 3.46Å; I189-L193 VanDerWaalsContact O-CG 3.29Å; I189-L193 WeakPolarHBondContact O-CG 3.39Å; I189-L193 PolarHBondContact O-N 2.89Å; I189-V257 HydrophobicContact CG2-CG1 4.36Å; I189-L259 HydrophobicContact CG2-CD2 3.67Å; I189-Y262 HydrophobicContact CB-CE2 4.32Å; I189-Y262 HydrophobicContact CG2-CE2 4.31Å
190	H	95.4	Very high	94.2	Very high	74 Å²	74	32.7 Å²	32.7	34%	0.343	17%	0.167	S	C	.	.	H	α-helix	trans	-56.8	-44	173	-90.8	-78.9	0	0	0	111.5	G186 R187 L193 Q194 L259	G186-H190 WeakPolarHBondContact O-CB 3.44Å; G186-H190 PolarHBondContact O-CD2 2.93Å; G186-H190 PolarHBondContact O-N 2.93Å; R187-H190 PolarHBondContact O-N 2.74Å; H190-L193 CarbonylContact O-C 3.59Å; H190-L193 PolarHBondContact O-N 2.98Å; H190-Q194 VanDerWaalsContact O-CG 3.24Å; H190-Q194 WeakPolarHBondContact O-CG 3.11Å; H190-Q194 PolarHBondContact O-N 2.92Å; H190-Q194 PolarHBondContact O-NE2 2.79Å; H190-L259 VanDerWaalsContact CE1-CD1 3.49Å; H190-L259 WeakPolarHBondContact CE1-CD1 3.37Å
191	A	94.9	Very high	93.7	Very high	27 Å²	27	37.1 Å²	37.1	22%	0.223	19%	0.186	C	C	.	.	H	α-helix	trans	-63.4	-49.5	-178.8	0	0	0	0	0	112.4	R187 F188 I189 L193 Q194 W323	R187-A191 WeakPolarHBondContact O-CB 3.44Å; R187-A191 PolarHBondContact O-N 3.24Å; F188-A191 WeakPolarHBondContact O-CB 3.44Å; F188-A191 PolarHBondContact O-N 3.22Å; F188-A191 VanDerWaalsContact O-N 3.15Å; I189-A191 VanDerWaalsContact C-N 3.28Å; I189-A191 PolarHBondContact O-N 3.33Å; A191-L193 VanDerWaalsContact C-N 3.25Å; A191-L193 PolarHBondContact O-N 2.81Å; A191-Q194 WeakPolarHBondContact O-CB 3.43Å; A191-Q194 WeakPolarHBondContact O-CG 3.47Å; A191-Q194 PolarHBondContact O-N 3.13Å; A191-W323 HydrophobicContact CB-CD2 4.21Å; A191-W323 VanDerWaalsContact CB-CE2 3.42Å; A191-W323 HydrophobicContact CB-CH2 3.7Å; A191-W323 HydrophobicContact CB-CZ2 3.15Å; A191-W323 HydrophobicContact CB-CZ3 4.4Å
192	I	95.2	Very high	92.9	Very high	9 Å²	9	39.1 Å²	39.1	5%	0.046	20%	0.201	C	C	.	.	H	α-helix	trans	-71.8	-21.1	-178.5	70.2	177.4	0	0	0	112.7	Y137 V138 K141 F188 I189	Y137-I192 HydrophobicContact CE1-CB 4.23Å; Y137-I192 HydrophobicContact CE1-CD1 4.23Å; Y137-I192 HydrophobicContact CE1-CG1 4.22Å; Y137-I192 PolarHBondContact OH-O 2.78Å; V138-I192 HydrophobicContact CG2-CD1 4.19Å; K141-I192 HydrophobicContact CB-CD1 4.33Å; K141-I192 HydrophobicContact CB-CG2 4.03Å; K141-I192 HydrophobicContact CD-CB 4.43Å; K141-I192 HydrophobicContact CD-CG2 4.11Å; K141-I192 HydrophobicContact CG-CB 4.14Å; K141-I192 HydrophobicContact CG-CD1 4.44Å; K141-I192 HydrophobicContact CG-CG2 4Å; F188-I192 HydrophobicContact CD2-CG2 3.98Å; F188-I192 HydrophobicContact CE1-CD1 4.02Å; F188-I192 HydrophobicContact CE2-CG2 3.58Å; F188-I192 HydrophobicContact CZ-CD1 3.99Å; F188-I192 HydrophobicContact CZ-CG2 4.05Å; F188-I192 PolarHBondContact O-N 2.87Å; I189-I192 HydrophobicContact CD1-CD1 3.86Å; I189-I192 WeakPolarHBondContact O-CG1 3.41Å; I189-I192 PolarHBondContact O-N 2.84Å
193	L	95.6	Very high	91.5	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	4.3	176.2	-58.3	-175.9	0	0	0	113.2	Y137 I189 H190 A191 P195 I196 I197 L241 L244 L255 V257 L259	Y137-L193 HydrophobicContact CE1-CD2 3.99Å; I189-L193 HydrophobicContact CG2-CD1 3.69Å; I189-L193 HydrophobicContact CG2-CG 4.28Å; I189-L193 VanDerWaalsContact O-CB 3.31Å; I189-L193 WeakPolarHBondContact O-CB 3.46Å; I189-L193 VanDerWaalsContact O-CG 3.29Å; I189-L193 WeakPolarHBondContact O-CG 3.39Å; I189-L193 PolarHBondContact O-N 2.89Å; H190-L193 CarbonylContact O-C 3.59Å; H190-L193 PolarHBondContact O-N 2.98Å; A191-L193 VanDerWaalsContact C-N 3.25Å; A191-L193 PolarHBondContact O-N 2.81Å; L193-P195 VanDerWaalsContact C-N 3.31Å; L193-I196 HydrophobicContact CB-CG2 4.16Å; L193-I196 VanDerWaalsContact O-CG2 3.23Å; L193-I196 WeakPolarHBondContact O-CG2 3.48Å; L193-I196 PolarHBondContact O-N 3.45Å; L193-I197 HydrophobicContact CB-CD1 3.93Å; L193-I197 HydrophobicContact CB-CG1 4.36Å; L193-I197 VanDerWaalsContact O-CG1 3.28Å; L193-I197 WeakPolarHBondContact O-CG1 3.41Å; L193-I197 PolarHBondContact O-N 2.78Å; L193-L241 HydrophobicContact CD2-CD1 4.18Å; L193-L244 HydrophobicContact CD2-CD1 3.69Å; L193-L255 HydrophobicContact CD1-CD2 4.07Å; L193-V257 HydrophobicContact CD1-CB 4.29Å; L193-V257 HydrophobicContact CD1-CG1 4.45Å; L193-V257 HydrophobicContact CD1-CG2 4.15Å; L193-L259 HydrophobicContact CD1-CD2 4.41Å
194	Q	92.8	Very high	90	Very high	81 Å²	81	42.8 Å²	42.8	38%	0.379	23%	0.227	S	C	.	.	H	α-helix	trans	-51.5	-40	177.5	-77.6	-53.3	-60.2	0	0	114.5	H190 A191 I196 I197 S198	H190-Q194 VanDerWaalsContact O-CG 3.24Å; H190-Q194 WeakPolarHBondContact O-CG 3.11Å; H190-Q194 PolarHBondContact O-N 2.92Å; H190-Q194 PolarHBondContact O-NE2 2.79Å; A191-Q194 WeakPolarHBondContact O-CB 3.43Å; A191-Q194 WeakPolarHBondContact O-CG 3.47Å; A191-Q194 PolarHBondContact O-N 3.13Å; Q194-I196 VanDerWaalsContact C-N 3.31Å; Q194-I196 PolarHBondContact O-N 3.17Å; Q194-I197 PolarHBondContact O-N 3.47Å; Q194-S198 WeakPolarHBondContact O-CB 3.36Å; Q194-S198 PolarHBondContact O-N 2.98Å; Q194-S198 PolarHBondContact O-OG 3.28Å
195	P	91.7	Very high	88.3	Confident	63 Å²	63	51.4 Å²	51.4	41%	0.409	26%	0.259	S	S	.	.	H	α-helix	trans	-58.1	-42.9	-179.7	-26.3	35.7	0	0	0	112.8	L193 K199 V238	L193-P195 VanDerWaalsContact C-N 3.31Å; P195-K199 PolarHBondContact O-N 2.88Å; P195-V238 HydrophobicContact CB-CG1 4.33Å
196	I	92.7	Very high	86.2	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-80.3	-35.8	-179	-164.6	59.4	0	0	0	112.4	L193 Q194 S198 K199 L200 L241 L245 L255	L193-I196 HydrophobicContact CB-CG2 4.16Å; L193-I196 VanDerWaalsContact O-CG2 3.23Å; L193-I196 WeakPolarHBondContact O-CG2 3.48Å; L193-I196 PolarHBondContact O-N 3.45Å; Q194-I196 VanDerWaalsContact C-N 3.31Å; Q194-I196 PolarHBondContact O-N 3.17Å; I196-S198 VanDerWaalsContact C-N 3.28Å; I196-S198 PolarHBondContact O-N 3.33Å; I196-K199 HydrophobicContact CD1-CB 4.45Å; I196-K199 HydrophobicContact CD1-CD 4.22Å; I196-K199 PolarHBondContact O-N 3.2Å; I196-L200 PolarHBondContact O-N 3.36Å; I196-L241 HydrophobicContact CB-CB 3.88Å; I196-L241 HydrophobicContact CB-CD1 4.43Å; I196-L241 HydrophobicContact CG1-CB 4.36Å; I196-L241 HydrophobicContact CG2-CB 4.27Å; I196-L241 HydrophobicContact CG2-CD1 4.26Å; I196-L245 HydrophobicContact CD1-CD1 3.9Å; I196-L245 HydrophobicContact CD1-CD2 3.68Å; I196-L245 HydrophobicContact CD1-CG 3.73Å; I196-L245 HydrophobicContact CG1-CD2 3.74Å; I196-L245 HydrophobicContact CG1-CG 4.13Å; I196-L255 HydrophobicContact CG1-CD1 4.34Å; I196-L255 HydrophobicContact CG2-CD1 3.82Å
197	I	91.4	Very high	83.9	Confident	18 Å²	18	65.9 Å²	65.9	9%	0.092	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-39.1	174.7	-66.1	166.4	0	0	0	110.7	L193 Q194 K201 L259	L193-I197 HydrophobicContact CB-CD1 3.93Å; L193-I197 HydrophobicContact CB-CG1 4.36Å; L193-I197 VanDerWaalsContact O-CG1 3.28Å; L193-I197 WeakPolarHBondContact O-CG1 3.41Å; L193-I197 PolarHBondContact O-N 2.78Å; Q194-I197 PolarHBondContact O-N 3.47Å; I197-K201 WeakPolarHBondContact O-CG 3.29Å; I197-K201 PolarHBondContact O-N 3.38Å; I197-L259 HydrophobicContact CD1-CD1 3.7Å; I197-L259 HydrophobicContact CG1-CD1 4.26Å
198	S	89	Confident	81.3	Confident	65 Å²	65	68.7 Å²	68.7	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-67.6	-39.3	178.3	-58.4	0	0	0	0	111.8	Q194 I196 K201 S202	Q194-S198 WeakPolarHBondContact O-CB 3.36Å; Q194-S198 PolarHBondContact O-N 2.98Å; Q194-S198 PolarHBondContact O-OG 3.28Å; I196-S198 VanDerWaalsContact C-N 3.28Å; I196-S198 PolarHBondContact O-N 3.33Å; S198-K201 PolarHBondContact O-N 3.37Å; S198-S202 PolarHBondContact O-N 3.26Å
199	K	87.2	Confident	78.5	Confident	91 Å²	91	71.7 Å²	71.7	40%	0.396	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-44.9	174.9	-172.3	178.3	178.4	-177.5	0	112.3	P195 I196 K201 S202 D203	P195-K199 PolarHBondContact O-N 2.88Å; I196-K199 HydrophobicContact CD1-CB 4.45Å; I196-K199 HydrophobicContact CD1-CD 4.22Å; I196-K199 PolarHBondContact O-N 3.2Å; K199-K201 VanDerWaalsContact C-N 3.26Å; K199-K201 PolarHBondContact O-N 2.78Å; K199-S202 WeakPolarHBondContact CA-OG 3.07Å; K199-S202 PolarHBondContact O-N 2.77Å; K199-S202 PolarHBondContact O-OG 3.29Å; K199-D203 PolarHBondContact O-N 3.34Å
200	L	86.6	Confident	75.7	Confident	26 Å²	26	79 Å²	79	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-56.2	-40.6	173.4	-93.3	149.9	0	0	0	112.4	I196 S204 L245 D253 L255	I196-L200 PolarHBondContact O-N 3.36Å; L200-S204 WeakPolarHBondContact O-CB 3.45Å; L200-S204 PolarHBondContact O-N 3.2Å; L200-S204 VanDerWaalsContact O-N 3.12Å; L200-S204 PolarHBondContact O-OG 3.21Å; L200-L245 HydrophobicContact CD1-CD2 3.58Å; L200-L245 HydrophobicContact CD2-CD2 4.15Å; L200-L245 HydrophobicContact CG-CD2 3.64Å; L200-D253 HydrophobicContact CD2-CB 3.74Å; L200-L255 HydrophobicContact CD1-CB 4.42Å; L200-L255 HydrophobicContact CD1-CD1 4.35Å
201	K	84.1	Confident	73	Confident	124 Å²	124	83.1 Å²	83.1	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-71.8	-34.6	178.4	-72.2	177.8	-179.4	-179	0	113.1	I197 S198 K199 R205	I197-K201 WeakPolarHBondContact O-CG 3.29Å; I197-K201 PolarHBondContact O-N 3.38Å; S198-K201 PolarHBondContact O-N 3.37Å; K199-K201 VanDerWaalsContact C-N 3.26Å; K199-K201 PolarHBondContact O-N 2.78Å; K201-R205 WeakPolarHBondContact O-CG 3.32Å; K201-R205 PolarHBondContact O-N 3.31Å
202	S	76.9	Confident	69.9	Low	58 Å²	58	86.4 Å²	86.4	41%	0.406	46%	0.461	S	S	.	.	H	α-helix	trans	-68.3	-42.7	175.5	56.3	0	0	0	0	111.4	S198 K199 S204 R205 L206	S198-S202 PolarHBondContact O-N 3.26Å; K199-S202 WeakPolarHBondContact CA-OG 3.07Å; K199-S202 PolarHBondContact O-N 2.77Å; K199-S202 PolarHBondContact O-OG 3.29Å; S202-S204 VanDerWaalsContact C-N 3.34Å; S202-S204 PolarHBondContact O-N 2.93Å; S202-R205 PolarHBondContact O-N 3.23Å; S202-L206 PolarHBondContact O-N 3.07Å
203	D	69.6	Low	67	Low	57 Å²	57	93.3 Å²	93.3	31%	0.305	50%	0.498	S	S	.	.	H	α-helix	trans	-70	-34.2	-177.5	-64.6	-9.3	0	0	0	111.3	K199 R205 L206	K199-D203 PolarHBondContact O-N 3.34Å; D203-R205 VanDerWaalsContact C-N 3.35Å; D203-R205 PolarHBondContact O-N 2.93Å; D203-L206 PolarHBondContact O-N 2.91Å
204	S	64.9	Low	64.2	Low	68 Å²	68	99.4 Å²	99.4	48%	0.476	54%	0.535	S	S	.	.	H	α-helix	trans	-64.9	-35.6	174.3	-57	0	0	0	0	112.9	L200 S202 L206 H207	L200-S204 WeakPolarHBondContact O-CB 3.45Å; L200-S204 PolarHBondContact O-N 3.2Å; L200-S204 VanDerWaalsContact O-N 3.12Å; L200-S204 PolarHBondContact O-OG 3.21Å; S202-S204 VanDerWaalsContact C-N 3.34Å; S202-S204 PolarHBondContact O-N 2.93Å; S204-L206 VanDerWaalsContact C-N 3.33Å; S204-H207 PolarHBondContact O-N 2.81Å
205	R	59.9	Low	61.1	Low	191 Å²	191	102.1 Å²	102.1	72%	0.721	55%	0.552	S	S	*	*	H	α-helix	trans	-73.3	-23.6	179.6	-73.1	175.5	-176.4	-170.2	-0.3	113.4	K201 S202 D203 H207	K201-R205 WeakPolarHBondContact O-CG 3.32Å; K201-R205 PolarHBondContact O-N 3.31Å; S202-R205 PolarHBondContact O-N 3.23Å; D203-R205 VanDerWaalsContact C-N 3.35Å; D203-R205 PolarHBondContact O-N 2.93Å; R205-H207 VanDerWaalsContact C-N 3.28Å
206	L	53.8	Low	58.4	Low	135 Å²	135	106.1 Å²	106.1	71%	0.707	57%	0.57	S	S	*	*	H	α-helix	trans	-74.8	-20	174.8	-67.9	171.1	0	0	0	112.3	S202 D203 S204	S202-L206 PolarHBondContact O-N 3.07Å; D203-L206 PolarHBondContact O-N 2.91Å; S204-L206 VanDerWaalsContact C-N 3.33Å
207	H	49.8	Very low	55.5	Low	171 Å²	171	116.7 Å²	116.7	79%	0.792	61%	0.61	S	S	*	*	H	α-helix	trans	-91.7	-14.9	179.7	-82	-57.2	0	0	0	115	S204 R205	S204-H207 PolarHBondContact O-N 2.81Å; R205-H207 VanDerWaalsContact C-N 3.28Å
208	E	41.2	Very low	52.7	Low	179 Å²	179	124.6 Å²	124.6	84%	0.836	65%	0.646	S	S	*	*	S	Bend	trans	-94.9	-5.2	175.6	-76.5	-177.1	160	0	0	113.6
209	G	38.7	Very low	49.8	Very low	64 Å²	64	128 Å²	128	66%	0.66	66%	0.664	S	S	*	*			trans	-107.4	26.5	-168.8	0	0	0	0	0	116.5
210	D	38.5	Very low	47	Very low	152 Å²	152	131.2 Å²	131.2	81%	0.813	69%	0.686	S	S	*	*			trans	-117.5	71.6	179.4	-149.5	10.8	0	0	0	112.6
211	I	38.5	Very low	44.4	Very low	161 Å²	161	137.3 Å²	137.3	83%	0.826	72%	0.717	S	S	*	*			trans	-140.1	110.4	144.7	-57.8	-176.6	0	0	0	108.2
212	S	30.8	Very low	41.8	Very low	96 Å²	96	139 Å²	139	67%	0.671	73%	0.732	S	S	*	*			trans	121.1	107.2	146.7	70.9	0	0	0	0	118.4
213	L	32.7	Very low	39.5	Very low	154 Å²	154	141.8 Å²	141.8	81%	0.806	75%	0.751	S	S	*	*			trans	78.5	102.9	131.5	-59.8	169.6	0	0	0	119.5
214	T	36.4	Very low	37.5	Very low	129 Å²	129	143.6 Å²	143.6	79%	0.791	77%	0.774	S	S	*	*				17.4	118	129.7	58	0	0	0	0	117.5
215	D	29.1	Very low	36.1	Very low	138 Å²	138	146 Å²	146	74%	0.738	79%	0.788	S	S	*	*				-155.2	126.1	123.5	-155.8	10.7	0	0	0	111
216	D	33.6	Very low	34.5	Very low	147 Å²	147	142 Å²	142	79%	0.786	80%	0.796	S	S	*	*			trans	-67.9	133.1	169.7	-83.8	-49.6	0	0	0	109.5
217	R	32.4	Very low	33.4	Very low	226 Å²	226	144.3 Å²	144.3	85%	0.853	80%	0.803	S	S	*	*			trans	-162.3	105.8	147.2	-104.8	152.9	-151.9	-142.6	8.7	112
218	H	32.6	Very low	32.3	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.856	80%	0.804	S	S	*	*			trans	-48.5	136.5	155.6	-76.3	-46.6	0	0	0	112.1
219	T	28.1	Very low	31.9	Very low	137 Å²	137	138.9 Å²	138.9	84%	0.84	80%	0.801	S	S	*	*			trans	-154.4	115.1	135.2	25.5	0	0	0	0	110
220	N	29.4	Very low	31.7	Very low	158 Å²	158	144.7 Å²	144.7	85%	0.845	81%	0.811	S	S	*	*			trans	-69.4	131.1	162	-78.5	-29.2	0	0	0	109.4
221	I	31.9	Very low	31.2	Very low	154 Å²	154	148.7 Å²	148.7	79%	0.79	82%	0.815	S	S	*	*			trans	-140.3	113	150.2	-63.3	-174.7	0	0	0	108.7
222	D	27.8	Very low	30.8	Very low	159 Å²	159	150.7 Å²	150.7	85%	0.85	82%	0.818	S	S	*	*			trans	-65.9	137	162.5	-79.9	-46.7	0	0	0	111.1
223	S	29	Very low	30.9	Very low	116 Å²	116	157.2 Å²	157.2	81%	0.811	83%	0.827	S	S	*	*			trans	-163.4	125	145	12.1	0	0	0	0	111.4
224	A	28.3	Very low	31	Very low	96 Å²	96	159 Å²	159	79%	0.793	83%	0.832	S	S	*	*			trans	-85.1	-174.8	-178.7	0	0	0	0	0	111.8
225	P	34.5	Very low	30.9	Very low	118 Å²	118	162.2 Å²	162.2	77%	0.766	84%	0.835	S	S	*	*				-106.1	145.5	-120.7	32	-14.5	0	0	0	114
226	A	27	Very low	31.5	Very low	107 Å²	107	162.1 Å²	162.1	88%	0.884	83%	0.83	S	S	*	*			trans	-109.8	109.8	168.5	0	0	0	0	0	110.3
227	Q	30.6	Very low	31.9	Very low	184 Å²	184	163.3 Å²	163.3	86%	0.86	83%	0.831	S	S	*	*			trans	-77.8	136.3	173.3	-66.4	177.2	1.5	0	0	111
228	S	27.9	Very low	33.1	Very low	116 Å²	116	157.8 Å²	157.8	81%	0.811	82%	0.822	S	S	*	*			trans	172	160.2	143.9	45.3	0	0	0	0	110.7
229	P	32	Very low	34.9	Very low	119 Å²	119	155 Å²	155	77%	0.773	80%	0.804	S	S	*	*				-107.2	152.2	-77.1	28	-11.6	0	0	0	112.1	R231	P229-R231 PolarHBondContact O-N 2.98Å
230	E	33.7	Very low	37.6	Very low	186 Å²	186	153.9 Å²	153.9	87%	0.869	79%	0.793	S	S	*	*			trans	-54.9	104.9	178	-63.6	177.2	152.3	0	0	112.6
231	R	28.7	Very low	40.7	Very low	237 Å²	237	146.7 Å²	146.7	89%	0.894	75%	0.754	S	S	*	*			trans	-83.5	112.6	148.5	-73.7	-176.2	177.8	-172.4	-0	106.3	P229 R233	P229-R231 PolarHBondContact O-N 2.98Å; R231-R233 PolarHBondContact O-N 2.65Å
232	K	30.1	Very low	43.5	Very low	202 Å²	202	141.5 Å²	141.5	88%	0.878	73%	0.731	S	S	*	*			trans	-53.3	82.7	170.8	-74.7	178.7	176	177	0	110.2	Q234	K232-Q234 PolarHBondContact O-N 3.34Å
233	R	33.6	Very low	46.7	Very low	233 Å²	233	136.2 Å²	136.2	88%	0.879	70%	0.701	S	S	*	*			trans	-62.1	116.3	152	-84.3	177.5	157.5	165.6	-6.1	104.2	R231 K235	R231-R233 PolarHBondContact O-N 2.65Å; R233-K235 VanDerWaalsContact C-N 3.3Å; R233-K235 PolarHBondContact O-N 3.25Å
234	Q	33.6	Very low	49.8	Very low	193 Å²	193	130.7 Å²	130.7	90%	0.902	66%	0.662	S	S	*	*			trans	-50.7	105.5	164.4	-82.6	173	-27.5	0	0	106.4	K232 Q236	K232-Q234 PolarHBondContact O-N 3.34Å; Q234-Q236 VanDerWaalsContact C-N 3.28Å; Q234-Q236 PolarHBondContact O-N 2.94Å
235	K	34.7	Very low	53	Low	196 Å²	196	128.2 Å²	128.2	85%	0.852	64%	0.636	S	S	*	*			trans	-69.9	96.4	176.6	-159	179.1	-174	-176.3	0	103.7	R233 E237	R233-K235 VanDerWaalsContact C-N 3.3Å; R233-K235 PolarHBondContact O-N 3.25Å; K235-E237 PolarHBondContact O-N 3.27Å
236	Q	41.5	Very low	55.9	Low	135 Å²	135	123 Å²	123	63%	0.631	60%	0.602	S	S	*	*			trans	-56.2	107.1	171.3	-162.7	165.1	15.7	0	0	104.8	Q234 V238	Q234-Q236 VanDerWaalsContact C-N 3.28Å; Q234-Q236 PolarHBondContact O-N 2.94Å; Q236-V238 VanDerWaalsContact C-N 3.29Å; Q236-V238 PolarHBondContact O-N 3.28Å
237	E	43.3	Very low	59.1	Low	172 Å²	172	122.6 Å²	122.6	80%	0.804	58%	0.58	S	S	*	*			trans	-58.1	102	173.8	-84	-173.7	158.1	0	0	106.1	K235 R239	K235-E237 PolarHBondContact O-N 3.27Å; E237-R239 PolarHBondContact O-N 2.91Å
238	V	56.1	Low	62.1	Low	110 Å²	110	116.2 Å²	116.2	67%	0.667	55%	0.551	S	S	*	*			trans	-70.2	92.8	174.7	-178.2	0	0	0	0	104.8	P195 Q236 D240	P195-V238 HydrophobicContact CB-CG1 4.33Å; Q236-V238 VanDerWaalsContact C-N 3.29Å; Q236-V238 PolarHBondContact O-N 3.28Å; V238-D240 PolarHBondContact O-N 3.15Å
239	R	70.8	Confident	65	Low	128 Å²	128	117.1 Å²	117.1	48%	0.483	54%	0.541	S	S	.	.			trans	-54.8	132.7	170	-73.2	-165.9	-177.4	178.1	9.9	107.8	D140 E237 L241	D140-R239 IonicContact OD2-CZ 3.64Å; D140-R239 IonicContact OD2-NH1 2.77Å; D140-R239 PolarHBondContact OD2-NH1 2.61Å; D140-R239 IonicContact OD2-NH2 3.12Å; D140-R239 PolarHBondContact OD2-NH2 3.42Å; E237-R239 PolarHBondContact O-N 2.91Å; R239-L241 PolarHBondContact O-N 2.9Å; R239-L241 VanDerWaalsContact O-N 3.15Å
240	D	86	Confident	67.8	Low	113 Å²	113	117.3 Å²	117.3	60%	0.604	53%	0.532	S	S	*	.			trans	-65.6	115.1	177.5	-176.2	17	0	0	0	109.6	V238 S242	V238-D240 PolarHBondContact O-N 3.15Å; D240-S242 WeakPolarHBondContact OD1-CB 3.44Å; D240-S242 PolarHBondContact OD1-N 3.13Å; D240-S242 PolarHBondContact OD1-OG 3.24Å; D240-S242 VanDerWaalsContact OD1-OG 3.08Å; D240-S242 PolarHBondContact OD2-OG 2.68Å
241	L	93	Very high	70.3	Confident	7 Å²	7	110.2 Å²	110.2	4%	0.037	51%	0.508	C	S	.	.			trans	-97.8	12.4	178.3	-64	-177.1	0	0	0	112	Y137 L193 I196 R239 F243 L244	Y137-L241 HydrophobicContact CD1-CD2 4.14Å; Y137-L241 HydrophobicContact CD2-CD2 4.03Å; Y137-L241 HydrophobicContact CE1-CD1 4.24Å; Y137-L241 HydrophobicContact CE1-CD2 3.98Å; Y137-L241 HydrophobicContact CE2-CD2 3.87Å; Y137-L241 HydrophobicContact CG-CD2 4.15Å; L193-L241 HydrophobicContact CD2-CD1 4.18Å; I196-L241 HydrophobicContact CB-CB 3.88Å; I196-L241 HydrophobicContact CB-CD1 4.43Å; I196-L241 HydrophobicContact CG1-CB 4.36Å; I196-L241 HydrophobicContact CG2-CB 4.27Å; I196-L241 HydrophobicContact CG2-CD1 4.26Å; R239-L241 PolarHBondContact O-N 2.9Å; R239-L241 VanDerWaalsContact O-N 3.15Å; L241-F243 HydrophobicContact CD2-CE1 3.95Å; L241-F243 PolarHBondContact O-N 2.87Å; L241-F243 VanDerWaalsContact O-N 3.16Å; L241-L244 HydrophobicContact CB-CD1 4.39Å; L241-L244 HydrophobicContact CD2-CD1 4.44Å; L241-L244 WeakPolarHBondContact O-CB 3.36Å; L241-L244 PolarHBondContact O-N 3.45Å
242	S	91.6	Very high	73.2	Confident	44 Å²	44	106.6 Å²	106.6	31%	0.308	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-55.5	-29	178.6	63.4	0	0	0	0	113.5	D240 L244 L245	D240-S242 WeakPolarHBondContact OD1-CB 3.44Å; D240-S242 PolarHBondContact OD1-N 3.13Å; D240-S242 PolarHBondContact OD1-OG 3.24Å; D240-S242 VanDerWaalsContact OD1-OG 3.08Å; D240-S242 PolarHBondContact OD2-OG 2.68Å; S242-L244 PolarHBondContact O-N 2.86Å; S242-L245 WeakPolarHBondContact O-CB 3.43Å; S242-L245 PolarHBondContact O-N 3.49Å
243	F	93.9	Very high	76.2	Confident	49 Å²	49	100.8 Å²	100.8	22%	0.215	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-62.5	-12.1	176.5	77.3	-88	0	0	0	114.1	M130 L133 L134 L241	M130-F243 WeakPolarHBondContact CE-O 3.31Å; L133-F243 HydrophobicContact CB-CD2 3.94Å; L133-F243 HydrophobicContact CB-CE1 4.44Å; L133-F243 HydrophobicContact CB-CE2 3.49Å; L133-F243 VanDerWaalsContact CB-CE2 3.49Å; L133-F243 HydrophobicContact CB-CZ 3.79Å; L133-F243 HydrophobicContact CD1-CB 4.5Å; L133-F243 HydrophobicContact CD1-CD2 4.06Å; L133-F243 HydrophobicContact CD1-CE2 4.46Å; L133-F243 HydrophobicContact CD1-CG 4.15Å; L134-F243 HydrophobicContact CB-CE2 4.36Å; L241-F243 HydrophobicContact CD2-CE1 3.95Å; L241-F243 PolarHBondContact O-N 2.87Å; L241-F243 VanDerWaalsContact O-N 3.16Å
244	L	95.7	Very high	79	Confident	0 Å²	0	90.8 Å²	90.8	0%	0	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-90.8	-4.9	175.4	-61.8	175.5	0	0	0	113.3	L134 L193 L241 S242 L255 F256	L134-L244 HydrophobicContact CB-CD2 4.32Å; L134-L244 HydrophobicContact CD1-CD1 4.37Å; L134-L244 HydrophobicContact CD1-CD2 4.09Å; L193-L244 HydrophobicContact CD2-CD1 3.69Å; L241-L244 HydrophobicContact CB-CD1 4.39Å; L241-L244 HydrophobicContact CD2-CD1 4.44Å; L241-L244 WeakPolarHBondContact O-CB 3.36Å; L241-L244 PolarHBondContact O-N 3.45Å; S242-L244 PolarHBondContact O-N 2.86Å; L244-L255 HydrophobicContact CB-CD1 3.83Å; L244-F256 HydrophobicContact CD2-CB 4.39Å; L244-F256 HydrophobicContact CD2-CD1 3.95Å; L244-F256 WeakPolarHBondContact O-CB 3.48Å; L244-F256 PolarHBondContact O-N 2.8Å
245	L	94.9	Very high	82	Confident	44 Å²	44	83.1 Å²	83.1	23%	0.23	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	131.5	176.8	-63.1	174.8	0	0	0	110.4	I196 L200 S242	I196-L245 HydrophobicContact CD1-CD1 3.9Å; I196-L245 HydrophobicContact CD1-CD2 3.68Å; I196-L245 HydrophobicContact CD1-CG 3.73Å; I196-L245 HydrophobicContact CG1-CD2 3.74Å; I196-L245 HydrophobicContact CG1-CG 4.13Å; L200-L245 HydrophobicContact CD1-CD2 3.58Å; L200-L245 HydrophobicContact CD2-CD2 4.15Å; L200-L245 HydrophobicContact CG-CD2 3.64Å; S242-L245 WeakPolarHBondContact O-CB 3.43Å; S242-L245 PolarHBondContact O-N 3.49Å
246	V	95.7	Very high	85	Confident	9 Å²	9	73.8 Å²	73.8	6%	0.055	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	150.9	178.9	-64.3	0	0	0	0	109.8	F117 N122 M130 G254 F256	F117-V246 HydrophobicContact CB-CB 3.76Å; F117-V246 HydrophobicContact CB-CG1 3.79Å; F117-V246 HydrophobicContact CB-CG2 3.95Å; F117-V246 HydrophobicContact CD1-CG1 4.22Å; F117-V246 HydrophobicContact CG-CG1 4.11Å; N122-V246 WeakPolarHBondContact OD1-CA 3.38Å; M130-V246 HydrophobicContact CE-CG1 3.59Å; V246-G254 PolarHBondContact N-O 3.11Å; V246-G254 CarbonylContact O-C 3.46Å; V246-G254 WeakPolarHBondContact O-CA 3.28Å; V246-G254 PolarHBondContact O-N 2.88Å; V246-F256 HydrophobicContact CG1-CB 4Å; V246-F256 HydrophobicContact CG1-CD2 4.49Å
247	K	94.4	Very high	87.7	Confident	98 Å²	98	67.5 Å²	67.5	43%	0.426	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	138.7	175	-65.4	-167.2	174.3	-158.1	0	111.7	N122 R252 D253	N122-K247 PolarHBondContact ND2-N 2.85Å; N122-K247 PolarHBondContact ND2-O 3.29Å; N122-K247 PolarHBondContact OD1-N 3.44Å; K247-R252 CarbonylContact C-O 3.58Å; K247-R252 WeakPolarHBondContact CA-O 3.25Å; K247-D253 WeakPolarHBondContact CE-OD1 3.43Å
248	N	91.9	Very high	90.2	Very high	49 Å²	49	61.6 Å²	61.6	26%	0.262	31%	0.312	S	S	.	.			trans	-79.5	-173.9	172.2	79.3	1.5	0	0	0	111.4	S121 E250 G251 R252	S121-N248 WeakPolarHBondContact CB-O 3.17Å; S121-N248 PolarHBondContact OG-O 3.45Å; N248-E250 VanDerWaalsContact C-N 3.27Å; N248-E250 PolarHBondContact ND2-OE2 3.36Å; N248-E250 PolarHBondContact O-N 2.94Å; N248-E250 WeakPolarHBondContact OD1-CA 3.32Å; N248-E250 PolarHBondContact OD1-N 3.27Å; N248-E250 PolarHBondContact OD1-OE2 2.99Å; N248-G251 PolarHBondContact O-N 3.18Å; N248-G251 VanDerWaalsContact O-N 3.14Å; N248-G251 PolarHBondContact OD1-N 3.31Å; N248-R252 PolarHBondContact N-O 3.47Å; N248-R252 PolarHBondContact ND2-NE 3.41Å; N248-R252 PolarHBondContact OD1-N 3.31Å; N248-R252 PolarHBondContact OD1-O 2.74Å
249	K	90.7	Very high	92.1	Very high	135 Å²	135	58.1 Å²	58.1	59%	0.587	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-31.2	179.9	-71	-172.3	173.4	-167.1	0	113	H118 G251	H118-K249 HydrophobicContact CB-CG 4.31Å; K249-G251 PolarHBondContact O-N 3.05Å
250	E	89.6	Confident	93.3	Very high	124 Å²	124	53.8 Å²	53.8	58%	0.579	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	4.9	176.8	-51.9	83.1	-128.8	0	0	112.9	N248 R252	N248-E250 VanDerWaalsContact C-N 3.27Å; N248-E250 PolarHBondContact ND2-OE2 3.36Å; N248-E250 PolarHBondContact O-N 2.94Å; N248-E250 WeakPolarHBondContact OD1-CA 3.32Å; N248-E250 PolarHBondContact OD1-N 3.27Å; N248-E250 PolarHBondContact OD1-OE2 2.99Å; E250-R252 VanDerWaalsContact C-N 3.26Å; E250-R252 PolarHBondContact O-N 2.93Å; E250-R252 IonicContact OE2-CZ 2.68Å; E250-R252 IonicContact OE2-NE 2.83Å; E250-R252 IonicContact OE2-NH2 3.66Å; E250-R252 PolarHBondContact OE2-NH2 2.85Å
251	G	86.1	Confident	93.8	Very high	37 Å²	37	48.4 Å²	48.4	38%	0.381	26%	0.255	S	S	.	.	S	Bend	trans	77.4	6.1	179.6	0	0	0	0	0	115	N248 K249	N248-G251 PolarHBondContact O-N 3.18Å; N248-G251 VanDerWaalsContact O-N 3.14Å; N248-G251 PolarHBondContact OD1-N 3.31Å; K249-G251 PolarHBondContact O-N 3.05Å
252	R	90.3	Very high	94	Very high	161 Å²	161	49 Å²	49	61%	0.608	26%	0.257	S	S	*	.			trans	-76.5	144.8	174.4	-64.4	-179.1	-71.1	-177.2	-3.6	110.5	K247 N248 E250	K247-R252 CarbonylContact C-O 3.58Å; K247-R252 WeakPolarHBondContact CA-O 3.25Å; N248-R252 PolarHBondContact N-O 3.47Å; N248-R252 PolarHBondContact ND2-NE 3.41Å; N248-R252 PolarHBondContact OD1-N 3.31Å; N248-R252 PolarHBondContact OD1-O 2.74Å; E250-R252 VanDerWaalsContact C-N 3.26Å; E250-R252 PolarHBondContact O-N 2.93Å; E250-R252 IonicContact OE2-CZ 2.68Å; E250-R252 IonicContact OE2-NE 2.83Å; E250-R252 IonicContact OE2-NH2 3.66Å; E250-R252 PolarHBondContact OE2-NH2 2.85Å
253	D	92	Very high	94.2	Very high	80 Å²	80	50 Å²	50	43%	0.428	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	140.7	177.4	-65.5	-25.2	0	0	0	110.9	L200 K247	L200-D253 HydrophobicContact CD2-CB 3.74Å; K247-D253 WeakPolarHBondContact CE-OD1 3.43Å
254	G	93.7	Very high	94.2	Very high	22 Å²	22	53.7 Å²	53.7	23%	0.227	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	-177.3	178.3	0	0	0	0	0	110.4	V246	V246-G254 PolarHBondContact N-O 3.11Å; V246-G254 CarbonylContact O-C 3.46Å; V246-G254 WeakPolarHBondContact O-CA 3.28Å; V246-G254 PolarHBondContact O-N 2.88Å
255	L	95.8	Very high	94.1	Very high	33 Å²	33	55.6 Å²	55.6	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.4	-179.3	-165.9	68.7	0	0	0	110	L193 I196 L200 L244 V257 L259	L193-L255 HydrophobicContact CD1-CD2 4.07Å; I196-L255 HydrophobicContact CG1-CD1 4.34Å; I196-L255 HydrophobicContact CG2-CD1 3.82Å; L200-L255 HydrophobicContact CD1-CB 4.42Å; L200-L255 HydrophobicContact CD1-CD1 4.35Å; L244-L255 HydrophobicContact CB-CD1 3.83Å; L255-V257 HydrophobicContact CD2-CB 4.03Å; L255-V257 HydrophobicContact CG-CB 4.25Å; L255-V257 PolarHBondContact O-N 3.11Å; L255-L259 HydrophobicContact CD2-CD1 3.82Å; L255-L259 HydrophobicContact CD2-CD2 4.37Å; L255-L259 HydrophobicContact CD2-CG 4.03Å
256	F	97.4	Very high	94.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.288	C	S	.	.	S	Bend	trans	-61.1	-29.9	174.3	177	-135.2	0	0	0	113.1	L115 E116 F117 M130 V131 F166 L244 V246	L115-F256 WeakPolarHBondContact CA-O 3.32Å; L115-F256 HydrophobicContact CB-CD2 4.42Å; L115-F256 HydrophobicContact CB-CE1 4.24Å; L115-F256 HydrophobicContact CB-CE2 3.83Å; L115-F256 HydrophobicContact CB-CZ 3.74Å; L115-F256 HydrophobicContact CD1-CE1 3.85Å; L115-F256 HydrophobicContact CD1-CZ 3.89Å; L115-F256 HydrophobicContact CD2-CD1 4.39Å; L115-F256 HydrophobicContact CD2-CE1 4.27Å; L115-F256 HydrophobicContact CG-CE1 4.36Å; L115-F256 HydrophobicContact CG-CZ 4.3Å; E116-F256 PolarHBondContact N-O 3.5Å; F117-F256 AromaticContact CD1-CD2 3.63Å; F117-F256 HydrophobicContact CD1-CD2 3.63Å; F117-F256 AromaticContact CD1-CE2 3.57Å; F117-F256 HydrophobicContact CD1-CE2 3.57Å; F117-F256 HydrophobicContact CE1-CD2 4.26Å; F117-F256 AromaticContact CE1-CE2 3.85Å; F117-F256 HydrophobicContact CE1-CE2 3.85Å; M130-F256 HydrophobicContact CB-CD1 4.2Å; M130-F256 HydrophobicContact CB-CE1 3.82Å; M130-F256 HydrophobicContact CB-CZ 4.3Å; M130-F256 HydrophobicContact CE-CB 3.78Å; M130-F256 HydrophobicContact CE-CD1 3.84Å; M130-F256 HydrophobicContact CE-CD2 3.93Å; M130-F256 HydrophobicContact CE-CE1 4.37Å; M130-F256 HydrophobicContact CE-CE2 4.45Å; M130-F256 HydrophobicContact CE-CG 3.57Å; V131-F256 HydrophobicContact CG2-CE1 4.11Å; V131-F256 HydrophobicContact CG2-CZ 3.84Å; F166-F256 AromaticContact CD1-CE2 3.61Å; F166-F256 HydrophobicContact CD1-CE2 3.61Å; F166-F256 HydrophobicContact CD1-CZ 4.14Å; F166-F256 AromaticContact CE1-CE2 3.44Å; F166-F256 HydrophobicContact CE1-CE2 3.44Å; F166-F256 VanDerWaalsContact CE1-CE2 3.44Å; F166-F256 AromaticContact CE1-CZ 3.47Å; F166-F256 HydrophobicContact CE1-CZ 3.47Å; F166-F256 VanDerWaalsContact CE1-CZ 3.47Å; F166-F256 HydrophobicContact CZ-CE2 4.39Å; F166-F256 HydrophobicContact CZ-CZ 4.12Å; L244-F256 HydrophobicContact CD2-CB 4.39Å; L244-F256 HydrophobicContact CD2-CD1 3.95Å; L244-F256 WeakPolarHBondContact O-CB 3.48Å; L244-F256 PolarHBondContact O-N 2.8Å; V246-F256 HydrophobicContact CG1-CB 4Å; V246-F256 HydrophobicContact CG1-CD2 4.49Å
257	V	98.1	Very high	94.2	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.018	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-90.4	122.9	177	-179.9	0	0	0	0	109.7	F113 L115 L134 I189 L193 L255 L259	F113-V257 HydrophobicContact CD1-CG1 3.75Å; F113-V257 HydrophobicContact CD1-CG2 4.31Å; F113-V257 HydrophobicContact CE1-CG1 4.27Å; L115-V257 HydrophobicContact CD2-CB 4.25Å; L115-V257 HydrophobicContact CD2-CG1 4.47Å; L115-V257 HydrophobicContact CD2-CG2 3.74Å; L134-V257 HydrophobicContact CD1-CG2 4.3Å; L134-V257 HydrophobicContact CD2-CG2 3.76Å; I189-V257 HydrophobicContact CG2-CG1 4.36Å; L193-V257 HydrophobicContact CD1-CB 4.29Å; L193-V257 HydrophobicContact CD1-CG1 4.45Å; L193-V257 HydrophobicContact CD1-CG2 4.15Å; L255-V257 HydrophobicContact CD2-CB 4.03Å; L255-V257 HydrophobicContact CG-CB 4.25Å; L255-V257 PolarHBondContact O-N 3.11Å; V257-L259 HydrophobicContact CG1-CD2 3.99Å; V257-L259 PolarHBondContact O-N 3.12Å
258	D	97.3	Very high	94.4	Very high	48 Å²	48	52.7 Å²	52.7	26%	0.257	27%	0.272	S	S	.	.			trans	-76.1	107.2	170.6	-178.4	11	0	0	0	110	D114 G260 V261 R266	D114-D258 HydrophobicContact CB-CB 4.24Å; D114-D258 PolarHBondContact O-N 3.3Å; D258-G260 VanDerWaalsContact C-N 3.29Å; D258-G260 WeakPolarHBondContact OD1-CA 3.38Å; D258-G260 PolarHBondContact OD1-N 3.18Å; D258-V261 HydrophobicContact CB-CG1 4.02Å; D258-V261 WeakPolarHBondContact O-CG2 3.37Å; D258-V261 VanDerWaalsContact OD2-CG1 3.26Å; D258-V261 WeakPolarHBondContact OD2-CG1 3.29Å; D258-R266 IonicContact OD2-NH2 2.72Å
259	L	95.8	Very high	94.7	Very high	37 Å²	37	51.4 Å²	51.4	19%	0.194	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-79.8	-13.3	176.8	-58.9	176.4	0	0	0	112.6	I189 H190 L193 I197 L255 V257 V261 Y262	I189-L259 HydrophobicContact CG2-CD2 3.67Å; H190-L259 VanDerWaalsContact CE1-CD1 3.49Å; H190-L259 WeakPolarHBondContact CE1-CD1 3.37Å; L193-L259 HydrophobicContact CD1-CD2 4.41Å; I197-L259 HydrophobicContact CD1-CD1 3.7Å; I197-L259 HydrophobicContact CG1-CD1 4.26Å; L255-L259 HydrophobicContact CD2-CD1 3.82Å; L255-L259 HydrophobicContact CD2-CD2 4.37Å; L255-L259 HydrophobicContact CD2-CG 4.03Å; V257-L259 HydrophobicContact CG1-CD2 3.99Å; V257-L259 PolarHBondContact O-N 3.12Å; L259-V261 PolarHBondContact O-N 3Å; L259-Y262 HydrophobicContact CD2-CE2 4.25Å; L259-Y262 WeakPolarHBondContact O-CD2 3.22Å
260	G	95.6	Very high	95	Very high	37 Å²	37	45.1 Å²	45.1	38%	0.381	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-71.6	-6.6	178.9	0	0	0	0	0	113.8	D258 Y262 R266	D258-G260 VanDerWaalsContact C-N 3.29Å; D258-G260 WeakPolarHBondContact OD1-CA 3.38Å; D258-G260 PolarHBondContact OD1-N 3.18Å; G260-Y262 VanDerWaalsContact C-N 3.34Å; G260-R266 PolarHBondContact O-NH1 3.32Å
261	V	96.9	Very high	95.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-80.5	-10.4	-177.9	-49.1	0	0	0	0	114.8	Y112 D114 D258 L259 T263 R266	Y112-V261 HydrophobicContact CD2-CG2 4.46Å; Y112-V261 HydrophobicContact CE2-CB 4.21Å; Y112-V261 HydrophobicContact CE2-CG2 3.72Å; Y112-V261 PolarHBondContact OH-O 2.93Å; D114-V261 HydrophobicContact CB-CG1 3.54Å; D258-V261 HydrophobicContact CB-CG1 4.02Å; D258-V261 WeakPolarHBondContact O-CG2 3.37Å; D258-V261 VanDerWaalsContact OD2-CG1 3.26Å; D258-V261 WeakPolarHBondContact OD2-CG1 3.29Å; L259-V261 PolarHBondContact O-N 3Å; V261-T263 PolarHBondContact O-N 2.77Å; V261-R266 VanDerWaalsContact CG1-NH2 3.28Å; V261-R266 VanDerWaalsContact O-CG 3.25Å; V261-R266 WeakPolarHBondContact O-CG 3.17Å
262	Y	97.6	Very high	95.7	Very high	18 Å²	18	42.5 Å²	42.5	7%	0.071	21%	0.212	C	C	.	.			trans	-96.5	61.9	-176.1	-50.8	-66.2	0	0	0	111.5	Y112 I183 V185 G186 I189 L259 G260	Y112-Y262 HydrophobicContact CE1-CD1 4.35Å; Y112-Y262 HydrophobicContact CE1-CE1 4.32Å; Y112-Y262 HydrophobicContact CE2-CD1 4.48Å; Y112-Y262 HydrophobicContact CE2-CE1 4.22Å; Y112-Y262 AromaticContact CZ-CD1 3.98Å; Y112-Y262 PolarHBondContact O-OH 3.49Å; I183-Y262 WeakPolarHBondContact CD1-O 3.46Å; V185-Y262 HydrophobicContact CB-CD1 4.13Å; V185-Y262 HydrophobicContact CB-CE1 4.2Å; V185-Y262 HydrophobicContact CG1-CD1 3.86Å; V185-Y262 HydrophobicContact CG1-CE1 3.42Å; V185-Y262 VanDerWaalsContact CG1-CE1 3.42Å; G186-Y262 VanDerWaalsContact CA-CD2 3.46Å; I189-Y262 HydrophobicContact CB-CE2 4.32Å; I189-Y262 HydrophobicContact CG2-CE2 4.31Å; L259-Y262 HydrophobicContact CD2-CE2 4.25Å; L259-Y262 WeakPolarHBondContact O-CD2 3.22Å; G260-Y262 VanDerWaalsContact C-N 3.34Å
263	T	95.8	Very high	96	Very high	66 Å²	66	34.8 Å²	34.8	41%	0.405	18%	0.183	S	C	.	.	S	Bend	trans	-123.2	159.2	-177.6	59.9	0	0	0	0	112	N182 V261 N265 R266	N182-T263 PolarHBondContact ND2-O 2.84Å; V261-T263 PolarHBondContact O-N 2.77Å; T263-N265 PolarHBondContact O-N 3.33Å; T263-R266 WeakPolarHBondContact O-CB 3.47Å; T263-R266 PolarHBondContact O-N 3.4Å
264	K	93.3	Very high	96	Very high	127 Å²	127	31 Å²	31	55%	0.552	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	136.8	179.4	-63.8	174.9	171	-144.9	0	111.1	E105 R266	E105-K264 HydrophobicContact CB-CB 4.37Å; E105-K264 HydrophobicContact CG-CB 4.5Å; E105-K264 HydrophobicContact CG-CD 4.44Å; E105-K264 HydrophobicContact CG-CG 4.14Å; E105-K264 WeakPolarHBondContact OE1-CE 3.3Å; E105-K264 IonicContact OE1-NZ 3.85Å; E105-K264 PolarHBondContact OE1-NZ 3.49Å; E105-K264 WeakPolarHBondContact OE2-CD 3.5Å; E105-K264 IonicContact OE2-NZ 3.05Å; K264-R266 PolarHBondContact O-N 3.09Å
265	N	93.8	Very high	95.9	Very high	39 Å²	39	34.5 Å²	34.5	21%	0.209	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	36.5	178.4	-53.7	-48.7	0	0	0	113.3	V102 I103 E105 T263 N267	V102-N265 HydrophobicContact CG1-CB 4.34Å; I103-N265 CarbonylContact O-C 3.57Å; I103-N265 WeakPolarHBondContact O-CA 3.43Å; I103-N265 PolarHBondContact O-N 3.24Å; E105-N265 PolarHBondContact N-OD1 2.91Å; T263-N265 PolarHBondContact O-N 3.33Å; N265-N267 PolarHBondContact O-N 3.1Å; N265-N267 PolarHBondContact O-ND2 3.46Å
266	R	96.5	Very high	95.4	Very high	62 Å²	62	34.8 Å²	34.8	23%	0.234	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	129.9	-175.3	177.1	69.5	-178.7	-150.4	-4.1	110.1	I103 D258 G260 V261 T263 K264	I103-R266 HydrophobicContact CB-CB 4.46Å; I103-R266 WeakPolarHBondContact CB-O 3.26Å; I103-R266 HydrophobicContact CD1-CB 4.44Å; I103-R266 PolarHBondContact N-O 2.79Å; I103-R266 PolarHBondContact O-N 3.33Å; D258-R266 IonicContact OD2-NH2 2.72Å; G260-R266 PolarHBondContact O-NH1 3.32Å; V261-R266 VanDerWaalsContact CG1-NH2 3.28Å; V261-R266 VanDerWaalsContact O-CG 3.25Å; V261-R266 WeakPolarHBondContact O-CG 3.17Å; T263-R266 WeakPolarHBondContact O-CB 3.47Å; T263-R266 PolarHBondContact O-N 3.4Å; K264-R266 PolarHBondContact O-N 3.09Å
267	N	96.9	Very high	94.8	Very high	23 Å²	23	38.1 Å²	38.1	12%	0.123	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	121.7	168.1	-68.4	-161.4	0	0	0	108.5	Q46 A64 R75 Y100 E101 N265	Q46-N267 PolarHBondContact OE1-ND2 3.35Å; A64-N267 VanDerWaalsContact CB-OD1 3.32Å; A64-N267 WeakPolarHBondContact CB-OD1 3.25Å; R75-N267 VanDerWaalsContact CD-OD1 3.25Å; R75-N267 WeakPolarHBondContact CD-OD1 3.21Å; R75-N267 PolarHBondContact NH1-OD1 3.05Å; R75-N267 VanDerWaalsContact NH1-OD1 3.11Å; Y100-N267 HydrophobicContact CD1-CB 4.45Å; Y100-N267 HydrophobicContact CG-CB 4.45Å; E101-N267 CarbonylContact O-C 3.51Å; E101-N267 VanDerWaalsContact O-CA 3.3Å; E101-N267 WeakPolarHBondContact O-CA 3.47Å; N265-N267 PolarHBondContact O-N 3.1Å; N265-N267 PolarHBondContact O-ND2 3.46Å
268	F	97.6	Very high	94.2	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122	-179	-160.4	-113.3	0	0	0	109.8	Y100 E101 I103 Y112 D114 H169 L270 V310	Y100-F268 CarbonylContact C-O 3.47Å; Y100-F268 WeakPolarHBondContact CA-O 3.26Å; E101-F268 PolarHBondContact N-O 3.35Å; E101-F268 PolarHBondContact O-N 3.43Å; I103-F268 HydrophobicContact CD1-CB 3.76Å; I103-F268 HydrophobicContact CD1-CG 4.27Å; I103-F268 HydrophobicContact CG1-CB 4.33Å; Y112-F268 HydrophobicContact CD2-CD2 4.15Å; Y112-F268 HydrophobicContact CD2-CE1 4.18Å; Y112-F268 AromaticContact CD2-CE2 3.65Å; Y112-F268 HydrophobicContact CD2-CE2 3.65Å; Y112-F268 AromaticContact CD2-CZ 3.65Å; Y112-F268 HydrophobicContact CD2-CZ 3.65Å; Y112-F268 AromaticContact CE2-CD2 3.98Å; Y112-F268 HydrophobicContact CE2-CD2 3.98Å; Y112-F268 AromaticContact CE2-CE2 3.84Å; Y112-F268 HydrophobicContact CE2-CE2 3.84Å; Y112-F268 HydrophobicContact CE2-CZ 4.31Å; D114-F268 HydrophobicContact CB-CE2 4.24Å; H169-F268 HydrophobicContact CB-CE1 4.31Å; H169-F268 HydrophobicContact CB-CZ 4.02Å; H169-F268 AromaticContact CD2-CZ 3.72Å; H169-F268 AromaticContact CE1-CE1 3.66Å; H169-F268 AromaticContact CE1-CE2 3.61Å; H169-F268 AromaticContact CE1-CZ 3.39Å; H169-F268 WeakPolarHBondContact CE1-CZ 3.35Å; H169-F268 AromaticContact CG-CE1 3.87Å; H169-F268 AromaticContact CG-CZ 3.44Å; H169-F268 VanDerWaalsContact CG-CZ 3.44Å; H169-F268 AromaticContact ND1-CE1 3.3Å; H169-F268 VanDerWaalsContact ND1-CE1 3.3Å; H169-F268 WeakPolarHBondContact ND1-CE1 3.47Å; H169-F268 AromaticContact ND1-CE2 3.96Å; H169-F268 AromaticContact ND1-CZ 3.25Å; H169-F268 WeakPolarHBondContact ND1-CZ 3.49Å; H169-F268 AromaticContact NE2-CE2 3.72Å; H169-F268 AromaticContact NE2-CZ 3.72Å; F268-L270 PolarHBondContact O-N 3.25Å; F268-V310 HydrophobicContact CD1-CG2 3.69Å; F268-V310 HydrophobicContact CE1-CG2 3.93Å; F268-V310 HydrophobicContact CG-CG2 4.47Å
269	R	97.1	Very high	93.5	Very high	21 Å²	21	50.4 Å²	50.4	8%	0.079	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	133.5	-168.3	-171.9	166.6	55.6	161.9	9	111.3	Y100 S160 K275 F282	Y100-R269 HydrophobicContact CD1-CB 3.66Å; Y100-R269 HydrophobicContact CD1-CG 4.17Å; Y100-R269 HydrophobicContact CE1-CB 3.67Å; Y100-R269 HydrophobicContact CE1-CG 3.95Å; S160-R269 PolarHBondContact OG-NH2 2.92Å; R269-K275 VanDerWaalsContact NH1-CG 3.35Å; R269-F282 HydrophobicContact CB-CD2 4.31Å; R269-F282 HydrophobicContact CB-CE2 4.14Å; R269-F282 HydrophobicContact CG-CD2 4.2Å; R269-F282 HydrophobicContact CG-CE2 4.4Å
270	L	97.3	Very high	93.3	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.016	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-70.9	157.8	-175.2	-64.6	-174.6	0	0	0	113.1	F63 L85 Y89 C99 E101 F268 K272 S273 F305 L309	F63-L270 HydrophobicContact CD1-CD1 4.16Å; L85-L270 HydrophobicContact CD2-CD1 4.06Å; Y89-L270 HydrophobicContact CE2-CD1 4.5Å; C99-L270 HydrophobicContact CB-CD1 3.79Å; C99-L270 HydrophobicContact CB-CG 4.4Å; C99-L270 PolarHBondContact O-N 2.8Å; C99-L270 VanDerWaalsContact O-N 3.09Å; C99-L270 WeakPolarHBondContact SG-CD1 3.48Å; E101-L270 HydrophobicContact CB-CD2 3.7Å; F268-L270 PolarHBondContact O-N 3.25Å; L270-K272 PolarHBondContact O-N 3.46Å; L270-S273 WeakPolarHBondContact O-CB 3.19Å; L270-S273 PolarHBondContact O-N 3.22Å; L270-F305 HydrophobicContact CD1-CE2 4.3Å; L270-L309 HydrophobicContact CD2-CD2 3.7Å
271	Y	96.9	Very high	93.3	Very high	20 Å²	20	49.6 Å²	49.6	8%	0.078	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-53	133.9	161.7	173.5	-117.5	0	0	0	110.1	Y89 L158 S273 F282 V284 E301 V304 F305 S308	Y89-Y271 WeakPolarHBondContact CE1-O 3.48Å; Y89-Y271 PolarHBondContact OH-O 3.11Å; L158-Y271 HydrophobicContact CD1-CD2 4.43Å; L158-Y271 HydrophobicContact CD2-CD2 3.84Å; L158-Y271 HydrophobicContact CD2-CE2 4.32Å; Y271-S273 PolarHBondContact O-N 2.97Å; Y271-F282 WeakPolarHBondContact CD2-O 3.48Å; Y271-V284 HydrophobicContact CE2-CG2 4.01Å; Y271-E301 HydrophobicContact CE1-CG 4.03Å; Y271-V304 HydrophobicContact CD1-CG1 4.16Å; Y271-V304 HydrophobicContact CD2-CG1 4.2Å; Y271-V304 HydrophobicContact CE1-CB 4.39Å; Y271-V304 HydrophobicContact CE1-CG1 3.96Å; Y271-V304 HydrophobicContact CE2-CG1 3.99Å; Y271-V304 HydrophobicContact CG-CG1 4.28Å; Y271-F305 HydrophobicContact CD1-CB 4.2Å; Y271-S308 WeakPolarHBondContact CB-OG 3.29Å
272	K	95.2	Very high	93.3	Very high	86 Å²	86	49.6 Å²	49.6	37%	0.374	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	8.4	-172.8	-61.2	-168.2	161.8	-150.1	0	117	Y89 L270 F282 E301	Y89-K272 HydrophobicContact CE1-CB 4.09Å; L270-K272 PolarHBondContact O-N 3.46Å; K272-F282 VanDerWaalsContact CA-O 3.31Å; K272-F282 WeakPolarHBondContact CA-O 3.44Å; K272-F282 PolarHBondContact N-O 3.15Å; K272-E301 WeakPolarHBondContact CD-OE1 3.35Å; K272-E301 WeakPolarHBondContact CE-OE1 3.33Å; K272-E301 IonicContact NZ-OE1 2.61Å; K272-E301 PolarHBondContact NZ-OE1 3.19Å
273	S	94.7	Very high	93.2	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.276	C	S	.	.			trans	-95.4	142.8	171.5	-84.4	0	0	0	0	111.8	Y89 M97 C99 L270 Y271 A281 F282	Y89-S273 WeakPolarHBondContact OH-CA 3.24Å; Y89-S273 WeakPolarHBondContact OH-CB 3.35Å; Y89-S273 PolarHBondContact OH-N 3.15Å; Y89-S273 PolarHBondContact OH-OG 3.21Å; M97-S273 CarbonylContact O-C 3.59Å; M97-S273 WeakPolarHBondContact O-CA 3.47Å; M97-S273 VanDerWaalsContact O-CB 3.29Å; M97-S273 WeakPolarHBondContact O-CB 3.17Å; M97-S273 PolarHBondContact O-OG 2.87Å; C99-S273 WeakPolarHBondContact CA-OG 3.38Å; C99-S273 WeakPolarHBondContact CB-OG 3.36Å; C99-S273 PolarHBondContact N-OG 3.45Å; C99-S273 VanDerWaalsContact O-CB 3.28Å; C99-S273 WeakPolarHBondContact O-CB 3.42Å; C99-S273 PolarHBondContact O-OG 3.46Å; L270-S273 WeakPolarHBondContact O-CB 3.19Å; L270-S273 PolarHBondContact O-N 3.22Å; Y271-S273 PolarHBondContact O-N 2.97Å; S273-A281 VanDerWaalsContact O-CA 3.32Å; S273-A281 WeakPolarHBondContact O-CA 3.37Å; S273-F282 PolarHBondContact O-N 2.88Å
274	S	92.9	Very high	93.3	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.007	27%	0.271	C	S	.	.			trans	-109.2	169.7	170.7	78	0	0	0	0	111	M97 H98 R278 A280	M97-S274 PolarHBondContact O-N 3.18Å; H98-S274 WeakPolarHBondContact CA-O 3.19Å; H98-S274 PolarHBondContact CE1-OG 3.3Å; H98-S274 PolarHBondContact ND1-O 2.74Å; H98-S274 PolarHBondContact ND1-OG 3.44Å; S274-R278 WeakPolarHBondContact CB-O 3.13Å; S274-R278 PolarHBondContact OG-O 2.96Å; S274-A280 WeakPolarHBondContact CB-O 3.47Å
275	K	90.8	Very high	93.5	Very high	95 Å²	95	45.7 Å²	45.7	41%	0.413	25%	0.247	S	C	.	.			trans	-80	149.7	169.7	-85.4	165.9	-177.1	-176.8	0	108.6	H98 Y100 R269 G277 R278	H98-K275 PolarHBondContact CE1-O 3.38Å; H98-K275 VanDerWaalsContact CE1-O 3.3Å; H98-K275 PolarHBondContact ND1-O 3.5Å; Y100-K275 WeakPolarHBondContact OH-CG 3.45Å; R269-K275 VanDerWaalsContact NH1-CG 3.35Å; K275-G277 PolarHBondContact O-N 2.94Å; K275-R278 HydrophobicContact CB-CB 4.21Å; K275-R278 HydrophobicContact CB-CG 4.14Å; K275-R278 WeakPolarHBondContact O-CB 3.3Å; K275-R278 PolarHBondContact O-N 2.76Å
276	V	87.1	Confident	93.6	Very high	39 Å²	39	52 Å²	52	24%	0.236	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	135.8	172.2	169.9	0	0	0	0	110.2	E66 E68 H98 R278	E66-V276 HydrophobicContact CB-CG2 3.68Å; E66-V276 HydrophobicContact CG-CB 4.29Å; E66-V276 HydrophobicContact CG-CG2 3.49Å; E66-V276 VanDerWaalsContact CG-CG2 3.49Å; E68-V276 HydrophobicContact CG-CG1 4.39Å; H98-V276 HydrophobicContact CB-CG2 3.89Å; H98-V276 WeakPolarHBondContact CD2-CG2 3.34Å; H98-V276 PolarHBondContact ND1-N 3.18Å; V276-R278 PolarHBondContact O-N 3.26Å
277	G	83.7	Confident	93.5	Very high	69 Å²	69	51.4 Å²	51.4	71%	0.711	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	9.5	-177.4	0	0	0	0	0	114.6	K275	K275-G277 PolarHBondContact O-N 2.94Å
278	R	84.9	Confident	93.5	Very high	158 Å²	158	52 Å²	52	60%	0.596	28%	0.28	S	S	*	.			trans	-127.9	142.6	174.8	-57.5	-65.8	-175.4	169.1	0.4	110.1	S274 K275 V276	S274-R278 WeakPolarHBondContact CB-O 3.13Å; S274-R278 PolarHBondContact OG-O 2.96Å; K275-R278 HydrophobicContact CB-CB 4.21Å; K275-R278 HydrophobicContact CB-CG 4.14Å; K275-R278 WeakPolarHBondContact O-CB 3.3Å; K275-R278 PolarHBondContact O-N 2.76Å; V276-R278 PolarHBondContact O-N 3.26Å
279	N	83.1	Confident	93.4	Very high	152 Å²	152	56.7 Å²	56.7	81%	0.813	30%	0.302	S	S	*	.			trans	-99.3	2.2	178.3	-64.6	-10	0	0	0	113.2	A281	N279-A281 PolarHBondContact O-N 3.28Å
280	A	91.8	Very high	93.3	Very high	26 Å²	26	57 Å²	57	22%	0.215	30%	0.303	C	S	.	.			trans	-82.6	94.4	177.3	0	0	0	0	0	110	S160 T162 S274	S160-A280 PolarHBondContact OG-O 3.25Å; S160-A280 VanDerWaalsContact OG-O 3.13Å; T162-A280 HydrophobicContact CG2-CB 3.64Å; S274-A280 WeakPolarHBondContact CB-O 3.47Å
281	A	94.8	Very high	92.9	Very high	31 Å²	31	62.5 Å²	62.5	26%	0.256	34%	0.337	S	S	.	.			trans	-89.4	149.4	172.3	0	0	0	0	0	111.1	S273 N279 T283	S273-A281 VanDerWaalsContact O-CA 3.32Å; S273-A281 WeakPolarHBondContact O-CA 3.37Å; N279-A281 PolarHBondContact O-N 3.28Å; A281-T283 PolarHBondContact O-N 2.94Å
282	F	96.7	Very high	92.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-68.3	123.6	176.1	-84.6	-66.7	0	0	0	111.9	L158 D159 H169 R269 Y271 K272 S273	L158-F282 HydrophobicContact CB-CB 4.37Å; L158-F282 HydrophobicContact CB-CD1 3.84Å; L158-F282 HydrophobicContact CB-CG 4.39Å; D159-F282 WeakPolarHBondContact O-CA 3.23Å; H169-F282 HydrophobicContact CB-CE1 4.3Å; H169-F282 HydrophobicContact CB-CZ 4.44Å; H169-F282 AromaticContact CD2-CE1 3.88Å; H169-F282 AromaticContact CD2-CE2 3.82Å; H169-F282 AromaticContact CD2-CZ 3.26Å; H169-F282 WeakPolarHBondContact CD2-CZ 3.42Å; H169-F282 AromaticContact CE1-CE2 3.18Å; H169-F282 WeakPolarHBondContact CE1-CE2 3.49Å; H169-F282 AromaticContact CE1-CZ 3.5Å; H169-F282 AromaticContact CG-CE1 3.84Å; H169-F282 AromaticContact CG-CE2 3.88Å; H169-F282 AromaticContact CG-CZ 3.52Å; H169-F282 AromaticContact ND1-CD2 3.99Å; H169-F282 AromaticContact ND1-CE2 3.48Å; H169-F282 WeakPolarHBondContact ND1-CE2 3.5Å; H169-F282 AromaticContact ND1-CZ 3.64Å; H169-F282 AromaticContact NE2-CE2 3.36Å; H169-F282 WeakPolarHBondContact NE2-CE2 3.46Å; H169-F282 AromaticContact NE2-CZ 3.23Å; H169-F282 WeakPolarHBondContact NE2-CZ 3.46Å; R269-F282 HydrophobicContact CB-CD2 4.31Å; R269-F282 HydrophobicContact CB-CE2 4.14Å; R269-F282 HydrophobicContact CG-CD2 4.2Å; R269-F282 HydrophobicContact CG-CE2 4.4Å; Y271-F282 WeakPolarHBondContact CD2-O 3.48Å; K272-F282 VanDerWaalsContact CA-O 3.31Å; K272-F282 WeakPolarHBondContact CA-O 3.44Å; K272-F282 PolarHBondContact N-O 3.15Å; S273-F282 PolarHBondContact O-N 2.88Å
283	T	96.9	Very high	91.1	Very high	73 Å²	73	67 Å²	67	45%	0.448	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	169.6	171.5	60.5	0	0	0	0	110.3	L158 D159 A281 A285	L158-T283 CarbonylContact C-O 3.46Å; L158-T283 WeakPolarHBondContact CA-O 3.23Å; D159-T283 PolarHBondContact N-O 3.14Å; D159-T283 PolarHBondContact O-N 3.28Å; A281-T283 PolarHBondContact O-N 2.94Å; T283-A285 PolarHBondContact O-N 3.23Å
284	V	97.6	Very high	89.7	Confident	51 Å²	51	72.7 Å²	72.7	31%	0.309	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.9	174.5	179	0	0	0	0	108.2	L158 Y271 N288 V304	L158-V284 HydrophobicContact CD2-CG2 4.21Å; Y271-V284 HydrophobicContact CE2-CG2 4.01Å; V284-N288 HydrophobicContact CG1-CB 3.54Å; V284-V304 HydrophobicContact CG2-CG1 3.69Å; V284-V304 HydrophobicContact CG2-CG2 4.38Å
285	A	97.3	Very high	88.5	Confident	5 Å²	5	75 Å²	75	4%	0.041	42%	0.417	C	S	.	.			trans	-63.9	146	179.9	0	0	0	0	0	111.2	N157 D159 T283 D287 N288	N157-A285 HydrophobicContact CB-CB 4.15Å; N157-A285 WeakPolarHBondContact O-CB 3.3Å; N157-A285 PolarHBondContact O-N 2.87Å; D159-A285 HydrophobicContact CB-CB 3.94Å; T283-A285 PolarHBondContact O-N 3.23Å; A285-D287 WeakPolarHBondContact CB-OD1 3.32Å; A285-D287 PolarHBondContact O-N 3.18Å; A285-N288 WeakPolarHBondContact O-CB 3.37Å; A285-N288 PolarHBondContact O-N 2.86Å
286	E	96.3	Very high	87.1	Confident	171 Å²	171	81 Å²	81	80%	0.799	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-33.5	179	-62.5	174.3	161.9	0	0	113.3	K128 N288	K128-E286 IonicContact NZ-OE2 3.83Å; K128-E286 PolarHBondContact NZ-OE2 3.35Å; E286-N288 VanDerWaalsContact C-N 3.34Å
287	D	95	Very high	86.3	Confident	50 Å²	50	87.9 Å²	87.9	27%	0.267	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	12.5	-179.7	59.2	-32	0	0	0	113.1	R168 A285 Q289	R168-D287 IonicContact CZ-OD1 2.81Å; R168-D287 IonicContact CZ-OD2 2.61Å; R168-D287 IonicContact NH1-OD1 3.29Å; R168-D287 PolarHBondContact NH1-OD1 3.42Å; R168-D287 IonicContact NH1-OD2 2.88Å; R168-D287 PolarHBondContact NH1-OD2 2.82Å; R168-D287 IonicContact NH2-OD1 3.39Å; R168-D287 PolarHBondContact NH2-OD1 2.92Å; R168-D287 IonicContact NH2-OD2 3.39Å; A285-D287 WeakPolarHBondContact CB-OD1 3.32Å; A285-D287 PolarHBondContact O-N 3.18Å; D287-Q289 PolarHBondContact O-N 2.94Å
288	N	96.8	Very high	86.2	Confident	35 Å²	35	88.3 Å²	88.3	19%	0.187	46%	0.455	C	S	.	.			trans	-66	129	172	173.8	78.2	0	0	0	111.1	V155 N157 V284 A285 E286 F290	V155-N288 PolarHBondContact O-OD1 2.88Å; N157-N288 HydrophobicContact CB-CB 4.11Å; N157-N288 PolarHBondContact N-OD1 2.92Å; V284-N288 HydrophobicContact CG1-CB 3.54Å; A285-N288 WeakPolarHBondContact O-CB 3.37Å; A285-N288 PolarHBondContact O-N 2.86Å; E286-N288 VanDerWaalsContact C-N 3.34Å; N288-F290 PolarHBondContact ND2-N 2.88Å; N288-F290 PolarHBondContact ND2-O 2.85Å
289	Q	95.5	Very high	86.2	Confident	105 Å²	105	83 Å²	83	49%	0.491	44%	0.443	S	S	.	.			trans	-109.2	-5.8	175.7	-59.8	-173.4	30.5	0	0	113.3	V152 K153 D287 T291	V152-Q289 HydrophobicContact CG1-CB 4.42Å; V152-Q289 VanDerWaalsContact CG1-OE1 3.27Å; V152-Q289 HydrophobicContact CG2-CB 4.33Å; V152-Q289 HydrophobicContact CG2-CG 4.35Å; K153-Q289 HydrophobicContact CG-CB 4.5Å; D287-Q289 PolarHBondContact O-N 2.94Å; Q289-T291 PolarHBondContact O-N 2.69Å
290	F	94.8	Very high	86.5	Confident	26 Å²	26	79.6 Å²	79.6	11%	0.114	44%	0.436	C	S	.	.			trans	-71.7	129.6	175.9	170.1	-96.7	0	0	0	110.9	K153 V155 L156 M173 N288 A292 A307	K153-F290 WeakPolarHBondContact O-CA 3.3Å; K153-F290 WeakPolarHBondContact O-CD2 3.12Å; V155-F290 WeakPolarHBondContact O-CB 3.4Å; L156-F290 HydrophobicContact CB-CD1 3.89Å; L156-F290 HydrophobicContact CB-CE1 4.36Å; L156-F290 HydrophobicContact CB-CG 4.25Å; L156-F290 HydrophobicContact CD1-CD1 3.83Å; L156-F290 HydrophobicContact CD1-CE1 4.41Å; L156-F290 HydrophobicContact CG-CD1 4.41Å; M173-F290 HydrophobicContact CB-CE2 3.97Å; M173-F290 HydrophobicContact CG-CD2 4.28Å; M173-F290 HydrophobicContact CG-CE2 3.61Å; M173-F290 HydrophobicContact CG-CZ 3.88Å; N288-F290 PolarHBondContact ND2-N 2.88Å; N288-F290 PolarHBondContact ND2-O 2.85Å; F290-A292 HydrophobicContact CE1-CB 3.88Å; F290-A292 HydrophobicContact CZ-CB 4.13Å; F290-A307 HydrophobicContact CE1-CB 3.76Å; F290-A307 HydrophobicContact CZ-CB 3.95Å
291	T	88.5	Confident	86.4	Confident	119 Å²	119	81.1 Å²	81.1	73%	0.73	44%	0.438	S	S	*	.			trans	-117.1	119.9	172.5	-52.2	0	0	0	0	108.4	Q289	Q289-T291 PolarHBondContact O-N 2.69Å
292	A	79.3	Confident	86.3	Confident	21 Å²	21	80.9 Å²	80.9	17%	0.174	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-66.3	138.7	176.2	0	0	0	0	0	110.1	F290 N303	F290-A292 HydrophobicContact CE1-CB 3.88Å; F290-A292 HydrophobicContact CZ-CB 4.13Å; A292-N303 HydrophobicContact CB-CB 3.62Å
293	K	75.3	Confident	86.1	Confident	179 Å²	179	81.9 Å²	81.9	78%	0.778	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-64	126.6	177.2	-69.5	-176.8	-179.9	179.1	0	108.9	A295	K293-A295 PolarHBondContact O-N 2.78Å; K293-A295 VanDerWaalsContact O-N 3.17Å
294	P	64.4	Low	86	Confident	121 Å²	121	79.5 Å²	79.5	79%	0.786	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-68.4	116.2	-179.7	26.5	-32.2	0	0	0	109.7
295	A	68.6	Low	85.9	Confident	48 Å²	48	77.1 Å²	77.1	40%	0.397	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-85.4	134.5	163.2	0	0	0	0	0	108.4	K293 E297 K298	K293-A295 PolarHBondContact O-N 2.78Å; K293-A295 VanDerWaalsContact O-N 3.17Å; A295-E297 PolarHBondContact O-N 2.88Å; A295-K298 HydrophobicContact CB-CB 4.34Å; A295-K298 HydrophobicContact CB-CG 4.46Å; A295-K298 PolarHBondContact O-N 3.24Å
296	K	60.7	Low	85.8	Confident	221 Å²	221	77.8 Å²	77.8	96%	0.961	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-17.5	-174.5	-75.1	-175.8	177.3	-179.8	0	114.5
297	E	71.3	Confident	85.8	Confident	184 Å²	184	70 Å²	70	86%	0.86	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-1.4	-172.1	-65.2	175.3	-176.5	0	0	114	A295	A295-E297 PolarHBondContact O-N 2.88Å
298	K	79.6	Confident	85.9	Confident	78 Å²	78	67.9 Å²	67.9	34%	0.339	37%	0.365	S	S	.	.	S	Bend	trans	-122.4	142.2	-173.5	-64.6	-173.3	173	-172.6	0	112.4	A295 E302 L306	A295-K298 HydrophobicContact CB-CB 4.34Å; A295-K298 HydrophobicContact CB-CG 4.46Å; A295-K298 PolarHBondContact O-N 3.24Å; K298-E302 HydrophobicContact CB-CB 4.42Å; K298-E302 HydrophobicContact CB-CG 4.41Å; K298-E302 HydrophobicContact CD-CG 4.33Å; K298-E302 WeakPolarHBondContact CD-OE1 3.41Å; K298-E302 WeakPolarHBondContact CE-OE1 3.24Å; K298-E302 IonicContact NZ-OE1 3.16Å; K298-L306 HydrophobicContact CD-CD1 3.82Å; K298-L306 VanDerWaalsContact NZ-CD1 3.26Å
299	S	86.1	Confident	85.9	Confident	48 Å²	48	66.2 Å²	66.2	34%	0.336	36%	0.356	S	S	.	.			trans	-66.9	155.6	176.7	78.7	0	0	0	0	111.2	E301 E302 N303	S299-E301 PolarHBondContact O-N 3.22Å; S299-E302 WeakPolarHBondContact O-CB 3.37Å; S299-E302 PolarHBondContact O-N 3.29Å; S299-E302 WeakPolarHBondContact OG-CB 3.46Å; S299-E302 PolarHBondContact OG-N 3.47Å; S299-E302 VanDerWaalsContact OG-N 3.11Å; S299-N303 PolarHBondContact O-N 3.27Å; S299-N303 PolarHBondContact O-ND2 3.37Å; S299-N303 VanDerWaalsContact O-ND2 3.08Å
300	A	88.3	Confident	86	Confident	80 Å²	80	61.2 Å²	61.2	66%	0.661	33%	0.333	S	S	*	.	H	α-helix	trans	-56.5	-38	176.2	0	0	0	0	0	112	N303 V304	A300-N303 PolarHBondContact O-N 2.88Å; A300-V304 WeakPolarHBondContact O-CG2 3.46Å; A300-V304 PolarHBondContact O-N 3.44Å; A300-V304 VanDerWaalsContact O-N 3.16Å
301	E	90.9	Very high	86	Confident	58 Å²	58	60.1 Å²	60.1	27%	0.271	33%	0.328	S	S	.	.	H	α-helix	trans	-68.1	-41.1	178.3	-163.8	-173.1	-171.4	0	0	112.6	W86 Y271 K272 S299 N303 V304 F305	W86-E301 HydrophobicContact CH2-CB 4.38Å; W86-E301 HydrophobicContact CH2-CG 3.61Å; W86-E301 HydrophobicContact CZ2-CB 4.01Å; W86-E301 HydrophobicContact CZ2-CG 3.72Å; Y271-E301 HydrophobicContact CE1-CG 4.03Å; K272-E301 WeakPolarHBondContact CD-OE1 3.35Å; K272-E301 WeakPolarHBondContact CE-OE1 3.33Å; K272-E301 IonicContact NZ-OE1 2.61Å; K272-E301 PolarHBondContact NZ-OE1 3.19Å; S299-E301 PolarHBondContact O-N 3.22Å; E301-N303 VanDerWaalsContact C-N 3.28Å; E301-N303 PolarHBondContact O-N 3.4Å; E301-V304 WeakPolarHBondContact O-CB 3.43Å; E301-V304 PolarHBondContact O-N 2.85Å; E301-F305 PolarHBondContact O-N 2.95Å
302	E	92.1	Very high	86.3	Confident	26 Å²	26	56.1 Å²	56.1	12%	0.121	30%	0.302	C	S	.	.	H	α-helix	trans	-61.4	-39.6	173.8	-173.6	175.2	161.4	0	0	111.4	W86 K298 S299 V304 F305 L306	W86-E302 VanDerWaalsContact CD1-CG 3.44Å; W86-E302 HydrophobicContact CG-CG 4.07Å; W86-E302 HydrophobicContact CZ2-CB 4.4Å; W86-E302 VanDerWaalsContact NE1-CB 3.31Å; K298-E302 HydrophobicContact CB-CB 4.42Å; K298-E302 HydrophobicContact CB-CG 4.41Å; K298-E302 HydrophobicContact CD-CG 4.33Å; K298-E302 WeakPolarHBondContact CD-OE1 3.41Å; K298-E302 WeakPolarHBondContact CE-OE1 3.24Å; K298-E302 IonicContact NZ-OE1 3.16Å; S299-E302 WeakPolarHBondContact O-CB 3.37Å; S299-E302 PolarHBondContact O-N 3.29Å; S299-E302 WeakPolarHBondContact OG-CB 3.46Å; S299-E302 PolarHBondContact OG-N 3.47Å; S299-E302 VanDerWaalsContact OG-N 3.11Å; E302-V304 VanDerWaalsContact C-N 3.3Å; E302-V304 PolarHBondContact O-N 3.21Å; E302-F305 WeakPolarHBondContact O-CB 3.28Å; E302-F305 PolarHBondContact O-N 3.39Å; E302-L306 HydrophobicContact CG-CD1 4.09Å; E302-L306 HydrophobicContact CG-CG 4.42Å; E302-L306 WeakPolarHBondContact O-CB 3.37Å; E302-L306 VanDerWaalsContact O-CG 3.31Å; E302-L306 WeakPolarHBondContact O-CG 3.43Å; E302-L306 PolarHBondContact O-N 3.46Å
303	N	92.6	Very high	86.9	Confident	20 Å²	20	55.9 Å²	55.9	11%	0.107	30%	0.298	C	S	.	.	H	α-helix	trans	-65.1	-35.2	177.1	-66.1	-42.9	0	0	0	111.9	A292 S299 A300 E301 A307	A292-N303 HydrophobicContact CB-CB 3.62Å; S299-N303 PolarHBondContact O-N 3.27Å; S299-N303 PolarHBondContact O-ND2 3.37Å; S299-N303 VanDerWaalsContact O-ND2 3.08Å; A300-N303 PolarHBondContact O-N 2.88Å; E301-N303 VanDerWaalsContact C-N 3.28Å; E301-N303 PolarHBondContact O-N 3.4Å; N303-A307 VanDerWaalsContact O-CB 3.23Å; N303-A307 WeakPolarHBondContact O-CB 3.5Å; N303-A307 PolarHBondContact O-N 3.25Å
304	V	95	Very high	87.4	Confident	24 Å²	24	49.5 Å²	49.5	15%	0.145	28%	0.276	C	S	.	.	H	α-helix	trans	-67	-45.9	172.3	173.2	0	0	0	0	110.8	L156 Y271 V284 A300 E301 E302 L306 A307 S308	L156-V304 HydrophobicContact CD1-CG1 4.23Å; L156-V304 HydrophobicContact CD2-CG1 4.44Å; Y271-V304 HydrophobicContact CD1-CG1 4.16Å; Y271-V304 HydrophobicContact CD2-CG1 4.2Å; Y271-V304 HydrophobicContact CE1-CB 4.39Å; Y271-V304 HydrophobicContact CE1-CG1 3.96Å; Y271-V304 HydrophobicContact CE2-CG1 3.99Å; Y271-V304 HydrophobicContact CG-CG1 4.28Å; V284-V304 HydrophobicContact CG2-CG1 3.69Å; V284-V304 HydrophobicContact CG2-CG2 4.38Å; A300-V304 WeakPolarHBondContact O-CG2 3.46Å; A300-V304 PolarHBondContact O-N 3.44Å; A300-V304 VanDerWaalsContact O-N 3.16Å; E301-V304 WeakPolarHBondContact O-CB 3.43Å; E301-V304 PolarHBondContact O-N 2.85Å; E302-V304 VanDerWaalsContact C-N 3.3Å; E302-V304 PolarHBondContact O-N 3.21Å; V304-L306 PolarHBondContact O-N 2.87Å; V304-A307 PolarHBondContact O-N 2.92Å; V304-S308 WeakPolarHBondContact O-CB 3.49Å; V304-S308 PolarHBondContact O-N 3.16Å
305	F	95.6	Very high	88.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-54.9	-51.8	175.3	169.4	-105.7	0	0	0	111.5	L85 W86 L270 Y271 E301 E302 A307 S308 L309	L85-F305 HydrophobicContact CD2-CZ 3.91Å; L85-F305 HydrophobicContact CG-CZ 4.29Å; W86-F305 HydrophobicContact CB-CD1 3.98Å; W86-F305 HydrophobicContact CB-CE1 3.83Å; W86-F305 HydrophobicContact CD2-CB 4.24Å; W86-F305 AromaticContact CD2-CD1 3.94Å; W86-F305 HydrophobicContact CD2-CD1 3.94Å; W86-F305 HydrophobicContact CD2-CG 4.06Å; W86-F305 HydrophobicContact CE3-CB 3.65Å; W86-F305 AromaticContact CE3-CD1 3.61Å; W86-F305 HydrophobicContact CE3-CD1 3.61Å; W86-F305 AromaticContact CE3-CD2 3.68Å; W86-F305 HydrophobicContact CE3-CD2 3.68Å; W86-F305 HydrophobicContact CE3-CE1 4.17Å; W86-F305 HydrophobicContact CE3-CE2 4.22Å; W86-F305 AromaticContact CE3-CG 3.34Å; W86-F305 HydrophobicContact CE3-CG 3.34Å; W86-F305 HydrophobicContact CE3-CZ 4.44Å; W86-F305 HydrophobicContact CG-CD1 4.11Å; W86-F305 HydrophobicContact CG-CE1 4.44Å; W86-F305 HydrophobicContact CH2-CB 4.19Å; W86-F305 HydrophobicContact CZ3-CB 3.63Å; W86-F305 HydrophobicContact CZ3-CD1 4.43Å; W86-F305 AromaticContact CZ3-CD2 3.9Å; W86-F305 HydrophobicContact CZ3-CD2 3.9Å; W86-F305 AromaticContact CZ3-CG 3.73Å; W86-F305 HydrophobicContact CZ3-CG 3.73Å; L270-F305 HydrophobicContact CD1-CE2 4.3Å; Y271-F305 HydrophobicContact CD1-CB 4.2Å; E301-F305 PolarHBondContact O-N 2.95Å; E302-F305 WeakPolarHBondContact O-CB 3.28Å; E302-F305 PolarHBondContact O-N 3.39Å; F305-A307 VanDerWaalsContact C-N 3.32Å; F305-A307 PolarHBondContact O-N 3.43Å; F305-S308 PolarHBondContact O-N 3.47Å; F305-S308 VanDerWaalsContact O-N 3.11Å; F305-S308 PolarHBondContact O-OG 2.93Å; F305-L309 HydrophobicContact CD1-CD1 4.41Å; F305-L309 HydrophobicContact CE1-CD1 3.89Å; F305-L309 HydrophobicContact CZ-CD1 3.95Å; F305-L309 HydrophobicContact CZ-CG 4.5Å; F305-L309 PolarHBondContact O-N 3.47Å
306	L	95	Very high	88.6	Confident	20 Å²	20	48.3 Å²	48.3	11%	0.105	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-36.4	177.7	-67.7	173.3	0	0	0	112.8	Y82 K110 K298 E302 V304 S308 L309 N312	Y82-L306 HydrophobicContact CD2-CD2 4.4Å; Y82-L306 HydrophobicContact CG-CD2 4.35Å; K110-L306 PolarHBondContact NZ-O 2.88Å; K298-L306 HydrophobicContact CD-CD1 3.82Å; K298-L306 VanDerWaalsContact NZ-CD1 3.26Å; E302-L306 HydrophobicContact CG-CD1 4.09Å; E302-L306 HydrophobicContact CG-CG 4.42Å; E302-L306 WeakPolarHBondContact O-CB 3.37Å; E302-L306 VanDerWaalsContact O-CG 3.31Å; E302-L306 WeakPolarHBondContact O-CG 3.43Å; E302-L306 PolarHBondContact O-N 3.46Å; V304-L306 PolarHBondContact O-N 2.87Å; L306-S308 VanDerWaalsContact C-N 3.33Å; L306-L309 HydrophobicContact CD2-CD1 4.25Å; L306-N312 PolarHBondContact O-ND2 3.37Å
307	A	95.4	Very high	89.4	Confident	6 Å²	6	40.6 Å²	40.6	5%	0.05	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-34.7	175	0	0	0	0	0	112	K110 L156 M173 F290 N303 V304 F305 L309	K110-A307 PolarHBondContact NZ-O 3.29Å; L156-A307 HydrophobicContact CD2-CB 4.07Å; M173-A307 HydrophobicContact CE-CB 4.43Å; M173-A307 HydrophobicContact SD-CB 4.44Å; F290-A307 HydrophobicContact CE1-CB 3.76Å; F290-A307 HydrophobicContact CZ-CB 3.95Å; N303-A307 VanDerWaalsContact O-CB 3.23Å; N303-A307 WeakPolarHBondContact O-CB 3.5Å; N303-A307 PolarHBondContact O-N 3.25Å; V304-A307 PolarHBondContact O-N 2.92Å; F305-A307 VanDerWaalsContact C-N 3.32Å; F305-A307 PolarHBondContact O-N 3.43Å; A307-L309 PolarHBondContact O-N 3.17Å
308	S	97.1	Very high	89.9	Confident	7 Å²	7	33.2 Å²	33.2	5%	0.049	21%	0.207	C	C	.	.	H	α-helix	trans	-71.6	-24.6	-178.5	75.6	0	0	0	0	114.8	Y271 V304 F305 L306 V310	Y271-S308 WeakPolarHBondContact CB-OG 3.29Å; V304-S308 WeakPolarHBondContact O-CB 3.49Å; V304-S308 PolarHBondContact O-N 3.16Å; F305-S308 PolarHBondContact O-N 3.47Å; F305-S308 VanDerWaalsContact O-N 3.11Å; F305-S308 PolarHBondContact O-OG 2.93Å; L306-S308 VanDerWaalsContact C-N 3.33Å; S308-V310 PolarHBondContact O-N 2.88Å
309	L	97.8	Very high	90.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.217	C	C	.	.			trans	-68.2	119	178	-70.6	163.9	0	0	0	110.6	F63 Y82 E101 K110 L270 F305 L306 A307 C311 N312	F63-L309 HydrophobicContact CE1-CD2 4.2Å; Y82-L309 HydrophobicContact CD1-CD1 3.33Å; Y82-L309 HydrophobicContact CD1-CD2 4.38Å; Y82-L309 HydrophobicContact CD1-CG 4.45Å; Y82-L309 HydrophobicContact CD2-CD1 4.1Å; Y82-L309 HydrophobicContact CE1-CD1 3.4Å; Y82-L309 HydrophobicContact CE1-CD2 3.91Å; Y82-L309 HydrophobicContact CE1-CG 4.15Å; Y82-L309 HydrophobicContact CE2-CD1 4.11Å; Y82-L309 HydrophobicContact CG-CD1 3.72Å; E101-L309 HydrophobicContact CB-CD2 4.32Å; E101-L309 HydrophobicContact CG-CD2 4.21Å; E101-L309 WeakPolarHBondContact OE2-CA 3.11Å; K110-L309 WeakPolarHBondContact CE-O 3.3Å; K110-L309 PolarHBondContact NZ-O 3.15Å; L270-L309 HydrophobicContact CD2-CD2 3.7Å; F305-L309 HydrophobicContact CD1-CD1 4.41Å; F305-L309 HydrophobicContact CE1-CD1 3.89Å; F305-L309 HydrophobicContact CZ-CD1 3.95Å; F305-L309 HydrophobicContact CZ-CG 4.5Å; F305-L309 PolarHBondContact O-N 3.47Å; L306-L309 HydrophobicContact CD2-CD1 4.25Å; A307-L309 PolarHBondContact O-N 3.17Å; L309-C311 PolarHBondContact O-N 3.42Å; L309-N312 HydrophobicContact CB-CB 3.63Å; L309-N312 PolarHBondContact O-N 3.07Å
310	V	97.9	Very high	90.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-36.7	-173	171.6	0	0	0	0	111.5	E101 I103 C109 K110 Y112 F268 S308	E101-V310 PolarHBondContact OE1-N 3.5Å; E101-V310 PolarHBondContact OE2-N 2.67Å; I103-V310 HydrophobicContact CD1-CB 3.94Å; I103-V310 HydrophobicContact CD1-CG1 3.76Å; I103-V310 HydrophobicContact CD1-CG2 4.17Å; I103-V310 HydrophobicContact CG1-CB 4.17Å; I103-V310 HydrophobicContact CG1-CG1 4.19Å; C109-V310 HydrophobicContact CB-CG1 3.86Å; K110-V310 WeakPolarHBondContact CG-O 3.36Å; K110-V310 PolarHBondContact N-O 2.96Å; Y112-V310 HydrophobicContact CD1-CB 4.48Å; Y112-V310 HydrophobicContact CD1-CG1 3.45Å; Y112-V310 VanDerWaalsContact CD1-CG1 3.45Å; Y112-V310 HydrophobicContact CD1-CG2 4.16Å; Y112-V310 HydrophobicContact CD2-CG2 4.44Å; Y112-V310 HydrophobicContact CE1-CG1 3.73Å; Y112-V310 HydrophobicContact CG-CG1 4.13Å; Y112-V310 HydrophobicContact CG-CG2 3.97Å; F268-V310 HydrophobicContact CD1-CG2 3.69Å; F268-V310 HydrophobicContact CE1-CG2 3.93Å; F268-V310 HydrophobicContact CG-CG2 4.47Å; S308-V310 PolarHBondContact O-N 2.88Å
311	C	95.5	Very high	91.1	Very high	2 Å²	2	32 Å²	32	1%	0.014	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-0.7	179.6	-67.9	0	0	0	0	113.9	E101 P104 L309 V313 A384 V385	E101-C311 WeakPolarHBondContact OE1-CB 3.42Å; E101-C311 PolarHBondContact OE1-N 3.42Å; P104-C311 VanDerWaalsContact CD-SG 3.56Å; L309-C311 PolarHBondContact O-N 3.42Å; C311-V313 PolarHBondContact O-N 2.87Å; C311-A384 HydrophobicContact CB-CB 4.48Å; C311-V385 WeakPolarHBondContact O-CG2 3.4Å
312	N	94.8	Very high	91.3	Very high	36 Å²	36	31.3 Å²	31.3	19%	0.193	18%	0.178	C	C	.	.			trans	-75.4	73	177.5	-174.6	27.4	0	0	0	111.4	Y82 K110 L306 L309 V385	Y82-N312 HydrophobicContact CE2-CB 3.83Å; K110-N312 WeakPolarHBondContact CE-O 3.37Å; K110-N312 PolarHBondContact NZ-O 3.19Å; L306-N312 PolarHBondContact O-ND2 3.37Å; L309-N312 HydrophobicContact CB-CB 3.63Å; L309-N312 PolarHBondContact O-N 3.07Å; N312-V385 VanDerWaalsContact CA-CG2 3.48Å; N312-V385 HydrophobicContact CB-CG2 4.4Å; N312-V385 WeakPolarHBondContact OD1-CG2 3.43Å
313	V	91.4	Very high	91.1	Very high	15 Å²	15	33 Å²	33	9%	0.091	18%	0.183	C	C	.	.			trans	-127.8	112.7	179.3	-176.3	0	0	0	0	108.9	V108 K110 A178 C311 V385	V108-V313 HydrophobicContact CG1-CB 4.42Å; V108-V313 HydrophobicContact CG1-CG1 4.01Å; K110-V313 HydrophobicContact CG-CG2 3.78Å; A178-V313 HydrophobicContact CB-CG1 3.85Å; C311-V313 PolarHBondContact O-N 2.87Å; V313-V385 VanDerWaalsContact N-CG2 3.27Å
314	S	84.5	Confident	90.4	Very high	45 Å²	45	37.2 Å²	37.2	32%	0.315	21%	0.206	S	C	.	.			trans	-80	154.4	172.1	-54	0	0	0	0	111.3	T316 Q318 D386	S314-T316 PolarHBondContact O-N 3.21Å; S314-Q318 PolarHBondContact O-NE2 3.31Å; S314-Q318 PolarHBondContact O-OE1 2.84Å; S314-D386 WeakPolarHBondContact CA-OD2 3.39Å; S314-D386 WeakPolarHBondContact CB-OD2 3.32Å
315	F	80.3	Confident	88.5	Confident	45 Å²	45	39.8 Å²	39.8	20%	0.197	23%	0.229	C	C	.	.			trans	-85.6	93.4	170.7	-178.4	-125.3	0	0	0	111	F383 D386 L388 V390	F315-F383 HydrophobicContact CB-CB 4.36Å; F315-F383 HydrophobicContact CB-CD1 3.72Å; F315-F383 HydrophobicContact CB-CD2 4Å; F315-F383 HydrophobicContact CB-CE1 3.92Å; F315-F383 HydrophobicContact CB-CE2 4.19Å; F315-F383 HydrophobicContact CB-CG 3.77Å; F315-F383 HydrophobicContact CB-CZ 4.15Å; F315-F383 HydrophobicContact CD2-CD1 4.34Å; F315-F383 HydrophobicContact CD2-CD2 4.22Å; F315-F383 AromaticContact CD2-CE1 3.68Å; F315-F383 HydrophobicContact CD2-CE1 3.68Å; F315-F383 AromaticContact CD2-CE2 3.55Å; F315-F383 HydrophobicContact CD2-CE2 3.55Å; F315-F383 AromaticContact CD2-CZ 3.23Å; F315-F383 HydrophobicContact CD2-CZ 3.23Å; F315-F383 HydrophobicContact CE2-CE2 4.1Å; F315-F383 AromaticContact CE2-CZ 3.89Å; F315-F383 HydrophobicContact CE2-CZ 3.89Å; F315-F383 HydrophobicContact CG-CD1 4.45Å; F315-F383 HydrophobicContact CG-CD2 4.2Å; F315-F383 HydrophobicContact CG-CE1 4.22Å; F315-F383 AromaticContact CG-CE2 3.98Å; F315-F383 HydrophobicContact CG-CE2 3.98Å; F315-F383 HydrophobicContact CG-CG 4.44Å; F315-F383 AromaticContact CG-CZ 3.99Å; F315-F383 HydrophobicContact CG-CZ 3.99Å; F315-D386 PolarHBondContact N-OD2 3.46Å; F315-L388 HydrophobicContact CB-CD1 4.12Å; F315-L388 HydrophobicContact CD1-CD1 3.96Å; F315-L388 HydrophobicContact CG-CD1 4.48Å; F315-V390 HydrophobicContact CD1-CG2 4.37Å; F315-V390 HydrophobicContact CE1-CG2 4.15Å; F315-V390 HydrophobicContact CZ-CG2 4.25Å
316	T	79.8	Confident	86.2	Confident	100 Å²	100	44.9 Å²	44.9	61%	0.613	26%	0.262	S	S	*	.	S	Bend	trans	-112.7	25.6	173.8	75.1	0	0	0	0	112.1	S314 Q318	S314-T316 PolarHBondContact O-N 3.21Å; T316-Q318 PolarHBondContact OG1-NE2 2.89Å
317	G	75.9	Confident	83.4	Confident	58 Å²	58	51.5 Å²	51.5	60%	0.598	29%	0.292	S	S	*	.	S	Bend	trans	83.1	26.5	-177	0	0	0	0	0	114.2
318	Q	82.7	Confident	80.4	Confident	30 Å²	30	57.3 Å²	57.3	14%	0.14	33%	0.328	C	S	.	.			trans	-63.9	150.2	176.5	-59.2	89.9	-15.4	0	0	112.1	N176 S314 T316 I320	N176-Q318 CarbonylContact O-C 3.55Å; N176-Q318 WeakPolarHBondContact O-CA 3.42Å; S314-Q318 PolarHBondContact O-NE2 3.31Å; S314-Q318 PolarHBondContact O-OE1 2.84Å; T316-Q318 PolarHBondContact OG1-NE2 2.89Å; Q318-I320 PolarHBondContact O-N 3.27Å
319	R	90.8	Very high	77.4	Confident	148 Å²	148	66 Å²	66	56%	0.558	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	122.1	169.5	-170.3	179	-168.1	-173.3	-2	109.8	Y146 N176 A177 A178 L321	Y146-R319 PolarHBondContact O-NH1 3.26Å; N176-R319 PolarHBondContact O-N 2.84Å; A177-R319 VanDerWaalsContact CA-O 3.26Å; A177-R319 WeakPolarHBondContact CA-O 3.3Å; A178-R319 PolarHBondContact N-O 2.8Å; R319-L321 HydrophobicContact CG-CD2 4.2Å; R319-L321 PolarHBondContact O-N 2.68Å
320	I	93.8	Very high	74.1	Confident	28 Å²	28	73.2 Å²	73.2	14%	0.144	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	115.8	174.2	-55.9	-54.7	0	0	0	109.9	V108 A178 K180 Q318 F383	V108-I320 HydrophobicContact CG1-CD1 3.99Å; V108-I320 HydrophobicContact CG2-CD1 4.16Å; A178-I320 HydrophobicContact CB-CD1 4.49Å; A178-I320 CarbonylContact O-C 3.35Å; A178-I320 WeakPolarHBondContact O-CA 3.49Å; K180-I320 HydrophobicContact CB-CG2 3.65Å; K180-I320 HydrophobicContact CG-CG2 4.4Å; Q318-I320 PolarHBondContact O-N 3.27Å; I320-F383 HydrophobicContact CD1-CE1 4.08Å; I320-F383 HydrophobicContact CD1-CZ 3.84Å; I320-F383 HydrophobicContact CG1-CZ 4.44Å
321	L	95.1	Very high	71	Confident	3 Å²	3	79.9 Å²	79.9	2%	0.016	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	132.1	177.8	-50.9	-175.7	0	0	0	109.2	Y146 V148 L174 A177 A178 F179 K180 R319	Y146-L321 HydrophobicContact CD1-CB 4.42Å; Y146-L321 HydrophobicContact CD1-CD2 3.93Å; Y146-L321 HydrophobicContact CD2-CD1 4.12Å; Y146-L321 HydrophobicContact CE1-CB 4.24Å; Y146-L321 HydrophobicContact CG-CD1 4.24Å; Y146-L321 HydrophobicContact CG-CD2 3.97Å; V148-L321 HydrophobicContact CG2-CD1 4.36Å; V148-L321 HydrophobicContact CG2-CD2 4.14Å; L174-L321 HydrophobicContact CD1-CD1 4.12Å; A177-L321 HydrophobicContact CB-CD1 4.2Å; A177-L321 HydrophobicContact CB-CD2 4.36Å; A177-L321 HydrophobicContact CB-CG 4.27Å; A178-L321 PolarHBondContact O-N 3.01Å; F179-L321 HydrophobicContact CD1-CB 4.06Å; F179-L321 HydrophobicContact CD2-CB 4.41Å; F179-L321 HydrophobicContact CD2-CD1 4.16Å; F179-L321 HydrophobicContact CE1-CB 4.13Å; F179-L321 HydrophobicContact CE2-CB 4.46Å; F179-L321 HydrophobicContact CE2-CD1 3.74Å; F179-L321 HydrophobicContact CG-CB 4.21Å; F179-L321 HydrophobicContact CZ-CB 4.33Å; F179-L321 HydrophobicContact CZ-CD1 4.01Å; K180-L321 PolarHBondContact N-O 2.63Å; R319-L321 HydrophobicContact CG-CD2 4.2Å; R319-L321 PolarHBondContact O-N 2.68Å
322	T	93.6	Very high	67.9	Low	45 Å²	45	88.1 Å²	88.1	28%	0.276	47%	0.474	S	S	.	.			trans	-129.7	146.7	177.9	45.4	0	0	0	0	108.5	Y146 K180	Y146-T322 VanDerWaalsContact CE1-O 3.26Å; Y146-T322 WeakPolarHBondContact CE1-O 3.39Å; Y146-T322 PolarHBondContact OH-O 3.26Å; K180-T322 HydrophobicContact CB-CG2 3.81Å; K180-T322 HydrophobicContact CD-CG2 3.78Å; K180-T322 HydrophobicContact CG-CG2 4.42Å
323	W	88.8	Confident	64.7	Low	62 Å²	62	90.6 Å²	90.6	24%	0.235	49%	0.494	C	S	.	.			trans	-118.4	94.8	166.7	-172.7	-80.8	0	0	0	108.1	V145 R187 F188 A191	V145-W323 HydrophobicContact CB-CZ3 4.49Å; V145-W323 HydrophobicContact CG1-CE3 4.07Å; V145-W323 HydrophobicContact CG1-CZ3 3.59Å; V145-W323 HydrophobicContact CG2-CZ3 4.07Å; R187-W323 HydrophobicContact CB-CB 4.07Å; R187-W323 HydrophobicContact CB-CG 4.08Å; R187-W323 WeakPolarHBondContact CD-O 3.12Å; F188-W323 HydrophobicContact CB-CB 4.22Å; F188-W323 HydrophobicContact CB-CD2 4.46Å; F188-W323 HydrophobicContact CB-CE3 4.29Å; F188-W323 HydrophobicContact CB-CG 4.44Å; F188-W323 AromaticContact CD2-CE3 3.74Å; F188-W323 HydrophobicContact CD2-CE3 3.74Å; F188-W323 AromaticContact CD2-CZ3 3.96Å; F188-W323 HydrophobicContact CD2-CZ3 3.96Å; A191-W323 HydrophobicContact CB-CD2 4.21Å; A191-W323 VanDerWaalsContact CB-CE2 3.42Å; A191-W323 HydrophobicContact CB-CH2 3.7Å; A191-W323 HydrophobicContact CB-CZ2 3.15Å; A191-W323 HydrophobicContact CB-CZ3 4.4Å
324	D	77	Confident	61.8	Low	108 Å²	108	96.2 Å²	96.2	58%	0.578	53%	0.531	S	S	*	.			trans	-94.2	128.1	167.9	-61.9	-42.1	0	0	0	106.8
325	A	55.1	Low	59.1	Low	77 Å²	77	100.3 Å²	100.3	64%	0.636	55%	0.554	S	S	*	*			trans	-54.3	134.6	175.2	0	0	0	0	0	108.1	E327	A325-E327 PolarHBondContact O-N 3.27Å
326	P	49	Very low	56.6	Low	107 Å²	107	102.3 Å²	102.3	70%	0.695	58%	0.579	S	S	*	*			trans	-59.4	113.5	174.6	23	-30	0	0	0	107.1	T328	P326-T328 PolarHBondContact O-N 3.45Å
327	E	35.2	Very low	54.1	Low	159 Å²	159	106.5 Å²	106.5	74%	0.743	59%	0.592	S	S	*	*			trans	-49.9	113.8	160.6	-70.6	178.2	171.9	0	0	105.2	A325 K329	A325-E327 PolarHBondContact O-N 3.27Å; E327-K329 PolarHBondContact O-N 3.38Å
328	T	31.6	Very low	51.7	Low	129 Å²	129	109 Å²	109	79%	0.791	60%	0.6	S	S	*	*			trans	-56	98.5	167.2	32.4	0	0	0	0	105.8	P326 E330	P326-T328 PolarHBondContact O-N 3.45Å; T328-E330 PolarHBondContact O-N 2.79Å
329	K	34	Very low	49.3	Very low	189 Å²	189	115.7 Å²	115.7	82%	0.822	63%	0.631	S	S	*	*			trans	-63	83.5	166.9	-72.5	-176	177.7	-179.8	0	106.2	E327 V331	E327-K329 PolarHBondContact O-N 3.38Å; K329-V331 VanDerWaalsContact C-N 3.33Å; K329-V331 PolarHBondContact O-N 2.89Å
330	E	29.8	Very low	46.2	Very low	152 Å²	152	117.6 Å²	117.6	71%	0.71	65%	0.647	S	S	*	*			trans	-58.9	107.7	157.1	-76.5	-160.8	162.7	0	0	106.2	T328 K332	T328-E330 PolarHBondContact O-N 2.79Å; E330-K332 PolarHBondContact O-N 2.76Å
331	V	32.2	Very low	42.8	Very low	139 Å²	139	119.8 Å²	119.8	84%	0.842	68%	0.676	S	S	*	*			trans	-64	90.7	171.8	178.8	0	0	0	0	106.7	K329	K329-V331 VanDerWaalsContact C-N 3.33Å; K329-V331 PolarHBondContact O-N 2.89Å
332	K	31.3	Very low	39.7	Very low	175 Å²	175	127.5 Å²	127.5	76%	0.761	72%	0.716	S	S	*	*			trans	-82.5	115	162.1	-71.1	-173.5	-179.9	178.2	0	107.5	E330	E330-K332 PolarHBondContact O-N 2.76Å
333	S	27.8	Very low	36.3	Very low	89 Å²	89	132.2 Å²	132.2	62%	0.622	74%	0.74	S	S	*	*			trans	-48.6	152.4	174.5	47	0	0	0	0	112.9	T335	S333-T335 PolarHBondContact O-N 3.03Å
334	P	30.3	Very low	33.4	Very low	133 Å²	133	133.7 Å²	133.7	86%	0.864	76%	0.76	S	S	*	*			trans	-80.5	113.9	178.8	32.2	-28.8	0	0	0	109.5
335	T	26.7	Very low	30.9	Very low	130 Å²	130	135.2 Å²	135.2	80%	0.798	77%	0.768	S	S	*	*			trans	-124.4	120.4	161.4	-25.7	0	0	0	0	108.4	S333	S333-T335 PolarHBondContact O-N 3.03Å
336	A	27.7	Very low	29.5	Very low	87 Å²	87	140 Å²	140	72%	0.719	78%	0.777	S	S	*	*			trans	-72.2	137.7	177	0	0	0	0	0	111
337	Q	28.8	Very low	28.5	Very low	189 Å²	189	138.1 Å²	138.1	88%	0.883	78%	0.777	S	S	*	*				157.1	142.1	118.1	-84.9	179	-6.4	0	0	113.3
338	S	25.2	Very low	27.9	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	78%	0.783	S	S	*	*			trans	81.6	97.8	147.9	-160.6	0	0	0	0	121.7
339	Q	31.1	Very low	27.5	Very low	170 Å²	170	139.8 Å²	139.8	79%	0.794	78%	0.783	S	S	*	*				21.9	138.4	126.8	-69.6	-171.5	-14.5	0	0	123
340	Q	27	Very low	27.1	Very low	188 Å²	188	135 Å²	135	88%	0.879	77%	0.774	S	S	*	*			trans	95.1	128.9	147.4	-76.2	178.5	12.4	0	0	120.3
341	G	22.7	Very low	27.5	Very low	74 Å²	74	131.1 Å²	131.1	76%	0.763	77%	0.774	S	S	*	*			trans	121.1	124.7	141.9	0	0	0	0	0	116.3
342	L	28.7	Very low	28.3	Very low	165 Å²	165	126.8 Å²	126.8	86%	0.864	75%	0.749	S	S	*	*			trans	-43	146.6	171.9	-63.8	98.4	0	0	0	112.9
343	D	22.9	Very low	29.5	Very low	144 Å²	144	122.7 Å²	122.7	77%	0.77	74%	0.735	S	S	*	*				172.6	161.2	80.8	-130	-21	0	0	0	110.7
344	S	27.5	Very low	31.2	Very low	94 Å²	94	122 Å²	122	66%	0.657	73%	0.731	S	S	*	*			trans	26.3	134.8	157.5	75.4	0	0	0	0	123.4
345	N	24.3	Very low	33.2	Very low	140 Å²	140	116 Å²	116	75%	0.749	69%	0.692	S	S	*	*			trans	88.2	125.2	138.8	-92.2	-11.1	0	0	0	122.2
346	Q	26.8	Very low	35.2	Very low	178 Å²	178	113.3 Å²	113.3	83%	0.832	68%	0.677	S	S	*	*			trans	72.1	107.5	144.4	-68.5	-178.1	13.3	0	0	119.4
347	G	26.3	Very low	37.4	Very low	66 Å²	66	110.8 Å²	110.8	68%	0.68	65%	0.648	S	S	*	*				104	86.5	117.1	0	0	0	0	0	116.1
348	T	23.9	Very low	39.7	Very low	142 Å²	142	108.2 Å²	108.2	87%	0.871	63%	0.634	S	S	*	*			trans	-158.6	82.5	134.5	-24.5	0	0	0	0	109.5	S350	T348-S350 VanDerWaalsContact C-N 3.34Å; T348-S350 PolarHBondContact O-N 3.21Å
349	F	22.6	Very low	42.3	Very low	181 Å²	181	108.3 Å²	108.3	79%	0.794	62%	0.623	S	S	*	*			trans	-74.2	89.6	172.7	-93.3	-93.3	0	0	0	109.4	G351 L353	F349-G351 PolarHBondContact O-N 3Å; F349-L353 HydrophobicContact CD1-CD1 4.34Å; F349-L353 HydrophobicContact CE1-CD1 3.72Å; F349-L353 HydrophobicContact CZ-CD1 4.45Å
350	S	26.3	Very low	44.7	Very low	90 Å²	90	100.6 Å²	100.6	63%	0.629	59%	0.587	S	S	*	*			trans	-68.8	117.3	153.1	-173.2	0	0	0	0	106.9	T348 C352	T348-S350 VanDerWaalsContact C-N 3.34Å; T348-S350 PolarHBondContact O-N 3.21Å; S350-C352 PolarHBondContact O-N 3.12Å
351	G	37.3	Very low	47.4	Very low	69 Å²	69	91.8 Å²	91.8	71%	0.711	55%	0.546	S	S	*	.	S	Bend	trans	-62.1	99	-168.5	0	0	0	0	0	113.2	F349	F349-G351 PolarHBondContact O-N 3Å
352	C	49.8	Very low	50.4	Low	48 Å²	48	93.1 Å²	93.1	32%	0.324	54%	0.536	S	S	.	.			trans	-164.8	45.8	174.1	-125.1	0	0	0	0	115.3	S350 R378	S350-C352 PolarHBondContact O-N 3.12Å; C352-R378 PolarHBondContact SG-O 3.06Å
353	L	55.6	Low	53.2	Low	90 Å²	90	86.3 Å²	86.3	47%	0.471	50%	0.499	S	S	.	.	S	Bend	trans	-128.9	-24.3	179.2	-67.9	172	0	0	0	115.6	F349	F349-L353 HydrophobicContact CD1-CD1 4.34Å; F349-L353 HydrophobicContact CE1-CD1 3.72Å; F349-L353 HydrophobicContact CZ-CD1 4.45Å
354	S	63.3	Low	56.3	Low	75 Å²	75	79.5 Å²	79.5	52%	0.524	46%	0.463	S	S	.	.			trans	-135.9	140.6	-179.4	59.1	0	0	0	0	112.5	D361 W380	S354-D361 WeakPolarHBondContact CA-OD2 3.25Å; S354-D361 WeakPolarHBondContact CB-OD2 3.1Å; S354-W380 PolarHBondContact O-NE1 2.85Å
355	S	72.6	Confident	59.3	Low	6 Å²	6	78.1 Å²	78.1	4%	0.042	45%	0.445	C	S	.	.			trans	-82	172.3	166	83.3	0	0	0	0	111.1	Y357 D361 W380	S355-Y357 PolarHBondContact O-N 2.98Å; S355-Y357 PolarHBondContact OG-N 3.39Å; S355-Y357 PolarHBondContact OG-O 3.42Å; S355-D361 VanDerWaalsContact CB-OD1 3.28Å; S355-D361 WeakPolarHBondContact CB-OD1 3.42Å; S355-D361 PolarHBondContact N-OD2 2.97Å; S355-D361 VanDerWaalsContact OG-CG 3.32Å; S355-D361 PolarHBondContact OG-OD1 3.31Å; S355-D361 PolarHBondContact OG-OD2 3.17Å; S355-W380 VanDerWaalsContact CA-NE1 3.33Å
356	P	68	Low	62.3	Low	74 Å²	74	75.9 Å²	75.9	48%	0.481	44%	0.436	S	S	.	.	S	Bend	trans	-61.3	-14.6	169.2	-23.7	34.7	0	0	0	113.6	W380	P356-W380 HydrophobicContact CG-CH2 3.89Å; P356-W380 HydrophobicContact CG-CZ2 4.22Å
357	Y	74.3	Confident	65.2	Low	33 Å²	33	69.2 Å²	69.2	13%	0.129	41%	0.407	C	S	.	.			trans	-107.1	78.9	-178	-50.7	-85.3	0	0	0	109.9	H54 S355 E359 V360 D361 L389	H54-Y357 HydrophobicContact CB-CE1 4.18Å; H54-Y357 PolarHBondContact CD2-OH 3.36Å; H54-Y357 VanDerWaalsContact CD2-OH 3.3Å; H54-Y357 AromaticContact CE1-CZ 3.8Å; H54-Y357 PolarHBondContact CE1-OH 3.38Å; H54-Y357 AromaticContact CG-CE1 3.9Å; H54-Y357 VanDerWaalsContact CG-OH 3.3Å; H54-Y357 AromaticContact ND1-CE1 3.47Å; H54-Y357 WeakPolarHBondContact ND1-CE1 3.21Å; H54-Y357 AromaticContact ND1-CZ 3.65Å; H54-Y357 PolarHBondContact ND1-OH 3.03Å; H54-Y357 VanDerWaalsContact ND1-OH 3.11Å; H54-Y357 PolarHBondContact NE2-OH 3.45Å; H54-Y357 VanDerWaalsContact NE2-OH 3.12Å; S355-Y357 PolarHBondContact O-N 2.98Å; S355-Y357 PolarHBondContact OG-N 3.39Å; S355-Y357 PolarHBondContact OG-O 3.42Å; Y357-E359 PolarHBondContact O-N 3.4Å; Y357-V360 PolarHBondContact O-N 3.17Å; Y357-D361 PolarHBondContact O-N 3.2Å; Y357-L389 HydrophobicContact CD2-CD1 4.03Å; Y357-L389 HydrophobicContact CD2-CD2 3.71Å; Y357-L389 HydrophobicContact CE2-CD1 3.96Å; Y357-L389 HydrophobicContact CE2-CD2 4.35Å; Y357-L389 HydrophobicContact CG-CD2 4.33Å
358	K	78.7	Confident	68.2	Low	135 Å²	135	66.1 Å²	66.1	59%	0.587	37%	0.374	S	S	*	.	H	α-helix	trans	-62.2	-33.9	-174.4	-69	-178.7	179.9	175.8	0	112.4	D361 N362	K358-D361 PolarHBondContact O-N 3.12Å; K358-N362 WeakPolarHBondContact O-CB 3.45Å; K358-N362 PolarHBondContact O-N 3.43Å; K358-N362 PolarHBondContact O-ND2 3.24Å
359	E	78.1	Confident	71.3	Confident	112 Å²	112	67.8 Å²	67.8	52%	0.523	37%	0.365	S	S	.	.	H	α-helix	trans	-64.7	-43.1	178.9	-58.9	73.8	-160.6	0	0	110.4	Y357 N362 F363 I445	Y357-E359 PolarHBondContact O-N 3.4Å; E359-N362 PolarHBondContact O-N 3.07Å; E359-F363 PolarHBondContact O-N 3.03Å; E359-F363 VanDerWaalsContact O-N 3.13Å; E359-I445 HydrophobicContact CB-CG2 3.86Å
360	V	81.6	Confident	74	Confident	8 Å²	8	62.8 Å²	62.8	5%	0.048	34%	0.343	C	S	.	.	H	α-helix	trans	-68.6	-40.3	175.6	-174.3	0	0	0	0	110.8	Y357 N362 F363 V364 L389 Y391 V415	Y357-V360 PolarHBondContact O-N 3.17Å; V360-N362 VanDerWaalsContact C-N 3.35Å; V360-N362 PolarHBondContact O-N 3.44Å; V360-F363 WeakPolarHBondContact O-CB 3.21Å; V360-F363 PolarHBondContact O-N 3.36Å; V360-V364 WeakPolarHBondContact O-CG2 3.47Å; V360-V364 PolarHBondContact O-N 3.16Å; V360-L389 HydrophobicContact CB-CD2 4.47Å; V360-L389 HydrophobicContact CG1-CD2 4.06Å; V360-Y391 HydrophobicContact CG1-CE2 4.18Å; V360-Y391 WeakPolarHBondContact CG1-OH 2.98Å; V360-V415 HydrophobicContact CG1-CB 4.45Å; V360-V415 HydrophobicContact CG1-CG1 4.12Å; V360-V415 HydrophobicContact CG1-CG2 4.09Å
361	D	84.3	Confident	76.5	Confident	3 Å²	3	64.5 Å²	64.5	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-59.8	-45.3	175.4	-64.8	-11.4	0	0	0	112	S354 S355 Y357 K358 F363 V364 F365 I377 Y391	S354-D361 WeakPolarHBondContact CA-OD2 3.25Å; S354-D361 WeakPolarHBondContact CB-OD2 3.1Å; S355-D361 VanDerWaalsContact CB-OD1 3.28Å; S355-D361 WeakPolarHBondContact CB-OD1 3.42Å; S355-D361 PolarHBondContact N-OD2 2.97Å; S355-D361 VanDerWaalsContact OG-CG 3.32Å; S355-D361 PolarHBondContact OG-OD1 3.31Å; S355-D361 PolarHBondContact OG-OD2 3.17Å; Y357-D361 PolarHBondContact O-N 3.2Å; K358-D361 PolarHBondContact O-N 3.12Å; D361-F363 VanDerWaalsContact C-N 3.3Å; D361-F363 PolarHBondContact O-N 3.41Å; D361-V364 PolarHBondContact O-N 3.24Å; D361-V364 VanDerWaalsContact O-N 3.15Å; D361-F365 HydrophobicContact CB-CE2 4.24Å; D361-F365 WeakPolarHBondContact O-CD2 3.36Å; D361-F365 WeakPolarHBondContact O-CG 3.35Å; D361-F365 PolarHBondContact O-N 3.44Å; D361-I377 HydrophobicContact CB-CD1 3.99Å; D361-Y391 VanDerWaalsContact OD1-CE1 3.25Å; D361-Y391 WeakPolarHBondContact OD1-CE1 3.31Å; D361-Y391 PolarHBondContact OD1-OH 3.41Å
362	N	85.1	Confident	78.4	Confident	102 Å²	102	65.3 Å²	65.3	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-57.4	-45	176.4	-72.6	-23	0	0	0	111.1	K358 E359 V360 F365 T366	K358-N362 WeakPolarHBondContact O-CB 3.45Å; K358-N362 PolarHBondContact O-N 3.43Å; K358-N362 PolarHBondContact O-ND2 3.24Å; E359-N362 PolarHBondContact O-N 3.07Å; V360-N362 VanDerWaalsContact C-N 3.35Å; V360-N362 PolarHBondContact O-N 3.44Å; N362-F365 WeakPolarHBondContact O-CB 3.47Å; N362-F365 PolarHBondContact O-N 3.32Å; N362-T366 WeakPolarHBondContact O-CG2 3.36Å; N362-T366 PolarHBondContact O-N 3.44Å
363	F	87.8	Confident	80	Confident	23 Å²	23	65.6 Å²	65.6	10%	0.101	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-47	173.8	170.4	-113.3	0	0	0	112.1	E359 V360 D361 F365 T366 L367 W422 L441 P442 I445	E359-F363 PolarHBondContact O-N 3.03Å; E359-F363 VanDerWaalsContact O-N 3.13Å; V360-F363 WeakPolarHBondContact O-CB 3.21Å; V360-F363 PolarHBondContact O-N 3.36Å; D361-F363 VanDerWaalsContact C-N 3.3Å; D361-F363 PolarHBondContact O-N 3.41Å; F363-F365 VanDerWaalsContact C-N 3.26Å; F363-F365 PolarHBondContact O-N 2.8Å; F363-T366 WeakPolarHBondContact O-CA 3.14Å; F363-T366 WeakPolarHBondContact O-CB 3.32Å; F363-T366 PolarHBondContact O-N 3.07Å; F363-T366 PolarHBondContact O-OG1 3.07Å; F363-L367 HydrophobicContact CD1-CD1 4.27Å; F363-L367 HydrophobicContact CE1-CD1 3.64Å; F363-L367 HydrophobicContact CE1-CG 4.23Å; F363-L367 HydrophobicContact CE2-CD1 4.47Å; F363-L367 HydrophobicContact CE2-CD2 3.98Å; F363-L367 HydrophobicContact CE2-CG 4.22Å; F363-L367 HydrophobicContact CZ-CD1 3.77Å; F363-L367 HydrophobicContact CZ-CD2 3.85Å; F363-L367 HydrophobicContact CZ-CG 3.99Å; F363-L367 PolarHBondContact O-N 2.77Å; F363-W422 AromaticContact CE1-CD1 3.72Å; F363-W422 HydrophobicContact CE1-CG 4.05Å; F363-W422 AromaticContact CZ-CD1 3.58Å; F363-W422 HydrophobicContact CZ-CG 4.26Å; F363-W422 AromaticContact CZ-NE1 3.52Å; F363-L441 HydrophobicContact CD1-CD2 4.09Å; F363-L441 HydrophobicContact CE1-CD2 3.53Å; F363-L441 HydrophobicContact CZ-CD2 4.27Å; F363-P442 HydrophobicContact CD2-CG 3.39Å; F363-P442 HydrophobicContact CE2-CG 3.43Å; F363-P442 VanDerWaalsContact CE2-CG 3.43Å; F363-P442 HydrophobicContact CG-CG 4.13Å; F363-P442 HydrophobicContact CZ-CG 4.2Å; F363-I445 HydrophobicContact CB-CD1 3.7Å; F363-I445 HydrophobicContact CD1-CD1 3.64Å; F363-I445 HydrophobicContact CD2-CD1 4.49Å; F363-I445 HydrophobicContact CE1-CD1 4.39Å; F363-I445 HydrophobicContact CG-CD1 3.68Å
364	V	88.4	Confident	81.6	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-58.8	-37.9	176.8	172.8	0	0	0	0	111.6	V360 D361 T366 L367 V368 I377 Y391 I393 I413 V415	V360-V364 WeakPolarHBondContact O-CG2 3.47Å; V360-V364 PolarHBondContact O-N 3.16Å; D361-V364 PolarHBondContact O-N 3.24Å; D361-V364 VanDerWaalsContact O-N 3.15Å; V364-T366 PolarHBondContact O-N 3.33Å; V364-L367 WeakPolarHBondContact O-CB 3.31Å; V364-L367 PolarHBondContact O-N 2.86Å; V364-V368 WeakPolarHBondContact O-CG2 3.31Å; V364-V368 PolarHBondContact O-N 3.17Å; V364-I377 HydrophobicContact CB-CD1 4.46Å; V364-I377 HydrophobicContact CG1-CD1 4.28Å; V364-I377 HydrophobicContact CG1-CG1 4.15Å; V364-Y391 HydrophobicContact CG1-CG 4.36Å; V364-Y391 HydrophobicContact CG2-CD2 3.93Å; V364-Y391 HydrophobicContact CG2-CE2 3.77Å; V364-Y391 HydrophobicContact CG2-CG 4.36Å; V364-I393 HydrophobicContact CG1-CD1 3.97Å; V364-I413 HydrophobicContact CG2-CG2 4.33Å; V364-V415 HydrophobicContact CG2-CG2 4.27Å
365	F	89.4	Confident	82.7	Confident	66 Å²	66	63.8 Å²	63.8	29%	0.289	34%	0.335	S	S	.	.	H	α-helix	trans	-61.4	-32	174.1	-70.5	-55.9	0	0	0	113	D361 N362 F363 L367 I377	D361-F365 HydrophobicContact CB-CE2 4.24Å; D361-F365 WeakPolarHBondContact O-CD2 3.36Å; D361-F365 WeakPolarHBondContact O-CG 3.35Å; D361-F365 PolarHBondContact O-N 3.44Å; N362-F365 WeakPolarHBondContact O-CB 3.47Å; N362-F365 PolarHBondContact O-N 3.32Å; F363-F365 VanDerWaalsContact C-N 3.26Å; F363-F365 PolarHBondContact O-N 2.8Å; F365-L367 VanDerWaalsContact C-N 3.33Å; F365-I377 HydrophobicContact CD1-CG1 4.44Å; F365-I377 HydrophobicContact CE1-CB 4.34Å; F365-I377 HydrophobicContact CE1-CD1 3.95Å; F365-I377 HydrophobicContact CE1-CG1 3.83Å; F365-I377 HydrophobicContact CE2-CD1 4.01Å; F365-I377 HydrophobicContact CZ-CB 4.41Å; F365-I377 HydrophobicContact CZ-CD1 3.65Å; F365-I377 HydrophobicContact CZ-CG1 4Å
366	T	88.1	Confident	83.4	Confident	92 Å²	92	65 Å²	65	56%	0.564	34%	0.343	S	S	*	.	H	α-helix	trans	-67.8	-33.4	173.4	74.4	0	0	0	0	112.5	N362 F363 V364	N362-T366 WeakPolarHBondContact O-CG2 3.36Å; N362-T366 PolarHBondContact O-N 3.44Å; F363-T366 WeakPolarHBondContact O-CA 3.14Å; F363-T366 WeakPolarHBondContact O-CB 3.32Å; F363-T366 PolarHBondContact O-N 3.07Å; F363-T366 PolarHBondContact O-OG1 3.07Å; V364-T366 PolarHBondContact O-N 3.33Å
367	L	88.3	Confident	84.4	Confident	39 Å²	39	61.6 Å²	61.6	20%	0.204	32%	0.321	C	S	.	.	H	α-helix	trans	-74.3	-30.4	-178.6	-61.5	-179.3	0	0	0	113.3	F363 V364 F365 R369 I413 W422	F363-L367 HydrophobicContact CD1-CD1 4.27Å; F363-L367 HydrophobicContact CE1-CD1 3.64Å; F363-L367 HydrophobicContact CE1-CG 4.23Å; F363-L367 HydrophobicContact CE2-CD1 4.47Å; F363-L367 HydrophobicContact CE2-CD2 3.98Å; F363-L367 HydrophobicContact CE2-CG 4.22Å; F363-L367 HydrophobicContact CZ-CD1 3.77Å; F363-L367 HydrophobicContact CZ-CD2 3.85Å; F363-L367 HydrophobicContact CZ-CG 3.99Å; F363-L367 PolarHBondContact O-N 2.77Å; V364-L367 WeakPolarHBondContact O-CB 3.31Å; V364-L367 PolarHBondContact O-N 2.86Å; F365-L367 VanDerWaalsContact C-N 3.33Å; L367-R369 VanDerWaalsContact C-N 3.26Å; L367-R369 PolarHBondContact O-N 3.36Å; L367-I413 HydrophobicContact CD1-CG2 4.12Å; L367-W422 HydrophobicContact CD1-CD2 3.57Å; L367-W422 HydrophobicContact CD1-CE3 3.69Å; L367-W422 HydrophobicContact CD1-CG 4.19Å; L367-W422 HydrophobicContact CD1-CH2 4.01Å; L367-W422 HydrophobicContact CD1-CZ2 3.91Å; L367-W422 HydrophobicContact CD1-CZ3 3.91Å; L367-W422 HydrophobicContact CD2-CH2 3.93Å; L367-W422 HydrophobicContact CD2-CZ2 3.46Å; L367-W422 VanDerWaalsContact CD2-CZ2 3.46Å; L367-W422 HydrophobicContact CG-CH2 4.47Å; L367-W422 HydrophobicContact CG-CZ2 4.3Å
368	V	89.3	Confident	85	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.006	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	37.4	-175	-59.3	0	0	0	0	112.5	V364 G375 I393 Y396 I413	V364-V368 WeakPolarHBondContact O-CG2 3.31Å; V364-V368 PolarHBondContact O-N 3.17Å; V368-G375 PolarHBondContact O-N 2.91Å; V368-I393 HydrophobicContact CB-CG2 4.09Å; V368-I393 HydrophobicContact CG1-CB 4.42Å; V368-I393 HydrophobicContact CG1-CD1 3.94Å; V368-I393 HydrophobicContact CG1-CG1 3.88Å; V368-I393 HydrophobicContact CG1-CG2 3.69Å; V368-Y396 HydrophobicContact CB-CD1 3.79Å; V368-Y396 HydrophobicContact CB-CE1 4.24Å; V368-Y396 HydrophobicContact CB-CG 3.99Å; V368-Y396 HydrophobicContact CG1-CD1 3.97Å; V368-Y396 HydrophobicContact CG1-CE1 4.36Å; V368-Y396 WeakPolarHBondContact O-CD2 3.13Å; V368-I413 HydrophobicContact CG1-CG1 4.35Å
369	R	87.7	Confident	85.3	Confident	176 Å²	176	64.4 Å²	64.4	66%	0.664	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	116	179	-167.2	-177.3	-149.9	-178.5	7.2	110.1	L367 V373	L367-R369 VanDerWaalsContact C-N 3.26Å; L367-R369 PolarHBondContact O-N 3.36Å; R369-V373 WeakPolarHBondContact CA-O 3.49Å
370	K	80.8	Confident	85.8	Confident	76 Å²	76	60.5 Å²	60.5	33%	0.33	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	140.2	176.1	-162.6	-178.9	173.5	177.6	0	110.9	G372 V373 Y396 W398	K370-G372 VanDerWaalsContact C-N 3.27Å; K370-G372 PolarHBondContact O-N 3.12Å; K370-V373 PolarHBondContact N-O 2.97Å; K370-V373 VanDerWaalsContact N-O 3.11Å; K370-V373 WeakPolarHBondContact O-CB 3.47Å; K370-V373 PolarHBondContact O-N 2.99Å; K370-Y396 HydrophobicContact CB-CE2 3.76Å; K370-Y396 WeakPolarHBondContact CB-OH 3.45Å; K370-W398 HydrophobicContact CD-CD2 4.45Å; K370-W398 HydrophobicContact CD-CG 4.49Å
371	D	78.6	Confident	86.1	Confident	127 Å²	127	60.9 Å²	60.9	68%	0.679	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	40	173.1	-52.9	-35.2	0	0	0	114.2	V373	D371-V373 PolarHBondContact O-N 3.41Å
372	G	77.4	Confident	86.3	Confident	85 Å²	85	61.2 Å²	61.2	88%	0.876	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	-2.4	-178.2	0	0	0	0	0	115.2	K370	K370-G372 VanDerWaalsContact C-N 3.27Å; K370-G372 PolarHBondContact O-N 3.12Å
373	V	83.3	Confident	86.3	Confident	54 Å²	54	56.4 Å²	56.4	33%	0.327	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	124.7	172.9	-175.2	0	0	0	0	109.4	R369 K370 D371 K395 Y396 F405	R369-V373 WeakPolarHBondContact CA-O 3.49Å; K370-V373 PolarHBondContact N-O 2.97Å; K370-V373 VanDerWaalsContact N-O 3.11Å; K370-V373 WeakPolarHBondContact O-CB 3.47Å; K370-V373 PolarHBondContact O-N 2.99Å; D371-V373 PolarHBondContact O-N 3.41Å; V373-K395 VanDerWaalsContact CG1-O 3.22Å; V373-K395 WeakPolarHBondContact CG1-O 3.4Å; V373-Y396 HydrophobicContact CB-CD2 4.45Å; V373-Y396 HydrophobicContact CG1-CD2 4.08Å; V373-F405 HydrophobicContact CG2-CZ 4.5Å
374	Q	87.8	Confident	86	Confident	124 Å²	124	55.5 Å²	55.5	58%	0.579	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	117.4	173.8	-176.2	171.7	-11.5	0	0	110
375	G	86.6	Confident	85.7	Confident	3 Å²	3	56.5 Å²	56.5	3%	0.031	29%	0.288	C	S	.	.			trans	-75.9	162.6	172.6	0	0	0	0	0	112.5	V368 A394 Y396	V368-G375 PolarHBondContact O-N 2.91Å; G375-A394 WeakPolarHBondContact CA-O 3.22Å; G375-Y396 VanDerWaalsContact CA-CB 3.45Å
376	S	88	Confident	85.3	Confident	31 Å²	31	55.9 Å²	55.9	22%	0.217	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.1	171.7	60.3	0	0	0	0	109.5	R378 A394	S376-R378 PolarHBondContact O-N 3.18Å; S376-A394 PolarHBondContact N-O 3.19Å; S376-A394 PolarHBondContact O-N 3.23Å
377	I	89	Confident	85	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.015	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	119.4	170.4	-64	167.6	0	0	0	107.5	D361 V364 F365 Y391 I393	D361-I377 HydrophobicContact CB-CD1 3.99Å; V364-I377 HydrophobicContact CB-CD1 4.46Å; V364-I377 HydrophobicContact CG1-CD1 4.28Å; V364-I377 HydrophobicContact CG1-CG1 4.15Å; F365-I377 HydrophobicContact CD1-CG1 4.44Å; F365-I377 HydrophobicContact CE1-CB 4.34Å; F365-I377 HydrophobicContact CE1-CD1 3.95Å; F365-I377 HydrophobicContact CE1-CG1 3.83Å; F365-I377 HydrophobicContact CE2-CD1 4.01Å; F365-I377 HydrophobicContact CZ-CB 4.41Å; F365-I377 HydrophobicContact CZ-CD1 3.65Å; F365-I377 HydrophobicContact CZ-CG1 4Å; I377-Y391 HydrophobicContact CD1-CD1 3.88Å; I377-Y391 HydrophobicContact CD1-CE1 3.81Å; I377-Y391 HydrophobicContact CG1-CD1 4.05Å; I377-Y391 HydrophobicContact CG1-CE1 4.48Å; I377-Y391 HydrophobicContact CG2-CD1 3.81Å; I377-Y391 HydrophobicContact CG2-CE1 4.41Å; I377-I393 HydrophobicContact CG1-CD1 4.5Å
378	R	86.6	Confident	84.9	Confident	136 Å²	136	50.2 Å²	50.2	51%	0.513	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-42.6	175.9	-172.8	-175.9	175.1	177.1	-0.1	110.8	C352 S376 D392 A394 N410	C352-R378 PolarHBondContact SG-O 3.06Å; S376-R378 PolarHBondContact O-N 3.18Å; R378-D392 WeakPolarHBondContact CA-O 3.34Å; R378-D392 HydrophobicContact CB-CB 4.49Å; R378-D392 VanDerWaalsContact CB-O 3.23Å; R378-D392 WeakPolarHBondContact CB-O 3.29Å; R378-D392 PolarHBondContact N-O 3.08Å; R378-A394 HydrophobicContact CB-CB 3.82Å; R378-A394 HydrophobicContact CG-CB 4.26Å; R378-N410 PolarHBondContact NH1-ND2 2.79Å
379	R	85.3	Confident	84.8	Confident	92 Å²	92	50.2 Å²	50.2	35%	0.347	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	162.3	179.1	56.5	176.8	175.4	174.8	2	109.1	D392	R379-D392 HydrophobicContact CG-CB 3.55Å; R379-D392 IonicContact CZ-OD2 3.52Å; R379-D392 VanDerWaalsContact CZ-OD2 3.24Å; R379-D392 PolarHBondContact N-O 3.31Å; R379-D392 IonicContact NE-OD2 3.96Å; R379-D392 PolarHBondContact NE-OD2 3.46Å; R379-D392 IonicContact NH2-OD2 3.89Å; R379-D392 PolarHBondContact NH2-OD2 3.19Å; R379-D392 PolarHBondContact O-N 3.38Å
380	W	88.4	Confident	84.9	Confident	30 Å²	30	42.1 Å²	42.1	11%	0.114	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	157.4	175.2	61.7	-93.2	0	0	0	109.8	S354 S355 P356 L389 V390 Y391	S354-W380 PolarHBondContact O-NE1 2.85Å; S355-W380 VanDerWaalsContact CA-NE1 3.33Å; P356-W380 HydrophobicContact CG-CH2 3.89Å; P356-W380 HydrophobicContact CG-CZ2 4.22Å; W380-L389 HydrophobicContact CE3-CD1 4.1Å; W380-L389 HydrophobicContact CZ3-CD1 4.49Å; W380-V390 CarbonylContact C-O 3.52Å; W380-V390 VanDerWaalsContact CA-O 3.23Å; W380-V390 WeakPolarHBondContact CA-O 3.44Å; W380-Y391 HydrophobicContact CB-CD1 3.7Å; W380-Y391 HydrophobicContact CB-CE1 3.84Å; W380-Y391 HydrophobicContact CB-CG 4.39Å
381	N	87.9	Confident	85.4	Confident	15 Å²	15	38.5 Å²	38.5	8%	0.08	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.3	173.2	-53.6	-78.6	0	0	0	109.4	V108 F383 V390	V108-N381 HydrophobicContact CG2-CB 3.99Å; N381-F383 HydrophobicContact CB-CE2 4.01Å; N381-V390 PolarHBondContact N-O 3.25Å; N381-V390 PolarHBondContact O-N 3.11Å
382	Y	87.7	Confident	85.9	Confident	10 Å²	10	32.8 Å²	32.8	4%	0.039	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.8	175.8	178.5	-123.2	0	0	0	111.4	A107 V108 A384 L388 L389 L417	A107-Y382 HydrophobicContact CB-CD1 4.09Å; V108-Y382 WeakPolarHBondContact CB-O 3.42Å; V108-Y382 VanDerWaalsContact CG2-O 3.32Å; V108-Y382 WeakPolarHBondContact CG2-O 3.39Å; V108-Y382 PolarHBondContact N-O 3.19Å; Y382-A384 HydrophobicContact CE1-CB 3.98Å; Y382-L388 WeakPolarHBondContact CA-O 3.34Å; Y382-L389 HydrophobicContact CD2-CD1 3.76Å; Y382-L389 HydrophobicContact CG-CD1 4.1Å; Y382-L417 HydrophobicContact CE2-CD1 4.33Å
383	F	85.6	Confident	86.5	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.009	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	99.3	175.8	-64.6	-94.8	0	0	0	109.3	V108 F315 I320 N381 V385 D386 Q387 L388 V390	V108-F383 HydrophobicContact CB-CD1 4.18Å; V108-F383 HydrophobicContact CB-CE1 4.28Å; V108-F383 HydrophobicContact CG1-CD1 4.18Å; V108-F383 HydrophobicContact CG1-CE1 3.96Å; V108-F383 HydrophobicContact CG2-CD1 4.29Å; V108-F383 HydrophobicContact CG2-CE1 4.12Å; V108-F383 HydrophobicContact CG2-CE2 4.46Å; V108-F383 HydrophobicContact CG2-CZ 4.2Å; F315-F383 HydrophobicContact CB-CB 4.36Å; F315-F383 HydrophobicContact CB-CD1 3.72Å; F315-F383 HydrophobicContact CB-CD2 4Å; F315-F383 HydrophobicContact CB-CE1 3.92Å; F315-F383 HydrophobicContact CB-CE2 4.19Å; F315-F383 HydrophobicContact CB-CG 3.77Å; F315-F383 HydrophobicContact CB-CZ 4.15Å; F315-F383 HydrophobicContact CD2-CD1 4.34Å; F315-F383 HydrophobicContact CD2-CD2 4.22Å; F315-F383 AromaticContact CD2-CE1 3.68Å; F315-F383 HydrophobicContact CD2-CE1 3.68Å; F315-F383 AromaticContact CD2-CE2 3.55Å; F315-F383 HydrophobicContact CD2-CE2 3.55Å; F315-F383 AromaticContact CD2-CZ 3.23Å; F315-F383 HydrophobicContact CD2-CZ 3.23Å; F315-F383 HydrophobicContact CE2-CE2 4.1Å; F315-F383 AromaticContact CE2-CZ 3.89Å; F315-F383 HydrophobicContact CE2-CZ 3.89Å; F315-F383 HydrophobicContact CG-CD1 4.45Å; F315-F383 HydrophobicContact CG-CD2 4.2Å; F315-F383 HydrophobicContact CG-CE1 4.22Å; F315-F383 AromaticContact CG-CE2 3.98Å; F315-F383 HydrophobicContact CG-CE2 3.98Å; F315-F383 HydrophobicContact CG-CG 4.44Å; F315-F383 AromaticContact CG-CZ 3.99Å; F315-F383 HydrophobicContact CG-CZ 3.99Å; I320-F383 HydrophobicContact CD1-CE1 4.08Å; I320-F383 HydrophobicContact CD1-CZ 3.84Å; I320-F383 HydrophobicContact CG1-CZ 4.44Å; N381-F383 HydrophobicContact CB-CE2 4.01Å; F383-V385 VanDerWaalsContact C-N 3.29Å; F383-V385 PolarHBondContact O-N 3.17Å; F383-D386 PolarHBondContact O-N 3.06Å; F383-Q387 WeakPolarHBondContact O-CA 3.36Å; F383-Q387 PolarHBondContact O-N 3.23Å; F383-L388 HydrophobicContact CB-CB 4.37Å; F383-L388 PolarHBondContact N-O 3.18Å; F383-L388 PolarHBondContact O-N 3.36Å; F383-V390 HydrophobicContact CD2-CG2 4Å; F383-V390 HydrophobicContact CE2-CB 4.27Å; F383-V390 HydrophobicContact CE2-CG2 3.78Å
384	A	82.4	Confident	86.7	Confident	4 Å²	4	27 Å²	27	3%	0.033	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-39.2	-172.9	0	0	0	0	0	113.4	A107 C311 Y382 D386 Q387	A107-A384 HydrophobicContact CB-CB 4.42Å; C311-A384 HydrophobicContact CB-CB 4.48Å; Y382-A384 HydrophobicContact CE1-CB 3.98Å; A384-D386 PolarHBondContact O-N 3.13Å; A384-Q387 PolarHBondContact O-N 3.23Å
385	V	80.8	Confident	86.6	Confident	21 Å²	21	28.5 Å²	28.5	13%	0.127	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-43.8	-178.4	-180	0	0	0	0	112.6	A59 Y82 C311 N312 V313 F383	A59-V385 WeakPolarHBondContact CB-O 3.44Å; Y82-V385 HydrophobicContact CE2-CG2 4.24Å; C311-V385 WeakPolarHBondContact O-CG2 3.4Å; N312-V385 VanDerWaalsContact CA-CG2 3.48Å; N312-V385 HydrophobicContact CB-CG2 4.4Å; N312-V385 WeakPolarHBondContact OD1-CG2 3.43Å; V313-V385 VanDerWaalsContact N-CG2 3.27Å; F383-V385 VanDerWaalsContact C-N 3.29Å; F383-V385 PolarHBondContact O-N 3.17Å
386	D	81.6	Confident	86.7	Confident	52 Å²	52	29 Å²	29	28%	0.278	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-1.7	-176.9	-57	-46.9	0	0	0	111.9	S314 F315 F383 A384 L388	S314-D386 WeakPolarHBondContact CA-OD2 3.39Å; S314-D386 WeakPolarHBondContact CB-OD2 3.32Å; F315-D386 PolarHBondContact N-OD2 3.46Å; F383-D386 PolarHBondContact O-N 3.06Å; A384-D386 PolarHBondContact O-N 3.13Å; D386-L388 HydrophobicContact CB-CB 4.45Å; D386-L388 HydrophobicContact CB-CD1 3.79Å; D386-L388 HydrophobicContact CB-CG 3.65Å; D386-L388 WeakPolarHBondContact O-CG 3.45Å; D386-L388 PolarHBondContact O-N 3.06Å
387	Q	81.8	Confident	86.8	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	39.6	-172.2	-62.9	178.6	-8.2	0	0	113.1	F56 E58 F383 A384 L417 K418	F56-Q387 PolarHBondContact O-NE2 2.81Å; F56-Q387 VanDerWaalsContact O-NE2 3.13Å; F56-Q387 PolarHBondContact O-OE1 3.42Å; E58-Q387 PolarHBondContact O-NE2 3.13Å; F383-Q387 WeakPolarHBondContact O-CA 3.36Å; F383-Q387 PolarHBondContact O-N 3.23Å; A384-Q387 PolarHBondContact O-N 3.23Å; Q387-L417 HydrophobicContact CB-CB 4.4Å; Q387-L417 WeakPolarHBondContact O-CB 2.92Å; Q387-L417 PolarHBondContact O-N 2.96Å; Q387-K418 HydrophobicContact CB-CB 4.25Å
388	L	86.9	Confident	86.8	Confident	12 Å²	12	34.1 Å²	34.1	6%	0.063	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.4	-177.5	-63.5	-179	0	0	0	111.4	F315 Y382 F383 D386 V390 V414 V415 D416	F315-L388 HydrophobicContact CB-CD1 4.12Å; F315-L388 HydrophobicContact CD1-CD1 3.96Å; F315-L388 HydrophobicContact CG-CD1 4.48Å; Y382-L388 WeakPolarHBondContact CA-O 3.34Å; F383-L388 HydrophobicContact CB-CB 4.37Å; F383-L388 PolarHBondContact N-O 3.18Å; F383-L388 PolarHBondContact O-N 3.36Å; D386-L388 HydrophobicContact CB-CB 4.45Å; D386-L388 HydrophobicContact CB-CD1 3.79Å; D386-L388 HydrophobicContact CB-CG 3.65Å; D386-L388 WeakPolarHBondContact O-CG 3.45Å; D386-L388 PolarHBondContact O-N 3.06Å; L388-V390 HydrophobicContact CB-CG2 4.48Å; L388-V414 HydrophobicContact CD2-CG1 4.3Å; L388-V415 WeakPolarHBondContact CA-O 3.15Å; L388-D416 HydrophobicContact CD2-CB 3.68Å
389	L	87.6	Confident	86.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	111.2	169.9	-149.9	66.9	0	0	0	108.8	Y357 V360 W380 Y382 Y391 V415	Y357-L389 HydrophobicContact CD2-CD1 4.03Å; Y357-L389 HydrophobicContact CD2-CD2 3.71Å; Y357-L389 HydrophobicContact CE2-CD1 3.96Å; Y357-L389 HydrophobicContact CE2-CD2 4.35Å; Y357-L389 HydrophobicContact CG-CD2 4.33Å; V360-L389 HydrophobicContact CB-CD2 4.47Å; V360-L389 HydrophobicContact CG1-CD2 4.06Å; W380-L389 HydrophobicContact CE3-CD1 4.1Å; W380-L389 HydrophobicContact CZ3-CD1 4.49Å; Y382-L389 HydrophobicContact CD2-CD1 3.76Å; Y382-L389 HydrophobicContact CG-CD1 4.1Å; L389-Y391 HydrophobicContact CB-CE2 4.04Å; L389-Y391 HydrophobicContact CD2-CE2 3.6Å; L389-Y391 WeakPolarHBondContact CD2-OH 3.3Å; L389-Y391 HydrophobicContact CG-CE2 3.7Å; L389-V415 HydrophobicContact CB-CB 4.22Å; L389-V415 PolarHBondContact N-O 3.32Å; L389-V415 PolarHBondContact O-N 2.8Å
390	V	89.1	Confident	87.1	Confident	7 Å²	7	26.9 Å²	26.9	4%	0.042	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	114	-174.8	-178.9	0	0	0	0	110	F315 W380 N381 F383 L388 M412 V414	F315-V390 HydrophobicContact CD1-CG2 4.37Å; F315-V390 HydrophobicContact CE1-CG2 4.15Å; F315-V390 HydrophobicContact CZ-CG2 4.25Å; W380-V390 CarbonylContact C-O 3.52Å; W380-V390 VanDerWaalsContact CA-O 3.23Å; W380-V390 WeakPolarHBondContact CA-O 3.44Å; N381-V390 PolarHBondContact N-O 3.25Å; N381-V390 PolarHBondContact O-N 3.11Å; F383-V390 HydrophobicContact CD2-CG2 4Å; F383-V390 HydrophobicContact CE2-CB 4.27Å; F383-V390 HydrophobicContact CE2-CG2 3.78Å; L388-V390 HydrophobicContact CB-CG2 4.48Å; V390-M412 HydrophobicContact CG1-SD 4.43Å; V390-V414 HydrophobicContact CG1-CG2 4.3Å; V390-V414 HydrophobicContact CG2-CG1 4.09Å; V390-V414 HydrophobicContact CG2-CG2 4.3Å
391	Y	90.3	Very high	87	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.7	179.5	-64.9	-91.8	0	0	0	111.4	V360 D361 V364 I377 W380 L389 M412 I413 V415	V360-Y391 HydrophobicContact CG1-CE2 4.18Å; V360-Y391 WeakPolarHBondContact CG1-OH 2.98Å; D361-Y391 VanDerWaalsContact OD1-CE1 3.25Å; D361-Y391 WeakPolarHBondContact OD1-CE1 3.31Å; D361-Y391 PolarHBondContact OD1-OH 3.41Å; V364-Y391 HydrophobicContact CG1-CG 4.36Å; V364-Y391 HydrophobicContact CG2-CD2 3.93Å; V364-Y391 HydrophobicContact CG2-CE2 3.77Å; V364-Y391 HydrophobicContact CG2-CG 4.36Å; I377-Y391 HydrophobicContact CD1-CD1 3.88Å; I377-Y391 HydrophobicContact CD1-CE1 3.81Å; I377-Y391 HydrophobicContact CG1-CD1 4.05Å; I377-Y391 HydrophobicContact CG1-CE1 4.48Å; I377-Y391 HydrophobicContact CG2-CD1 3.81Å; I377-Y391 HydrophobicContact CG2-CE1 4.41Å; W380-Y391 HydrophobicContact CB-CD1 3.7Å; W380-Y391 HydrophobicContact CB-CE1 3.84Å; W380-Y391 HydrophobicContact CB-CG 4.39Å; L389-Y391 HydrophobicContact CB-CE2 4.04Å; L389-Y391 HydrophobicContact CD2-CE2 3.6Å; L389-Y391 WeakPolarHBondContact CD2-OH 3.3Å; L389-Y391 HydrophobicContact CG-CE2 3.7Å; Y391-M412 CarbonylContact O-C 3.5Å; Y391-M412 WeakPolarHBondContact O-CA 2.91Å; Y391-I413 PolarHBondContact N-O 3.4Å; Y391-I413 PolarHBondContact O-N 3.38Å; Y391-V415 HydrophobicContact CD2-CG2 4.36Å; Y391-V415 HydrophobicContact CE2-CG2 4.08Å
392	D	89.1	Confident	87	Confident	6 Å²	6	31 Å²	31	3%	0.032	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.6	166.9	-174.8	-23.4	0	0	0	108	R378 R379 N410 H427	R378-D392 WeakPolarHBondContact CA-O 3.34Å; R378-D392 HydrophobicContact CB-CB 4.49Å; R378-D392 VanDerWaalsContact CB-O 3.23Å; R378-D392 WeakPolarHBondContact CB-O 3.29Å; R378-D392 PolarHBondContact N-O 3.08Å; R379-D392 HydrophobicContact CG-CB 3.55Å; R379-D392 IonicContact CZ-OD2 3.52Å; R379-D392 VanDerWaalsContact CZ-OD2 3.24Å; R379-D392 PolarHBondContact N-O 3.31Å; R379-D392 IonicContact NE-OD2 3.96Å; R379-D392 PolarHBondContact NE-OD2 3.46Å; R379-D392 IonicContact NH2-OD2 3.89Å; R379-D392 PolarHBondContact NH2-OD2 3.19Å; R379-D392 PolarHBondContact O-N 3.38Å; D392-N410 PolarHBondContact OD1-ND2 2.77Å; D392-N410 VanDerWaalsContact OD1-ND2 3.13Å; D392-H427 IonicContact OD2-NE2 2.98Å
393	I	91	Very high	87	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.9	-173.6	-53.6	-54.6	0	0	0	110.2	V364 V368 I377 Y396 N410 I411 I413	V364-I393 HydrophobicContact CG1-CD1 3.97Å; V368-I393 HydrophobicContact CB-CG2 4.09Å; V368-I393 HydrophobicContact CG1-CB 4.42Å; V368-I393 HydrophobicContact CG1-CD1 3.94Å; V368-I393 HydrophobicContact CG1-CG1 3.88Å; V368-I393 HydrophobicContact CG1-CG2 3.69Å; I377-I393 HydrophobicContact CG1-CD1 4.5Å; I393-Y396 HydrophobicContact CG2-CD1 4.4Å; I393-N410 WeakPolarHBondContact O-CB 3.39Å; I393-N410 PolarHBondContact O-ND2 3.14Å; I393-I411 HydrophobicContact CB-CG1 3.94Å; I393-I411 HydrophobicContact CG1-CG1 4.19Å; I393-I411 HydrophobicContact CG2-CG1 4.5Å; I393-I411 PolarHBondContact N-O 3Å; I393-I411 VanDerWaalsContact N-O 3.09Å; I393-I413 HydrophobicContact CD1-CG1 4.19Å; I393-I413 HydrophobicContact CG1-CG1 3.88Å
394	A	87.2	Confident	87.2	Confident	19 Å²	19	40.6 Å²	40.6	16%	0.157	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	156.3	169.4	0	0	0	0	0	111.1	G375 S376 R378 Y396	G375-A394 WeakPolarHBondContact CA-O 3.22Å; S376-A394 PolarHBondContact N-O 3.19Å; S376-A394 PolarHBondContact O-N 3.23Å; R378-A394 HydrophobicContact CB-CB 3.82Å; R378-A394 HydrophobicContact CG-CB 4.26Å; A394-Y396 PolarHBondContact O-N 3.22Å
395	K	86.3	Confident	87.4	Confident	155 Å²	155	43.8 Å²	43.8	67%	0.674	21%	0.212	S	C	*	.	S	Bend	trans	60.7	2.7	176.1	-56.6	178.6	-179.3	177.1	0	115.6	V373	V373-K395 VanDerWaalsContact CG1-O 3.22Å; V373-K395 WeakPolarHBondContact CG1-O 3.4Å
396	Y	87.6	Confident	87.6	Confident	14 Å²	14	43.2 Å²	43.2	6%	0.055	21%	0.208	C	C	.	.			trans	-139.2	120	174.5	-175.8	-94	0	0	0	109	V368 K370 V373 G375 I393 A394 W398 F405 I411	V368-Y396 HydrophobicContact CB-CD1 3.79Å; V368-Y396 HydrophobicContact CB-CE1 4.24Å; V368-Y396 HydrophobicContact CB-CG 3.99Å; V368-Y396 HydrophobicContact CG1-CD1 3.97Å; V368-Y396 HydrophobicContact CG1-CE1 4.36Å; V368-Y396 WeakPolarHBondContact O-CD2 3.13Å; K370-Y396 HydrophobicContact CB-CE2 3.76Å; K370-Y396 WeakPolarHBondContact CB-OH 3.45Å; V373-Y396 HydrophobicContact CB-CD2 4.45Å; V373-Y396 HydrophobicContact CG1-CD2 4.08Å; G375-Y396 VanDerWaalsContact CA-CB 3.45Å; I393-Y396 HydrophobicContact CG2-CD1 4.4Å; A394-Y396 PolarHBondContact O-N 3.22Å; Y396-W398 HydrophobicContact CE1-CB 3.83Å; Y396-W398 HydrophobicContact CE2-CB 4.28Å; Y396-F405 HydrophobicContact CD2-CE1 4.23Å; Y396-F405 HydrophobicContact CE2-CE1 4.24Å; Y396-F405 HydrophobicContact CE2-CZ 4.48Å; Y396-I411 HydrophobicContact CD1-CD1 3.7Å; Y396-I411 HydrophobicContact CE1-CD1 3.91Å
397	R	89.8	Confident	87.6	Confident	87 Å²	87	50 Å²	50	33%	0.328	24%	0.235	S	C	.	.			trans	-131	23	-170.4	-59.9	-175.1	177.8	113.1	1.6	113.1	C399 F405 H406 S408 N409 N410	R397-C399 PolarHBondContact O-N 3.34Å; R397-F405 HydrophobicContact CB-CD1 4.44Å; R397-F405 WeakPolarHBondContact O-CA 3.34Å; R397-H406 HydrophobicContact CB-CB 4.28Å; R397-H406 PolarHBondContact O-N 3.26Å; R397-S408 PolarHBondContact NE-O 2.77Å; R397-N409 VanDerWaalsContact CD-O 3.31Å; R397-N409 WeakPolarHBondContact CD-O 3.42Å; R397-N410 PolarHBondContact NE-OD1 3.08Å; R397-N410 VanDerWaalsContact NE-OD1 3.09Å
398	W	89.8	Confident	87.5	Confident	54 Å²	54	53.9 Å²	53.9	21%	0.205	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	122.5	-179.8	-178.6	-103.3	0	0	0	110	K370 Y396 S403 R404 F405 Q424	K370-W398 HydrophobicContact CD-CD2 4.45Å; K370-W398 HydrophobicContact CD-CG 4.49Å; Y396-W398 HydrophobicContact CE1-CB 3.83Å; Y396-W398 HydrophobicContact CE2-CB 4.28Å; W398-S403 WeakPolarHBondContact CH2-O 3.15Å; W398-S403 VanDerWaalsContact CZ2-C 3.47Å; W398-S403 WeakPolarHBondContact CZ2-O 3.41Å; W398-R404 VanDerWaalsContact CE3-C 3.45Å; W398-R404 HydrophobicContact CZ3-CB 4.45Å; W398-F405 HydrophobicContact CB-CD1 4.02Å; W398-F405 HydrophobicContact CB-CE1 3.73Å; W398-F405 HydrophobicContact CB-CZ 4.11Å; W398-F405 HydrophobicContact CD2-CE2 4.41Å; W398-F405 HydrophobicContact CE3-CD1 4.31Å; W398-F405 AromaticContact CE3-CD2 3.39Å; W398-F405 HydrophobicContact CE3-CD2 3.39Å; W398-F405 HydrophobicContact CE3-CE1 4.32Å; W398-F405 AromaticContact CE3-CE2 3.39Å; W398-F405 HydrophobicContact CE3-CE2 3.39Å; W398-F405 AromaticContact CE3-CG 3.86Å; W398-F405 HydrophobicContact CE3-CG 3.86Å; W398-F405 AromaticContact CE3-CZ 3.88Å; W398-F405 HydrophobicContact CE3-CZ 3.88Å; W398-F405 AromaticContact CZ3-CD2 3.75Å; W398-F405 HydrophobicContact CZ3-CD2 3.75Å; W398-F405 AromaticContact CZ3-CE2 3.83Å; W398-F405 HydrophobicContact CZ3-CE2 3.83Å; W398-Q424 PolarHBondContact O-NE2 3.02Å
399	C	89.4	Confident	87.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.9	178.5	172.4	0	0	0	0	111	R397 N401 V402 S403 R404 H406 C426	R397-C399 PolarHBondContact O-N 3.34Å; C399-N401 WeakPolarHBondContact SG-CB 2.96Å; C399-N401 PolarHBondContact SG-N 3.26Å; C399-N401 VanDerWaalsContact SG-N 3.38Å; C399-V402 HydrophobicContact CB-CG2 3.72Å; C399-S403 VanDerWaalsContact O-CA 3.25Å; C399-S403 WeakPolarHBondContact O-CA 3.48Å; C399-S403 PolarHBondContact O-N 2.9Å; C399-R404 PolarHBondContact N-O 2.61Å; C399-R404 PolarHBondContact O-N 3.44Å; C399-H406 WeakPolarHBondContact CB-CD2 3.47Å; C399-H406 WeakPolarHBondContact CB-NE2 3.16Å; C399-H406 PolarHBondContact SG-NE2 2.84Å; C399-H406 VanDerWaalsContact SG-NE2 3.36Å; C399-C426 PolarHBondContact SG-SG 2.83Å
400	E	88.2	Confident	87.2	Confident	76 Å²	76	56.3 Å²	56.3	36%	0.355	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-36.2	178.1	-171.1	176.1	175.2	0	0	111.9	V402 S403 F434 S436	E400-V402 PolarHBondContact O-N 3.4Å; E400-S403 PolarHBondContact O-N 2.92Å; E400-S403 PolarHBondContact O-OG 3.44Å; E400-F434 HydrophobicContact CB-CE1 4.49Å; E400-F434 HydrophobicContact CB-CZ 4.01Å; E400-S436 WeakPolarHBondContact OE2-CB 3.07Å
401	N	87.4	Confident	87.2	Confident	78 Å²	78	56 Å²	56	42%	0.417	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-48.8	178.5	-164.1	28.5	0	0	0	112.9	C399 C431 F434	C399-N401 WeakPolarHBondContact SG-CB 2.96Å; C399-N401 PolarHBondContact SG-N 3.26Å; C399-N401 VanDerWaalsContact SG-N 3.38Å; N401-C431 PolarHBondContact ND2-SG 3.39Å; N401-C431 VanDerWaalsContact ND2-SG 3.37Å; N401-F434 HydrophobicContact CB-CB 4.22Å; N401-F434 HydrophobicContact CB-CD1 3.68Å; N401-F434 HydrophobicContact CB-CD2 3.33Å; N401-F434 HydrophobicContact CB-CE1 3.77Å; N401-F434 HydrophobicContact CB-CE2 3.43Å; N401-F434 VanDerWaalsContact CB-CE2 3.43Å; N401-F434 HydrophobicContact CB-CG 3.45Å; N401-F434 VanDerWaalsContact CB-CG 3.45Å; N401-F434 HydrophobicContact CB-CZ 3.65Å; N401-F434 VanDerWaalsContact N-CZ 3.28Å; N401-F434 WeakPolarHBondContact OD1-CD2 3.11Å
402	V	87.2	Confident	87.3	Confident	52 Å²	52	57.3 Å²	57.3	32%	0.315	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-1.4	-177.6	-63.8	0	0	0	0	112.4	C399 E400 R404	C399-V402 HydrophobicContact CB-CG2 3.72Å; E400-V402 PolarHBondContact O-N 3.4Å; V402-R404 HydrophobicContact CB-CG 4.09Å; V402-R404 HydrophobicContact CG2-CG 3.65Å; V402-R404 PolarHBondContact O-N 3.37Å; V402-R404 VanDerWaalsContact O-N 3.15Å
403	S	88.8	Confident	87.4	Confident	85 Å²	85	57.2 Å²	57.2	59%	0.594	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	39.6	-177.2	-66.7	0	0	0	0	113.5	W398 C399 E400	W398-S403 WeakPolarHBondContact CH2-O 3.15Å; W398-S403 VanDerWaalsContact CZ2-C 3.47Å; W398-S403 WeakPolarHBondContact CZ2-O 3.41Å; C399-S403 VanDerWaalsContact O-CA 3.25Å; C399-S403 WeakPolarHBondContact O-CA 3.48Å; C399-S403 PolarHBondContact O-N 2.9Å; E400-S403 PolarHBondContact O-N 2.92Å; E400-S403 PolarHBondContact O-OG 3.44Å
404	R	88.4	Confident	87.4	Confident	129 Å²	129	57.2 Å²	57.2	49%	0.487	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	167.2	177.9	66.6	-180	177.7	79.8	1.3	112.2	W398 C399 V402	W398-R404 VanDerWaalsContact CE3-C 3.45Å; W398-R404 HydrophobicContact CZ3-CB 4.45Å; C399-R404 PolarHBondContact N-O 2.61Å; C399-R404 PolarHBondContact O-N 3.44Å; V402-R404 HydrophobicContact CB-CG 4.09Å; V402-R404 HydrophobicContact CG2-CG 3.65Å; V402-R404 PolarHBondContact O-N 3.37Å; V402-R404 VanDerWaalsContact O-N 3.15Å
405	F	87.3	Confident	87.4	Confident	71 Å²	71	56.3 Å²	56.3	31%	0.311	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.6	170.4	-70	-86.9	0	0	0	111.6	V373 Y396 R397 W398	V373-F405 HydrophobicContact CG2-CZ 4.5Å; Y396-F405 HydrophobicContact CD2-CE1 4.23Å; Y396-F405 HydrophobicContact CE2-CE1 4.24Å; Y396-F405 HydrophobicContact CE2-CZ 4.48Å; R397-F405 HydrophobicContact CB-CD1 4.44Å; R397-F405 WeakPolarHBondContact O-CA 3.34Å; W398-F405 HydrophobicContact CB-CD1 4.02Å; W398-F405 HydrophobicContact CB-CE1 3.73Å; W398-F405 HydrophobicContact CB-CZ 4.11Å; W398-F405 HydrophobicContact CD2-CE2 4.41Å; W398-F405 HydrophobicContact CE3-CD1 4.31Å; W398-F405 AromaticContact CE3-CD2 3.39Å; W398-F405 HydrophobicContact CE3-CD2 3.39Å; W398-F405 HydrophobicContact CE3-CE1 4.32Å; W398-F405 AromaticContact CE3-CE2 3.39Å; W398-F405 HydrophobicContact CE3-CE2 3.39Å; W398-F405 AromaticContact CE3-CG 3.86Å; W398-F405 HydrophobicContact CE3-CG 3.86Å; W398-F405 AromaticContact CE3-CZ 3.88Å; W398-F405 HydrophobicContact CE3-CZ 3.88Å; W398-F405 AromaticContact CZ3-CD2 3.75Å; W398-F405 HydrophobicContact CZ3-CD2 3.75Å; W398-F405 AromaticContact CZ3-CE2 3.83Å; W398-F405 HydrophobicContact CZ3-CE2 3.83Å
406	H	85.8	Confident	87.5	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.046	25%	0.245	C	C	.	.			trans	-70.4	146.2	165.5	-71.3	-78.1	0	0	0	110.7	R397 C399 N409 D428	R397-H406 HydrophobicContact CB-CB 4.28Å; R397-H406 PolarHBondContact O-N 3.26Å; C399-H406 WeakPolarHBondContact CB-CD2 3.47Å; C399-H406 WeakPolarHBondContact CB-NE2 3.16Å; C399-H406 PolarHBondContact SG-NE2 2.84Å; C399-H406 VanDerWaalsContact SG-NE2 3.36Å; H406-N409 HydrophobicContact CB-CB 4.49Å; H406-N409 WeakPolarHBondContact CB-O 3.21Å; H406-D428 WeakPolarHBondContact CE1-CB 3.5Å; H406-D428 VanDerWaalsContact CE1-CG 3.48Å; H406-D428 IonicContact CE1-OD2 2.79Å; H406-D428 PolarHBondContact CE1-OD2 2.8Å; H406-D428 IonicContact CG-OD2 3.6Å; H406-D428 IonicContact ND1-OD2 3.61Å; H406-D428 PolarHBondContact ND1-OD2 3.4Å
407	K	81.3	Confident	87.1	Confident	193 Å²	193	49.6 Å²	49.6	84%	0.839	24%	0.244	S	C	*	.	S	Bend	trans	-71	-41.5	-179.6	-68.3	-176.9	178.6	179.4	0	112.2
408	S	78.4	Confident	86.5	Confident	83 Å²	83	49 Å²	49	58%	0.58	24%	0.244	S	C	*	.	S	Bend	trans	-132	-37	-171.5	50.1	0	0	0	0	113.9	R397	R397-S408 PolarHBondContact NE-O 2.77Å
409	N	83.6	Confident	86.1	Confident	48 Å²	48	52 Å²	52	26%	0.257	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-78.4	134.1	-174.8	-65.2	-47.2	0	0	0	112.1	R397 H406 H427 D428	R397-N409 VanDerWaalsContact CD-O 3.31Å; R397-N409 WeakPolarHBondContact CD-O 3.42Å; H406-N409 HydrophobicContact CB-CB 4.49Å; H406-N409 WeakPolarHBondContact CB-O 3.21Å; N409-H427 HydrophobicContact CB-CB 4.4Å; N409-D428 HydrophobicContact CB-CB 3.99Å; N409-D428 PolarHBondContact ND2-OD2 2.76Å
410	N	85.6	Confident	85.9	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.08	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-76.3	162	175.2	-72	-4.7	0	0	0	111.4	R378 D392 I393 R397 H427	R378-N410 PolarHBondContact NH1-ND2 2.79Å; D392-N410 PolarHBondContact OD1-ND2 2.77Å; D392-N410 VanDerWaalsContact OD1-ND2 3.13Å; I393-N410 WeakPolarHBondContact O-CB 3.39Å; I393-N410 PolarHBondContact O-ND2 3.14Å; R397-N410 PolarHBondContact NE-OD1 3.08Å; R397-N410 VanDerWaalsContact NE-OD1 3.09Å; N410-H427 WeakPolarHBondContact O-CB 3.24Å; N410-H427 PolarHBondContact O-CD2 3.12Å; N410-H427 PolarHBondContact O-N 3.21Å; N410-H427 VanDerWaalsContact O-N 3.09Å
411	I	89.6	Confident	85.9	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	161.3	169.7	65.8	162.7	0	0	0	110.3	I393 Y396 I413	I393-I411 HydrophobicContact CB-CG1 3.94Å; I393-I411 HydrophobicContact CG1-CG1 4.19Å; I393-I411 HydrophobicContact CG2-CG1 4.5Å; I393-I411 PolarHBondContact N-O 3Å; I393-I411 VanDerWaalsContact N-O 3.09Å; Y396-I411 HydrophobicContact CD1-CD1 3.7Å; Y396-I411 HydrophobicContact CE1-CD1 3.91Å; I411-I413 HydrophobicContact CD1-CD1 4.34Å
412	M	90.9	Very high	86.2	Confident	28 Å²	28	49.2 Å²	49.2	14%	0.138	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139	170.8	-65.1	173.7	-79.6	0	0	109.4	V390 Y391 Q424 K425 H427	V390-M412 HydrophobicContact CG1-SD 4.43Å; Y391-M412 CarbonylContact O-C 3.5Å; Y391-M412 WeakPolarHBondContact O-CA 2.91Å; M412-Q424 WeakPolarHBondContact O-CA 3.37Å; M412-K425 HydrophobicContact CB-CB 4.33Å; M412-K425 HydrophobicContact CE-CB 3.86Å; M412-K425 PolarHBondContact N-O 3.13Å; M412-K425 PolarHBondContact O-N 3.43Å; M412-H427 VanDerWaalsContact CG-NE2 3.27Å; M412-H427 WeakPolarHBondContact CG-NE2 2.97Å; M412-H427 PolarHBondContact SD-CE1 2.64Å
413	I	91.5	Very high	86.5	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.7	165	-59.7	-61.2	0	0	0	106.9	V364 L367 V368 Y391 I393 I411 V415 W422 Q424	V364-I413 HydrophobicContact CG2-CG2 4.33Å; L367-I413 HydrophobicContact CD1-CG2 4.12Å; V368-I413 HydrophobicContact CG1-CG1 4.35Å; Y391-I413 PolarHBondContact N-O 3.4Å; Y391-I413 PolarHBondContact O-N 3.38Å; I393-I413 HydrophobicContact CD1-CG1 4.19Å; I393-I413 HydrophobicContact CG1-CG1 3.88Å; I411-I413 HydrophobicContact CD1-CD1 4.34Å; I413-V415 HydrophobicContact CG2-CG2 4.41Å; I413-W422 HydrophobicContact CD1-CE3 4.36Å; I413-W422 HydrophobicContact CD1-CZ3 4.01Å; I413-W422 HydrophobicContact CG2-CE3 4.09Å; I413-Q424 HydrophobicContact CD1-CB 4.34Å; I413-Q424 HydrophobicContact CD1-CG 4.42Å
414	V	90.6	Very high	86.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.5	177.1	-174.9	0	0	0	0	107.9	L388 V390 W422 Y423 K425	L388-V414 HydrophobicContact CD2-CG1 4.3Å; V390-V414 HydrophobicContact CG1-CG2 4.3Å; V390-V414 HydrophobicContact CG2-CG1 4.09Å; V390-V414 HydrophobicContact CG2-CG2 4.3Å; V414-W422 CarbonylContact O-C 3.58Å; V414-W422 WeakPolarHBondContact O-CA 3.32Å; V414-W422 WeakPolarHBondContact O-CB 3.37Å; V414-Y423 HydrophobicContact CB-CD2 3.98Å; V414-Y423 HydrophobicContact CB-CE1 4.12Å; V414-Y423 HydrophobicContact CB-CE2 3.53Å; V414-Y423 HydrophobicContact CB-CG 4.46Å; V414-Y423 HydrophobicContact CG1-CE1 3.93Å; V414-Y423 HydrophobicContact CG1-CE2 3.89Å; V414-Y423 VanDerWaalsContact CG1-CZ 3.45Å; V414-Y423 WeakPolarHBondContact CG1-OH 3.29Å; V414-Y423 HydrophobicContact CG2-CD2 4.31Å; V414-Y423 HydrophobicContact CG2-CE2 3.76Å; V414-Y423 PolarHBondContact N-O 2.7Å; V414-Y423 PolarHBondContact O-N 3.29Å; V414-K425 HydrophobicContact CG2-CD 4.44Å
415	V	88.4	Confident	86.8	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.6	173.7	176.5	0	0	0	0	107.8	V360 V364 L388 L389 Y391 I413 L417 W422 L441	V360-V415 HydrophobicContact CG1-CB 4.45Å; V360-V415 HydrophobicContact CG1-CG1 4.12Å; V360-V415 HydrophobicContact CG1-CG2 4.09Å; V364-V415 HydrophobicContact CG2-CG2 4.27Å; L388-V415 WeakPolarHBondContact CA-O 3.15Å; L389-V415 HydrophobicContact CB-CB 4.22Å; L389-V415 PolarHBondContact N-O 3.32Å; L389-V415 PolarHBondContact O-N 2.8Å; Y391-V415 HydrophobicContact CD2-CG2 4.36Å; Y391-V415 HydrophobicContact CE2-CG2 4.08Å; I413-V415 HydrophobicContact CG2-CG2 4.41Å; V415-L417 HydrophobicContact CG1-CD2 3.79Å; V415-L417 HydrophobicContact CG1-CG 4.39Å; V415-W422 HydrophobicContact CG2-CB 4.18Å; V415-L441 HydrophobicContact CG1-CD1 3.8Å; V415-L441 HydrophobicContact CG1-CD2 3.93Å
416	D	87.9	Confident	86.8	Confident	20 Å²	20	37 Å²	37	11%	0.107	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	99.4	175.8	-168.8	-34.3	0	0	0	107.9	L388 K418 E419 E420 V421	L388-D416 HydrophobicContact CD2-CB 3.68Å; D416-K418 PolarHBondContact O-N 2.94Å; D416-K418 WeakPolarHBondContact OD1-CB 3.44Å; D416-K418 PolarHBondContact OD1-N 2.71Å; D416-E419 PolarHBondContact OD1-N 2.55Å; D416-E420 WeakPolarHBondContact O-CA 3.43Å; D416-E420 PolarHBondContact O-N 3.41Å; D416-V421 WeakPolarHBondContact CA-O 3.16Å; D416-V421 HydrophobicContact CB-CG2 3.94Å; D416-V421 WeakPolarHBondContact CB-O 3.14Å; D416-V421 PolarHBondContact N-O 3.23Å; D416-V421 PolarHBondContact O-N 3.04Å; D416-V421 VanDerWaalsContact O-N 3.12Å
417	L	80.4	Confident	86.6	Confident	9 Å²	9	40.2 Å²	40.2	5%	0.047	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.3	-177.3	-61.5	174.5	0	0	0	111.8	Y382 Q387 V415	Y382-L417 HydrophobicContact CE2-CD1 4.33Å; Q387-L417 HydrophobicContact CB-CB 4.4Å; Q387-L417 WeakPolarHBondContact O-CB 2.92Å; Q387-L417 PolarHBondContact O-N 2.96Å; V415-L417 HydrophobicContact CG1-CD2 3.79Å; V415-L417 HydrophobicContact CG1-CG 4.39Å
418	K	76.6	Confident	86.6	Confident	73 Å²	73	32 Å²	32	32%	0.317	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-53.9	179.4	148.5	151.9	-162.9	-157.6	0	111.2	K57 Q387 D416 E420	K57-K418 VanDerWaalsContact O-CA 3.31Å; K57-K418 WeakPolarHBondContact O-CA 3.49Å; K57-K418 WeakPolarHBondContact O-CB 3.25Å; K57-K418 WeakPolarHBondContact O-CD 3.47Å; K57-K418 WeakPolarHBondContact O-CE 3.31Å; K57-K418 WeakPolarHBondContact O-CG 2.99Å; Q387-K418 HydrophobicContact CB-CB 4.25Å; D416-K418 PolarHBondContact O-N 2.94Å; D416-K418 WeakPolarHBondContact OD1-CB 3.44Å; D416-K418 PolarHBondContact OD1-N 2.71Å; K418-E420 VanDerWaalsContact C-N 3.26Å
419	E	81.5	Confident	86.6	Confident	119 Å²	119	32.7 Å²	32.7	56%	0.556	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.7	179.5	-60.6	-57.9	138.1	0	0	112.4	D416 V421	D416-E419 PolarHBondContact OD1-N 2.55Å; E419-V421 VanDerWaalsContact C-N 3.25Å; E419-V421 HydrophobicContact CB-CG2 3.86Å; E419-V421 PolarHBondContact O-N 3.26Å
420	E	83.8	Confident	86.5	Confident	29 Å²	29	37.4 Å²	37.4	14%	0.136	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	40.1	-176.7	-60.6	177.8	144.4	0	0	112.6	K57 D416 K418 L441 S448	K57-E420 VanDerWaalsContact CE-OE2 3.29Å; K57-E420 WeakPolarHBondContact CE-OE2 3.33Å; K57-E420 IonicContact NZ-OE1 3.84Å; K57-E420 IonicContact NZ-OE2 2.71Å; K57-E420 PolarHBondContact NZ-OE2 3.42Å; D416-E420 WeakPolarHBondContact O-CA 3.43Å; D416-E420 PolarHBondContact O-N 3.41Å; K418-E420 VanDerWaalsContact C-N 3.26Å; E420-L441 WeakPolarHBondContact O-CG 3.39Å; E420-L441 PolarHBondContact O-N 3.22Å; E420-S448 WeakPolarHBondContact OE1-CB 3.27Å; E420-S448 PolarHBondContact OE1-N 3.39Å; E420-S448 PolarHBondContact OE1-OG 3.1Å; E420-S448 PolarHBondContact OE2-OG 3.18Å
421	V	89.6	Confident	86.2	Confident	26 Å²	26	36.8 Å²	36.8	16%	0.158	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	164.3	178.9	-61.9	0	0	0	0	111.7	D416 E419 F439	D416-V421 WeakPolarHBondContact CA-O 3.16Å; D416-V421 HydrophobicContact CB-CG2 3.94Å; D416-V421 WeakPolarHBondContact CB-O 3.14Å; D416-V421 PolarHBondContact N-O 3.23Å; D416-V421 PolarHBondContact O-N 3.04Å; D416-V421 VanDerWaalsContact O-N 3.12Å; E419-V421 VanDerWaalsContact C-N 3.25Å; E419-V421 HydrophobicContact CB-CG2 3.86Å; E419-V421 PolarHBondContact O-N 3.26Å; V421-F439 CarbonylContact C-O 3.54Å; V421-F439 WeakPolarHBondContact CA-O 3.2Å; V421-F439 VanDerWaalsContact CB-O 3.25Å; V421-F439 WeakPolarHBondContact CB-O 3.38Å
422	W	93.4	Very high	85.4	Confident	39 Å²	39	46.9 Å²	46.9	15%	0.148	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	157.8	167.6	71.3	-81.5	0	0	0	111	F363 L367 I413 V414 V415 F439 L441	F363-W422 AromaticContact CE1-CD1 3.72Å; F363-W422 HydrophobicContact CE1-CG 4.05Å; F363-W422 AromaticContact CZ-CD1 3.58Å; F363-W422 HydrophobicContact CZ-CG 4.26Å; F363-W422 AromaticContact CZ-NE1 3.52Å; L367-W422 HydrophobicContact CD1-CD2 3.57Å; L367-W422 HydrophobicContact CD1-CE3 3.69Å; L367-W422 HydrophobicContact CD1-CG 4.19Å; L367-W422 HydrophobicContact CD1-CH2 4.01Å; L367-W422 HydrophobicContact CD1-CZ2 3.91Å; L367-W422 HydrophobicContact CD1-CZ3 3.91Å; L367-W422 HydrophobicContact CD2-CH2 3.93Å; L367-W422 HydrophobicContact CD2-CZ2 3.46Å; L367-W422 VanDerWaalsContact CD2-CZ2 3.46Å; L367-W422 HydrophobicContact CG-CH2 4.47Å; L367-W422 HydrophobicContact CG-CZ2 4.3Å; I413-W422 HydrophobicContact CD1-CE3 4.36Å; I413-W422 HydrophobicContact CD1-CZ3 4.01Å; I413-W422 HydrophobicContact CG2-CE3 4.09Å; V414-W422 CarbonylContact O-C 3.58Å; V414-W422 WeakPolarHBondContact O-CA 3.32Å; V414-W422 WeakPolarHBondContact O-CB 3.37Å; V415-W422 HydrophobicContact CG2-CB 4.18Å; W422-F439 VanDerWaalsContact CD1-O 3.3Å; W422-F439 HydrophobicContact CD2-CB 4.33Å; W422-F439 HydrophobicContact CD2-CD2 4.47Å; W422-F439 HydrophobicContact CG-CB 4.48Å; W422-F439 HydrophobicContact CH2-CD2 4.01Å; W422-F439 HydrophobicContact CH2-CE2 4.42Å; W422-F439 HydrophobicContact CZ2-CB 4.02Å; W422-F439 AromaticContact CZ2-CD2 3.82Å; W422-F439 HydrophobicContact CZ2-CD2 3.82Å; W422-F439 HydrophobicContact CZ2-CG 4.05Å; W422-F439 HydrophobicContact CZ3-CD2 4.4Å; W422-F439 PolarHBondContact N-O 3.28Å; W422-F439 PolarHBondContact O-N 3.2Å; W422-L441 HydrophobicContact CB-CD2 3.94Å; W422-L441 HydrophobicContact CG-CD2 4.28Å
423	Y	93.1	Very high	84.8	Confident	8 Å²	8	53.3 Å²	53.3	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	158.4	175	56.3	-91.1	0	0	0	111.5	V414 K425 R435 S436	V414-Y423 HydrophobicContact CB-CD2 3.98Å; V414-Y423 HydrophobicContact CB-CE1 4.12Å; V414-Y423 HydrophobicContact CB-CE2 3.53Å; V414-Y423 HydrophobicContact CB-CG 4.46Å; V414-Y423 HydrophobicContact CG1-CE1 3.93Å; V414-Y423 HydrophobicContact CG1-CE2 3.89Å; V414-Y423 VanDerWaalsContact CG1-CZ 3.45Å; V414-Y423 WeakPolarHBondContact CG1-OH 3.29Å; V414-Y423 HydrophobicContact CG2-CD2 4.31Å; V414-Y423 HydrophobicContact CG2-CE2 3.76Å; V414-Y423 PolarHBondContact N-O 2.7Å; V414-Y423 PolarHBondContact O-N 3.29Å; Y423-K425 HydrophobicContact CD2-CG 4.21Å; Y423-K425 HydrophobicContact CE2-CD 4.06Å; Y423-K425 HydrophobicContact CE2-CG 4.14Å; Y423-R435 HydrophobicContact CD2-CG 3.62Å; Y423-R435 HydrophobicContact CE2-CG 4Å; Y423-R435 HydrophobicContact CG-CG 4.2Å; Y423-S436 WeakPolarHBondContact CA-OG 3.5Å; Y423-S436 WeakPolarHBondContact CB-OG 3.49Å
424	Q	92.7	Very high	84.4	Confident	11 Å²	11	54.8 Å²	54.8	5%	0.051	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	141.4	177.3	-177	-178.1	80.4	0	0	111.5	W398 M412 I413 S436	W398-Q424 PolarHBondContact O-NE2 3.02Å; M412-Q424 WeakPolarHBondContact O-CA 3.37Å; I413-Q424 HydrophobicContact CD1-CB 4.34Å; I413-Q424 HydrophobicContact CD1-CG 4.42Å; Q424-S436 PolarHBondContact N-OG 3.16Å; Q424-S436 PolarHBondContact O-N 3.24Å
425	K	91.2	Very high	84.3	Confident	54 Å²	54	60.5 Å²	60.5	24%	0.235	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	165.1	163.8	-72.7	-175.8	167.2	168.5	0	110.1	M412 V414 Y423	M412-K425 HydrophobicContact CB-CB 4.33Å; M412-K425 HydrophobicContact CE-CB 3.86Å; M412-K425 PolarHBondContact N-O 3.13Å; M412-K425 PolarHBondContact O-N 3.43Å; V414-K425 HydrophobicContact CG2-CD 4.44Å; Y423-K425 HydrophobicContact CD2-CG 4.21Å; Y423-K425 HydrophobicContact CE2-CD 4.06Å; Y423-K425 HydrophobicContact CE2-CG 4.14Å
426	C	87.5	Confident	84.3	Confident	8 Å²	8	60.9 Å²	60.9	5%	0.054	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.6	-180	-66.2	0	0	0	0	111.7	C399 D428 C431	C399-C426 PolarHBondContact SG-SG 2.83Å; C426-D428 VanDerWaalsContact C-N 3.25Å; C426-D428 HydrophobicContact CB-CB 4.46Å; C426-C431 HydrophobicContact CB-CB 3.64Å
427	H	80.9	Confident	84.5	Confident	77 Å²	77	63.8 Å²	63.8	36%	0.356	31%	0.311	S	S	.	.			trans	-81.3	-6.8	170.8	-71.5	-66	0	0	0	113.4	D392 N409 N410 M412	D392-H427 IonicContact OD2-NE2 2.98Å; N409-H427 HydrophobicContact CB-CB 4.4Å; N410-H427 WeakPolarHBondContact O-CB 3.24Å; N410-H427 PolarHBondContact O-CD2 3.12Å; N410-H427 PolarHBondContact O-N 3.21Å; N410-H427 VanDerWaalsContact O-N 3.09Å; M412-H427 VanDerWaalsContact CG-NE2 3.27Å; M412-H427 WeakPolarHBondContact CG-NE2 2.97Å; M412-H427 PolarHBondContact SD-CE1 2.64Å
428	D	81.4	Confident	85	Confident	22 Å²	22	66.2 Å²	66.2	12%	0.118	33%	0.329	C	S	.	.			trans	-68.8	130	-177.9	-159.7	-69.1	0	0	0	111.3	H406 N409 C426 D430 C431 R432	H406-D428 WeakPolarHBondContact CE1-CB 3.5Å; H406-D428 VanDerWaalsContact CE1-CG 3.48Å; H406-D428 IonicContact CE1-OD2 2.79Å; H406-D428 PolarHBondContact CE1-OD2 2.8Å; H406-D428 IonicContact CG-OD2 3.6Å; H406-D428 IonicContact ND1-OD2 3.61Å; H406-D428 PolarHBondContact ND1-OD2 3.4Å; N409-D428 HydrophobicContact CB-CB 3.99Å; N409-D428 PolarHBondContact ND2-OD2 2.76Å; C426-D428 VanDerWaalsContact C-N 3.25Å; C426-D428 HydrophobicContact CB-CB 4.46Å; D428-D430 PolarHBondContact O-N 3.24Å; D428-D430 PolarHBondContact OD1-N 3.24Å; D428-D430 VanDerWaalsContact OD1-N 3.14Å; D428-C431 HydrophobicContact CB-CB 4.18Å; D428-C431 CarbonylContact O-C 3.57Å; D428-C431 WeakPolarHBondContact O-CA 3.34Å; D428-C431 PolarHBondContact O-N 3.15Å; D428-R432 PolarHBondContact O-N 3.1Å
429	P	78.6	Confident	85.6	Confident	96 Å²	96	66 Å²	66	62%	0.623	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-54.4	-36.1	179.7	-27	35	0	0	0	113.7	C431 R432	P429-C431 PolarHBondContact O-N 3.2Å; P429-R432 VanDerWaalsContact O-CB 3.32Å; P429-R432 WeakPolarHBondContact O-CB 3.33Å; P429-R432 PolarHBondContact O-N 3.38Å
430	D	80.4	Confident	86	Confident	147 Å²	147	65.1 Å²	65.1	79%	0.786	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-70.8	-16.7	179.2	-62.1	-23.1	0	0	0	111.8	D428	D428-D430 PolarHBondContact O-N 3.24Å; D428-D430 PolarHBondContact OD1-N 3.24Å; D428-D430 VanDerWaalsContact OD1-N 3.14Å
431	C	80.9	Confident	85.9	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.014	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-110.3	15.8	177.7	-60.6	0	0	0	0	112.3	N401 C426 D428 P429 N433 F434	N401-C431 PolarHBondContact ND2-SG 3.39Å; N401-C431 VanDerWaalsContact ND2-SG 3.37Å; C426-C431 HydrophobicContact CB-CB 3.64Å; D428-C431 HydrophobicContact CB-CB 4.18Å; D428-C431 CarbonylContact O-C 3.57Å; D428-C431 WeakPolarHBondContact O-CA 3.34Å; D428-C431 PolarHBondContact O-N 3.15Å; P429-C431 PolarHBondContact O-N 3.2Å; C431-N433 PolarHBondContact O-N 3.38Å; C431-F434 HydrophobicContact CB-CB 4Å; C431-F434 VanDerWaalsContact O-CB 3.26Å; C431-F434 WeakPolarHBondContact O-CB 3.07Å; C431-F434 PolarHBondContact O-N 3.21Å
432	R	71.9	Confident	85.5	Confident	213 Å²	213	65.2 Å²	65.2	80%	0.804	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-35.6	-174.9	-175.9	176.3	-178	176.2	1.2	113.7	D428 P429	D428-R432 PolarHBondContact O-N 3.1Å; P429-R432 VanDerWaalsContact O-CB 3.32Å; P429-R432 WeakPolarHBondContact O-CB 3.33Å; P429-R432 PolarHBondContact O-N 3.38Å
433	N	79.4	Confident	84.4	Confident	163 Å²	163	69 Å²	69	87%	0.872	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	2.8	178.2	-63.4	-24.2	0	0	0	112.8	C431	C431-N433 PolarHBondContact O-N 3.38Å
434	F	83.1	Confident	83.1	Confident	34 Å²	34	74.9 Å²	74.9	15%	0.149	38%	0.383	C	S	.	.			trans	-79.4	133.4	-179.4	174.4	-104.8	0	0	0	111.2	E400 N401 C431	E400-F434 HydrophobicContact CB-CE1 4.49Å; E400-F434 HydrophobicContact CB-CZ 4.01Å; N401-F434 HydrophobicContact CB-CB 4.22Å; N401-F434 HydrophobicContact CB-CD1 3.68Å; N401-F434 HydrophobicContact CB-CD2 3.33Å; N401-F434 HydrophobicContact CB-CE1 3.77Å; N401-F434 HydrophobicContact CB-CE2 3.43Å; N401-F434 VanDerWaalsContact CB-CE2 3.43Å; N401-F434 HydrophobicContact CB-CG 3.45Å; N401-F434 VanDerWaalsContact CB-CG 3.45Å; N401-F434 HydrophobicContact CB-CZ 3.65Å; N401-F434 VanDerWaalsContact N-CZ 3.28Å; N401-F434 WeakPolarHBondContact OD1-CD2 3.11Å; C431-F434 HydrophobicContact CB-CB 4Å; C431-F434 VanDerWaalsContact O-CB 3.26Å; C431-F434 WeakPolarHBondContact O-CB 3.07Å; C431-F434 PolarHBondContact O-N 3.21Å
435	R	87.9	Confident	82.1	Confident	120 Å²	120	75.2 Å²	75.2	45%	0.453	39%	0.385	S	S	.	.			trans	-136.8	126.8	167.2	-178.7	-173.3	175.8	167.8	-1.4	105.7	Y423	Y423-R435 HydrophobicContact CD2-CG 3.62Å; Y423-R435 HydrophobicContact CE2-CG 4Å; Y423-R435 HydrophobicContact CG-CG 4.2Å
436	S	89.3	Confident	80.8	Confident	9 Å²	9	73.3 Å²	73.3	6%	0.063	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-63.9	171.3	173.3	70.9	0	0	0	0	111.2	E400 Y423 Q424	E400-S436 WeakPolarHBondContact OE2-CB 3.07Å; Y423-S436 WeakPolarHBondContact CA-OG 3.5Å; Y423-S436 WeakPolarHBondContact CB-OG 3.49Å; Q424-S436 PolarHBondContact N-OG 3.16Å; Q424-S436 PolarHBondContact O-N 3.24Å
437	S	90.4	Very high	79.5	Confident	80 Å²	80	74.2 Å²	74.2	56%	0.559	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-54.5	149.5	163	-61.1	0	0	0	0	110.7	F439	S437-F439 WeakPolarHBondContact O-CD2 3.22Å; S437-F439 WeakPolarHBondContact O-CE2 3.36Å
438	S	90.8	Very high	78.5	Confident	61 Å²	61	72.3 Å²	72.3	43%	0.427	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-78.9	129.7	170.8	-62.6	0	0	0	0	109.4
439	F	90.2	Very high	77.4	Confident	69 Å²	69	75.9 Å²	75.9	30%	0.303	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142.6	178.7	-61	-81.5	0	0	0	109.9	V421 W422 S437	V421-F439 CarbonylContact C-O 3.54Å; V421-F439 WeakPolarHBondContact CA-O 3.2Å; V421-F439 VanDerWaalsContact CB-O 3.25Å; V421-F439 WeakPolarHBondContact CB-O 3.38Å; W422-F439 VanDerWaalsContact CD1-O 3.3Å; W422-F439 HydrophobicContact CD2-CB 4.33Å; W422-F439 HydrophobicContact CD2-CD2 4.47Å; W422-F439 HydrophobicContact CG-CB 4.48Å; W422-F439 HydrophobicContact CH2-CD2 4.01Å; W422-F439 HydrophobicContact CH2-CE2 4.42Å; W422-F439 HydrophobicContact CZ2-CB 4.02Å; W422-F439 AromaticContact CZ2-CD2 3.82Å; W422-F439 HydrophobicContact CZ2-CD2 3.82Å; W422-F439 HydrophobicContact CZ2-CG 4.05Å; W422-F439 HydrophobicContact CZ3-CD2 4.4Å; W422-F439 PolarHBondContact N-O 3.28Å; W422-F439 PolarHBondContact O-N 3.2Å; S437-F439 WeakPolarHBondContact O-CD2 3.22Å; S437-F439 WeakPolarHBondContact O-CE2 3.36Å
440	P	88.6	Confident	76.4	Confident	100 Å²	100	75.1 Å²	75.1	65%	0.649	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.6	149	-178.9	28.1	-34.9	0	0	0	112.2
441	L	83.1	Confident	75	Confident	14 Å²	14	70.6 Å²	70.6	7%	0.073	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-78.8	149.6	168.8	-63.8	175.3	0	0	0	111	F363 V415 E420 W422 I445	F363-L441 HydrophobicContact CD1-CD2 4.09Å; F363-L441 HydrophobicContact CE1-CD2 3.53Å; F363-L441 HydrophobicContact CZ-CD2 4.27Å; V415-L441 HydrophobicContact CG1-CD1 3.8Å; V415-L441 HydrophobicContact CG1-CD2 3.93Å; E420-L441 WeakPolarHBondContact O-CG 3.39Å; E420-L441 PolarHBondContact O-N 3.22Å; W422-L441 HydrophobicContact CB-CD2 3.94Å; W422-L441 HydrophobicContact CG-CD2 4.28Å; L441-I445 HydrophobicContact CB-CD1 4.25Å; L441-I445 HydrophobicContact CB-CG1 4.15Å; L441-I445 HydrophobicContact CD2-CD1 4.16Å
442	P	81.3	Confident	73.7	Confident	42 Å²	42	75 Å²	75	27%	0.273	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-56.5	140.3	168.9	-23.4	31.4	0	0	0	112.1	F363 E444 I445 C446	F363-P442 HydrophobicContact CD2-CG 3.39Å; F363-P442 HydrophobicContact CE2-CG 3.43Å; F363-P442 VanDerWaalsContact CE2-CG 3.43Å; F363-P442 HydrophobicContact CG-CG 4.13Å; F363-P442 HydrophobicContact CZ-CG 4.2Å; P442-E444 VanDerWaalsContact CB-OE2 3.32Å; P442-E444 WeakPolarHBondContact CB-OE2 3.27Å; P442-E444 PolarHBondContact O-N 3.06Å; P442-I445 HydrophobicContact CB-CG1 4.22Å; P442-I445 HydrophobicContact CG-CD1 4.35Å; P442-I445 HydrophobicContact CG-CG1 4.38Å; P442-I445 WeakPolarHBondContact O-CG1 3.49Å; P442-I445 PolarHBondContact O-N 3.16Å; P442-C446 PolarHBondContact O-N 2.81Å; P442-C446 PolarHBondContact O-SG 3.46Å
443	Q	70.8	Confident	72.6	Confident	119 Å²	119	70.6 Å²	70.6	56%	0.556	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-31	-173.9	-173.4	172	3.8	0	0	112.5	I445 C446 Y449	Q443-I445 PolarHBondContact O-N 2.96Å; Q443-C446 WeakPolarHBondContact O-CB 3.4Å; Q443-C446 PolarHBondContact O-N 3.37Å; Q443-C446 VanDerWaalsContact O-N 3.13Å; Q443-Y449 HydrophobicContact CG-CD1 4.21Å; Q443-Y449 HydrophobicContact CG-CD2 3.93Å; Q443-Y449 HydrophobicContact CG-CG 3.76Å; Q443-Y449 VanDerWaalsContact O-CB 3.29Å; Q443-Y449 WeakPolarHBondContact O-CB 3.39Å; Q443-Y449 WeakPolarHBondContact O-CD1 3.38Å
444	E	64.3	Low	71	Confident	132 Å²	132	68.8 Å²	68.8	62%	0.617	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.4	-179.1	-53.1	76.3	-165.7	0	0	112.7	P442	P442-E444 VanDerWaalsContact CB-OE2 3.32Å; P442-E444 WeakPolarHBondContact CB-OE2 3.27Å; P442-E444 PolarHBondContact O-N 3.06Å
445	I	71.6	Confident	69.2	Low	18 Å²	18	75.6 Å²	75.6	9%	0.092	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-7.8	173.7	72.9	168.7	0	0	0	112.1	E359 F363 L441 P442 Q443 V447	E359-I445 HydrophobicContact CB-CG2 3.86Å; F363-I445 HydrophobicContact CB-CD1 3.7Å; F363-I445 HydrophobicContact CD1-CD1 3.64Å; F363-I445 HydrophobicContact CD2-CD1 4.49Å; F363-I445 HydrophobicContact CE1-CD1 4.39Å; F363-I445 HydrophobicContact CG-CD1 3.68Å; L441-I445 HydrophobicContact CB-CD1 4.25Å; L441-I445 HydrophobicContact CB-CG1 4.15Å; L441-I445 HydrophobicContact CD2-CD1 4.16Å; P442-I445 HydrophobicContact CB-CG1 4.22Å; P442-I445 HydrophobicContact CG-CD1 4.35Å; P442-I445 HydrophobicContact CG-CG1 4.38Å; P442-I445 WeakPolarHBondContact O-CG1 3.49Å; P442-I445 PolarHBondContact O-N 3.16Å; Q443-I445 PolarHBondContact O-N 2.96Å; I445-V447 PolarHBondContact O-N 3.49Å
446	C	64.8	Low	67.2	Low	13 Å²	13	79 Å²	79	9%	0.088	42%	0.419	C	S	.	.			trans	-67.8	117.5	171.8	-71.1	0	0	0	0	108.3	P442 Q443 S448 Y449 I450	P442-C446 PolarHBondContact O-N 2.81Å; P442-C446 PolarHBondContact O-SG 3.46Å; Q443-C446 WeakPolarHBondContact O-CB 3.4Å; Q443-C446 PolarHBondContact O-N 3.37Å; Q443-C446 VanDerWaalsContact O-N 3.13Å; C446-S448 PolarHBondContact O-N 2.94Å; C446-Y449 WeakPolarHBondContact O-CB 3.35Å; C446-Y449 PolarHBondContact O-N 2.92Å; C446-I450 PolarHBondContact O-N 2.85Å
447	V	60.1	Low	65.2	Low	27 Å²	27	82.9 Å²	82.9	16%	0.164	44%	0.439	C	S	.	.	H	α-helix	trans	-72.6	-20	-171.8	-140.5	0	0	0	0	112.1	S55 I445 Y449 I450 L451	S55-V447 VanDerWaalsContact CA-CB 3.41Å; I445-V447 PolarHBondContact O-N 3.49Å; V447-Y449 VanDerWaalsContact C-N 3.29Å; V447-Y449 PolarHBondContact O-N 2.98Å; V447-I450 HydrophobicContact CG1-CD1 4.32Å; V447-I450 PolarHBondContact O-N 3.46Å; V447-L451 PolarHBondContact O-N 2.82Å
448	S	59.2	Low	63.4	Low	38 Å²	38	83.7 Å²	83.7	27%	0.266	43%	0.433	S	S	.	.	H	α-helix	trans	-61	-35.6	168	60	0	0	0	0	113.1	E420 C446 T452	E420-S448 WeakPolarHBondContact OE1-CB 3.27Å; E420-S448 PolarHBondContact OE1-N 3.39Å; E420-S448 PolarHBondContact OE1-OG 3.1Å; E420-S448 PolarHBondContact OE2-OG 3.18Å; C446-S448 PolarHBondContact O-N 2.94Å; S448-T452 PolarHBondContact O-N 2.85Å
449	Y	58.6	Low	61.8	Low	97 Å²	97	82.7 Å²	82.7	38%	0.38	43%	0.429	S	S	.	.	H	α-helix	trans	-71.7	-43.2	176.8	176.8	-111.8	0	0	0	111.4	Q443 C446 V447 L451 T452	Q443-Y449 HydrophobicContact CG-CD1 4.21Å; Q443-Y449 HydrophobicContact CG-CD2 3.93Å; Q443-Y449 HydrophobicContact CG-CG 3.76Å; Q443-Y449 VanDerWaalsContact O-CB 3.29Å; Q443-Y449 WeakPolarHBondContact O-CB 3.39Å; Q443-Y449 WeakPolarHBondContact O-CD1 3.38Å; C446-Y449 WeakPolarHBondContact O-CB 3.35Å; C446-Y449 PolarHBondContact O-N 2.92Å; V447-Y449 VanDerWaalsContact C-N 3.29Å; V447-Y449 PolarHBondContact O-N 2.98Å; Y449-L451 PolarHBondContact O-N 3.23Å; Y449-T452 PolarHBondContact O-N 3.49Å; Y449-T452 VanDerWaalsContact O-N 3.16Å; Y449-T452 PolarHBondContact O-OG1 2.98Å
450	I	57.6	Low	60.3	Low	79 Å²	79	81.9 Å²	81.9	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-58.5	-37.3	177.7	-61.2	173.6	0	0	0	111.2	C446 V447 L453	C446-I450 PolarHBondContact O-N 2.85Å; V447-I450 HydrophobicContact CG1-CD1 4.32Å; V447-I450 PolarHBondContact O-N 3.46Å; I450-L453 WeakPolarHBondContact O-CB 3.46Å; I450-L453 PolarHBondContact O-N 2.82Å
451	L	50.5	Low	59.3	Low	53 Å²	53	81.6 Å²	81.6	28%	0.277	42%	0.417	S	S	.	.	H	α-helix	trans	-74.7	-26.3	179.1	-76.1	-178.3	0	0	0	115.1	F52 S55 V447 Y449 L453 D454	F52-L451 HydrophobicContact CD2-CD1 4.24Å; F52-L451 HydrophobicContact CD2-CD2 4.22Å; F52-L451 HydrophobicContact CE2-CD1 4.18Å; S55-L451 WeakPolarHBondContact OG-CD1 3.35Å; S55-L451 WeakPolarHBondContact OG-CD2 3.23Å; S55-L451 VanDerWaalsContact OG-CG 3.31Å; S55-L451 WeakPolarHBondContact OG-CG 3.47Å; V447-L451 PolarHBondContact O-N 2.82Å; Y449-L451 PolarHBondContact O-N 3.23Å; L451-L453 PolarHBondContact O-N 2.81Å; L451-D454 PolarHBondContact O-N 3.43Å; L451-D454 VanDerWaalsContact O-N 3.13Å
452	T	55.1	Low	58.5	Low	94 Å²	94	82.2 Å²	82.2	58%	0.577	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-8	174.3	55.9	0	0	0	0	112.9	S448 Y449	S448-T452 PolarHBondContact O-N 2.85Å; Y449-T452 PolarHBondContact O-N 3.49Å; Y449-T452 VanDerWaalsContact O-N 3.16Å; Y449-T452 PolarHBondContact O-OG1 2.98Å
453	L	48.2	Very low	57.9	Low	120 Å²	120	83.1 Å²	83.1	63%	0.628	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.5	177.9	-56.4	173.2	0	0	0	113.7	I450 L451	I450-L453 WeakPolarHBondContact O-CB 3.46Å; I450-L453 PolarHBondContact O-N 2.82Å; L451-L453 PolarHBondContact O-N 2.81Å
454	D	46	Very low	57.6	Low	126 Å²	126	84.7 Å²	84.7	67%	0.674	44%	0.435	S	S	*	.			trans	-130.5	60.8	-171.7	-86.4	-14.7	0	0	0	113.3	L451 E456	L451-D454 PolarHBondContact O-N 3.43Å; L451-D454 VanDerWaalsContact O-N 3.13Å; D454-E456 VanDerWaalsContact C-N 3.33Å; D454-E456 PolarHBondContact O-N 3.09Å
455	E	45.6	Very low	57.4	Low	177 Å²	177	82.8 Å²	82.8	83%	0.827	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	8	179.6	-76.2	-164.2	151.6	0	0	116
456	E	45.3	Very low	56.8	Low	191 Å²	191	81.9 Å²	81.9	89%	0.893	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	0.5	-169.7	-68	-167.5	158.5	0	0	117.4	D454 Q458	D454-E456 VanDerWaalsContact C-N 3.33Å; D454-E456 PolarHBondContact O-N 3.09Å; E456-Q458 PolarHBondContact O-N 2.71Å
457	D	46.4	Very low	57.1	Low	90 Å²	90	84.9 Å²	84.9	48%	0.481	44%	0.442	S	S	.	.			trans	-100.5	22.5	-160.5	-108.7	6.2	0	0	0	118.2	A459	D457-A459 PolarHBondContact O-N 2.97Å; D457-A459 VanDerWaalsContact O-N 3.08Å
458	Q	53.2	Low	57.7	Low	97 Å²	97	84.9 Å²	84.9	45%	0.453	44%	0.441	S	S	.	.			trans	-84.2	83	-179.6	-67	-169.4	24.1	0	0	113.9	E456 S471	E456-Q458 PolarHBondContact O-N 2.71Å; Q458-S471 WeakPolarHBondContact O-CB 3.42Å; Q458-S471 PolarHBondContact O-OG 3.18Å
459	A	57.6	Low	58.3	Low	40 Å²	40	88.7 Å²	88.7	33%	0.331	46%	0.455	S	S	.	.			trans	-82.5	-16.4	179.7	0	0	0	0	0	115.6	P44 D457 P470 S471	P44-A459 HydrophobicContact CG-CB 4.4Å; D457-A459 PolarHBondContact O-N 2.97Å; D457-A459 VanDerWaalsContact O-N 3.08Å; A459-P470 CarbonylContact O-C 3.55Å; A459-P470 WeakPolarHBondContact O-CA 3.41Å; A459-S471 PolarHBondContact O-N 3.11Å
460	Y	58.9	Low	58.5	Low	53 Å²	53	88.1 Å²	88.1	21%	0.208	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	142.9	-176	-67.2	-84.1	0	0	0	112.7	P44 I76 E469 P470	P44-Y460 HydrophobicContact CB-CE2 4.07Å; I76-Y460 HydrophobicContact CG2-CD2 4.47Å; I76-Y460 HydrophobicContact CG2-CE2 4.11Å; Y460-E469 WeakPolarHBondContact CA-O 3.29Å; Y460-P470 HydrophobicContact CD1-CB 4.35Å; Y460-P470 HydrophobicContact CD1-CG 4.42Å; Y460-P470 HydrophobicContact CE1-CB 4.19Å; Y460-P470 HydrophobicContact CE1-CG 4Å
461	L	66.4	Low	58.3	Low	93 Å²	93	86.2 Å²	86.2	49%	0.487	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149.1	176.5	-63.7	174.6	0	0	0	110.6	I468 E469	L461-I468 WeakPolarHBondContact O-CA 3.37Å; L461-E469 PolarHBondContact N-O 3.3Å; L461-E469 PolarHBondContact O-N 3.19Å
462	M	68	Low	58.1	Low	27 Å²	27	92.7 Å²	92.7	13%	0.133	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	128	170.4	-174.7	172.5	173.8	0	0	109.3	W40 Y92 L96 N467 I468	W40-M462 HydrophobicContact CH2-SD 4.43Å; W40-M462 HydrophobicContact CZ2-CE 4.16Å; W40-M462 HydrophobicContact CZ2-SD 3.33Å; W40-M462 WeakPolarHBondContact CZ2-SD 3.35Å; W40-M462 PolarHBondContact NE1-SD 3.17Å; Y92-M462 HydrophobicContact CD2-CE 3.77Å; Y92-M462 HydrophobicContact CE2-CE 4.29Å; Y92-M462 HydrophobicContact CG-CE 4.2Å; L96-M462 HydrophobicContact CD1-CE 4.49Å; M462-N467 CarbonylContact C-O 3.55Å; M462-N467 VanDerWaalsContact CA-O 3.24Å; M462-N467 WeakPolarHBondContact CA-O 3.41Å; M462-I468 HydrophobicContact CB-CG1 4.16Å; M462-I468 HydrophobicContact CG-CG1 4.08Å; M462-I468 HydrophobicContact SD-CG1 4.35Å
463	D	67.9	Low	57.2	Low	62 Å²	62	91.4 Å²	91.4	33%	0.332	48%	0.484	S	S	.	.			trans	-79.2	172	178	73.7	21.4	0	0	0	112.7	T465 G466 N467	D463-T465 PolarHBondContact O-N 3.43Å; D463-T465 VanDerWaalsContact OD1-CA 3.27Å; D463-T465 WeakPolarHBondContact OD1-CA 3.4Å; D463-T465 WeakPolarHBondContact OD1-CB 3.35Å; D463-T465 PolarHBondContact OD1-N 2.82Å; D463-T465 PolarHBondContact OD1-OG1 2.76Å; D463-T465 PolarHBondContact OD2-OG1 2.96Å; D463-T465 VanDerWaalsContact OD2-OG1 3.14Å; D463-G466 WeakPolarHBondContact O-CA 3.02Å; D463-G466 PolarHBondContact O-N 2.88Å; D463-G466 PolarHBondContact OD1-N 3.18Å; D463-N467 PolarHBondContact N-O 2.94Å; D463-N467 PolarHBondContact OD1-N 2.91Å; D463-N467 WeakPolarHBondContact OD2-CB 3.48Å; D463-N467 PolarHBondContact OD2-ND2 3.14Å
464	D	64.5	Low	56.3	Low	152 Å²	152	91.7 Å²	91.7	81%	0.813	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.8	-179.2	-64.8	-29	0	0	0	113.4	Y92	Y92-D464 PolarHBondContact OH-O 3.44Å
465	T	60.9	Low	55.4	Low	91 Å²	91	90 Å²	90	56%	0.558	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	0.1	174.5	58	0	0	0	0	112.9	Y92 D463 N467	Y92-T465 WeakPolarHBondContact CD1-O 3.43Å; Y92-T465 WeakPolarHBondContact CE1-O 3.09Å; D463-T465 PolarHBondContact O-N 3.43Å; D463-T465 VanDerWaalsContact OD1-CA 3.27Å; D463-T465 WeakPolarHBondContact OD1-CA 3.4Å; D463-T465 WeakPolarHBondContact OD1-CB 3.35Å; D463-T465 PolarHBondContact OD1-N 2.82Å; D463-T465 PolarHBondContact OD1-OG1 2.76Å; D463-T465 PolarHBondContact OD2-OG1 2.96Å; D463-T465 VanDerWaalsContact OD2-OG1 3.14Å; T465-N467 PolarHBondContact OG1-ND2 3.14Å
466	G	57.6	Low	54.7	Low	0 Å²	0	87.5 Å²	87.5	0%	0	49%	0.494	C	S	.	.			trans	83.3	13.6	176.9	0	0	0	0	0	115.6	S95 D463	S95-G466 WeakPolarHBondContact CB-O 3.31Å; S95-G466 PolarHBondContact OG-O 2.69Å; D463-G466 WeakPolarHBondContact O-CA 3.02Å; D463-G466 PolarHBondContact O-N 2.88Å; D463-G466 PolarHBondContact OD1-N 3.18Å
467	N	71.3	Confident	53.9	Low	75 Å²	75	82.6 Å²	82.6	40%	0.401	48%	0.481	S	S	.	.			trans	-79.5	141.5	173.2	-51.5	-57.8	0	0	0	110.3	M462 D463 T465	M462-N467 CarbonylContact C-O 3.55Å; M462-N467 VanDerWaalsContact CA-O 3.24Å; M462-N467 WeakPolarHBondContact CA-O 3.41Å; D463-N467 PolarHBondContact N-O 2.94Å; D463-N467 PolarHBondContact OD1-N 2.91Å; D463-N467 WeakPolarHBondContact OD2-CB 3.48Å; D463-N467 PolarHBondContact OD2-ND2 3.14Å; T465-N467 PolarHBondContact OG1-ND2 3.14Å
468	I	72.8	Confident	52.8	Low	27 Å²	27	87.2 Å²	87.2	14%	0.138	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	108.3	178.5	-59.3	172.5	0	0	0	110	L42 L65 K67 I76 L96 L461 M462	L42-I468 HydrophobicContact CD1-CB 4.4Å; L42-I468 HydrophobicContact CD1-CD1 4.34Å; L42-I468 HydrophobicContact CD1-CG1 4.23Å; L42-I468 HydrophobicContact CD1-CG2 3.38Å; L42-I468 HydrophobicContact CD2-CD1 4.44Å; L65-I468 HydrophobicContact CD1-CD1 3.42Å; L65-I468 VanDerWaalsContact CD1-CD1 3.42Å; K67-I468 PolarHBondContact NZ-O 2.7Å; I76-I468 HydrophobicContact CD1-CB 4.41Å; I76-I468 HydrophobicContact CD1-CD1 4.24Å; I76-I468 HydrophobicContact CD1-CG2 3.5Å; I76-I468 VanDerWaalsContact CD1-CG2 3.5Å; L96-I468 HydrophobicContact CD2-CD1 4.36Å; L461-I468 WeakPolarHBondContact O-CA 3.37Å; M462-I468 HydrophobicContact CB-CG1 4.16Å; M462-I468 HydrophobicContact CG-CG1 4.08Å; M462-I468 HydrophobicContact SD-CG1 4.35Å
469	E	72.3	Confident	51.5	Low	118 Å²	118	94 Å²	94	55%	0.551	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	154.9	-177.6	-61.6	-159.1	157.2	0	0	111.6	Y460 L461 S471	Y460-E469 WeakPolarHBondContact CA-O 3.29Å; L461-E469 PolarHBondContact N-O 3.3Å; L461-E469 PolarHBondContact O-N 3.19Å; E469-S471 PolarHBondContact O-N 3.45Å
470	P	62.5	Low	50.1	Low	85 Å²	85	98.1 Å²	98.1	55%	0.552	55%	0.546	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.1	137.5	167.9	-16.4	29.1	0	0	0	109.7	A459 Y460 Q472	A459-P470 CarbonylContact O-C 3.55Å; A459-P470 WeakPolarHBondContact O-CA 3.41Å; Y460-P470 HydrophobicContact CD1-CB 4.35Å; Y460-P470 HydrophobicContact CD1-CG 4.42Å; Y460-P470 HydrophobicContact CE1-CB 4.19Å; Y460-P470 HydrophobicContact CE1-CG 4Å; P470-Q472 PolarHBondContact O-N 2.74Å
471	S	53.5	Low	48.5	Very low	39 Å²	39	102 Å²	102	27%	0.273	58%	0.576	S	S	.	*			trans	-55	124.1	167.7	171.1	0	0	0	0	108.1	Q458 A459 E469 A473	Q458-S471 WeakPolarHBondContact O-CB 3.42Å; Q458-S471 PolarHBondContact O-OG 3.18Å; A459-S471 PolarHBondContact O-N 3.11Å; E469-S471 PolarHBondContact O-N 3.45Å; S471-A473 PolarHBondContact O-N 3.24Å; S471-A473 PolarHBondContact OG-N 3.43Å
472	Q	45.3	Very low	46.9	Very low	189 Å²	189	107.5 Å²	107.5	88%	0.883	60%	0.599	S	S	*	*			trans	-71.9	71.3	163.6	-67	-171.1	6.8	0	0	108	P470	P470-Q472 PolarHBondContact O-N 2.74Å
473	A	37.4	Very low	44.9	Very low	67 Å²	67	110.8 Å²	110.8	55%	0.554	63%	0.63	S	S	*	*			trans	-57.7	145.6	147.1	0	0	0	0	0	106.5	S471 S475	S471-A473 PolarHBondContact O-N 3.24Å; S471-A473 PolarHBondContact OG-N 3.43Å; A473-S475 VanDerWaalsContact C-N 3.33Å; A473-S475 PolarHBondContact O-N 2.91Å
474	P	28.2	Very low	42.9	Very low	127 Å²	127	114.3 Å²	114.3	83%	0.825	65%	0.654	S	S	*	*			trans	-58.6	99.4	-178.8	24.1	-31.7	0	0	0	108.6	S476	P474-S476 PolarHBondContact O-N 3.36Å; P474-S476 VanDerWaalsContact O-N 3.14Å
475	S	27.8	Very low	41.7	Very low	91 Å²	91	112.8 Å²	112.8	64%	0.636	65%	0.653	S	S	*	*			trans	-68.6	112.1	159.2	63.4	0	0	0	0	104.5	A473 S477	A473-S475 VanDerWaalsContact C-N 3.33Å; A473-S475 PolarHBondContact O-N 2.91Å; S475-S477 PolarHBondContact O-N 3.2Å
476	S	31	Very low	40	Very low	124 Å²	124	117.2 Å²	117.2	87%	0.867	67%	0.667	S	S	*	*			trans	-57.1	79.6	144.4	55.1	0	0	0	0	106.6	P474 M478	P474-S476 PolarHBondContact O-N 3.36Å; P474-S476 VanDerWaalsContact O-N 3.14Å; S476-M478 PolarHBondContact O-N 3.32Å
477	S	29.3	Very low	39.3	Very low	88 Å²	88	123.3 Å²	123.3	62%	0.615	70%	0.704	S	S	*	*			trans	-79.3	117.6	177	63.5	0	0	0	0	107	S475	S475-S477 PolarHBondContact O-N 3.2Å
478	M	23.4	Very low	37.3	Very low	187 Å²	187	131 Å²	131	92%	0.921	73%	0.728	S	S	*	*			trans	-131.4	104.3	135.3	-67.9	-154.7	97.3	0	0	107.4	S476	S476-M478 PolarHBondContact O-N 3.32Å
479	R	25.5	Very low	35.4	Very low	240 Å²	240	133.1 Å²	133.1	91%	0.906	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-84.8	127.4	156.5	-84.5	-173.7	174.1	-173.1	-1.6	106.8
480	P	28.2	Very low	34	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-79.4	130.3	168.4	-1.6	19.5	0	0	0	109.5
481	T	25.1	Very low	33.1	Very low	136 Å²	136	137.5 Å²	137.5	83%	0.834	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-68.9	141.3	157.8	33.5	0	0	0	0	110	A483	T481-A483 PolarHBondContact O-N 2.81Å
482	E	33	Very low	32.4	Very low	207 Å²	207	142.6 Å²	142.6	97%	0.967	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-51.8	122.3	176.1	-69.2	176	154.6	0	0	112.3
483	A	26.4	Very low	32.3	Very low	96 Å²	96	139.2 Å²	139.2	79%	0.793	78%	0.781	S	S	*	*			trans	-140.1	142.3	154.6	0	0	0	0	0	108	T481	T481-A483 PolarHBondContact O-N 2.81Å
484	T	25.4	Very low	32.7	Very low	136 Å²	136	143.1 Å²	143.1	83%	0.834	79%	0.787	S	S	*	*			trans	-53	161.1	-174	36.1	0	0	0	0	115.7
485	P	38.8	Very low	33.5	Very low	121 Å²	121	143.9 Å²	143.9	79%	0.786	78%	0.78	S	S	*	*			trans	-84.9	123.6	-153.2	33.3	-31.2	0	0	0	112.3
486	E	24.9	Very low	34.2	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	78%	0.781	S	S	*	*			trans	-113.8	113.3	159.4	-79.5	-168	159.3	0	0	109.5	W488	E486-W488 PolarHBondContact O-N 3.49Å
487	V	43.7	Very low	34.9	Very low	129 Å²	129	147.4 Å²	147.4	78%	0.782	77%	0.77	S	S	*	*			trans	-61.9	112.7	172.6	170.5	0	0	0	0	109.3
488	W	28.1	Very low	35.7	Very low	237 Å²	237	148.7 Å²	148.7	90%	0.898	77%	0.77	S	S	*	*			trans	-159.8	124.3	155.4	-74.8	101.5	0	0	0	111.8	E486	E486-W488 PolarHBondContact O-N 3.49Å
489	G	33.2	Very low	36.8	Very low	71 Å²	71	146.6 Å²	146.6	73%	0.732	76%	0.756	S	S	*	*			trans	154.7	94.6	170.3	0	0	0	0	0	111.2
490	D	44.1	Very low	37.8	Very low	124 Å²	124	139.1 Å²	139.1	66%	0.663	74%	0.74	S	S	*	*			trans	-70.8	151.5	-170.7	-82.3	-34.2	0	0	0	113.8	Q492 D493	D490-Q492 PolarHBondContact O-N 3.06Å; D490-D493 PolarHBondContact O-N 3.2Å
491	E	42.7	Very low	38.5	Very low	171 Å²	171	136 Å²	136	80%	0.799	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-3.1	178.8	-64.9	-178.3	151.9	0	0	115.3
492	Q	39.7	Very low	39.4	Very low	146 Å²	146	134 Å²	134	68%	0.682	70%	0.703	S	S	*	*	H	α-helix	trans	-83.1	-29.4	-176.5	-146.4	147.5	2	0	0	112.4	D490 Q495 E496	D490-Q492 PolarHBondContact O-N 3.06Å; Q492-Q495 PolarHBondContact O-N 2.8Å; Q492-E496 PolarHBondContact O-N 3.28Å
493	D	42	Very low	40	Very low	118 Å²	118	127.8 Å²	127.8	63%	0.631	68%	0.677	S	S	*	*	H	α-helix	trans	-75.1	-31.3	179.1	-70.4	-18.2	0	0	0	112.2	D490 Q495 F497	D490-D493 PolarHBondContact O-N 3.2Å; D493-Q495 VanDerWaalsContact C-N 3.34Å; D493-F497 PolarHBondContact O-N 3.42Å
494	E	45.5	Very low	40.7	Very low	149 Å²	149	131.4 Å²	131.4	70%	0.696	68%	0.675	S	S	*	*	H	α-helix	trans	-68.3	-33.3	173.9	-94.1	-172.1	156.3	0	0	112.1	L498	E494-L498 PolarHBondContact O-N 2.93Å; E494-L498 VanDerWaalsContact O-N 3.16Å
495	Q	44.6	Very low	41.3	Very low	142 Å²	142	131.2 Å²	131.2	66%	0.664	66%	0.664	S	S	*	*	H	α-helix	trans	-73.9	-33.6	177.4	-75.5	-173.8	-1.1	0	0	112.8	Q492 D493 K499	Q492-Q495 PolarHBondContact O-N 2.8Å; D493-Q495 VanDerWaalsContact C-N 3.34Å; Q495-K499 VanDerWaalsContact O-CB 3.3Å; Q495-K499 WeakPolarHBondContact O-CB 3.43Å; Q495-K499 PolarHBondContact O-N 2.86Å
496	E	42.5	Very low	41.5	Very low	144 Å²	144	132.9 Å²	132.9	67%	0.673	66%	0.661	S	S	*	*	H	α-helix	trans	-69.5	-37.7	174.6	-81.2	-165	158.2	0	0	112.4	Q492 K499 S500	Q492-E496 PolarHBondContact O-N 3.28Å; E496-K499 PolarHBondContact O-N 3.25Å; E496-S500 WeakPolarHBondContact O-CB 3.43Å; E496-S500 PolarHBondContact O-N 3.24Å
497	F	46	Very low	42.1	Very low	145 Å²	145	133.9 Å²	133.9	64%	0.636	66%	0.658	S	S	*	*	H	α-helix	trans	-64.5	-47.7	175.7	-177.4	-102.1	0	0	0	111.8	D493 K499 S500 V501	D493-F497 PolarHBondContact O-N 3.42Å; F497-K499 VanDerWaalsContact C-N 3.28Å; F497-K499 PolarHBondContact O-N 2.88Å; F497-S500 PolarHBondContact O-N 3.29Å; F497-V501 HydrophobicContact CD1-CG2 4.45Å; F497-V501 HydrophobicContact CE1-CG2 4.1Å; F497-V501 HydrophobicContact CE2-CG2 4.44Å; F497-V501 HydrophobicContact CZ-CG2 4.1Å; F497-V501 WeakPolarHBondContact O-CG2 3.45Å; F497-V501 PolarHBondContact O-N 2.79Å; F497-V501 VanDerWaalsContact O-N 3.07Å
498	L	45.8	Very low	41.8	Very low	115 Å²	115	132.5 Å²	132.5	60%	0.602	65%	0.654	S	S	*	*	H	α-helix	trans	-63.9	-33	177.6	-83.1	160.1	0	0	0	112.7	E494 N502	E494-L498 PolarHBondContact O-N 2.93Å; E494-L498 VanDerWaalsContact O-N 3.16Å; L498-N502 WeakPolarHBondContact O-CB 3.35Å; L498-N502 PolarHBondContact O-N 2.94Å; L498-N502 VanDerWaalsContact O-N 3.17Å
499	K	46.8	Very low	42.1	Very low	143 Å²	143	127.2 Å²	127.2	62%	0.622	65%	0.648	S	S	*	*	H	α-helix	trans	-70.4	-39.2	175.5	-165.6	176.6	-177.4	-177.1	0	112.3	Q495 E496 F497 N502 D503	Q495-K499 VanDerWaalsContact O-CB 3.3Å; Q495-K499 WeakPolarHBondContact O-CB 3.43Å; Q495-K499 PolarHBondContact O-N 2.86Å; E496-K499 PolarHBondContact O-N 3.25Å; F497-K499 VanDerWaalsContact C-N 3.28Å; F497-K499 PolarHBondContact O-N 2.88Å; K499-N502 PolarHBondContact O-N 2.88Å; K499-D503 WeakPolarHBondContact O-CB 3.41Å; K499-D503 PolarHBondContact O-N 3.26Å
500	S	47.5	Very low	42.6	Very low	84 Å²	84	133.1 Å²	133.1	59%	0.587	66%	0.656	S	S	*	*	H	α-helix	trans	-69.4	-34.7	178.5	-143.9	0	0	0	0	112.8	E496 F497 F504	E496-S500 WeakPolarHBondContact O-CB 3.43Å; E496-S500 PolarHBondContact O-N 3.24Å; F497-S500 PolarHBondContact O-N 3.29Å; S500-F504 PolarHBondContact O-N 3.16Å
501	V	43.4	Very low	42.5	Very low	60 Å²	60	133.6 Å²	133.6	36%	0.364	66%	0.657	S	S	.	*	H	α-helix	trans	-69.5	-41.7	174.5	174.7	0	0	0	0	111.3	F497 F504 E505	F497-V501 HydrophobicContact CD1-CG2 4.45Å; F497-V501 HydrophobicContact CE1-CG2 4.1Å; F497-V501 HydrophobicContact CE2-CG2 4.44Å; F497-V501 HydrophobicContact CZ-CG2 4.1Å; F497-V501 WeakPolarHBondContact O-CG2 3.45Å; F497-V501 PolarHBondContact O-N 2.79Å; F497-V501 VanDerWaalsContact O-N 3.07Å; V501-F504 PolarHBondContact O-N 3.1Å; V501-E505 PolarHBondContact O-N 3.26Å; V501-E505 VanDerWaalsContact O-N 3.17Å
502	N	44.1	Very low	42.5	Very low	92 Å²	92	129 Å²	129	49%	0.492	64%	0.644	S	S	.	*	H	α-helix	trans	-68.9	-35.9	177.1	-120.6	-17.2	0	0	0	112.7	L498 K499 F504 E505 Q506	L498-N502 WeakPolarHBondContact O-CB 3.35Å; L498-N502 PolarHBondContact O-N 2.94Å; L498-N502 VanDerWaalsContact O-N 3.17Å; K499-N502 PolarHBondContact O-N 2.88Å; N502-F504 VanDerWaalsContact C-N 3.27Å; N502-F504 PolarHBondContact O-N 2.91Å; N502-E505 PolarHBondContact O-N 3.18Å; N502-Q506 PolarHBondContact O-N 2.99Å; N502-Q506 VanDerWaalsContact O-N 3.12Å
503	D	44.9	Very low	42.6	Very low	78 Å²	78	128 Å²	128	42%	0.417	64%	0.643	S	S	.	*	H	α-helix	trans	-68.1	-26.6	175.7	-80	-9.1	0	0	0	112.4	K499	K499-D503 WeakPolarHBondContact O-CB 3.41Å; K499-D503 PolarHBondContact O-N 3.26Å
504	F	40.7	Very low	42.5	Very low	172 Å²	172	129.9 Å²	129.9	75%	0.754	65%	0.648	S	S	*	*	H	α-helix	trans	-75.5	-41.9	174	-174.4	-100.1	0	0	0	111.9	S500 V501 N502 Q506 R507	S500-F504 PolarHBondContact O-N 3.16Å; V501-F504 PolarHBondContact O-N 3.1Å; N502-F504 VanDerWaalsContact C-N 3.27Å; N502-F504 PolarHBondContact O-N 2.91Å; F504-Q506 VanDerWaalsContact C-N 3.32Å; F504-Q506 PolarHBondContact O-N 3.32Å; F504-R507 PolarHBondContact O-N 2.83Å
505	E	38.9	Very low	42.3	Very low	132 Å²	132	128.1 Å²	128.1	62%	0.617	64%	0.643	S	S	*	*	H	α-helix	trans	-70.4	-25.6	178.2	-72	-173	162.5	0	0	113.3	V501 N502	V501-E505 PolarHBondContact O-N 3.26Å; V501-E505 VanDerWaalsContact O-N 3.17Å; N502-E505 PolarHBondContact O-N 3.18Å
506	Q	42.6	Very low	42	Very low	155 Å²	155	127.2 Å²	127.2	72%	0.724	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-7.2	176.3	-73.7	-175.2	9.9	0	0	115	N502 F504	N502-Q506 PolarHBondContact O-N 2.99Å; N502-Q506 VanDerWaalsContact O-N 3.12Å; F504-Q506 VanDerWaalsContact C-N 3.32Å; F504-Q506 PolarHBondContact O-N 3.32Å
507	R	37.3	Very low	41.8	Very low	205 Å²	205	126.8 Å²	126.8	77%	0.774	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	4.9	-177.8	-75.9	-175.1	-176.8	178.4	5.2	115.3	F504 T509	F504-R507 PolarHBondContact O-N 2.83Å; R507-T509 VanDerWaalsContact C-N 3.29Å; R507-T509 PolarHBondContact O-N 3.02Å
508	S	37.2	Very low	41.5	Very low	100 Å²	100	123.9 Å²	123.9	70%	0.699	64%	0.638	S	S	*	*			trans	-82.9	69	174.6	62.7	0	0	0	0	112
509	T	35.4	Very low	41.2	Very low	126 Å²	126	122.5 Å²	122.5	77%	0.773	64%	0.637	S	S	*	*			trans	-79.6	129	157.3	42.4	0	0	0	0	109.3	R507 I511	R507-T509 VanDerWaalsContact C-N 3.29Å; R507-T509 PolarHBondContact O-N 3.02Å; T509-I511 PolarHBondContact O-N 2.9Å
510	E	43.7	Very low	40.9	Very low	195 Å²	195	119.3 Å²	119.3	91%	0.911	64%	0.637	S	S	*	*			trans	-40.9	126.6	177.9	-69.6	172.4	154.5	0	0	112.3	S512	E510-S512 PolarHBondContact O-N 3.42Å
511	I	41.2	Very low	40.7	Very low	134 Å²	134	118.3 Å²	118.3	69%	0.687	63%	0.634	S	S	*	*			trans	-73	119.5	174.2	-60.2	171.9	0	0	0	107.1	T509 L515	T509-I511 PolarHBondContact O-N 2.9Å; I511-L515 HydrophobicContact CG2-CB 4.24Å; I511-L515 HydrophobicContact CG2-CD1 4.28Å
512	S	43.4	Very low	40.7	Very low	75 Å²	75	122.1 Å²	122.1	52%	0.524	65%	0.653	S	S	.	*			trans	-65.3	139.2	179.1	174.4	0	0	0	0	112.2	E510 E514 L515	E510-S512 PolarHBondContact O-N 3.42Å; S512-E514 PolarHBondContact O-N 3.28Å; S512-L515 PolarHBondContact O-N 3.16Å
513	D	40.3	Very low	40.5	Very low	124 Å²	124	126.7 Å²	126.7	66%	0.663	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-15.2	-179	-70.6	-26	0	0	0	114.7	L516	D513-L516 PolarHBondContact O-N 3.48Å
514	E	40.6	Very low	40.3	Very low	158 Å²	158	130.4 Å²	130.4	74%	0.738	69%	0.688	S	S	*	*	H	α-helix	trans	-70.3	-25.4	174.6	-107.7	177.9	164.2	0	0	113.9	S512 T518	S512-E514 PolarHBondContact O-N 3.28Å; E514-T518 PolarHBondContact O-OG1 3.36Å
515	L	40.4	Very low	40.2	Very low	111 Å²	111	130.8 Å²	130.8	58%	0.581	71%	0.712	S	S	*	*	H	α-helix	trans	-78.6	-22.5	176.7	-93.5	157.4	0	0	0	113	I511 S512 T518	I511-L515 HydrophobicContact CG2-CB 4.24Å; I511-L515 HydrophobicContact CG2-CD1 4.28Å; S512-L515 PolarHBondContact O-N 3.16Å; L515-T518 PolarHBondContact O-OG1 3.26Å
516	L	39.1	Very low	40.3	Very low	123 Å²	123	130.8 Å²	130.8	64%	0.644	72%	0.717	S	S	*	*	H	α-helix	trans	-76.7	-27.4	175.2	-81.1	163.2	0	0	0	112.2	D513	D513-L516 PolarHBondContact O-N 3.48Å
517	L	38.8	Very low	40.1	Very low	135 Å²	135	129.5 Å²	129.5	71%	0.707	72%	0.717	S	S	*	*	H	α-helix	trans	-82.2	-20.9	-179.5	-81	157.7	0	0	0	113.8
518	T	40.1	Very low	40.3	Very low	85 Å²	85	125.3 Å²	125.3	52%	0.521	71%	0.714	S	S	.	*	H	α-helix	trans	-83.3	-32.2	177.1	23.4	0	0	0	0	112.7	E514 L515 A520 A521	E514-T518 PolarHBondContact O-OG1 3.36Å; L515-T518 PolarHBondContact O-OG1 3.26Å; T518-A520 VanDerWaalsContact C-N 3.26Å; T518-A520 PolarHBondContact O-N 3.24Å; T518-A521 PolarHBondContact O-N 3.26Å
519	C	39.3	Very low	40.5	Very low	86 Å²	86	126.8 Å²	126.8	58%	0.581	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-18.8	176.7	-71.2	0	0	0	0	114.2
520	A	40.1	Very low	40.8	Very low	75 Å²	75	126.8 Å²	126.8	62%	0.62	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-16.5	178.3	0	0	0	0	0	113.6	T518	T518-A520 VanDerWaalsContact C-N 3.26Å; T518-A520 PolarHBondContact O-N 3.24Å
521	A	44	Very low	40.6	Very low	64 Å²	64	122.3 Å²	122.3	53%	0.529	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.3	-19	-178.9	0	0	0	0	0	113.6	T518 F523	T518-A521 PolarHBondContact O-N 3.26Å; A521-F523 VanDerWaalsContact C-N 3.33Å; A521-F523 PolarHBondContact O-N 3.24Å
522	D	41.7	Very low	40.6	Very low	140 Å²	140	121.4 Å²	121.4	75%	0.749	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	8.8	-178.3	-76.1	-18.2	0	0	0	114
523	F	40.6	Very low	40.3	Very low	187 Å²	187	125 Å²	125	82%	0.82	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-1.7	175.7	-87.7	-80.6	0	0	0	114.9	A521	A521-F523 VanDerWaalsContact C-N 3.33Å; A521-F523 PolarHBondContact O-N 3.24Å
524	D	41	Very low	40.3	Very low	157 Å²	157	125.1 Å²	125.1	84%	0.84	72%	0.716	S	S	*	*			trans	-125.2	61.6	172.8	-88.8	-27.9	0	0	0	111.1
525	S	38.3	Very low	40.3	Very low	180 Å²	180	122.1 Å²	122.1	100%	1.259	71%	0.714	S	S	*	*			trans	-141.6	0	165.8	-72.1	0	0	0	0	112.4

Retrieved 525 of 525 residues in 219.3 ms (Link to these results)

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