A0A060VD03_HUMAN Loading...

MHC class I antigen

AlphaFold DB , UniProt , Accession A0A060VD03, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 366 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	35.6	Very low	42.1	Very low	239 Å²	239	146.5 Å²	146.5	100%	1.177	75%	0.749	S	S	*	*				0	101	0	-75.9	163.2	157.3	0	0	108.1
2	R	34.3	Very low	42.3	Very low	252 Å²	252	145.6 Å²	145.6	95%	0.951	75%	0.746	S	S	*	*			trans	-85	110.8	171	-91.9	-179.6	172.8	164.8	-2.6	106.7	M4	R2-M4 PolarHBondContact O-N 3.18Å; R2-M4 VanDerWaalsContact O-N 3.11Å
3	V	37.1	Very low	42	Very low	141 Å²	141	143 Å²	143	86%	0.855	73%	0.733	S	S	*	*			trans	-70.6	104.5	171.7	179.2	0	0	0	0	106.7	A5	V3-A5 PolarHBondContact O-N 3.15Å
4	M	39.2	Very low	42	Very low	177 Å²	177	137.4 Å²	137.4	87%	0.872	71%	0.713	S	S	*	*			trans	-81.2	98.3	175.5	-164.1	164.4	66.7	0	0	106.9	R2	R2-M4 PolarHBondContact O-N 3.18Å; R2-M4 VanDerWaalsContact O-N 3.11Å
5	A	44.6	Very low	41.8	Very low	67 Å²	67	130.9 Å²	130.9	55%	0.554	69%	0.693	S	S	*	*			trans	-60	139.9	172.5	0	0	0	0	0	109.3	V3 R7	V3-A5 PolarHBondContact O-N 3.15Å; A5-R7 PolarHBondContact O-N 2.6Å; A5-R7 VanDerWaalsContact O-N 3.17Å
6	P	43.2	Very low	41.5	Very low	84 Å²	84	125.1 Å²	125.1	55%	0.545	68%	0.675	S	S	.	*			trans	-67.5	119.3	-174.5	-10.8	25.4	0	0	0	109.5	A8 L9	P6-A8 PolarHBondContact O-N 3.47Å; P6-L9 PolarHBondContact O-N 2.86Å
7	R	48.9	Very low	41.2	Very low	223 Å²	223	124.5 Å²	124.5	84%	0.842	67%	0.671	S	S	*	*	H	α-helix	trans	-53.3	-17	173	-88.4	177.8	164.1	168.7	-6.3	113.8	A5	A5-R7 PolarHBondContact O-N 2.6Å; A5-R7 VanDerWaalsContact O-N 3.17Å
8	A	48.3	Very low	40.9	Very low	66 Å²	66	121.3 Å²	121.3	55%	0.545	66%	0.664	S	S	.	*	H	α-helix	trans	-72.3	-29.9	174.7	0	0	0	0	0	113.8	P6	P6-A8 PolarHBondContact O-N 3.47Å
9	L	43.2	Very low	40.8	Very low	112 Å²	112	120.6 Å²	120.6	59%	0.586	66%	0.659	S	S	*	*	H	α-helix	trans	-75.5	-29.5	-178.7	-123.6	93.9	0	0	0	112.7	P6 L13	P6-L9 PolarHBondContact O-N 2.86Å; L9-L13 PolarHBondContact O-N 3.39Å
10	L	41.6	Very low	40.5	Very low	121 Å²	121	119.6 Å²	119.6	63%	0.634	66%	0.656	S	S	*	*	H	α-helix	trans	-74.7	-25.9	178.7	-93.6	142.3	0	0	0	113.2	S14	L10-S14 PolarHBondContact O-N 2.93Å; L10-S14 PolarHBondContact O-OG 2.93Å
11	L	46.8	Very low	40.3	Very low	130 Å²	130	121.9 Å²	121.9	68%	0.681	66%	0.662	S	S	*	*	H	α-helix	trans	-77.3	-33.7	175.6	-75.5	165.6	0	0	0	112.3	L13 S14 G15	L11-L13 VanDerWaalsContact C-N 3.34Å; L11-S14 WeakPolarHBondContact CA-OG 3.45Å; L11-S14 PolarHBondContact O-N 2.97Å; L11-S14 PolarHBondContact O-OG 3.21Å; L11-S14 VanDerWaalsContact O-OG 3.14Å; L11-G15 PolarHBondContact O-N 3.04Å
12	L	44.7	Very low	40.7	Very low	135 Å²	135	115.5 Å²	115.5	71%	0.707	64%	0.637	S	S	*	*	H	α-helix	trans	-68.7	-33.2	175	-76.3	161.9	0	0	0	112.5	G16	L12-G16 PolarHBondContact O-N 3.22Å
13	L	38.8	Very low	41.5	Very low	112 Å²	112	108.1 Å²	108.1	59%	0.586	61%	0.609	S	S	*	*	H	α-helix	trans	-76.1	-24.6	176.3	-74.6	162.8	0	0	0	113.3	L9 L11 L17	L9-L13 PolarHBondContact O-N 3.39Å; L11-L13 VanDerWaalsContact C-N 3.34Å; L13-L17 WeakPolarHBondContact O-CD1 3.37Å; L13-L17 WeakPolarHBondContact O-CG 3.33Å; L13-L17 PolarHBondContact O-N 2.94Å
14	S	41.6	Very low	42.2	Very low	64 Å²	64	104 Å²	104	45%	0.448	59%	0.589	S	S	.	*	H	α-helix	trans	-83.4	-29.2	176.3	32.7	0	0	0	0	112.9	L10 L11 A18	L10-S14 PolarHBondContact O-N 2.93Å; L10-S14 PolarHBondContact O-OG 2.93Å; L11-S14 WeakPolarHBondContact CA-OG 3.45Å; L11-S14 PolarHBondContact O-N 2.97Å; L11-S14 PolarHBondContact O-OG 3.21Å; L11-S14 VanDerWaalsContact O-OG 3.14Å; S14-A18 PolarHBondContact O-N 3.05Å
15	G	39.6	Very low	43.8	Very low	40 Å²	40	98.4 Å²	98.4	41%	0.412	57%	0.568	S	S	.	*	H	α-helix	trans	-68	-36.9	169.9	0	0	0	0	0	113.2	L11 L19	L11-G15 PolarHBondContact O-N 3.04Å; G15-L19 WeakPolarHBondContact O-CD1 3.08Å
16	G	36.7	Very low	46	Very low	39 Å²	39	98.8 Å²	98.8	40%	0.402	57%	0.566	S	S	.	*	H	α-helix	trans	-71.5	-37.1	177.3	0	0	0	0	0	114.1	L12 L19 T20	L12-G16 PolarHBondContact O-N 3.22Å; G16-L19 PolarHBondContact O-N 3.35Å; G16-T20 PolarHBondContact O-N 3.47Å; G16-T20 PolarHBondContact O-OG1 2.93Å
17	L	35.6	Very low	48.5	Very low	115 Å²	115	96.2 Å²	96.2	60%	0.602	55%	0.547	S	S	*	.	H	α-helix	trans	-72	-31.3	178.9	-79.5	163.2	0	0	0	113	L13 L19 T20	L13-L17 WeakPolarHBondContact O-CD1 3.37Å; L13-L17 WeakPolarHBondContact O-CG 3.33Å; L13-L17 PolarHBondContact O-N 2.94Å; L17-L19 VanDerWaalsContact C-N 3.27Å; L17-L19 PolarHBondContact O-N 3.49Å; L17-T20 PolarHBondContact O-OG1 3.43Å
18	A	36.8	Very low	50.8	Low	66 Å²	66	86.7 Å²	86.7	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-69.7	-23.9	174.8	0	0	0	0	0	113.1	S14	S14-A18 PolarHBondContact O-N 3.05Å
19	L	39.1	Very low	53.2	Low	109 Å²	109	83.5 Å²	83.5	57%	0.571	49%	0.488	S	S	*	.	H	α-helix	trans	-86.5	-18.6	-180	-83.2	158.9	0	0	0	113.5	G15 G16 L17	G15-L19 WeakPolarHBondContact O-CD1 3.08Å; G16-L19 PolarHBondContact O-N 3.35Å; L17-L19 VanDerWaalsContact C-N 3.27Å; L17-L19 PolarHBondContact O-N 3.49Å
20	T	35.5	Very low	55.8	Low	100 Å²	100	80.5 Å²	80.5	61%	0.613	47%	0.469	S	S	*	.	H	α-helix	trans	-96.6	-18.2	-179.2	52.2	0	0	0	0	114.1	G16 L17 T22	G16-T20 PolarHBondContact O-N 3.47Å; G16-T20 PolarHBondContact O-OG1 2.93Å; L17-T20 PolarHBondContact O-OG1 3.43Å; T20-T22 VanDerWaalsContact C-N 3.32Å; T20-T22 PolarHBondContact O-N 3.3Å
21	E	35.6	Very low	58.5	Low	167 Å²	167	75.1 Å²	75.1	78%	0.78	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-77.6	-12.5	179.7	-95.7	-174.2	162.6	0	0	114.1	W23	E21-W23 PolarHBondContact O-N 3.37Å
22	T	43.5	Very low	61	Low	105 Å²	105	72.9 Å²	72.9	64%	0.644	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-86.7	4.6	-173.7	56.3	0	0	0	0	115.3	T20	T20-T22 VanDerWaalsContact C-N 3.32Å; T20-T22 PolarHBondContact O-N 3.3Å
23	W	50.8	Low	63.6	Low	98 Å²	98	66.6 Å²	66.6	37%	0.371	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-121.6	20.3	-174.5	-62.1	77.5	0	0	0	113.3	E21 C25 H287 E288 L290	E21-W23 PolarHBondContact O-N 3.37Å; W23-C25 PolarHBondContact O-N 2.86Å; W23-H287 WeakPolarHBondContact CH2-O 3.29Å; W23-H287 VanDerWaalsContact CZ3-O 3.3Å; W23-H287 WeakPolarHBondContact CZ3-O 3.34Å; W23-E288 HydrophobicContact CD2-CB 4.39Å; W23-E288 HydrophobicContact CE3-CB 3.47Å; W23-E288 VanDerWaalsContact CE3-CB 3.47Å; W23-E288 HydrophobicContact CE3-CG 3.94Å; W23-E288 HydrophobicContact CH2-CB 4.19Å; W23-E288 VanDerWaalsContact CZ3-CA 3.42Å; W23-E288 HydrophobicContact CZ3-CB 3.42Å; W23-E288 VanDerWaalsContact CZ3-CB 3.42Å; W23-E288 HydrophobicContact CZ3-CG 4.16Å; W23-E288 WeakPolarHBondContact CZ3-O 3.35Å; W23-L290 WeakPolarHBondContact CH2-O 3.23Å; W23-L290 VanDerWaalsContact CZ3-O 3.31Å; W23-L290 WeakPolarHBondContact CZ3-O 3.41Å
24	A	53.2	Low	66.5	Low	53 Å²	53	63.1 Å²	63.1	44%	0.438	38%	0.376	S	S	.	.	S	Bend	trans	-82	103.8	167.6	0	0	0	0	0	106.5	S26 P129	A24-S26 PolarHBondContact O-N 2.89Å; A24-P129 HydrophobicContact CB-CB 3.71Å; A24-P129 HydrophobicContact CB-CG 3.13Å
25	C	71.5	Confident	69.2	Low	61 Å²	61	60.1 Å²	60.1	41%	0.412	36%	0.355	S	S	.	.			trans	-51.4	106.4	-173.1	-55.3	0	0	0	0	110.9	W23 E288	W23-C25 PolarHBondContact O-N 2.86Å; C25-E288 PolarHBondContact SG-OE1 3.09Å
26	S	90.8	Very high	72	Confident	74 Å²	74	60.6 Å²	60.6	52%	0.517	35%	0.349	S	S	.	.			trans	-90.4	144.9	167.4	57.8	0	0	0	0	108.9	A24 L127	A24-S26 PolarHBondContact O-N 2.89Å; S26-L127 VanDerWaalsContact CA-O 3.3Å; S26-L127 WeakPolarHBondContact CA-O 3.2Å; S26-L127 WeakPolarHBondContact CB-O 3.08Å
27	H	95.4	Very high	74.9	Confident	30 Å²	30	59.6 Å²	59.6	14%	0.139	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.4	177.5	-67.7	-75.6	0	0	0	110.6	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.23Å; H27-D53 WeakPolarHBondContact CA-OD1 3.32Å; H27-D53 IonicContact CE1-OD2 3.46Å; H27-D53 IonicContact CG-OD2 3.73Å; H27-D53 IonicContact ND1-OD1 2.74Å; H27-D53 IonicContact ND1-OD2 2.77Å; H27-D53 PolarHBondContact ND1-OD2 3.36Å; H27-D126 CarbonylContact O-C 3.59Å; H27-D126 WeakPolarHBondContact O-CA 3.37Å; H27-L127 PolarHBondContact N-O 3.15Å; H27-L127 PolarHBondContact O-N 3.31Å; H27-L192 HydrophobicContact CB-CD1 4.45Å; H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 3.99Å; H27-L196 HydrophobicContact CB-CG 4.42Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.49Å
28	S	97.5	Very high	77.7	Confident	23 Å²	23	57.5 Å²	57.5	16%	0.161	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.8	179.5	66.7	0	0	0	0	111.7	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.58Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.3Å; S28-D53 PolarHBondContact N-OD1 3.5Å; S28-D53 PolarHBondContact O-N 3.41Å; S28-C125 WeakPolarHBondContact CA-O 3.32Å; S28-D126 WeakPolarHBondContact CB-OD1 3.31Å
29	M	98.6	Very high	80.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	121.8	167.1	-174.7	171.1	62.6	0	0	108.1	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.22Å; M29-Y31 HydrophobicContact CG-CE2 4.07Å; M29-Y31 HydrophobicContact SD-CE2 4.08Å; M29-Y51 CarbonylContact C-O 3.51Å; M29-Y51 WeakPolarHBondContact CA-O 3.2Å; M29-V52 HydrophobicContact CG-CG2 4.3Å; M29-F57 HydrophobicContact CG-CE1 4.38Å; M29-F57 HydrophobicContact SD-CZ 4.26Å; M29-G124 CarbonylContact O-C 3.59Å; M29-G124 WeakPolarHBondContact O-CA 3.41Å; M29-C125 PolarHBondContact N-O 3.46Å; M29-C125 PolarHBondContact O-N 2.87Å; M29-C188 HydrophobicContact CE-CB 4.19Å; M29-C188 VanDerWaalsContact CE-O 3.24Å; M29-C188 WeakPolarHBondContact CE-O 3.4Å; M29-C188 WeakPolarHBondContact CE-SG 3.48Å; M29-W191 HydrophobicContact CE-CB 4.02Å; M29-W191 HydrophobicContact SD-CB 4.38Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.95Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.34Å; M29-L192 HydrophobicContact SD-CB 4.42Å; M29-Y195 HydrophobicContact SD-CD2 3.72Å; M29-Y195 HydrophobicContact SD-CE2 3.58Å; M29-Y195 VanDerWaalsContact SD-CE2 3.58Å
30	R	98.6	Very high	82.8	Confident	49 Å²	49	55.9 Å²	55.9	19%	0.185	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	135.2	-176.1	-56.8	-62.5	-178.2	75	4	110.6	F32 G50 Y51 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.47Å; R30-F32 HydrophobicContact CB-CE2 3.64Å; R30-F32 HydrophobicContact CB-CZ 3.95Å; R30-G50 CarbonylContact O-C 3.59Å; R30-G50 WeakPolarHBondContact O-CA 3.36Å; R30-Y51 PolarHBondContact N-O 3.28Å; R30-Y51 PolarHBondContact O-N 2.99Å; R30-D126 IonicContact CZ-OD1 3.63Å; R30-D126 IonicContact NE-OD1 3.72Å; R30-D126 PolarHBondContact NE-OD1 3.14Å; R30-D126 VanDerWaalsContact NH2-CG 3.28Å; R30-D126 IonicContact NH2-OD1 3.86Å; R30-D126 PolarHBondContact NH2-OD1 3.37Å; R30-D126 IonicContact NH2-OD2 2.81Å; R30-D126 PolarHBondContact NH2-OD2 2.85Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.31Å; R30-Y137 PolarHBondContact NH2-OH 2.83Å
31	Y	98.8	Very high	85.5	Confident	8 Å²	8	61 Å²	61	3%	0.031	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.7	169.2	-70.2	-94.2	0	0	0	109.3	M29 V49 F57 V58 M122 Y123	M29-Y31 HydrophobicContact CE-CE2 4.22Å; M29-Y31 HydrophobicContact CG-CE2 4.07Å; M29-Y31 HydrophobicContact SD-CE2 4.08Å; Y31-V49 CarbonylContact C-O 3.56Å; Y31-V49 WeakPolarHBondContact CA-O 3.47Å; Y31-F57 HydrophobicContact CE1-CZ 4.13Å; Y31-F57 HydrophobicContact CE2-CZ 4.47Å; Y31-F57 AromaticContact CZ-CZ 3.76Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.3Å; Y31-V58 HydrophobicContact CE1-CG2 3.93Å; Y31-M122 WeakPolarHBondContact O-CA 3.36Å; Y31-Y123 VanDerWaalsContact CB-CE1 3.44Å; Y31-Y123 HydrophobicContact CD2-CD2 4.35Å; Y31-Y123 AromaticContact CD2-CE2 3.63Å; Y31-Y123 HydrophobicContact CD2-CE2 3.63Å; Y31-Y123 AromaticContact CD2-CZ 3.87Å; Y31-Y123 HydrophobicContact CE2-CE2 4.42Å; Y31-Y123 HydrophobicContact CG-CE1 4.25Å; Y31-Y123 AromaticContact CG-CE2 3.9Å; Y31-Y123 HydrophobicContact CG-CE2 3.9Å; Y31-Y123 AromaticContact CG-CZ 3.63Å; Y31-Y123 PolarHBondContact N-O 3.13Å; Y31-Y123 PolarHBondContact O-N 2.85Å; Y31-Y123 VanDerWaalsContact O-N 3.11Å
32	F	98.9	Very high	88.2	Confident	83 Å²	83	55.8 Å²	55.8	36%	0.364	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	113	177.7	-57.5	-95.5	0	0	0	108.8	R30 S48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.47Å; R30-F32 HydrophobicContact CB-CE2 3.64Å; R30-F32 HydrophobicContact CB-CZ 3.95Å; F32-S48 WeakPolarHBondContact O-CA 3.36Å; F32-V49 HydrophobicContact CB-CG2 3.87Å; F32-V49 HydrophobicContact CD2-CG2 4.32Å; F32-V49 PolarHBondContact N-O 3.25Å; F32-V49 PolarHBondContact O-N 3.33Å; F32-Y51 HydrophobicContact CD2-CD2 4.15Å; F32-Y51 HydrophobicContact CE2-CD2 4.14Å; F32-R121 WeakPolarHBondContact CA-O 3.24Å; F32-M122 HydrophobicContact CD1-CB 3.98Å; F32-M122 HydrophobicContact CD1-CG 3.71Å; F32-M122 HydrophobicContact CE1-CB 4.11Å; F32-M122 HydrophobicContact CE1-CG 3.41Å; F32-M122 VanDerWaalsContact CE1-CG 3.41Å; F32-M122 HydrophobicContact CZ-CG 4.01Å
33	D	98.8	Very high	90.6	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.016	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	139.5	175.4	-63.3	-28.6	0	0	0	109.2	F46 I47 S48 Q120 R121	D33-F46 HydrophobicContact CB-CE2 3.84Å; D33-F46 HydrophobicContact CB-CZ 4.11Å; D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.41Å; D33-S48 WeakPolarHBondContact OD1-CB 3.49Å; D33-S48 PolarHBondContact OD1-OG 3.33Å; D33-Q120 VanDerWaalsContact O-CA 3.3Å; D33-Q120 WeakPolarHBondContact O-CA 3.45Å; D33-R121 HydrophobicContact CB-CB 4.27Å; D33-R121 PolarHBondContact N-O 2.6Å; D33-R121 PolarHBondContact O-N 2.92Å; D33-R121 IonicContact OD2-NH1 2.65Å
34	T	98.9	Very high	92.8	Very high	39 Å²	39	52.1 Å²	52.1	24%	0.239	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	120	174.7	-61.1	0	0	0	0	109.9	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 4.03Å; T34-F46 WeakPolarHBondContact O-CA 3.19Å; T34-I47 PolarHBondContact N-O 3.14Å; T34-I47 PolarHBondContact O-N 3.42Å; T34-T118 HydrophobicContact CG2-CG2 4.1Å; T34-L119 WeakPolarHBondContact CA-O 3.47Å; T34-Q120 HydrophobicContact CG2-CG 4.18Å
35	A	98.7	Very high	95	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.008	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.5	175	0	0	0	0	0	110.3	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.54Å; A35-R45 VanDerWaalsContact CA-O 3.29Å; A35-R45 WeakPolarHBondContact CA-O 3.31Å; A35-F46 HydrophobicContact CB-CD2 4.26Å; A35-D98 HydrophobicContact CB-CB 3.63Å; A35-L102 HydrophobicContact CB-CD1 3.86Å; A35-T118 WeakPolarHBondContact O-CA 3.43Å; A35-L119 HydrophobicContact CB-CB 4.46Å; A35-L119 PolarHBondContact N-O 3.39Å; A35-L119 PolarHBondContact O-N 3.27Å
36	V	98.6	Very high	96.3	Very high	49 Å²	49	51.1 Å²	51.1	30%	0.297	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	115.4	-178.9	-173.3	0	0	0	0	109.3	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 4.03Å; V36-P44 CarbonylContact O-C 3.5Å; V36-P44 WeakPolarHBondContact O-CA 3.36Å; V36-P44 WeakPolarHBondContact O-CB 3.5Å; V36-R45 PolarHBondContact N-O 2.91Å; V36-R45 PolarHBondContact O-N 3.37Å; V36-H117 WeakPolarHBondContact CA-O 3.26Å; V36-T118 HydrophobicContact CG2-CG2 4.21Å
37	S	97.8	Very high	96.6	Very high	18 Å²	18	49.9 Å²	49.9	13%	0.126	27%	0.271	C	S	.	.			trans	-68.5	146.2	173.2	73.5	0	0	0	0	110.4	S116 H117	S37-S116 PolarHBondContact O-OG 3.37Å; S37-H117 PolarHBondContact N-O 3.46Å; S37-H117 PolarHBondContact OG-N 3.26Å; S37-H117 PolarHBondContact OG-O 3.48Å
38	R	95.6	Very high	96.8	Very high	72 Å²	72	48.4 Å²	48.4	27%	0.272	26%	0.264	S	S	.	.			trans	-139	74.8	-179.4	54.2	174.4	176.6	-159.8	-11.2	111.2	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 3.08Å; R38-R41 HydrophobicContact CB-CB 4.09Å; R38-R41 WeakPolarHBondContact CD-O 3.29Å; R38-R41 HydrophobicContact CG-CB 4.13Å; R38-R41 PolarHBondContact NE-O 3.14Å; R38-R41 VanDerWaalsContact NE-O 3.16Å; R38-R41 PolarHBondContact O-N 2.96Å; R38-E43 VanDerWaalsContact CZ-O 3.25Å; R38-E43 PolarHBondContact NE-O 2.92Å; R38-E43 PolarHBondContact NH2-O 2.81Å; R38-D63 IonicContact CZ-OD1 2.64Å; R38-D63 IonicContact CZ-OD2 2.99Å; R38-D63 IonicContact NH1-OD1 3.64Å; R38-D63 PolarHBondContact NH1-OD1 3.38Å; R38-D63 IonicContact NH1-OD2 3.06Å; R38-D63 PolarHBondContact NH1-OD2 3.28Å; R38-D63 IonicContact NH2-OD1 3.97Å; R38-D63 PolarHBondContact NH2-OD1 3.27Å; R38-D63 IonicContact NH2-OD2 3.28Å
39	P	91.6	Very high	96.9	Very high	51 Å²	51	48.7 Å²	48.7	33%	0.331	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	131.7	-177.8	-27.1	35.1	0	0	0	112.2	R41 E113 G115	P39-R41 PolarHBondContact O-N 3.29Å; P39-E113 WeakPolarHBondContact CB-O 3.38Å; P39-E113 WeakPolarHBondContact CG-O 3.46Å; P39-G115 VanDerWaalsContact CG-O 3.22Å; P39-G115 WeakPolarHBondContact CG-O 3.38Å
40	G	90.4	Very high	96.9	Very high	89 Å²	89	48.7 Å²	48.7	92%	0.918	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	0.7	-177.6	0	0	0	0	0	116.1	R38	R38-G40 PolarHBondContact O-N 3.08Å
41	R	92.6	Very high	96.9	Very high	209 Å²	209	49.6 Å²	49.6	79%	0.789	27%	0.269	S	S	*	.	S	Bend	trans	-122.9	21.9	-178.8	-58	-174.4	-178.9	-162.5	0.6	113.7	R38 P39	R38-R41 HydrophobicContact CB-CB 4.09Å; R38-R41 WeakPolarHBondContact CD-O 3.29Å; R38-R41 HydrophobicContact CG-CB 4.13Å; R38-R41 PolarHBondContact NE-O 3.14Å; R38-R41 VanDerWaalsContact NE-O 3.16Å; R38-R41 PolarHBondContact O-N 2.96Å; P39-R41 PolarHBondContact O-N 3.29Å
42	G	91.3	Very high	96.8	Very high	56 Å²	56	49.2 Å²	49.2	58%	0.577	27%	0.267	S	S	*	.	S	Bend	trans	96.6	-160.2	178.3	0	0	0	0	0	113.6
43	E	94.4	Very high	96.7	Very high	98 Å²	98	46.7 Å²	46.7	46%	0.458	26%	0.258	S	S	.	.	S	Bend	trans	-70.9	153.9	-177.3	-64.5	-55.6	159.2	0	0	112.6	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.25Å; R38-E43 PolarHBondContact NE-O 2.92Å; R38-E43 PolarHBondContact NH2-O 2.81Å; E43-R45 PolarHBondContact O-N 2.81Å; E43-R99 IonicContact OE1-CZ 3.59Å; E43-R99 VanDerWaalsContact OE1-CZ 3.28Å; E43-R99 IonicContact OE1-NE 2.72Å; E43-R99 IonicContact OE1-NH2 3.35Å; E43-R99 PolarHBondContact OE1-NH2 3.17Å; E43-R99 WeakPolarHBondContact OE2-CD 3.42Å; E43-R99 IonicContact OE2-CZ 3.47Å; E43-R99 IonicContact OE2-NE 3.03Å; E43-R99 PolarHBondContact OE2-NE 3.11Å; E43-R99 IonicContact OE2-NH1 3.34Å; E43-R99 IonicContact OE2-NH2 3.03Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å
44	P	97.2	Very high	96.6	Very high	28 Å²	28	49.6 Å²	49.6	18%	0.182	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-50.6	134.9	173.7	-26.1	34.9	0	0	0	111.8	V36 R99 L102	V36-P44 CarbonylContact O-C 3.5Å; V36-P44 WeakPolarHBondContact O-CA 3.36Å; V36-P44 WeakPolarHBondContact O-CB 3.5Å; P44-R99 HydrophobicContact CG-CB 4.4Å; P44-R99 HydrophobicContact CG-CG 4.11Å; P44-L102 HydrophobicContact CB-CD1 3.69Å; P44-L102 HydrophobicContact CG-CD1 3.87Å
45	R	98.4	Very high	96.5	Very high	90 Å²	90	49.2 Å²	49.2	34%	0.34	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	130.7	173.1	-176.8	-178.8	-177	-176.3	-0.5	108.4	A35 V36 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.54Å; A35-R45 VanDerWaalsContact CA-O 3.29Å; A35-R45 WeakPolarHBondContact CA-O 3.31Å; V36-R45 PolarHBondContact N-O 2.91Å; V36-R45 PolarHBondContact O-N 3.37Å; E43-R45 PolarHBondContact O-N 2.81Å; R45-I47 HydrophobicContact CG-CG1 4.4Å; R45-D61 IonicContact CZ-OD1 2.61Å; R45-D61 IonicContact CZ-OD2 3.16Å; R45-D61 IonicContact NE-OD1 3.72Å; R45-D61 PolarHBondContact NE-OD1 3.41Å; R45-D61 VanDerWaalsContact NE-OD1 3.08Å; R45-D61 IonicContact NE-OD2 3.65Å; R45-D61 IonicContact NH2-OD1 3.74Å; R45-D61 PolarHBondContact NH2-OD1 2.92Å; R45-D61 IonicContact NH2-OD2 2.64Å; R45-D61 PolarHBondContact NH2-OD2 2.93Å; R45-S62 WeakPolarHBondContact CA-OG 3.34Å; R45-D63 VanDerWaalsContact CD-OD2 3.3Å; R45-D63 WeakPolarHBondContact CD-OD2 3.39Å; R45-D63 HydrophobicContact CG-CB 4.38Å; R45-D63 IonicContact NE-OD2 2.8Å
46	F	98.8	Very high	96.4	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.6	176.8	175.8	-94.7	0	0	0	110.1	D33 T34 A35 F60 S62 Q94 A95 D98	D33-F46 HydrophobicContact CB-CE2 3.84Å; D33-F46 HydrophobicContact CB-CZ 4.11Å; T34-F46 WeakPolarHBondContact O-CA 3.19Å; A35-F46 HydrophobicContact CB-CD2 4.26Å; F46-F60 AromaticContact CD1-CD1 3.68Å; F46-F60 HydrophobicContact CD1-CD1 3.68Å; F46-F60 AromaticContact CD1-CE1 3.79Å; F46-F60 HydrophobicContact CD1-CE1 3.79Å; F46-F60 AromaticContact CE1-CD1 3.9Å; F46-F60 HydrophobicContact CE1-CD1 3.9Å; F46-F60 HydrophobicContact CE1-CE1 4.29Å; F46-S62 PolarHBondContact N-OG 2.84Å; F46-S62 PolarHBondContact O-N 2.95Å; F46-S62 PolarHBondContact O-OG 2.9Å; F46-Q94 HydrophobicContact CE2-CB 4.28Å; F46-Q94 HydrophobicContact CE2-CG 3.77Å; F46-Q94 HydrophobicContact CZ-CB 3.9Å; F46-Q94 HydrophobicContact CZ-CG 3.71Å; F46-A95 HydrophobicContact CB-CB 3.7Å; F46-A95 HydrophobicContact CD1-CB 3.68Å; F46-A95 HydrophobicContact CD2-CB 4.16Å; F46-A95 HydrophobicContact CE1-CB 4.33Å; F46-A95 HydrophobicContact CG-CB 3.57Å; F46-D98 HydrophobicContact CD2-CB 4.5Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.31Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.5Å
47	I	98.8	Very high	96.4	Very high	47 Å²	47	49.3 Å²	49.3	24%	0.241	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134	174.8	-59.9	171.3	0	0	0	107.3	D33 T34 R45 V49 F60	D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.41Å; T34-I47 PolarHBondContact N-O 3.14Å; T34-I47 PolarHBondContact O-N 3.42Å; R45-I47 HydrophobicContact CG-CG1 4.4Å; I47-V49 HydrophobicContact CG2-CG1 4.37Å; I47-F60 WeakPolarHBondContact CA-O 3.38Å
48	S	98.8	Very high	96.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.1	171	-174.3	0	0	0	0	109.6	F32 D33 R59 F60 Y91	F32-S48 WeakPolarHBondContact O-CA 3.36Å; D33-S48 WeakPolarHBondContact OD1-CB 3.49Å; D33-S48 PolarHBondContact OD1-OG 3.33Å; S48-R59 CarbonylContact O-C 3.59Å; S48-R59 WeakPolarHBondContact O-CA 3.28Å; S48-F60 PolarHBondContact N-O 2.68Å; S48-F60 PolarHBondContact O-N 3.28Å; S48-Y91 VanDerWaalsContact OG-CE1 3.29Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.48Å
49	V	98.9	Very high	96.6	Very high	29 Å²	29	48.9 Å²	48.9	18%	0.176	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	140.1	174.6	-63.5	0	0	0	0	110	Y31 F32 I47 Y51 V58 R59	Y31-V49 CarbonylContact C-O 3.56Å; Y31-V49 WeakPolarHBondContact CA-O 3.47Å; F32-V49 HydrophobicContact CB-CG2 3.87Å; F32-V49 HydrophobicContact CD2-CG2 4.32Å; F32-V49 PolarHBondContact N-O 3.25Å; F32-V49 PolarHBondContact O-N 3.33Å; I47-V49 HydrophobicContact CG2-CG1 4.37Å; V49-Y51 HydrophobicContact CB-CE2 4.14Å; V49-Y51 HydrophobicContact CG2-CD2 4.4Å; V49-Y51 HydrophobicContact CG2-CE2 3.85Å; V49-V58 WeakPolarHBondContact CA-O 3.23Å; V49-R59 HydrophobicContact CG1-CB 4.43Å; V49-R59 HydrophobicContact CG1-CG 4.2Å
50	G	98.7	Very high	96.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.1	177.5	0	0	0	0	0	111	R30 Q56 F57 V58	R30-G50 CarbonylContact O-C 3.59Å; R30-G50 WeakPolarHBondContact O-CA 3.36Å; G50-Q56 WeakPolarHBondContact O-CA 3.39Å; G50-F57 WeakPolarHBondContact O-CD1 3.43Å; G50-F57 PolarHBondContact O-N 2.96Å; G50-V58 PolarHBondContact N-O 3.39Å; G50-V58 PolarHBondContact O-N 2.97Å
51	Y	98.6	Very high	97.3	Very high	68 Å²	68	43.3 Å²	43.3	27%	0.267	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.4	178	-75.5	-102.5	0	0	0	110.5	M29 R30 F32 V49 T55 Q56	M29-Y51 CarbonylContact C-O 3.51Å; M29-Y51 WeakPolarHBondContact CA-O 3.2Å; R30-Y51 PolarHBondContact N-O 3.28Å; R30-Y51 PolarHBondContact O-N 2.99Å; F32-Y51 HydrophobicContact CD2-CD2 4.15Å; F32-Y51 HydrophobicContact CE2-CD2 4.14Å; V49-Y51 HydrophobicContact CB-CE2 4.14Å; V49-Y51 HydrophobicContact CG2-CD2 4.4Å; V49-Y51 HydrophobicContact CG2-CE2 3.85Å; Y51-T55 WeakPolarHBondContact CA-O 3.41Å; Y51-T55 VanDerWaalsContact CD1-C 3.48Å; Y51-Q56 HydrophobicContact CD1-CB 4Å; Y51-Q56 VanDerWaalsContact CD1-N 3.3Å; Y51-Q56 HydrophobicContact CD2-CG 4.36Å; Y51-Q56 HydrophobicContact CE1-CB 3.5Å; Y51-Q56 HydrophobicContact CE1-CG 4.21Å; Y51-Q56 HydrophobicContact CE2-CB 4.09Å; Y51-Q56 HydrophobicContact CE2-CG 3.85Å; Y51-Q56 HydrophobicContact CG-CB 4.48Å
52	V	98.2	Very high	97.6	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	119.4	156.8	176.5	0	0	0	0	106	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.58Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.3Å; M29-V52 HydrophobicContact CG-CG2 4.3Å; V52-D54 PolarHBondContact O-N 3.06Å; V52-T55 PolarHBondContact N-O 2.93Å; V52-T55 WeakPolarHBondContact O-CB 3.3Å; V52-T55 PolarHBondContact O-N 3.45Å; V52-F57 HydrophobicContact CG2-CD1 4.01Å; V52-F57 HydrophobicContact CG2-CE1 4.03Å; V52-W75 HydrophobicContact CB-CH2 4.37Å; V52-W75 HydrophobicContact CB-CZ2 4.43Å; V52-W75 HydrophobicContact CG2-CH2 3.85Å; V52-W75 HydrophobicContact CG2-CZ2 4.4Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.24Å; V52-Y195 HydrophobicContact CG2-CD2 3.97Å; V52-Y195 HydrophobicContact CG2-CG 4.46Å; V52-L196 HydrophobicContact CG1-CD2 4.09Å; V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.16Å; V52-L203 HydrophobicContact CG1-CD1 3.87Å; V52-L203 HydrophobicContact CG1-CD2 4.07Å; V52-L203 HydrophobicContact CG1-CG 4.5Å
53	D	95.9	Very high	97.8	Very high	30 Å²	30	35.7 Å²	35.7	16%	0.16	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	-124.3	-166.2	-52.9	-39.1	0	0	0	110.4	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.23Å; H27-D53 WeakPolarHBondContact CA-OD1 3.32Å; H27-D53 IonicContact CE1-OD2 3.46Å; H27-D53 IonicContact CG-OD2 3.73Å; H27-D53 IonicContact ND1-OD1 2.74Å; H27-D53 IonicContact ND1-OD2 2.77Å; H27-D53 PolarHBondContact ND1-OD2 3.36Å; S28-D53 PolarHBondContact N-OD1 3.5Å; S28-D53 PolarHBondContact O-N 3.41Å; D53-T55 VanDerWaalsContact C-N 3.35Å
54	D	95.7	Very high	98	Very high	63 Å²	63	32.6 Å²	32.6	34%	0.337	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	8.9	179.2	-61.1	-56.1	0	0	0	113.6	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.06Å; D54-Y233 HydrophobicContact CB-CE2 4.04Å; D54-P234 VanDerWaalsContact OD2-CB 3.24Å; D54-P234 WeakPolarHBondContact OD2-CB 3.37Å; D54-A235 HydrophobicContact CB-CB 4.29Å; D54-A235 WeakPolarHBondContact OD2-CB 3.34Å; D54-A235 PolarHBondContact OD2-N 2.95Å; D54-F265 HydrophobicContact CB-CE2 3.76Å; D54-F265 HydrophobicContact CB-CZ 3.7Å
55	T	96.8	Very high	97.9	Very high	31 Å²	31	36.9 Å²	36.9	19%	0.19	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	113.6	-176.8	-61	0	0	0	0	111.8	Y51 V52 D53 F57 A73 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.41Å; Y51-T55 VanDerWaalsContact CD1-C 3.48Å; V52-T55 PolarHBondContact N-O 2.93Å; V52-T55 WeakPolarHBondContact O-CB 3.3Å; V52-T55 PolarHBondContact O-N 3.45Å; D53-T55 VanDerWaalsContact C-N 3.35Å; T55-F57 PolarHBondContact O-N 3.06Å; T55-A73 HydrophobicContact CG2-CB 4.44Å; T55-L203 HydrophobicContact CG2-CD2 4.11Å; T55-Y233 PolarHBondContact OG1-OH 3.03Å
56	Q	97.6	Very high	97.8	Very high	52 Å²	52	36.4 Å²	36.4	24%	0.243	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.1	173.2	-166.3	179.9	4.2	0	0	110.5	G50 Y51 V58 R72	G50-Q56 WeakPolarHBondContact O-CA 3.39Å; Y51-Q56 HydrophobicContact CD1-CB 4Å; Y51-Q56 VanDerWaalsContact CD1-N 3.3Å; Y51-Q56 HydrophobicContact CD2-CG 4.36Å; Y51-Q56 HydrophobicContact CE1-CB 3.5Å; Y51-Q56 HydrophobicContact CE1-CG 4.21Å; Y51-Q56 HydrophobicContact CE2-CB 4.09Å; Y51-Q56 HydrophobicContact CE2-CG 3.85Å; Y51-Q56 HydrophobicContact CG-CB 4.48Å; Q56-V58 PolarHBondContact NE2-O 3.44Å; Q56-R72 HydrophobicContact CB-CB 4.47Å; Q56-R72 HydrophobicContact CG-CB 4.1Å; Q56-R72 HydrophobicContact CG-CG 4.31Å; Q56-R72 CarbonylContact O-C 3.41Å
57	F	98.2	Very high	97.8	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	-23.6	-179.4	76.4	-82.5	0	0	0	114.5	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.38Å; M29-F57 HydrophobicContact SD-CZ 4.26Å; Y31-F57 HydrophobicContact CE1-CZ 4.13Å; Y31-F57 HydrophobicContact CE2-CZ 4.47Å; Y31-F57 AromaticContact CZ-CZ 3.76Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.3Å; G50-F57 WeakPolarHBondContact O-CD1 3.43Å; G50-F57 PolarHBondContact O-N 2.96Å; V52-F57 HydrophobicContact CG2-CD1 4.01Å; V52-F57 HydrophobicContact CG2-CE1 4.03Å; T55-F57 PolarHBondContact O-N 3.06Å; F57-R72 PolarHBondContact O-N 3.39Å; F57-A73 HydrophobicContact CB-CB 4.09Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.34Å; F57-W75 HydrophobicContact CB-CZ3 3.89Å; F57-W75 HydrophobicContact CD1-CH2 4.02Å; F57-W75 AromaticContact CD2-CH2 3.72Å; F57-W75 HydrophobicContact CD2-CH2 3.72Å; F57-W75 AromaticContact CD2-CZ3 3.95Å; F57-W75 HydrophobicContact CD2-CZ3 3.95Å; F57-W75 AromaticContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CZ2 4.09Å; F57-W75 HydrophobicContact CG-CZ3 4.07Å; F57-V76 HydrophobicContact CB-CG1 4.41Å; F57-V76 HydrophobicContact CD2-CB 4.37Å; F57-V76 HydrophobicContact CD2-CG2 4.09Å; F57-V76 VanDerWaalsContact O-CG1 3.25Å; F57-V76 WeakPolarHBondContact O-CG1 3.39Å; F57-Y195 HydrophobicContact CD2-CE2 4.41Å; F57-Y195 HydrophobicContact CE2-CD2 4.24Å; F57-Y195 AromaticContact CE2-CE2 3.6Å; F57-Y195 HydrophobicContact CE2-CE2 3.6Å; F57-Y195 AromaticContact CE2-CZ 3.81Å; F57-Y195 HydrophobicContact CZ-CD2 4.32Å; F57-Y195 AromaticContact CZ-CE2 3.78Å; F57-Y195 HydrophobicContact CZ-CE2 3.78Å
58	V	98.4	Very high	97.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	153.6	176.9	-73.5	0	0	0	0	112.4	Y31 V49 G50 Q56 E70 W84 Y91	Y31-V58 HydrophobicContact CE1-CG2 3.93Å; V49-V58 WeakPolarHBondContact CA-O 3.23Å; G50-V58 PolarHBondContact N-O 3.39Å; G50-V58 PolarHBondContact O-N 2.97Å; Q56-V58 PolarHBondContact NE2-O 3.44Å; V58-E70 WeakPolarHBondContact CA-O 3.41Å; V58-W84 HydrophobicContact CG1-CH2 3.97Å; V58-W84 HydrophobicContact CG1-CZ3 3.89Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.39Å
59	R	98.4	Very high	97.7	Very high	82 Å²	82	43.2 Å²	43.2	31%	0.309	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	146.4	171.2	178.4	172.4	170.2	156.3	0.1	111.1	S48 V49 D61 E70 R72	S48-R59 CarbonylContact O-C 3.59Å; S48-R59 WeakPolarHBondContact O-CA 3.28Å; V49-R59 HydrophobicContact CG1-CB 4.43Å; V49-R59 HydrophobicContact CG1-CG 4.2Å; R59-D61 IonicContact NH2-OD2 2.9Å; R59-D61 PolarHBondContact NH2-OD2 3.3Å; R59-E70 PolarHBondContact N-O 2.97Å; R59-E70 PolarHBondContact O-N 3.48Å; R59-R72 HydrophobicContact CB-CG 3.91Å
60	F	98.8	Very high	97.6	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	142.6	165.6	179.3	-87	0	0	0	109.6	F46 I47 S48 P67 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.68Å; F46-F60 HydrophobicContact CD1-CD1 3.68Å; F46-F60 AromaticContact CD1-CE1 3.79Å; F46-F60 HydrophobicContact CD1-CE1 3.79Å; F46-F60 AromaticContact CE1-CD1 3.9Å; F46-F60 HydrophobicContact CE1-CD1 3.9Å; F46-F60 HydrophobicContact CE1-CE1 4.29Å; I47-F60 WeakPolarHBondContact CA-O 3.38Å; S48-F60 PolarHBondContact N-O 2.68Å; S48-F60 PolarHBondContact O-N 3.28Å; F60-P67 HydrophobicContact CE2-CB 3.87Å; F60-P67 HydrophobicContact CZ-CB 3.68Å; F60-Y91 HydrophobicContact CB-CD1 4.08Å; F60-Y91 HydrophobicContact CB-CD2 3.59Å; F60-Y91 HydrophobicContact CB-CE1 4.45Å; F60-Y91 HydrophobicContact CB-CE2 4.02Å; F60-Y91 HydrophobicContact CB-CG 3.64Å; F60-Y91 HydrophobicContact CD1-CG 4.34Å; F60-Y91 AromaticContact CD2-CD2 3.65Å; F60-Y91 HydrophobicContact CD2-CD2 3.65Å; F60-Y91 AromaticContact CD2-CG 3.86Å; F60-Y91 HydrophobicContact CD2-CG 3.86Å; F60-Y91 HydrophobicContact CG-CD1 4.46Å; F60-Y91 AromaticContact CG-CD2 3.8Å; F60-Y91 HydrophobicContact CG-CD2 3.8Å; F60-Y91 AromaticContact CG-CG 3.69Å; F60-Y91 HydrophobicContact CG-CG 3.69Å; F60-K92 HydrophobicContact CE2-CG 4.4Å; F60-K92 HydrophobicContact CZ-CG 4.14Å
61	D	98.6	Very high	97.6	Very high	19 Å²	19	46.9 Å²	46.9	10%	0.102	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	119.6	174.8	-164.5	-26.9	0	0	0	109.4	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 2.61Å; R45-D61 IonicContact CZ-OD2 3.16Å; R45-D61 IonicContact NE-OD1 3.72Å; R45-D61 PolarHBondContact NE-OD1 3.41Å; R45-D61 VanDerWaalsContact NE-OD1 3.08Å; R45-D61 IonicContact NE-OD2 3.65Å; R45-D61 IonicContact NH2-OD1 3.74Å; R45-D61 PolarHBondContact NH2-OD1 2.92Å; R45-D61 IonicContact NH2-OD2 2.64Å; R45-D61 PolarHBondContact NH2-OD2 2.93Å; R59-D61 IonicContact NH2-OD2 2.9Å; R59-D61 PolarHBondContact NH2-OD2 3.3Å; D61-D63 PolarHBondContact O-N 3.45Å; D61-D63 PolarHBondContact OD1-N 3.46Å; D61-D63 VanDerWaalsContact OD1-N 3.13Å; D61-A64 HydrophobicContact CB-CB 4.45Å; D61-A64 WeakPolarHBondContact O-CB 3.31Å; D61-A64 PolarHBondContact O-N 3.01Å
62	S	98.3	Very high	97.5	Very high	34 Å²	34	49.2 Å²	49.2	24%	0.238	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.2	-178.6	68.9	0	0	0	0	113.3	R45 F46 A64 P67	R45-S62 WeakPolarHBondContact CA-OG 3.34Å; F46-S62 PolarHBondContact N-OG 2.84Å; F46-S62 PolarHBondContact O-N 2.95Å; F46-S62 PolarHBondContact O-OG 2.9Å; S62-A64 VanDerWaalsContact C-N 3.35Å; S62-P67 WeakPolarHBondContact O-CG 3.48Å
63	D	97.3	Very high	97.4	Very high	70 Å²	70	49.4 Å²	49.4	37%	0.374	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-2.3	179.7	-79.9	3	0	0	0	112.7	R38 R45 D61	R38-D63 IonicContact CZ-OD1 2.64Å; R38-D63 IonicContact CZ-OD2 2.99Å; R38-D63 IonicContact NH1-OD1 3.64Å; R38-D63 PolarHBondContact NH1-OD1 3.38Å; R38-D63 IonicContact NH1-OD2 3.06Å; R38-D63 PolarHBondContact NH1-OD2 3.28Å; R38-D63 IonicContact NH2-OD1 3.97Å; R38-D63 PolarHBondContact NH2-OD1 3.27Å; R38-D63 IonicContact NH2-OD2 3.28Å; R45-D63 VanDerWaalsContact CD-OD2 3.3Å; R45-D63 WeakPolarHBondContact CD-OD2 3.39Å; R45-D63 HydrophobicContact CG-CB 4.38Å; R45-D63 IonicContact NE-OD2 2.8Å; D61-D63 PolarHBondContact O-N 3.45Å; D61-D63 PolarHBondContact OD1-N 3.46Å; D61-D63 VanDerWaalsContact OD1-N 3.13Å
64	A	97.1	Very high	97.4	Very high	34 Å²	34	52.8 Å²	52.8	28%	0.281	30%	0.295	S	S	.	.	S	Bend	trans	-62.2	149.8	173.2	0	0	0	0	0	111	D61 S62 S66 P67	D61-A64 HydrophobicContact CB-CB 4.45Å; D61-A64 WeakPolarHBondContact O-CB 3.31Å; D61-A64 PolarHBondContact O-N 3.01Å; S62-A64 VanDerWaalsContact C-N 3.35Å; A64-S66 PolarHBondContact O-N 3.48Å; A64-S66 VanDerWaalsContact O-N 3.16Å; A64-P67 VanDerWaalsContact O-CD 3.23Å; A64-P67 WeakPolarHBondContact O-CD 3.39Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.47Å
65	A	96.6	Very high	97.4	Very high	117 Å²	117	50.5 Å²	50.5	97%	0.967	28%	0.282	S	S	*	.	S	Bend	trans	-59.2	-30.9	179.8	0	0	0	0	0	113
66	S	96.1	Very high	97.5	Very high	81 Å²	81	49 Å²	49	57%	0.566	27%	0.273	S	S	*	.	S	Bend	trans	-134.4	89.2	171.6	-173.4	0	0	0	0	108.9	A64 R68	A64-S66 PolarHBondContact O-N 3.48Å; A64-S66 VanDerWaalsContact O-N 3.16Å; S66-R68 PolarHBondContact O-N 2.73Å; S66-R68 VanDerWaalsContact O-N 3.1Å
67	P	97.1	Very high	97.4	Very high	36 Å²	36	52.3 Å²	52.3	23%	0.234	29%	0.289	C	S	.	.			trans	-64.9	111.8	-175.3	-23.5	34.9	0	0	0	112	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.87Å; F60-P67 HydrophobicContact CZ-CB 3.68Å; S62-P67 WeakPolarHBondContact O-CG 3.48Å; A64-P67 VanDerWaalsContact O-CD 3.23Å; A64-P67 WeakPolarHBondContact O-CD 3.39Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.47Å; P67-K92 VanDerWaalsContact O-CE 3.28Å; P67-K92 WeakPolarHBondContact O-CE 3.25Å; P67-K92 PolarHBondContact O-NZ 2.96Å
68	R	97.9	Very high	97.2	Very high	151 Å²	151	58.1 Å²	58.1	57%	0.57	32%	0.316	S	S	*	.			trans	-146.7	160	177.2	63.2	-176.5	172.8	175	-0.1	110.7	S66 E70 T88	S66-R68 PolarHBondContact O-N 2.73Å; S66-R68 VanDerWaalsContact O-N 3.1Å; R68-E70 HydrophobicContact CG-CG 4.37Å; R68-E70 PolarHBondContact O-N 2.87Å; R68-T88 HydrophobicContact CB-CG2 4.19Å
69	G	97.7	Very high	97.2	Very high	6 Å²	6	58.6 Å²	58.6	6%	0.062	32%	0.318	C	S	.	.			trans	-64.1	130.4	168.4	0	0	0	0	0	109.7	T88	G69-T88 PolarHBondContact N-OG1 3.48Å
70	E	97.9	Very high	97	Very high	59 Å²	59	56.4 Å²	56.4	28%	0.276	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	133.9	-179	-64.6	179	162.2	0	0	110.1	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.41Å; R59-E70 PolarHBondContact N-O 2.97Å; R59-E70 PolarHBondContact O-N 3.48Å; R68-E70 HydrophobicContact CG-CG 4.37Å; R68-E70 PolarHBondContact O-N 2.87Å; E70-R72 IonicContact OE2-CZ 3.36Å; E70-R72 IonicContact OE2-NH2 3.49Å; E70-R72 PolarHBondContact OE2-NH2 2.92Å
71	P	98	Very high	97	Very high	47 Å²	47	60.9 Å²	60.9	31%	0.305	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	145	173.1	28.7	-33.9	0	0	0	110.8	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.76Å; P71-E77 HydrophobicContact CB-CG 3.71Å; P71-E77 HydrophobicContact CG-CG 3.95Å; P71-W84 HydrophobicContact CB-CH2 3.63Å; P71-W84 HydrophobicContact CB-CZ2 3.83Å; P71-W84 HydrophobicContact CG-CH2 4.23Å; P71-W84 HydrophobicContact CG-CZ2 4.26Å
72	R	97.4	Very high	96.9	Very high	117 Å²	117	68 Å²	68	44%	0.442	38%	0.383	S	S	.	.			trans	-126.9	-2.4	174.8	-60.4	-64	171.6	-176.2	-0.5	113.2	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CB-CB 4.47Å; Q56-R72 HydrophobicContact CG-CB 4.1Å; Q56-R72 HydrophobicContact CG-CG 4.31Å; Q56-R72 CarbonylContact O-C 3.41Å; F57-R72 PolarHBondContact O-N 3.39Å; R59-R72 HydrophobicContact CB-CG 3.91Å; E70-R72 IonicContact OE2-CZ 3.36Å; E70-R72 IonicContact OE2-NH2 3.49Å; E70-R72 PolarHBondContact OE2-NH2 2.92Å
73	A	96.1	Very high	96.9	Very high	4 Å²	4	66.8 Å²	66.8	3%	0.033	37%	0.373	C	S	.	.	S	Bend	trans	-136.2	143.9	173.1	0	0	0	0	0	111	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.44Å; F57-A73 HydrophobicContact CB-CB 4.09Å; A73-W75 VanDerWaalsContact C-N 3.29Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.36Å; A73-W75 HydrophobicContact CB-CZ2 3.97Å; A73-W75 PolarHBondContact O-N 2.86Å; A73-V76 WeakPolarHBondContact O-CG1 3.33Å; A73-V76 PolarHBondContact O-N 3.38Å
74	P	96.1	Very high	96.9	Very high	101 Å²	101	65.3 Å²	65.3	66%	0.656	36%	0.362	S	S	*	.	H	α-helix	trans	-58.4	-37.2	-177.4	-26.5	34.9	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 3.37Å; P74-E77 WeakPolarHBondContact O-CB 3.36Å; P74-E77 PolarHBondContact O-N 2.9Å; P74-E77 VanDerWaalsContact O-N 3.09Å
75	W	95.9	Very high	97	Very high	15 Å²	15	69 Å²	69	6%	0.057	38%	0.377	C	S	.	.	H	α-helix	trans	-70.3	-13.4	-176.1	53.5	-107.1	0	0	0	114.4	V52 F57 A73 Q78 Y195 N198 T202 L203	V52-W75 HydrophobicContact CB-CH2 4.37Å; V52-W75 HydrophobicContact CB-CZ2 4.43Å; V52-W75 HydrophobicContact CG2-CH2 3.85Å; V52-W75 HydrophobicContact CG2-CZ2 4.4Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.34Å; F57-W75 HydrophobicContact CB-CZ3 3.89Å; F57-W75 HydrophobicContact CD1-CH2 4.02Å; F57-W75 AromaticContact CD2-CH2 3.72Å; F57-W75 HydrophobicContact CD2-CH2 3.72Å; F57-W75 AromaticContact CD2-CZ3 3.95Å; F57-W75 HydrophobicContact CD2-CZ3 3.95Å; F57-W75 AromaticContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CH2 3.37Å; F57-W75 HydrophobicContact CG-CZ2 4.09Å; F57-W75 HydrophobicContact CG-CZ3 4.07Å; A73-W75 VanDerWaalsContact C-N 3.29Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.36Å; A73-W75 HydrophobicContact CB-CZ2 3.97Å; A73-W75 PolarHBondContact O-N 2.86Å; W75-Q78 WeakPolarHBondContact O-CG 3.25Å; W75-Y195 HydrophobicContact CE3-CD1 4.18Å; W75-Y195 HydrophobicContact CE3-CG 4.43Å; W75-Y195 HydrophobicContact CH2-CD2 4.5Å; W75-Y195 HydrophobicContact CH2-CG 4.11Å; W75-Y195 AromaticContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD2 4.26Å; W75-Y195 HydrophobicContact CZ3-CE1 4.26Å; W75-Y195 AromaticContact CZ3-CG 3.55Å; W75-Y195 HydrophobicContact CZ3-CG 3.55Å; W75-N198 HydrophobicContact CB-CB 4.37Å; W75-T202 VanDerWaalsContact CD1-OG1 3.28Å; W75-L203 HydrophobicContact CD2-CD1 4.42Å; W75-L203 HydrophobicContact CH2-CD1 4.39Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.16Å; W75-L203 HydrophobicContact CZ2-CG 4.41Å
76	V	97.3	Very high	97	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-94.1	-16.7	172.1	72.3	0	0	0	0	112	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.41Å; F57-V76 HydrophobicContact CD2-CB 4.37Å; F57-V76 HydrophobicContact CD2-CG2 4.09Å; F57-V76 VanDerWaalsContact O-CG1 3.25Å; F57-V76 WeakPolarHBondContact O-CG1 3.39Å; P71-V76 HydrophobicContact CB-CG1 3.76Å; A73-V76 WeakPolarHBondContact O-CG1 3.33Å; A73-V76 PolarHBondContact O-N 3.38Å; P74-V76 PolarHBondContact O-N 3.37Å; V76-Q78 PolarHBondContact O-N 3.48Å; V76-E79 HydrophobicContact CG2-CG 3.92Å; V76-E79 WeakPolarHBondContact O-CB 3.35Å; V76-E79 WeakPolarHBondContact O-CG 3.44Å; V76-E79 PolarHBondContact O-N 2.86Å; V76-Y83 HydrophobicContact CG2-CE1 4.04Å; V76-W84 HydrophobicContact CG1-CH2 4.06Å; V76-W84 HydrophobicContact CG1-CZ2 4.3Å; V76-W84 HydrophobicContact CG2-CH2 3.96Å; V76-W84 HydrophobicContact CG2-CZ2 4.02Å; V76-W84 WeakPolarHBondContact O-CZ2 3.4Å; V76-Y195 HydrophobicContact CG2-CE1 4.38Å
77	E	95.9	Very high	97.1	Very high	122 Å²	122	65.6 Å²	65.6	57%	0.57	33%	0.328	S	S	*	.	H	α-helix	trans	-63.4	-25.4	180	-65	-177.6	-179.1	0	0	112.8	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.71Å; P71-E77 HydrophobicContact CG-CG 3.95Å; P74-E77 WeakPolarHBondContact O-CB 3.36Å; P74-E77 PolarHBondContact O-N 2.9Å; P74-E77 VanDerWaalsContact O-N 3.09Å; E77-E79 PolarHBondContact O-N 3.43Å
78	Q	94.8	Very high	97.2	Very high	122 Å²	122	64.5 Å²	64.5	57%	0.57	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-11.1	175.5	67.8	-178.5	18.6	0	0	114	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.25Å; V76-Q78 PolarHBondContact O-N 3.48Å; Q78-N198 VanDerWaalsContact NE2-CB 3.29Å; Q78-N198 PolarHBondContact NE2-ND2 2.81Å; Q78-N198 PolarHBondContact NE2-OD1 2.88Å; Q78-N198 VanDerWaalsContact NE2-OD1 3.14Å
79	E	96.9	Very high	97.2	Very high	10 Å²	10	62.5 Å²	62.5	5%	0.047	32%	0.317	C	S	.	.	S	Bend	trans	-66.2	137.6	175.2	-65.2	-61.3	162.2	0	0	111	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 3.92Å; V76-E79 WeakPolarHBondContact O-CB 3.35Å; V76-E79 WeakPolarHBondContact O-CG 3.44Å; V76-E79 PolarHBondContact O-N 2.86Å; E77-E79 PolarHBondContact O-N 3.43Å; E79-Y83 HydrophobicContact CB-CD1 3.47Å; E79-Y83 VanDerWaalsContact CB-CD1 3.47Å; E79-Y83 HydrophobicContact CB-CE1 4.07Å; E79-Y83 HydrophobicContact CB-CG 3.77Å; E79-Y83 HydrophobicContact CG-CD1 4.03Å; E79-Y83 HydrophobicContact CG-CE1 4.22Å; E79-Y83 HydrophobicContact CG-CG 4.21Å; E79-W84 PolarHBondContact O-NE1 2.9Å; E79-W84 VanDerWaalsContact O-NE1 3.07Å; E79-R194 IonicContact OE1-CZ 3.37Å; E79-R194 IonicContact OE1-NE 3.74Å; E79-R194 PolarHBondContact OE1-NE 3.43Å; E79-R194 IonicContact OE1-NH2 3.29Å; E79-R194 PolarHBondContact OE1-NH2 3.42Å; E79-R194 IonicContact OE2-CZ 3.94Å; E79-R194 IonicContact OE2-NE 3.19Å; E79-R194 PolarHBondContact OE2-NE 2.93Å; E79-R194 IonicContact OE2-NH2 2.73Å; E79-R194 PolarHBondContact OE2-NH2 2.76Å; E79-N198 PolarHBondContact OE1-ND2 2.97Å
80	G	96.1	Very high	97.2	Very high	35 Å²	35	64.5 Å²	64.5	36%	0.361	33%	0.327	S	S	.	.			trans	-70.6	169.3	-174.1	0	0	0	0	0	114.3	E82 Y83 W84	G80-E82 PolarHBondContact O-N 3.25Å; G80-Y83 WeakPolarHBondContact O-CB 3.18Å; G80-Y83 PolarHBondContact O-N 3.42Å; G80-Y83 VanDerWaalsContact O-N 3.08Å; G80-W84 VanDerWaalsContact O-CD1 3.32Å; G80-W84 PolarHBondContact O-N 3.09Å
81	P	97.1	Very high	97.2	Very high	99 Å²	99	62 Å²	62	64%	0.643	32%	0.315	S	S	*	.	H	α-helix	trans	-57.9	-34.6	-179.1	23.1	-33.7	0	0	0	113.1	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.28Å; P81-Y83 PolarHBondContact O-N 2.92Å; P81-W84 PolarHBondContact O-N 3.19Å; P81-D85 WeakPolarHBondContact O-CB 3.49Å; P81-D85 PolarHBondContact O-N 2.86Å
82	E	97.7	Very high	97.3	Very high	168 Å²	168	63.9 Å²	63.9	79%	0.785	32%	0.318	S	S	*	.	H	α-helix	trans	-60.6	-36.5	178.1	-64.2	169.9	177.3	0	0	112.7	G80 R86	G80-E82 PolarHBondContact O-N 3.25Å; E82-R86 VanDerWaalsContact O-CB 3.25Å; E82-R86 WeakPolarHBondContact O-CB 3.09Å; E82-R86 PolarHBondContact O-N 3.01Å
83	Y	97.7	Very high	97.3	Very high	9 Å²	9	66 Å²	66	4%	0.035	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-52	174.1	168.4	-94.4	0	0	0	110.2	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.04Å; E79-Y83 HydrophobicContact CB-CD1 3.47Å; E79-Y83 VanDerWaalsContact CB-CD1 3.47Å; E79-Y83 HydrophobicContact CB-CE1 4.07Å; E79-Y83 HydrophobicContact CB-CG 3.77Å; E79-Y83 HydrophobicContact CG-CD1 4.03Å; E79-Y83 HydrophobicContact CG-CE1 4.22Å; E79-Y83 HydrophobicContact CG-CG 4.21Å; G80-Y83 WeakPolarHBondContact O-CB 3.18Å; G80-Y83 PolarHBondContact O-N 3.42Å; G80-Y83 VanDerWaalsContact O-N 3.08Å; P81-Y83 VanDerWaalsContact C-N 3.28Å; P81-Y83 PolarHBondContact O-N 2.92Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.83Å; Y83-R86 PolarHBondContact O-N 2.91Å; Y83-E87 HydrophobicContact CD1-CG 4.39Å; Y83-E87 HydrophobicContact CD2-CG 4.05Å; Y83-E87 HydrophobicContact CE1-CG 4.02Å; Y83-E87 HydrophobicContact CE2-CG 3.62Å; Y83-E87 HydrophobicContact CG-CG 4.4Å; Y83-E87 WeakPolarHBondContact O-CG 3.23Å; Y83-E87 PolarHBondContact O-N 3.08Å; Y83-W191 AromaticContact CD2-CH2 3.54Å; Y83-W191 HydrophobicContact CD2-CH2 3.54Å; Y83-W191 HydrophobicContact CD2-CZ2 4.21Å; Y83-W191 AromaticContact CD2-CZ3 3.78Å; Y83-W191 HydrophobicContact CD2-CZ3 3.78Å; Y83-W191 HydrophobicContact CE2-CE3 4.27Å; Y83-W191 AromaticContact CE2-CH2 3.96Å; Y83-W191 HydrophobicContact CE2-CH2 3.96Å; Y83-W191 AromaticContact CE2-CZ3 3.79Å; Y83-W191 HydrophobicContact CE2-CZ3 3.79Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.23Å; Y83-Y195 PolarHBondContact OH-OH 3.27Å
84	W	98.2	Very high	97.4	Very high	39 Å²	39	68.2 Å²	68.2	15%	0.148	34%	0.336	C	S	.	.	H	α-helix	trans	-63.9	-37.6	-177.9	-67.3	112.2	0	0	0	113.3	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.97Å; V58-W84 HydrophobicContact CG1-CZ3 3.89Å; P71-W84 HydrophobicContact CB-CH2 3.63Å; P71-W84 HydrophobicContact CB-CZ2 3.83Å; P71-W84 HydrophobicContact CG-CH2 4.23Å; P71-W84 HydrophobicContact CG-CZ2 4.26Å; V76-W84 HydrophobicContact CG1-CH2 4.06Å; V76-W84 HydrophobicContact CG1-CZ2 4.3Å; V76-W84 HydrophobicContact CG2-CH2 3.96Å; V76-W84 HydrophobicContact CG2-CZ2 4.02Å; V76-W84 WeakPolarHBondContact O-CZ2 3.4Å; E79-W84 PolarHBondContact O-NE1 2.9Å; E79-W84 VanDerWaalsContact O-NE1 3.07Å; G80-W84 VanDerWaalsContact O-CD1 3.32Å; G80-W84 PolarHBondContact O-N 3.09Å; P81-W84 PolarHBondContact O-N 3.19Å; W84-T88 WeakPolarHBondContact O-CB 3.37Å; W84-T88 PolarHBondContact O-N 2.8Å; W84-T88 PolarHBondContact O-OG1 2.83Å
85	D	98.1	Very high	97.5	Very high	110 Å²	110	64.2 Å²	64.2	59%	0.588	31%	0.311	S	S	*	.	H	α-helix	trans	-65.4	-46.4	174.6	-75.9	-21.2	0	0	0	110.8	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.49Å; P81-D85 PolarHBondContact O-N 2.86Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.83Å; D85-T88 PolarHBondContact O-N 2.93Å; D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.44Å; D85-Q89 PolarHBondContact O-N 3.46Å
86	R	97.7	Very high	97.6	Very high	108 Å²	108	68.7 Å²	68.7	41%	0.408	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-48.4	177.9	-172.3	-175.7	68.9	-156.2	-3.7	111.7	E82 Y83 T88 Q89 N90	E82-R86 VanDerWaalsContact O-CB 3.25Å; E82-R86 WeakPolarHBondContact O-CB 3.09Å; E82-R86 PolarHBondContact O-N 3.01Å; Y83-R86 PolarHBondContact O-N 2.91Å; R86-T88 VanDerWaalsContact C-N 3.35Å; R86-T88 PolarHBondContact O-N 3.16Å; R86-Q89 PolarHBondContact O-N 2.69Å; R86-N90 PolarHBondContact O-N 2.78Å; R86-N90 PolarHBondContact O-ND2 2.86Å; R86-N90 PolarHBondContact O-OD1 2.98Å
87	E	97.9	Very high	97.6	Very high	20 Å²	20	70.8 Å²	70.8	9%	0.093	35%	0.35	C	S	.	.	H	α-helix	trans	-64.8	-40.6	179.2	-64.7	-39.5	125.2	0	0	111.3	Y83 Q89 N90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.39Å; Y83-E87 HydrophobicContact CD2-CG 4.05Å; Y83-E87 HydrophobicContact CE1-CG 4.02Å; Y83-E87 HydrophobicContact CE2-CG 3.62Å; Y83-E87 HydrophobicContact CG-CG 4.4Å; Y83-E87 WeakPolarHBondContact O-CG 3.23Å; Y83-E87 PolarHBondContact O-N 3.08Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 3.15Å; E87-N90 WeakPolarHBondContact O-CB 3.35Å; E87-N90 PolarHBondContact O-N 2.89Å; E87-N90 VanDerWaalsContact O-N 3.1Å; E87-N90 PolarHBondContact OE2-ND2 2.93Å; E87-N90 VanDerWaalsContact OE2-ND2 3.16Å; E87-Y91 HydrophobicContact CB-CE2 3.99Å; E87-Y91 WeakPolarHBondContact O-CD2 3.03Å; E87-Y91 PolarHBondContact O-N 2.95Å
88	T	98.5	Very high	97.7	Very high	12 Å²	12	65.3 Å²	65.3	7%	0.074	33%	0.325	C	S	.	.	H	α-helix	trans	-58.3	-42	173.5	-64.3	0	0	0	0	112.1	R68 G69 W84 D85 R86 K92	R68-T88 HydrophobicContact CB-CG2 4.19Å; G69-T88 PolarHBondContact N-OG1 3.48Å; W84-T88 WeakPolarHBondContact O-CB 3.37Å; W84-T88 PolarHBondContact O-N 2.8Å; W84-T88 PolarHBondContact O-OG1 2.83Å; D85-T88 PolarHBondContact O-N 2.93Å; R86-T88 VanDerWaalsContact C-N 3.35Å; R86-T88 PolarHBondContact O-N 3.16Å; T88-K92 HydrophobicContact CG2-CD 4.2Å; T88-K92 WeakPolarHBondContact O-CG 3.36Å; T88-K92 PolarHBondContact O-N 2.69Å
89	Q	98.4	Very high	97.9	Very high	109 Å²	109	62.7 Å²	62.7	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-68.5	-36.1	175.6	-68.4	-62.2	-21.5	0	0	112.3	D85 R86 E87 K92 R93	D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.44Å; D85-Q89 PolarHBondContact O-N 3.46Å; R86-Q89 PolarHBondContact O-N 2.69Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 3.15Å; Q89-K92 PolarHBondContact O-N 2.81Å; Q89-R93 WeakPolarHBondContact O-CB 3.45Å; Q89-R93 WeakPolarHBondContact O-CG 3.44Å; Q89-R93 PolarHBondContact O-N 2.97Å
90	N	97.8	Very high	97.9	Very high	49 Å²	49	65.5 Å²	65.5	26%	0.262	33%	0.327	S	S	.	.	H	α-helix	trans	-59.8	-51.1	173.6	-67.1	-19.1	0	0	0	110.9	R86 E87 K92 R93 Q94	R86-N90 PolarHBondContact O-N 2.78Å; R86-N90 PolarHBondContact O-ND2 2.86Å; R86-N90 PolarHBondContact O-OD1 2.98Å; E87-N90 WeakPolarHBondContact O-CB 3.35Å; E87-N90 PolarHBondContact O-N 2.89Å; E87-N90 VanDerWaalsContact O-N 3.1Å; E87-N90 PolarHBondContact OE2-ND2 2.93Å; E87-N90 VanDerWaalsContact OE2-ND2 3.16Å; N90-K92 VanDerWaalsContact C-N 3.33Å; N90-K92 PolarHBondContact O-N 2.89Å; N90-R93 PolarHBondContact O-N 3.27Å; N90-R93 PolarHBondContact OD1-NH2 3.4Å; N90-Q94 PolarHBondContact O-N 3.3Å
91	Y	98.5	Very high	98	Very high	5 Å²	5	65.8 Å²	65.8	2%	0.02	32%	0.324	C	S	.	.	H	α-helix	trans	-59.3	-42.6	177.4	-62.2	-50.8	0	0	0	112.4	S48 V58 F60 E87 R93 Q94 A95	S48-Y91 VanDerWaalsContact OG-CE1 3.29Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.48Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.39Å; F60-Y91 HydrophobicContact CB-CD1 4.08Å; F60-Y91 HydrophobicContact CB-CD2 3.59Å; F60-Y91 HydrophobicContact CB-CE1 4.45Å; F60-Y91 HydrophobicContact CB-CE2 4.02Å; F60-Y91 HydrophobicContact CB-CG 3.64Å; F60-Y91 HydrophobicContact CD1-CG 4.34Å; F60-Y91 AromaticContact CD2-CD2 3.65Å; F60-Y91 HydrophobicContact CD2-CD2 3.65Å; F60-Y91 AromaticContact CD2-CG 3.86Å; F60-Y91 HydrophobicContact CD2-CG 3.86Å; F60-Y91 HydrophobicContact CG-CD1 4.46Å; F60-Y91 AromaticContact CG-CD2 3.8Å; F60-Y91 HydrophobicContact CG-CD2 3.8Å; F60-Y91 AromaticContact CG-CG 3.69Å; F60-Y91 HydrophobicContact CG-CG 3.69Å; E87-Y91 HydrophobicContact CB-CE2 3.99Å; E87-Y91 WeakPolarHBondContact O-CD2 3.03Å; E87-Y91 PolarHBondContact O-N 2.95Å; Y91-R93 PolarHBondContact O-N 3.1Å; Y91-Q94 PolarHBondContact O-N 2.78Å; Y91-A95 WeakPolarHBondContact O-CB 3.42Å; Y91-A95 PolarHBondContact O-N 2.83Å
92	K	98.4	Very high	98	Very high	87 Å²	87	61.5 Å²	61.5	38%	0.378	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-38.8	177.3	-74.6	176.4	179.8	175.8	0	112.5	F60 P67 T88 Q89 N90 Q96	F60-K92 HydrophobicContact CE2-CG 4.4Å; F60-K92 HydrophobicContact CZ-CG 4.14Å; P67-K92 VanDerWaalsContact O-CE 3.28Å; P67-K92 WeakPolarHBondContact O-CE 3.25Å; P67-K92 PolarHBondContact O-NZ 2.96Å; T88-K92 HydrophobicContact CG2-CD 4.2Å; T88-K92 WeakPolarHBondContact O-CG 3.36Å; T88-K92 PolarHBondContact O-N 2.69Å; Q89-K92 PolarHBondContact O-N 2.81Å; N90-K92 VanDerWaalsContact C-N 3.33Å; N90-K92 PolarHBondContact O-N 2.89Å; K92-Q96 WeakPolarHBondContact O-CG 3.44Å; K92-Q96 PolarHBondContact O-N 2.82Å
93	R	98.3	Very high	98	Very high	163 Å²	163	59.5 Å²	59.5	62%	0.615	28%	0.281	S	S	*	.	H	α-helix	trans	-66.3	-44.4	174.7	-74.4	-172.1	-65.6	169.2	-0.6	111.4	Q89 N90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.45Å; Q89-R93 WeakPolarHBondContact O-CG 3.44Å; Q89-R93 PolarHBondContact O-N 2.97Å; N90-R93 PolarHBondContact O-N 3.27Å; N90-R93 PolarHBondContact OD1-NH2 3.4Å; Y91-R93 PolarHBondContact O-N 3.1Å; R93-Q96 PolarHBondContact O-N 3.48Å; R93-A97 PolarHBondContact O-N 2.91Å
94	Q	98.3	Very high	97.9	Very high	49 Å²	49	62.5 Å²	62.5	23%	0.229	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-45.2	177.1	-170.4	61.1	47.4	0	0	111.4	F46 N90 Y91 Q96 A97 D98	F46-Q94 HydrophobicContact CE2-CB 4.28Å; F46-Q94 HydrophobicContact CE2-CG 3.77Å; F46-Q94 HydrophobicContact CZ-CB 3.9Å; F46-Q94 HydrophobicContact CZ-CG 3.71Å; N90-Q94 PolarHBondContact O-N 3.3Å; Y91-Q94 PolarHBondContact O-N 2.78Å; Q94-Q96 VanDerWaalsContact C-N 3.27Å; Q94-Q96 PolarHBondContact O-N 2.79Å; Q94-A97 CarbonylContact O-C 3.58Å; Q94-A97 WeakPolarHBondContact O-CA 3.36Å; Q94-A97 WeakPolarHBondContact O-CB 3.46Å; Q94-A97 PolarHBondContact O-N 2.85Å; Q94-D98 PolarHBondContact NE2-OD1 2.83Å; Q94-D98 PolarHBondContact O-N 3.11Å
95	A	98.4	Very high	97.9	Very high	18 Å²	18	60.9 Å²	60.9	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-56.3	-39.8	176.4	0	0	0	0	0	112.9	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.7Å; F46-A95 HydrophobicContact CD1-CB 3.68Å; F46-A95 HydrophobicContact CD2-CB 4.16Å; F46-A95 HydrophobicContact CE1-CB 4.33Å; F46-A95 HydrophobicContact CG-CB 3.57Å; Y91-A95 WeakPolarHBondContact O-CB 3.42Å; Y91-A95 PolarHBondContact O-N 2.83Å; A95-R99 WeakPolarHBondContact O-CB 2.97Å; A95-R99 PolarHBondContact O-N 3.47Å
96	Q	98.1	Very high	97.9	Very high	109 Å²	109	58.7 Å²	58.7	51%	0.509	28%	0.275	S	S	.	.	H	α-helix	trans	-70.2	-39.3	174.9	-67.1	-58.2	-34.6	0	0	112.3	K92 R93 Q94 R99 V100	K92-Q96 WeakPolarHBondContact O-CG 3.44Å; K92-Q96 PolarHBondContact O-N 2.82Å; R93-Q96 PolarHBondContact O-N 3.48Å; Q94-Q96 VanDerWaalsContact C-N 3.27Å; Q94-Q96 PolarHBondContact O-N 2.79Å; Q96-R99 PolarHBondContact O-N 3.01Å; Q96-V100 WeakPolarHBondContact O-CG2 3.39Å; Q96-V100 PolarHBondContact O-N 2.97Å; Q96-V100 VanDerWaalsContact O-N 3.16Å
97	A	97.8	Very high	97.8	Very high	44 Å²	44	55.6 Å²	55.6	36%	0.364	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-43.8	175.8	0	0	0	0	0	111.3	R93 Q94 R99 V100 S101	R93-A97 PolarHBondContact O-N 2.91Å; Q94-A97 CarbonylContact O-C 3.58Å; Q94-A97 WeakPolarHBondContact O-CA 3.36Å; Q94-A97 WeakPolarHBondContact O-CB 3.46Å; Q94-A97 PolarHBondContact O-N 2.85Å; A97-R99 PolarHBondContact O-N 3.19Å; A97-V100 PolarHBondContact O-N 3.18Å; A97-S101 WeakPolarHBondContact O-CB 3.12Å; A97-S101 PolarHBondContact O-N 3.48Å; A97-S101 PolarHBondContact O-OG 2.92Å
98	D	98.1	Very high	97.8	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.032	28%	0.283	C	S	.	.	H	α-helix	trans	-67.6	-36.8	178.7	-73.6	-0.4	0	0	0	112	A35 F46 Q94 V100 S101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.63Å; F46-D98 HydrophobicContact CD2-CB 4.5Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.31Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.5Å; Q94-D98 PolarHBondContact NE2-OD1 2.83Å; Q94-D98 PolarHBondContact O-N 3.11Å; D98-V100 VanDerWaalsContact C-N 3.29Å; D98-V100 PolarHBondContact O-N 3.31Å; D98-S101 PolarHBondContact O-N 3.12Å; D98-L102 WeakPolarHBondContact O-CB 3.4Å; D98-L102 WeakPolarHBondContact O-CG 3.3Å; D98-L102 PolarHBondContact O-N 2.04Å; D98-L119 HydrophobicContact CB-CD2 4.19Å
99	R	97.8	Very high	97.8	Very high	68 Å²	68	59.9 Å²	59.9	26%	0.257	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-39.3	172.1	178.5	-168.8	174.5	-166.7	6.8	112.4	E43 P44 A95 Q96 A97 R103	E43-R99 IonicContact OE1-CZ 3.59Å; E43-R99 VanDerWaalsContact OE1-CZ 3.28Å; E43-R99 IonicContact OE1-NE 2.72Å; E43-R99 IonicContact OE1-NH2 3.35Å; E43-R99 PolarHBondContact OE1-NH2 3.17Å; E43-R99 WeakPolarHBondContact OE2-CD 3.42Å; E43-R99 IonicContact OE2-CZ 3.47Å; E43-R99 IonicContact OE2-NE 3.03Å; E43-R99 PolarHBondContact OE2-NE 3.11Å; E43-R99 IonicContact OE2-NH1 3.34Å; E43-R99 IonicContact OE2-NH2 3.03Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å; P44-R99 HydrophobicContact CG-CB 4.4Å; P44-R99 HydrophobicContact CG-CG 4.11Å; A95-R99 WeakPolarHBondContact O-CB 2.97Å; A95-R99 PolarHBondContact O-N 3.47Å; Q96-R99 PolarHBondContact O-N 3.01Å; A97-R99 PolarHBondContact O-N 3.19Å; R99-R103 PolarHBondContact O-NE 3.26Å
100	V	97.4	Very high	97.7	Very high	68 Å²	68	62 Å²	62	41%	0.412	31%	0.306	S	S	.	.	H	α-helix	trans	-72.5	-41.3	175.2	174.3	0	0	0	0	110.1	Q96 A97 D98 R103 N104	Q96-V100 WeakPolarHBondContact O-CG2 3.39Å; Q96-V100 PolarHBondContact O-N 2.97Å; Q96-V100 VanDerWaalsContact O-N 3.16Å; A97-V100 PolarHBondContact O-N 3.18Å; D98-V100 VanDerWaalsContact C-N 3.29Å; D98-V100 PolarHBondContact O-N 3.31Å; V100-R103 WeakPolarHBondContact O-CB 3.21Å; V100-R103 PolarHBondContact O-N 2.86Å; V100-N104 PolarHBondContact O-N 2.88Å
101	S	97.9	Very high	97.6	Very high	42 Å²	42	62.5 Å²	62.5	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-61.5	-45.2	178.9	-60.3	0	0	0	0	112.1	A97 D98 R103 N104 L105	A97-S101 WeakPolarHBondContact O-CB 3.12Å; A97-S101 PolarHBondContact O-N 3.48Å; A97-S101 PolarHBondContact O-OG 2.92Å; D98-S101 PolarHBondContact O-N 3.12Å; S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 2.75Å; S101-N104 PolarHBondContact O-N 2.89Å; S101-N104 VanDerWaalsContact O-N 3.09Å; S101-L105 WeakPolarHBondContact O-CB 3.41Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.48Å; S101-L105 PolarHBondContact O-N 3.14Å
102	L	98.1	Very high	97.4	Very high	8 Å²	8	66 Å²	66	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-56.1	-39.5	174.4	-77.3	168.1	0	0	0	112.5	A35 P44 D98 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.86Å; P44-L102 HydrophobicContact CB-CD1 3.69Å; P44-L102 HydrophobicContact CG-CD1 3.87Å; D98-L102 WeakPolarHBondContact O-CB 3.4Å; D98-L102 WeakPolarHBondContact O-CG 3.3Å; D98-L102 PolarHBondContact O-N 2.04Å; L102-R106 WeakPolarHBondContact O-CB 3.34Å; L102-R106 PolarHBondContact O-N 3.38Å; L102-R106 VanDerWaalsContact O-N 3.13Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; L102-L119 HydrophobicContact CD2-CB 3.69Å; L102-L119 HydrophobicContact CG-CB 4.12Å; L102-Y142 HydrophobicContact CD2-CE2 4.04Å
103	R	96.1	Very high	97	Very high	126 Å²	126	68 Å²	68	48%	0.475	34%	0.343	S	S	.	.	H	α-helix	trans	-68.5	-41.5	175.8	-76.2	-177.5	-88.7	169.9	-8.3	112.3	R99 V100 S101 G107	R99-R103 PolarHBondContact O-NE 3.26Å; V100-R103 WeakPolarHBondContact O-CB 3.21Å; V100-R103 PolarHBondContact O-N 2.86Å; S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 2.75Å; R103-G107 PolarHBondContact O-N 3.39Å
104	N	97.1	Very high	96.6	Very high	72 Å²	72	67.2 Å²	67.2	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-66.1	-46.9	177.7	-68.9	-21.5	0	0	0	111.7	V100 S101 R106 G107 Y108	V100-N104 PolarHBondContact O-N 2.88Å; S101-N104 PolarHBondContact O-N 2.89Å; S101-N104 VanDerWaalsContact O-N 3.09Å; N104-R106 PolarHBondContact O-N 3.43Å; N104-G107 CarbonylContact O-C 3.54Å; N104-G107 WeakPolarHBondContact O-CA 3.24Å; N104-G107 PolarHBondContact O-N 3.27Å; N104-Y108 WeakPolarHBondContact O-CD1 3.35Å; N104-Y108 PolarHBondContact O-N 3.35Å
105	L	97.9	Very high	96.3	Very high	5 Å²	5	65.8 Å²	65.8	3%	0.026	35%	0.35	C	S	.	.	H	α-helix	trans	-59.7	-47.2	179.9	-70.5	166.9	0	0	0	110.9	S101 G107 Y108 Y109 L119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.41Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.48Å; S101-L105 PolarHBondContact O-N 3.14Å; L105-G107 PolarHBondContact O-N 2.83Å; L105-Y108 HydrophobicContact CD2-CD2 4.49Å; L105-Y108 PolarHBondContact O-N 3.38Å; L105-Y109 HydrophobicContact CD2-CE2 4.29Å; L105-Y109 VanDerWaalsContact O-CD2 3.26Å; L105-Y109 WeakPolarHBondContact O-CD2 3.36Å; L105-Y109 PolarHBondContact O-N 2.97Å; L105-L119 HydrophobicContact CD1-CD1 3.85Å; L105-L119 HydrophobicContact CD1-CD2 4.24Å; L105-L119 HydrophobicContact CD1-CG 4.49Å; L105-Y142 HydrophobicContact CB-CD1 4.34Å; L105-Y142 HydrophobicContact CB-CD2 4.21Å; L105-Y142 HydrophobicContact CB-CE1 3.98Å; L105-Y142 HydrophobicContact CB-CE2 3.86Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.59Å; L105-Y142 HydrophobicContact CD1-CE2 3.94Å; L105-Y142 HydrophobicContact CD1-CG 4.02Å; L105-Y142 HydrophobicContact CG-CD2 4.42Å; L105-Y147 HydrophobicContact CD2-CD1 4.34Å; L105-Y147 HydrophobicContact CD2-CD2 4.04Å; L105-Y147 HydrophobicContact CD2-CE1 3.75Å; L105-Y147 HydrophobicContact CD2-CE2 3.38Å; L105-Y147 HydrophobicContact CD2-CG 4.48Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.49Å
106	R	96.6	Very high	96.2	Very high	64 Å²	64	68.6 Å²	68.6	24%	0.242	37%	0.369	C	S	.	.	H	α-helix	trans	-52.8	-41.7	173.7	-170.4	-174.5	67.6	176.3	9.4	112.1	L102 N104 N110 Q111 E113	L102-R106 WeakPolarHBondContact O-CB 3.34Å; L102-R106 PolarHBondContact O-N 3.38Å; L102-R106 VanDerWaalsContact O-N 3.13Å; N104-R106 PolarHBondContact O-N 3.43Å; R106-N110 PolarHBondContact O-N 3.38Å; R106-N110 VanDerWaalsContact O-N 3.15Å; R106-Q111 HydrophobicContact CG-CB 3.78Å; R106-Q111 PolarHBondContact O-N 3.16Å; R106-E113 IonicContact CZ-OE1 3.68Å; R106-E113 IonicContact NH1-OE1 3.54Å; R106-E113 IonicContact NH2-OE1 3.3Å; R106-E113 PolarHBondContact NH2-OE1 3.34Å
107	G	96.6	Very high	96.3	Very high	44 Å²	44	64.1 Å²	64.1	45%	0.454	35%	0.347	S	S	.	.	H	α-helix	trans	-66.6	-45.4	175.3	0	0	0	0	0	113.2	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 3.39Å; N104-G107 CarbonylContact O-C 3.54Å; N104-G107 WeakPolarHBondContact O-CA 3.24Å; N104-G107 PolarHBondContact O-N 3.27Å; L105-G107 PolarHBondContact O-N 2.83Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 3.44Å; G107-N110 PolarHBondContact O-N 2.98Å; G107-N110 VanDerWaalsContact O-N 3.14Å
108	Y	97.8	Very high	96.3	Very high	54 Å²	54	63.9 Å²	63.9	21%	0.212	34%	0.341	C	S	.	.	H	α-helix	trans	-61.9	-35.6	179.3	-63.3	-11.8	0	0	0	112.7	N104 L105 I166 K170	N104-Y108 WeakPolarHBondContact O-CD1 3.35Å; N104-Y108 PolarHBondContact O-N 3.35Å; L105-Y108 HydrophobicContact CD2-CD2 4.49Å; L105-Y108 PolarHBondContact O-N 3.38Å; Y108-I166 HydrophobicContact CD1-CD1 4.17Å; Y108-I166 HydrophobicContact CD2-CD1 4.44Å; Y108-I166 HydrophobicContact CE1-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.08Å; Y108-I166 HydrophobicContact CE2-CB 4.16Å; Y108-I166 HydrophobicContact CE2-CG2 4.04Å; Y108-I166 HydrophobicContact CG-CD1 4.18Å; Y108-K170 PolarHBondContact OH-NZ 3.35Å
109	Y	97.8	Very high	96.3	Very high	68 Å²	68	64.1 Å²	64.1	27%	0.267	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	4.5	178.3	-69	-72.8	0	0	0	114	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.29Å; L105-Y109 VanDerWaalsContact O-CD2 3.26Å; L105-Y109 WeakPolarHBondContact O-CD2 3.36Å; L105-Y109 PolarHBondContact O-N 2.97Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 3.44Å; Y109-Q111 VanDerWaalsContact C-N 3.26Å; Y109-Q111 PolarHBondContact O-N 2.91Å; Y109-Y142 AromaticContact CD2-CD1 3.73Å; Y109-Y142 HydrophobicContact CD2-CD1 3.73Å; Y109-Y142 AromaticContact CD2-CE1 3.54Å; Y109-Y142 HydrophobicContact CD2-CE1 3.54Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.88Å; Y109-Y142 HydrophobicContact CE2-CE1 3.88Å; Y109-Y142 HydrophobicContact CG-CE1 4.43Å; Y109-Y147 HydrophobicContact CE2-CD2 4.34Å; Y109-Y147 HydrophobicContact CE2-CE2 4.04Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.4Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.47Å; Y109-D161 VanDerWaalsContact CE1-OD2 3.24Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.45Å; Y109-D161 VanDerWaalsContact OH-CG 3.23Å; Y109-D161 PolarHBondContact OH-OD1 2.61Å; Y109-D161 VanDerWaalsContact OH-OD1 3.13Å; Y109-D161 PolarHBondContact OH-OD2 3.02Å; Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.42Å; Y109-A163 HydrophobicContact CE1-CB 3.61Å; Y109-A163 HydrophobicContact CE2-CB 3.9Å; Y109-A163 VanDerWaalsContact CZ-CB 3.47Å
110	N	96.6	Very high	96.4	Very high	152 Å²	152	64.6 Å²	64.6	81%	0.813	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	40.6	-178.5	-57.5	-60	0	0	0	113.7	R106 G107	R106-N110 PolarHBondContact O-N 3.38Å; R106-N110 VanDerWaalsContact O-N 3.15Å; G107-N110 PolarHBondContact O-N 2.98Å; G107-N110 VanDerWaalsContact O-N 3.14Å
111	Q	96.7	Very high	96.4	Very high	60 Å²	60	63.3 Å²	63.3	28%	0.28	34%	0.336	S	S	.	.			trans	-88.6	152.3	-176.5	-69.8	165.3	-33.9	0	0	112.1	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.78Å; R106-Q111 PolarHBondContact O-N 3.16Å; Y109-Q111 VanDerWaalsContact C-N 3.26Å; Y109-Q111 PolarHBondContact O-N 2.91Å; Q111-H117 PolarHBondContact NE2-CE1 3.44Å; Q111-H117 PolarHBondContact OE1-CE1 2.99Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.22Å; Q111-Y142 PolarHBondContact OE1-OH 2.94Å; Q111-D143 PolarHBondContact NE2-OD2 2.82Å
112	S	93.7	Very high	96.5	Very high	79 Å²	79	62.3 Å²	62.3	55%	0.552	33%	0.327	S	S	*	.			trans	-68.6	153.9	-179.7	58.5	0	0	0	0	113.1	D114 G115	S112-D114 VanDerWaalsContact C-N 3.29Å; S112-D114 PolarHBondContact O-N 2.94Å; S112-G115 PolarHBondContact O-N 2.98Å
113	E	89.7	Confident	96.5	Very high	129 Å²	129	63.4 Å²	63.4	60%	0.603	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-24.8	179.2	-57.9	-150.3	123.5	0	0	114.5	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.38Å; P39-E113 WeakPolarHBondContact CG-O 3.46Å; R106-E113 IonicContact CZ-OE1 3.68Å; R106-E113 IonicContact NH1-OE1 3.54Å; R106-E113 IonicContact NH2-OE1 3.3Å; R106-E113 PolarHBondContact NH2-OE1 3.34Å; E113-G115 PolarHBondContact O-N 3.44Å
114	D	89.9	Confident	96.6	Very high	146 Å²	146	57.4 Å²	57.4	78%	0.781	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-7.7	-177.4	-58.2	-40.1	0	0	0	113.2	S112	S112-D114 VanDerWaalsContact C-N 3.29Å; S112-D114 PolarHBondContact O-N 2.94Å
115	G	92.4	Very high	96.7	Very high	19 Å²	19	54 Å²	54	20%	0.196	29%	0.29	C	S	.	.			trans	-76.4	130.6	179.6	0	0	0	0	0	112.8	P39 S112 E113 H117	P39-G115 VanDerWaalsContact CG-O 3.22Å; P39-G115 WeakPolarHBondContact CG-O 3.38Å; S112-G115 PolarHBondContact O-N 2.98Å; E113-G115 PolarHBondContact O-N 3.44Å; G115-H117 PolarHBondContact O-CD2 3.07Å
116	S	97	Very high	96.7	Very high	78 Å²	78	54.8 Å²	54.8	55%	0.545	29%	0.294	S	S	.	.			trans	-79.4	131.5	164.8	-175.2	0	0	0	0	109	S37	S37-S116 PolarHBondContact O-OG 3.37Å
117	H	98.3	Very high	96.7	Very high	14 Å²	14	51.9 Å²	51.9	7%	0.065	28%	0.283	C	S	.	.			trans	-131.9	151.8	-176.9	-64.2	-74	0	0	0	110.8	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 WeakPolarHBondContact CA-O 3.26Å; S37-H117 PolarHBondContact N-O 3.46Å; S37-H117 PolarHBondContact OG-N 3.26Å; S37-H117 PolarHBondContact OG-O 3.48Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; Q111-H117 PolarHBondContact NE2-CE1 3.44Å; Q111-H117 PolarHBondContact OE1-CE1 2.99Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.22Å; G115-H117 PolarHBondContact O-CD2 3.07Å; H117-Y142 HydrophobicContact CB-CE2 3.8Å; H117-Y142 WeakPolarHBondContact CB-OH 3.49Å; H117-Y142 AromaticContact CG-CZ 3.98Å; H117-Y142 AromaticContact ND1-CZ 3.9Å; H117-Y142 PolarHBondContact ND1-OH 2.81Å; H117-D143 WeakPolarHBondContact CA-OD1 3.47Å; H117-D143 WeakPolarHBondContact CB-OD1 3.4Å; H117-D143 IonicContact CE1-OD2 2.75Å; H117-D143 IonicContact CG-OD1 2.72Å; H117-D143 IonicContact CG-OD2 3.68Å; H117-D143 IonicContact ND1-OD1 3.21Å; H117-D143 IonicContact ND1-OD2 3.75Å; H117-D143 PolarHBondContact ND1-OD2 3.36Å
118	T	98.7	Very high	96.5	Very high	39 Å²	39	50.1 Å²	50.1	24%	0.239	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.9	-175.9	-57.5	0	0	0	0	110.1	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.1Å; A35-T118 WeakPolarHBondContact O-CA 3.43Å; V36-T118 HydrophobicContact CG2-CG2 4.21Å; T118-Q120 HydrophobicContact CG2-CG 3.89Å; T118-Y142 CarbonylContact O-C 3.57Å; T118-Y142 WeakPolarHBondContact O-CA 3.49Å; T118-Y142 VanDerWaalsContact O-CD2 3.3Å; T118-Y142 WeakPolarHBondContact O-CD2 3.48Å; T118-D143 PolarHBondContact N-OD1 3.08Å; T118-D143 PolarHBondContact O-N 2.84Å
119	L	98.8	Very high	96.1	Very high	11 Å²	11	51.9 Å²	51.9	6%	0.058	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.3	169.5	175.3	62.3	0	0	0	108.1	T34 A35 D98 L102 L105 A141	T34-L119 WeakPolarHBondContact CA-O 3.47Å; A35-L119 HydrophobicContact CB-CB 4.46Å; A35-L119 PolarHBondContact N-O 3.39Å; A35-L119 PolarHBondContact O-N 3.27Å; D98-L119 HydrophobicContact CB-CD2 4.19Å; L102-L119 HydrophobicContact CD2-CB 3.69Å; L102-L119 HydrophobicContact CG-CB 4.12Å; L105-L119 HydrophobicContact CD1-CD1 3.85Å; L105-L119 HydrophobicContact CD1-CD2 4.24Å; L105-L119 HydrophobicContact CD1-CG 4.49Å; L119-A141 WeakPolarHBondContact CD1-O 3.48Å
120	Q	98.8	Very high	95.6	Very high	79 Å²	79	53.5 Å²	53.5	37%	0.369	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	143.4	177.7	-60.9	174.2	-90.6	0	0	109.2	D33 T34 T118 S140 A141	D33-Q120 VanDerWaalsContact O-CA 3.3Å; D33-Q120 WeakPolarHBondContact O-CA 3.45Å; T34-Q120 HydrophobicContact CG2-CG 4.18Å; T118-Q120 HydrophobicContact CG2-CG 3.89Å; Q120-S140 CarbonylContact O-C 3.52Å; Q120-S140 WeakPolarHBondContact O-CA 3.2Å; Q120-A141 HydrophobicContact CB-CB 4.44Å; Q120-A141 PolarHBondContact N-O 2.81Å; Q120-A141 PolarHBondContact O-N 3.46Å
121	R	98.7	Very high	95.2	Very high	41 Å²	41	47.1 Å²	47.1	16%	0.155	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	133	173.3	179.4	176	170.5	-114.6	3.5	109.7	F32 D33 Y123 D138 Q139	F32-R121 WeakPolarHBondContact CA-O 3.24Å; D33-R121 HydrophobicContact CB-CB 4.27Å; D33-R121 PolarHBondContact N-O 2.6Å; D33-R121 PolarHBondContact O-N 2.92Å; D33-R121 IonicContact OD2-NH1 2.65Å; R121-Y123 HydrophobicContact CG-CD1 4.3Å; R121-Y123 VanDerWaalsContact CZ-CD1 3.49Å; R121-Y123 VanDerWaalsContact NH1-CD1 3.28Å; R121-Y123 VanDerWaalsContact NH1-CE1 3.28Å; R121-D138 IonicContact CZ-OD1 3.71Å; R121-D138 IonicContact NE-OD1 3.37Å; R121-D138 PolarHBondContact NE-OD1 2.93Å; R121-D138 IonicContact NE-OD2 3.67Å; R121-D138 IonicContact NH2-OD1 3.64Å; R121-D138 PolarHBondContact NH2-OD1 2.81Å; R121-Q139 CarbonylContact C-O 3.53Å; R121-Q139 VanDerWaalsContact CA-O 3.31Å; R121-Q139 WeakPolarHBondContact CA-O 3.36Å
122	M	98.8	Very high	95.1	Very high	20 Å²	20	52.3 Å²	52.3	10%	0.099	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.3	169.3	-176.6	-79	-74.3	0	0	108.4	Y31 F32 Y137 D138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.36Å; F32-M122 HydrophobicContact CD1-CB 3.98Å; F32-M122 HydrophobicContact CD1-CG 3.71Å; F32-M122 HydrophobicContact CE1-CB 4.11Å; F32-M122 HydrophobicContact CE1-CG 3.41Å; F32-M122 VanDerWaalsContact CE1-CG 3.41Å; F32-M122 HydrophobicContact CZ-CG 4.01Å; M122-Y137 HydrophobicContact CE-CD1 4.12Å; M122-Y137 HydrophobicContact CE-CG 4.17Å; M122-Y137 HydrophobicContact SD-CG 4.48Å; M122-D138 WeakPolarHBondContact O-CA 3.49Å; M122-Q139 HydrophobicContact CB-CG 4.11Å; M122-Q139 VanDerWaalsContact CE-CD 3.45Å; M122-Q139 HydrophobicContact CE-CG 3.85Å; M122-Q139 PolarHBondContact N-O 3.42Å; M122-Q139 PolarHBondContact O-N 3.22Å
123	Y	98.6	Very high	95.2	Very high	32 Å²	32	50.9 Å²	50.9	13%	0.125	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	155.6	174	68.3	-85.7	0	0	0	110.7	Y31 R121 Y137 Y183	Y31-Y123 VanDerWaalsContact CB-CE1 3.44Å; Y31-Y123 HydrophobicContact CD2-CD2 4.35Å; Y31-Y123 AromaticContact CD2-CE2 3.63Å; Y31-Y123 HydrophobicContact CD2-CE2 3.63Å; Y31-Y123 AromaticContact CD2-CZ 3.87Å; Y31-Y123 HydrophobicContact CE2-CE2 4.42Å; Y31-Y123 HydrophobicContact CG-CE1 4.25Å; Y31-Y123 AromaticContact CG-CE2 3.9Å; Y31-Y123 HydrophobicContact CG-CE2 3.9Å; Y31-Y123 AromaticContact CG-CZ 3.63Å; Y31-Y123 PolarHBondContact N-O 3.13Å; Y31-Y123 PolarHBondContact O-N 2.85Å; Y31-Y123 VanDerWaalsContact O-N 3.11Å; R121-Y123 HydrophobicContact CG-CD1 4.3Å; R121-Y123 VanDerWaalsContact CZ-CD1 3.49Å; R121-Y123 VanDerWaalsContact NH1-CD1 3.28Å; R121-Y123 VanDerWaalsContact NH1-CE1 3.28Å; Y123-Y137 WeakPolarHBondContact CA-O 3.21Å; Y123-Y137 WeakPolarHBondContact CB-O 3.34Å; Y123-Y183 AromaticContact CD2-CE1 3.93Å; Y123-Y183 HydrophobicContact CD2-CE1 3.93Å; Y123-Y183 HydrophobicContact CE2-CE1 4.06Å
124	G	98.5	Very high	95.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.1	-175.7	-177.2	0	0	0	0	0	114.4	M29 G136 Y137 L184	M29-G124 CarbonylContact O-C 3.59Å; M29-G124 WeakPolarHBondContact O-CA 3.41Å; G124-G136 CarbonylContact O-C 3.48Å; G124-G136 WeakPolarHBondContact O-CA 3.48Å; G124-Y137 PolarHBondContact N-O 2.9Å; G124-Y137 PolarHBondContact O-N 3.42Å; G124-L184 WeakPolarHBondContact O-CD2 3.3Å
125	C	98.5	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.2	-176.8	53.8	0	0	0	0	111.4	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.32Å; M29-C125 PolarHBondContact N-O 3.46Å; M29-C125 PolarHBondContact O-N 2.87Å; C125-L133 HydrophobicContact CB-CD1 3.56Å; C125-R135 CarbonylContact C-O 3.56Å; C125-R135 WeakPolarHBondContact CA-O 3.24Å; C125-C188 HydrophobicContact CB-CB 3.94Å; C125-C188 WeakPolarHBondContact CB-SG 3.37Å; C125-C188 PolarHBondContact N-SG 2.75Å; C125-C188 VanDerWaalsContact N-SG 3.36Å; C125-C188 WeakPolarHBondContact SG-CB 3.06Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.82Å
126	D	97.9	Very high	96.1	Very high	21 Å²	21	47.3 Å²	47.3	11%	0.112	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.3	171	-60.4	-10.9	0	0	0	108.7	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.59Å; H27-D126 WeakPolarHBondContact O-CA 3.37Å; S28-D126 WeakPolarHBondContact CB-OD1 3.31Å; R30-D126 IonicContact CZ-OD1 3.63Å; R30-D126 IonicContact NE-OD1 3.72Å; R30-D126 PolarHBondContact NE-OD1 3.14Å; R30-D126 VanDerWaalsContact NH2-CG 3.28Å; R30-D126 IonicContact NH2-OD1 3.86Å; R30-D126 PolarHBondContact NH2-OD1 3.37Å; R30-D126 IonicContact NH2-OD2 2.81Å; R30-D126 PolarHBondContact NH2-OD2 2.85Å; D126-L134 HydrophobicContact CB-CB 4.34Å; D126-L134 PolarHBondContact O-N 3.48Å; D126-R135 HydrophobicContact CB-CB 4.43Å; D126-R135 PolarHBondContact N-O 3.21Å; D126-R135 PolarHBondContact O-N 3.2Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.31Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.3Å; D126-Y137 PolarHBondContact OD2-OH 2.89Å
127	L	96.4	Very high	96.2	Very high	3 Å²	3	45.4 Å²	45.4	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.2	172.5	-57	-176.6	0	0	0	110.1	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.3Å; S26-L127 WeakPolarHBondContact CA-O 3.2Å; S26-L127 WeakPolarHBondContact CB-O 3.08Å; H27-L127 PolarHBondContact N-O 3.15Å; H27-L127 PolarHBondContact O-N 3.31Å; L127-R132 CarbonylContact C-O 3.58Å; L127-R132 VanDerWaalsContact CA-O 3.25Å; L127-R132 WeakPolarHBondContact CA-O 3.34Å; L127-V189 HydrophobicContact CD2-CB 4.14Å; L127-V189 HydrophobicContact CD2-CG1 3.73Å; L127-V189 HydrophobicContact CD2-CG2 3.8Å; L127-L192 HydrophobicContact CB-CD2 4.5Å; L127-L192 HydrophobicContact CD1-CB 4.25Å; L127-L192 HydrophobicContact CD1-CD2 3.69Å; L127-L192 HydrophobicContact CD1-CG 3.72Å; L127-L192 HydrophobicContact CD2-CD2 4.48Å; L127-L192 HydrophobicContact CG-CD2 3.56Å; L127-L192 HydrophobicContact CG-CG 4.19Å; L127-R193 HydrophobicContact CD1-CG 3.92Å
128	G	93.1	Very high	96.2	Very high	8 Å²	8	45.1 Å²	45.1	8%	0.082	22%	0.224	C	C	.	.			trans	-69.7	174.1	165	0	0	0	0	0	111.6	D130 G131 R132	G128-D130 PolarHBondContact O-N 3.28Å; G128-G131 WeakPolarHBondContact O-CA 3.26Å; G128-G131 PolarHBondContact O-N 3.05Å; G128-R132 PolarHBondContact N-O 3.18Å
129	P	88.6	Confident	96.2	Very high	90 Å²	90	47.2 Å²	47.2	58%	0.584	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.4	178.9	-18.2	29.2	0	0	0	113.6	A24 G131	A24-P129 HydrophobicContact CB-CB 3.71Å; A24-P129 HydrophobicContact CB-CG 3.13Å; P129-G131 PolarHBondContact O-N 3.46Å
130	D	88.3	Confident	96.2	Very high	102 Å²	102	47.7 Å²	47.7	55%	0.545	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	3.4	173.7	69.6	-14.2	0	0	0	112.9	G128 R132	G128-D130 PolarHBondContact O-N 3.28Å; D130-R132 PolarHBondContact O-N 3.2Å; D130-R132 WeakPolarHBondContact OD1-CB 3.46Å; D130-R132 PolarHBondContact OD1-N 2.81Å; D130-R132 WeakPolarHBondContact OD2-CD 2.89Å; D130-R132 WeakPolarHBondContact OD2-CG 3.3Å; D130-R132 IonicContact OD2-NE 2.65Å
131	G	88.6	Confident	96.2	Very high	18 Å²	18	44.8 Å²	44.8	19%	0.186	22%	0.224	C	C	.	.	S	Bend	trans	71.6	8.7	-178.4	0	0	0	0	0	113.8	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.26Å; G128-G131 PolarHBondContact O-N 3.05Å; P129-G131 PolarHBondContact O-N 3.46Å; G131-R193 VanDerWaalsContact O-CZ 3.25Å; G131-R193 PolarHBondContact O-NE 3.19Å; G131-R193 PolarHBondContact O-NH2 2.97Å
132	R	93.4	Very high	96.2	Very high	169 Å²	169	43.3 Å²	43.3	64%	0.638	22%	0.219	S	C	*	.	S	Bend	trans	-89.2	156.9	179.2	-61.3	-173.3	-176.7	172	-2.1	111	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.58Å; L127-R132 VanDerWaalsContact CA-O 3.25Å; L127-R132 WeakPolarHBondContact CA-O 3.34Å; G128-R132 PolarHBondContact N-O 3.18Å; D130-R132 PolarHBondContact O-N 3.2Å; D130-R132 WeakPolarHBondContact OD1-CB 3.46Å; D130-R132 PolarHBondContact OD1-N 2.81Å; D130-R132 WeakPolarHBondContact OD2-CD 2.89Å; D130-R132 WeakPolarHBondContact OD2-CG 3.3Å; D130-R132 IonicContact OD2-NE 2.65Å; R132-L134 PolarHBondContact O-N 2.94Å; R132-L134 VanDerWaalsContact O-N 3.08Å
133	L	96.7	Very high	96.2	Very high	50 Å²	50	45.4 Å²	45.4	26%	0.262	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	117.4	174.3	-176.8	72.4	0	0	0	109.5	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.56Å; L133-R135 WeakPolarHBondContact CD1-O 3.12Å; L133-L154 HydrophobicContact CD2-CD1 4.13Å; L133-E185 HydrophobicContact CD2-CB 4.37Å; L133-E185 HydrophobicContact CD2-CG 3.65Å; L133-V189 HydrophobicContact CB-CG2 4.03Å; L133-V189 HydrophobicContact CD1-CG2 4.1Å
134	L	96.3	Very high	96.1	Very high	122 Å²	122	46.7 Å²	46.7	64%	0.639	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	-45.9	170.3	-179.5	63.4	0	0	0	110	D126 R132	D126-L134 HydrophobicContact CB-CB 4.34Å; D126-L134 PolarHBondContact O-N 3.48Å; R132-L134 PolarHBondContact O-N 2.94Å; R132-L134 VanDerWaalsContact O-N 3.08Å
135	R	96.7	Very high	96.1	Very high	91 Å²	91	54.2 Å²	54.2	34%	0.343	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	143.7	-177.8	-173.9	162.3	171.5	142.6	9.6	112.1	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.56Å; C125-R135 WeakPolarHBondContact CA-O 3.24Å; D126-R135 HydrophobicContact CB-CB 4.43Å; D126-R135 PolarHBondContact N-O 3.21Å; D126-R135 PolarHBondContact O-N 3.2Å; L133-R135 WeakPolarHBondContact CD1-O 3.12Å; R135-Y137 HydrophobicContact CB-CE2 4.04Å; R135-Y137 VanDerWaalsContact CD-CZ 3.44Å; R135-Y137 WeakPolarHBondContact CD-OH 3.36Å; R135-Y137 HydrophobicContact CG-CD2 4.39Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.71Å; R135-E152 VanDerWaalsContact CZ-CD 3.43Å; R135-E152 VanDerWaalsContact CZ-CG 3.45Å; R135-E152 IonicContact CZ-OE1 3.65Å; R135-E152 IonicContact NH1-OE1 3.31Å; R135-E152 PolarHBondContact NH1-OE1 2.83Å; R135-E152 IonicContact NH1-OE2 3.78Å; R135-E152 IonicContact NH2-OE1 2.71Å; R135-E152 PolarHBondContact NH2-OE1 2.8Å
136	G	98	Very high	96.1	Very high	5 Å²	5	60.4 Å²	60.4	5%	0.052	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	151.6	170.5	0	0	0	0	0	111.3	G124	G124-G136 CarbonylContact O-C 3.48Å; G124-G136 WeakPolarHBondContact O-CA 3.48Å
137	Y	98.3	Very high	96.2	Very high	38 Å²	38	59.8 Å²	59.8	15%	0.149	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.5	-178.5	-53.9	-97.5	0	0	0	110.6	R30 M122 Y123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.31Å; R30-Y137 PolarHBondContact NH2-OH 2.83Å; M122-Y137 HydrophobicContact CE-CD1 4.12Å; M122-Y137 HydrophobicContact CE-CG 4.17Å; M122-Y137 HydrophobicContact SD-CG 4.48Å; Y123-Y137 WeakPolarHBondContact CA-O 3.21Å; Y123-Y137 WeakPolarHBondContact CB-O 3.34Å; G124-Y137 PolarHBondContact N-O 2.9Å; G124-Y137 PolarHBondContact O-N 3.42Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.31Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.3Å; D126-Y137 PolarHBondContact OD2-OH 2.89Å; R135-Y137 HydrophobicContact CB-CE2 4.04Å; R135-Y137 VanDerWaalsContact CD-CZ 3.44Å; R135-Y137 WeakPolarHBondContact CD-OH 3.36Å; R135-Y137 HydrophobicContact CG-CD2 4.39Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.71Å
138	D	98.6	Very high	96.3	Very high	9 Å²	9	60 Å²	60	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	109.5	160.6	-174.9	92.9	0	0	0	107.4	R121 M122 L150 L180	R121-D138 IonicContact CZ-OD1 3.71Å; R121-D138 IonicContact NE-OD1 3.37Å; R121-D138 PolarHBondContact NE-OD1 2.93Å; R121-D138 IonicContact NE-OD2 3.67Å; R121-D138 IonicContact NH2-OD1 3.64Å; R121-D138 PolarHBondContact NH2-OD1 2.81Å; M122-D138 WeakPolarHBondContact O-CA 3.49Å; D138-L150 HydrophobicContact CB-CB 3.93Å; D138-L150 HydrophobicContact CB-CD2 4.19Å; D138-L150 WeakPolarHBondContact O-CB 3.37Å; D138-L150 PolarHBondContact O-N 2.63Å; D138-L180 HydrophobicContact CB-CD1 4.29Å
139	Q	98.6	Very high	96.5	Very high	82 Å²	82	61 Å²	61	38%	0.383	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	140.5	-178	62.1	-171.6	57.6	0	0	110.6	R121 M122 I148 A149	R121-Q139 CarbonylContact C-O 3.53Å; R121-Q139 VanDerWaalsContact CA-O 3.31Å; R121-Q139 WeakPolarHBondContact CA-O 3.36Å; M122-Q139 HydrophobicContact CB-CG 4.11Å; M122-Q139 VanDerWaalsContact CE-CD 3.45Å; M122-Q139 HydrophobicContact CE-CG 3.85Å; M122-Q139 PolarHBondContact N-O 3.42Å; M122-Q139 PolarHBondContact O-N 3.22Å; Q139-I148 WeakPolarHBondContact CA-O 3.48Å; Q139-A149 HydrophobicContact CB-CB 3.93Å
140	S	98.7	Very high	97	Very high	22 Å²	22	57.4 Å²	57.4	15%	0.154	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.5	179.7	-55.3	0	0	0	0	111.1	Q120 Y147 I148	Q120-S140 CarbonylContact O-C 3.52Å; Q120-S140 WeakPolarHBondContact O-CA 3.2Å; S140-Y147 WeakPolarHBondContact O-CB 3.48Å; S140-Y147 PolarHBondContact O-N 2.9Å; S140-I148 PolarHBondContact N-O 2.88Å; S140-I148 PolarHBondContact O-N 3.41Å
141	A	98.8	Very high	97.5	Very high	17 Å²	17	54.7 Å²	54.7	14%	0.14	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	145.2	175.7	0	0	0	0	0	110.5	L119 Q120 K145	L119-A141 WeakPolarHBondContact CD1-O 3.48Å; Q120-A141 HydrophobicContact CB-CB 4.44Å; Q120-A141 PolarHBondContact N-O 2.81Å; Q120-A141 PolarHBondContact O-N 3.46Å; A141-K145 CarbonylContact C-O 3.53Å; A141-K145 WeakPolarHBondContact CA-O 3.22Å; A141-K145 VanDerWaalsContact CB-O 3.24Å; A141-K145 WeakPolarHBondContact CB-O 3.28Å
142	Y	98.8	Very high	97.9	Very high	11 Å²	11	60.2 Å²	60.2	4%	0.043	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	128.2	177.4	-174.6	-121.5	0	0	0	110.3	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.04Å; L105-Y142 HydrophobicContact CB-CD1 4.34Å; L105-Y142 HydrophobicContact CB-CD2 4.21Å; L105-Y142 HydrophobicContact CB-CE1 3.98Å; L105-Y142 HydrophobicContact CB-CE2 3.86Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.59Å; L105-Y142 HydrophobicContact CD1-CE2 3.94Å; L105-Y142 HydrophobicContact CD1-CG 4.02Å; L105-Y142 HydrophobicContact CG-CD2 4.42Å; Y109-Y142 AromaticContact CD2-CD1 3.73Å; Y109-Y142 HydrophobicContact CD2-CD1 3.73Å; Y109-Y142 AromaticContact CD2-CE1 3.54Å; Y109-Y142 HydrophobicContact CD2-CE1 3.54Å; Y109-Y142 AromaticContact CE2-CD1 3.54Å; Y109-Y142 HydrophobicContact CE2-CD1 3.54Å; Y109-Y142 AromaticContact CE2-CE1 3.88Å; Y109-Y142 HydrophobicContact CE2-CE1 3.88Å; Y109-Y142 HydrophobicContact CG-CE1 4.43Å; Q111-Y142 PolarHBondContact OE1-OH 2.94Å; H117-Y142 HydrophobicContact CB-CE2 3.8Å; H117-Y142 WeakPolarHBondContact CB-OH 3.49Å; H117-Y142 AromaticContact CG-CZ 3.98Å; H117-Y142 AromaticContact ND1-CZ 3.9Å; H117-Y142 PolarHBondContact ND1-OH 2.81Å; T118-Y142 CarbonylContact O-C 3.57Å; T118-Y142 WeakPolarHBondContact O-CA 3.49Å; T118-Y142 VanDerWaalsContact O-CD2 3.3Å; T118-Y142 WeakPolarHBondContact O-CD2 3.48Å; Y142-G144 PolarHBondContact O-N 2.84Å; Y142-K145 PolarHBondContact N-O 3.33Å; Y142-K145 PolarHBondContact O-N 3.41Å
143	D	98.2	Very high	98.1	Very high	64 Å²	64	55.9 Å²	55.9	34%	0.342	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	40.1	-174.6	-66.6	-21.7	0	0	0	113.2	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 2.82Å; H117-D143 WeakPolarHBondContact CA-OD1 3.47Å; H117-D143 WeakPolarHBondContact CB-OD1 3.4Å; H117-D143 IonicContact CE1-OD2 2.75Å; H117-D143 IonicContact CG-OD1 2.72Å; H117-D143 IonicContact CG-OD2 3.68Å; H117-D143 IonicContact ND1-OD1 3.21Å; H117-D143 IonicContact ND1-OD2 3.75Å; H117-D143 PolarHBondContact ND1-OD2 3.36Å; T118-D143 PolarHBondContact N-OD1 3.08Å; T118-D143 PolarHBondContact O-N 2.84Å; D143-K145 VanDerWaalsContact C-N 3.32Å; D143-K145 PolarHBondContact O-N 2.85Å
144	G	97.4	Very high	98.2	Very high	58 Å²	58	54 Å²	54	60%	0.598	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	9.6	177.8	0	0	0	0	0	115.2	Y142	Y142-G144 PolarHBondContact O-N 2.84Å
145	K	98.5	Very high	98.2	Very high	159 Å²	159	56.2 Å²	56.2	69%	0.691	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	145.5	176.4	-62.5	-179.6	-177.7	177.6	0	110.7	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.53Å; A141-K145 WeakPolarHBondContact CA-O 3.22Å; A141-K145 VanDerWaalsContact CB-O 3.24Å; A141-K145 WeakPolarHBondContact CB-O 3.28Å; Y142-K145 PolarHBondContact N-O 3.33Å; Y142-K145 PolarHBondContact O-N 3.41Å; D143-K145 VanDerWaalsContact C-N 3.32Å; D143-K145 PolarHBondContact O-N 2.85Å; K145-Y147 PolarHBondContact O-N 2.62Å
146	D	98.7	Very high	98.3	Very high	129 Å²	129	53.8 Å²	53.8	69%	0.69	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53	136.1	174.3	-66.5	-21.7	0	0	0	110.6	A160	D146-A160 HydrophobicContact CB-CB 4.31Å; D146-A160 WeakPolarHBondContact O-CB 3.42Å
147	Y	98.8	Very high	98.3	Very high	8 Å²	8	54.2 Å²	54.2	3%	0.031	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	-61.9	179.2	179.8	-108.3	0	0	0	110.3	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.34Å; L105-Y147 HydrophobicContact CD2-CD2 4.04Å; L105-Y147 HydrophobicContact CD2-CE1 3.75Å; L105-Y147 HydrophobicContact CD2-CE2 3.38Å; L105-Y147 HydrophobicContact CD2-CG 4.48Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.49Å; Y109-Y147 HydrophobicContact CE2-CD2 4.34Å; Y109-Y147 HydrophobicContact CE2-CE2 4.04Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.4Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.47Å; S140-Y147 WeakPolarHBondContact O-CB 3.48Å; S140-Y147 PolarHBondContact O-N 2.9Å; K145-Y147 PolarHBondContact O-N 2.62Å; Y147-A160 WeakPolarHBondContact O-CB 3.36Å; Y147-A160 PolarHBondContact O-N 3.22Å; Y147-A163 PolarHBondContact OH-O 2.89Å; Y147-A164 HydrophobicContact CD2-CB 3.82Å; Y147-A164 HydrophobicContact CE1-CB 4.44Å; Y147-A164 HydrophobicContact CE2-CB 3.67Å; Y147-A164 HydrophobicContact CG-CB 4.27Å; Y147-A164 WeakPolarHBondContact O-CB 3.41Å; Y147-T167 HydrophobicContact CE1-CG2 4.16Å; Y147-T167 WeakPolarHBondContact OH-CB 2.99Å; Y147-T167 PolarHBondContact OH-OG1 3.49Å
148	I	98.8	Very high	98.4	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.046	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	142.1	-179.7	-162	168.7	0	0	0	110.9	Q139 S140 W157 T158 T167 Q168 L171	Q139-I148 WeakPolarHBondContact CA-O 3.48Å; S140-I148 PolarHBondContact N-O 2.88Å; S140-I148 PolarHBondContact O-N 3.41Å; I148-W157 HydrophobicContact CD1-CB 4.44Å; I148-W157 HydrophobicContact CD1-CE3 4.18Å; I148-W157 HydrophobicContact CG1-CB 4.47Å; I148-W157 HydrophobicContact CG1-CE3 4.03Å; I148-T158 WeakPolarHBondContact CA-O 3.33Å; I148-T167 HydrophobicContact CD1-CG2 3.96Å; I148-Q168 HydrophobicContact CD1-CB 3.99Å; I148-L171 HydrophobicContact CD1-CD1 3.74Å
149	A	98.8	Very high	98.4	Very high	29 Å²	29	56.9 Å²	56.9	24%	0.24	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	139.8	177.6	0	0	0	0	0	111.7	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.93Å; A149-W157 CarbonylContact O-C 3.59Å; A149-W157 WeakPolarHBondContact O-CA 3.36Å; A149-T158 PolarHBondContact N-O 3.02Å; A149-T158 PolarHBondContact O-N 3.35Å
150	L	98.8	Very high	98.4	Very high	14 Å²	14	56 Å²	56	7%	0.073	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	128.4	167	-176.4	68.2	0	0	0	108.6	D138 L154 W157 A177 L180 L184	D138-L150 HydrophobicContact CB-CB 3.93Å; D138-L150 HydrophobicContact CB-CD2 4.19Å; D138-L150 WeakPolarHBondContact O-CB 3.37Å; D138-L150 PolarHBondContact O-N 2.63Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.32Å; L150-W157 HydrophobicContact CB-CE3 4.1Å; L150-W157 HydrophobicContact CB-CH2 4.29Å; L150-W157 HydrophobicContact CB-CZ3 3.84Å; L150-W157 HydrophobicContact CD1-CD2 4.22Å; L150-W157 HydrophobicContact CD1-CE3 4.35Å; L150-W157 HydrophobicContact CD1-CH2 4.18Å; L150-W157 HydrophobicContact CD1-CZ2 4Å; L150-W157 HydrophobicContact CD1-CZ3 4.33Å; L150-A177 HydrophobicContact CD1-CB 3.99Å; L150-L180 HydrophobicContact CD2-CB 4.24Å; L150-L184 HydrophobicContact CD2-CD1 3.91Å
151	N	98.6	Very high	98.3	Very high	44 Å²	44	57.5 Å²	57.5	24%	0.235	32%	0.319	C	S	.	.			trans	-72.9	162.8	-179.7	-67.9	-28.2	0	0	0	111.4	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 2.65Å; N151-L154 WeakPolarHBondContact O-CA 3.23Å; N151-L154 PolarHBondContact O-N 3.49Å; N151-S156 WeakPolarHBondContact CB-O 3.18Å; N151-S156 WeakPolarHBondContact CB-OG 3.24Å; N151-S156 PolarHBondContact N-O 3.36Å; N151-S156 PolarHBondContact ND2-OG 3.44Å; N151-T158 PolarHBondContact ND2-OG1 2.72Å; N151-T158 WeakPolarHBondContact OD1-CB 3.45Å; N151-T158 PolarHBondContact OD1-OG1 2.83Å
152	E	97.6	Very high	98.3	Very high	134 Å²	134	62 Å²	62	63%	0.626	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.8	-179.9	-67.3	178.2	-161.6	0	0	113.8	R135 L154	R135-E152 VanDerWaalsContact CZ-CD 3.43Å; R135-E152 VanDerWaalsContact CZ-CG 3.45Å; R135-E152 IonicContact CZ-OE1 3.65Å; R135-E152 IonicContact NH1-OE1 3.31Å; R135-E152 PolarHBondContact NH1-OE1 2.83Å; R135-E152 IonicContact NH1-OE2 3.78Å; R135-E152 IonicContact NH2-OE1 2.71Å; R135-E152 PolarHBondContact NH2-OE1 2.8Å; E152-L154 PolarHBondContact O-N 3.37Å
153	D	97.4	Very high	98.3	Very high	79 Å²	79	61.7 Å²	61.7	42%	0.422	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.3	174.7	69.9	5.1	0	0	0	113.9	N151 R155 S156	N151-D153 PolarHBondContact O-N 2.65Å; D153-R155 WeakPolarHBondContact O-CG 3.38Å; D153-R155 PolarHBondContact O-N 3.08Å; D153-R155 PolarHBondContact OD1-N 3.41Å; D153-S156 PolarHBondContact OD1-N 3.26Å; D153-S156 PolarHBondContact OD1-OG 2.96Å; D153-S156 VanDerWaalsContact OD1-OG 3.1Å; D153-S156 WeakPolarHBondContact OD2-CB 3.48Å; D153-S156 PolarHBondContact OD2-OG 2.84Å
154	L	97.9	Very high	98.3	Very high	10 Å²	10	58.6 Å²	58.6	5%	0.052	33%	0.328	C	S	.	.	S	Bend	trans	53.5	28.6	-175.2	-53.2	-178.9	0	0	0	113.6	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.13Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.32Å; N151-L154 WeakPolarHBondContact O-CA 3.23Å; N151-L154 PolarHBondContact O-N 3.49Å; E152-L154 PolarHBondContact O-N 3.37Å; L154-R181 HydrophobicContact CB-CB 4.1Å; L154-R181 HydrophobicContact CB-CG 3.9Å; L154-R181 HydrophobicContact CD1-CG 4.19Å; L154-L184 HydrophobicContact CD2-CD1 3.96Å; L154-E185 HydrophobicContact CD1-CG 4.25Å
155	R	97.6	Very high	98.3	Very high	168 Å²	168	60.2 Å²	60.2	63%	0.634	32%	0.32	S	S	*	.	S	Bend	trans	-135.2	-33	-174.3	-70.1	172.5	-170.6	-146.1	5.4	112.8	D153 R181	D153-R155 WeakPolarHBondContact O-CG 3.38Å; D153-R155 PolarHBondContact O-N 3.08Å; D153-R155 PolarHBondContact OD1-N 3.41Å; R155-R181 VanDerWaalsContact NH2-NH1 3.15Å
156	S	97.9	Very high	98.3	Very high	41 Å²	41	56 Å²	56	29%	0.287	30%	0.304	S	S	.	.			trans	-114.3	164.4	-177.3	63.5	0	0	0	0	111.8	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.18Å; N151-S156 WeakPolarHBondContact CB-OG 3.24Å; N151-S156 PolarHBondContact N-O 3.36Å; N151-S156 PolarHBondContact ND2-OG 3.44Å; D153-S156 PolarHBondContact OD1-N 3.26Å; D153-S156 PolarHBondContact OD1-OG 2.96Å; D153-S156 VanDerWaalsContact OD1-OG 3.1Å; D153-S156 WeakPolarHBondContact OD2-CB 3.48Å; D153-S156 PolarHBondContact OD2-OG 2.84Å
157	W	98.7	Very high	98.3	Very high	14 Å²	14	51.3 Å²	51.3	5%	0.053	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.1	-176.7	-60.7	90.8	0	0	0	110.6	I148 A149 L150 Q168 L171 A176 A177 L180	I148-W157 HydrophobicContact CD1-CB 4.44Å; I148-W157 HydrophobicContact CD1-CE3 4.18Å; I148-W157 HydrophobicContact CG1-CB 4.47Å; I148-W157 HydrophobicContact CG1-CE3 4.03Å; A149-W157 CarbonylContact O-C 3.59Å; A149-W157 WeakPolarHBondContact O-CA 3.36Å; L150-W157 HydrophobicContact CB-CE3 4.1Å; L150-W157 HydrophobicContact CB-CH2 4.29Å; L150-W157 HydrophobicContact CB-CZ3 3.84Å; L150-W157 HydrophobicContact CD1-CD2 4.22Å; L150-W157 HydrophobicContact CD1-CE3 4.35Å; L150-W157 HydrophobicContact CD1-CH2 4.18Å; L150-W157 HydrophobicContact CD1-CZ2 4Å; L150-W157 HydrophobicContact CD1-CZ3 4.33Å; W157-Q168 HydrophobicContact CB-CG 4.08Å; W157-Q168 PolarHBondContact O-NE2 3.3Å; W157-L171 HydrophobicContact CD2-CD1 3.96Å; W157-L171 HydrophobicContact CE3-CD1 3.99Å; W157-L171 HydrophobicContact CH2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CB 4.18Å; W157-L171 HydrophobicContact CZ2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CG 4.42Å; W157-L171 HydrophobicContact CZ3-CD1 3.91Å; W157-A176 HydrophobicContact CZ2-CB 4.28Å; W157-A177 HydrophobicContact CZ2-CB 4.34Å; W157-L180 HydrophobicContact CH2-CD1 3.35Å; W157-L180 HydrophobicContact CZ2-CD1 3.8Å; W157-L180 HydrophobicContact CZ3-CD1 4.46Å
158	T	98.7	Very high	98.3	Very high	80 Å²	80	52.6 Å²	52.6	49%	0.491	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.5	166.7	-66.1	0	0	0	0	108.9	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.33Å; A149-T158 PolarHBondContact N-O 3.02Å; A149-T158 PolarHBondContact O-N 3.35Å; N151-T158 PolarHBondContact ND2-OG1 2.72Å; N151-T158 WeakPolarHBondContact OD1-CB 3.45Å; N151-T158 PolarHBondContact OD1-OG1 2.83Å
159	A	98.7	Very high	98.3	Very high	23 Å²	23	57.7 Å²	57.7	19%	0.19	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	133.6	174	0	0	0	0	0	110.3	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.72Å; A159-Q165 HydrophobicContact CB-CG 3.96Å; A159-Q168 HydrophobicContact CB-CB 4.39Å
160	A	98.5	Very high	98.3	Very high	62 Å²	62	61.9 Å²	61.9	51%	0.512	32%	0.323	S	S	.	.	S	Bend	trans	-76	-30.1	-177.4	0	0	0	0	0	113.4	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.31Å; D146-A160 WeakPolarHBondContact O-CB 3.42Å; Y147-A160 WeakPolarHBondContact O-CB 3.36Å; Y147-A160 PolarHBondContact O-N 3.22Å
161	D	98.3	Very high	98.2	Very high	55 Å²	55	63.2 Å²	63.2	29%	0.294	33%	0.33	S	S	.	.	S	Bend	trans	-151.1	-176.2	-179.3	67.1	30.1	0	0	0	112.9	Y109 A163 A164 Q165	Y109-D161 VanDerWaalsContact CE1-OD2 3.24Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.45Å; Y109-D161 VanDerWaalsContact OH-CG 3.23Å; Y109-D161 PolarHBondContact OH-OD1 2.61Å; Y109-D161 VanDerWaalsContact OH-OD1 3.13Å; Y109-D161 PolarHBondContact OH-OD2 3.02Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.92Å; D161-A163 WeakPolarHBondContact OD1-CA 3.3Å; D161-A163 WeakPolarHBondContact OD1-CB 3.43Å; D161-A163 PolarHBondContact OD1-N 3.03Å; D161-A164 PolarHBondContact O-N 3.4Å; D161-A164 PolarHBondContact OD1-N 2.72Å; D161-Q165 WeakPolarHBondContact O-CG 3.41Å; D161-Q165 PolarHBondContact O-N 3.33Å
162	T	98.1	Very high	98.2	Very high	110 Å²	110	65.2 Å²	65.2	68%	0.675	34%	0.337	S	S	*	.	H	α-helix	trans	-65.9	-27.9	-179.2	51.9	0	0	0	0	113.8
163	A	97.9	Very high	98.2	Very high	5 Å²	5	63.1 Å²	63.1	4%	0.041	34%	0.343	C	S	.	.	H	α-helix	trans	-72.9	-41.7	175	0	0	0	0	0	110	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.42Å; Y109-A163 HydrophobicContact CE1-CB 3.61Å; Y109-A163 HydrophobicContact CE2-CB 3.9Å; Y109-A163 VanDerWaalsContact CZ-CB 3.47Å; Y147-A163 PolarHBondContact OH-O 2.89Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.92Å; D161-A163 WeakPolarHBondContact OD1-CA 3.3Å; D161-A163 WeakPolarHBondContact OD1-CB 3.43Å; D161-A163 PolarHBondContact OD1-N 3.03Å; A163-Q165 VanDerWaalsContact C-N 3.28Å; A163-Q165 PolarHBondContact O-N 3.35Å; A163-I166 VanDerWaalsContact O-CB 3.28Å; A163-I166 WeakPolarHBondContact O-CB 3.3Å; A163-I166 PolarHBondContact O-N 2.87Å; A163-I166 VanDerWaalsContact O-N 3.08Å
164	A	98.4	Very high	98.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-33.2	174.2	0	0	0	0	0	113.4	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.82Å; Y147-A164 HydrophobicContact CE1-CB 4.44Å; Y147-A164 HydrophobicContact CE2-CB 3.67Å; Y147-A164 HydrophobicContact CG-CB 4.27Å; Y147-A164 WeakPolarHBondContact O-CB 3.41Å; A159-A164 HydrophobicContact CB-CB 3.72Å; D161-A164 PolarHBondContact O-N 3.4Å; D161-A164 PolarHBondContact OD1-N 2.72Å; A164-I166 PolarHBondContact O-N 2.84Å; A164-T167 WeakPolarHBondContact O-CA 3.22Å; A164-T167 WeakPolarHBondContact O-CB 3.45Å; A164-T167 PolarHBondContact O-N 3.04Å; A164-Q168 PolarHBondContact O-N 2.79Å
165	Q	98.7	Very high	98.2	Very high	92 Å²	92	69.8 Å²	69.8	43%	0.43	38%	0.376	S	S	.	.	H	α-helix	trans	-58.7	-32.2	173.5	-73	171.7	0.8	0	0	112.6	A159 D161 A163 T167 Q168 H169	A159-Q165 HydrophobicContact CB-CG 3.96Å; D161-Q165 WeakPolarHBondContact O-CG 3.41Å; D161-Q165 PolarHBondContact O-N 3.33Å; A163-Q165 VanDerWaalsContact C-N 3.28Å; A163-Q165 PolarHBondContact O-N 3.35Å; Q165-T167 VanDerWaalsContact C-N 3.34Å; Q165-T167 PolarHBondContact O-N 2.98Å; Q165-Q168 PolarHBondContact O-N 3.2Å; Q165-H169 PolarHBondContact O-CD2 3.17Å; Q165-H169 PolarHBondContact O-N 2.82Å
166	I	98.3	Very high	98.2	Very high	70 Å²	70	62.5 Å²	62.5	36%	0.359	35%	0.351	S	S	.	.	H	α-helix	trans	-63.3	-43.2	174.6	-55.6	171.3	0	0	0	110.2	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.17Å; Y108-I166 HydrophobicContact CD2-CD1 4.44Å; Y108-I166 HydrophobicContact CE1-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.08Å; Y108-I166 HydrophobicContact CE2-CB 4.16Å; Y108-I166 HydrophobicContact CE2-CG2 4.04Å; Y108-I166 HydrophobicContact CG-CD1 4.18Å; A163-I166 VanDerWaalsContact O-CB 3.28Å; A163-I166 WeakPolarHBondContact O-CB 3.3Å; A163-I166 PolarHBondContact O-N 2.87Å; A163-I166 VanDerWaalsContact O-N 3.08Å; A164-I166 PolarHBondContact O-N 2.84Å; I166-K170 WeakPolarHBondContact O-CG 3.41Å; I166-K170 PolarHBondContact O-N 2.85Å
167	T	98.3	Very high	98.2	Very high	30 Å²	30	60.9 Å²	60.9	18%	0.184	34%	0.341	C	S	.	.	H	α-helix	trans	-67.4	-43.7	174.8	-69.8	0	0	0	0	111.2	Y147 I148 A164 Q165 H169 K170 L171	Y147-T167 HydrophobicContact CE1-CG2 4.16Å; Y147-T167 WeakPolarHBondContact OH-CB 2.99Å; Y147-T167 PolarHBondContact OH-OG1 3.49Å; I148-T167 HydrophobicContact CD1-CG2 3.96Å; A164-T167 WeakPolarHBondContact O-CA 3.22Å; A164-T167 WeakPolarHBondContact O-CB 3.45Å; A164-T167 PolarHBondContact O-N 3.04Å; Q165-T167 VanDerWaalsContact C-N 3.34Å; Q165-T167 PolarHBondContact O-N 2.98Å; T167-H169 PolarHBondContact O-N 2.86Å; T167-K170 WeakPolarHBondContact O-CB 3.38Å; T167-K170 PolarHBondContact O-N 2.82Å; T167-L171 HydrophobicContact CG2-CD1 3.8Å; T167-L171 HydrophobicContact CG2-CG 4.05Å; T167-L171 WeakPolarHBondContact O-CG 3.17Å; T167-L171 PolarHBondContact O-N 3.36Å
168	Q	98.6	Very high	98.2	Very high	35 Å²	35	65.9 Å²	65.9	16%	0.164	37%	0.365	C	S	.	.	H	α-helix	trans	-52.3	-52	177.5	174.1	173.2	9	0	0	111.6	I148 W157 A159 A164 Q165 K170 L171 E172	I148-Q168 HydrophobicContact CD1-CB 3.99Å; W157-Q168 HydrophobicContact CB-CG 4.08Å; W157-Q168 PolarHBondContact O-NE2 3.3Å; A159-Q168 HydrophobicContact CB-CB 4.39Å; A164-Q168 PolarHBondContact O-N 2.79Å; Q165-Q168 PolarHBondContact O-N 3.2Å; Q168-K170 VanDerWaalsContact C-N 3.26Å; Q168-K170 PolarHBondContact O-N 3.29Å; Q168-L171 PolarHBondContact O-N 3.26Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; Q168-E172 HydrophobicContact CG-CG 4.34Å; Q168-E172 VanDerWaalsContact CG-OE1 3.29Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.46Å; Q168-E172 PolarHBondContact NE2-OE1 2.65Å; Q168-E172 WeakPolarHBondContact O-CG 3.29Å; Q168-E172 PolarHBondContact O-N 3.13Å
169	H	98.5	Very high	98.1	Very high	116 Å²	116	69 Å²	69	54%	0.537	37%	0.374	S	S	.	.	H	α-helix	trans	-60.5	-34.8	179	-69.4	-43.3	0	0	0	113.3	Q165 T167 E172 A173	Q165-H169 PolarHBondContact O-CD2 3.17Å; Q165-H169 PolarHBondContact O-N 2.82Å; T167-H169 PolarHBondContact O-N 2.86Å; H169-E172 IonicContact ND1-OE2 3.93Å; H169-E172 PolarHBondContact ND1-OE2 3.39Å; H169-A173 VanDerWaalsContact O-CB 3.26Å; H169-A173 WeakPolarHBondContact O-CB 3.44Å; H169-A173 PolarHBondContact O-N 2.84Å
170	K	97.9	Very high	98	Very high	118 Å²	118	69.4 Å²	69.4	51%	0.513	37%	0.372	S	S	.	.	H	α-helix	trans	-67.7	-42.5	174.9	-71	176.9	177.5	-174.3	0	111.7	Y108 I166 T167 Q168 A174	Y108-K170 PolarHBondContact OH-NZ 3.35Å; I166-K170 WeakPolarHBondContact O-CG 3.41Å; I166-K170 PolarHBondContact O-N 2.85Å; T167-K170 WeakPolarHBondContact O-CB 3.38Å; T167-K170 PolarHBondContact O-N 2.82Å; Q168-K170 VanDerWaalsContact C-N 3.26Å; Q168-K170 PolarHBondContact O-N 3.29Å; K170-A174 VanDerWaalsContact O-CB 3.28Å; K170-A174 WeakPolarHBondContact O-CB 3.37Å; K170-A174 PolarHBondContact O-N 3Å
171	L	98	Very high	98	Very high	42 Å²	42	69.9 Å²	69.9	22%	0.22	36%	0.361	C	S	.	.	H	α-helix	trans	-66.9	-40.6	178.4	-66.5	175.2	0	0	0	111.7	I148 W157 T167 Q168 A174 R175 A176	I148-L171 HydrophobicContact CD1-CD1 3.74Å; W157-L171 HydrophobicContact CD2-CD1 3.96Å; W157-L171 HydrophobicContact CE3-CD1 3.99Å; W157-L171 HydrophobicContact CH2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CB 4.18Å; W157-L171 HydrophobicContact CZ2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CG 4.42Å; W157-L171 HydrophobicContact CZ3-CD1 3.91Å; T167-L171 HydrophobicContact CG2-CD1 3.8Å; T167-L171 HydrophobicContact CG2-CG 4.05Å; T167-L171 WeakPolarHBondContact O-CG 3.17Å; T167-L171 PolarHBondContact O-N 3.36Å; Q168-L171 PolarHBondContact O-N 3.26Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; L171-A174 CarbonylContact O-C 3.59Å; L171-A174 PolarHBondContact O-N 3.22Å; L171-R175 PolarHBondContact O-N 2.91Å; L171-A176 HydrophobicContact CB-CB 4.05Å; L171-A176 HydrophobicContact CD2-CB 3.65Å; L171-A176 HydrophobicContact CG-CB 4.43Å; L171-A176 PolarHBondContact O-N 3.32Å
172	E	98.3	Very high	98	Very high	86 Å²	86	70.3 Å²	70.3	40%	0.402	37%	0.372	S	S	.	.	H	α-helix	trans	-63.7	-47.9	175.1	-72	169.5	172.3	0	0	111.3	Q168 H169 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.34Å; Q168-E172 VanDerWaalsContact CG-OE1 3.29Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.46Å; Q168-E172 PolarHBondContact NE2-OE1 2.65Å; Q168-E172 WeakPolarHBondContact O-CG 3.29Å; Q168-E172 PolarHBondContact O-N 3.13Å; H169-E172 IonicContact ND1-OE2 3.93Å; H169-E172 PolarHBondContact ND1-OE2 3.39Å; E172-A174 VanDerWaalsContact C-N 3.26Å; E172-A174 PolarHBondContact O-N 3.49Å; E172-R175 PolarHBondContact O-N 2.9Å
173	A	98.3	Very high	98	Very high	89 Å²	89	68 Å²	68	74%	0.736	35%	0.351	S	S	*	.	H	α-helix	trans	-61	-35.5	176.8	0	0	0	0	0	112.5	H169 R175	H169-A173 VanDerWaalsContact O-CB 3.26Å; H169-A173 WeakPolarHBondContact O-CB 3.44Å; H169-A173 PolarHBondContact O-N 2.84Å; A173-R175 VanDerWaalsContact C-N 3.32Å
174	A	97.6	Very high	98	Very high	67 Å²	67	67.8 Å²	67.8	55%	0.554	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-3.8	176.6	0	0	0	0	0	114	K170 L171 E172 A176	K170-A174 VanDerWaalsContact O-CB 3.28Å; K170-A174 WeakPolarHBondContact O-CB 3.37Å; K170-A174 PolarHBondContact O-N 3Å; L171-A174 CarbonylContact O-C 3.59Å; L171-A174 PolarHBondContact O-N 3.22Å; E172-A174 VanDerWaalsContact C-N 3.26Å; E172-A174 PolarHBondContact O-N 3.49Å; A174-A176 PolarHBondContact O-N 3.1Å
175	R	97.5	Very high	98	Very high	162 Å²	162	72 Å²	72	61%	0.611	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	37.6	-172.6	-56.6	-177.1	176.2	-162.5	1.7	113.4	L171 E172 A173 A177 E178	L171-R175 PolarHBondContact O-N 2.91Å; E172-R175 PolarHBondContact O-N 2.9Å; A173-R175 VanDerWaalsContact C-N 3.32Å; R175-A177 PolarHBondContact O-N 2.82Å; R175-A177 VanDerWaalsContact O-N 3.16Å; R175-E178 HydrophobicContact CB-CG 4.28Å; R175-E178 IonicContact NH1-OE1 3.26Å; R175-E178 WeakPolarHBondContact O-CB 3.38Å; R175-E178 PolarHBondContact O-N 3.06Å
176	A	97.5	Very high	98	Very high	15 Å²	15	68.7 Å²	68.7	12%	0.124	36%	0.36	C	S	.	.	H	α-helix	trans	-59.2	-31.2	-175	0	0	0	0	0	113.1	W157 L171 A174 E178 Q179 L180	W157-A176 HydrophobicContact CZ2-CB 4.28Å; L171-A176 HydrophobicContact CB-CB 4.05Å; L171-A176 HydrophobicContact CD2-CB 3.65Å; L171-A176 HydrophobicContact CG-CB 4.43Å; L171-A176 PolarHBondContact O-N 3.32Å; A174-A176 PolarHBondContact O-N 3.1Å; A176-E178 VanDerWaalsContact C-N 3.27Å; A176-E178 PolarHBondContact O-N 3.28Å; A176-Q179 PolarHBondContact O-N 2.87Å; A176-L180 PolarHBondContact O-N 2.86Å; A176-L180 VanDerWaalsContact O-N 3.1Å
177	A	98.1	Very high	97.9	Very high	8 Å²	8	68.1 Å²	68.1	7%	0.066	36%	0.36	C	S	.	.	H	α-helix	trans	-60.3	-33.9	176.9	0	0	0	0	0	112.7	L150 W157 R175 Q179 L180 R181	L150-A177 HydrophobicContact CD1-CB 3.99Å; W157-A177 HydrophobicContact CZ2-CB 4.34Å; R175-A177 PolarHBondContact O-N 2.82Å; R175-A177 VanDerWaalsContact O-N 3.16Å; A177-Q179 VanDerWaalsContact C-N 3.35Å; A177-Q179 PolarHBondContact O-N 3.02Å; A177-L180 PolarHBondContact O-N 3.49Å; A177-R181 WeakPolarHBondContact O-CB 3.49Å; A177-R181 PolarHBondContact O-N 3.1Å
178	E	97.8	Very high	97.9	Very high	119 Å²	119	66.7 Å²	66.7	56%	0.556	35%	0.351	S	S	*	.	H	α-helix	trans	-64.6	-40.1	178.2	-64.1	178.2	-176.5	0	0	111.5	R175 A176 A182	R175-E178 HydrophobicContact CB-CG 4.28Å; R175-E178 IonicContact NH1-OE1 3.26Å; R175-E178 WeakPolarHBondContact O-CB 3.38Å; R175-E178 PolarHBondContact O-N 3.06Å; A176-E178 VanDerWaalsContact C-N 3.27Å; A176-E178 PolarHBondContact O-N 3.28Å; E178-A182 WeakPolarHBondContact O-CB 3.37Å; E178-A182 PolarHBondContact O-N 3.16Å
179	Q	96.5	Very high	97.9	Very high	146 Å²	146	65.4 Å²	65.4	68%	0.682	35%	0.345	S	S	*	.	H	α-helix	trans	-70	-44.5	178.2	-64.2	-179.8	-3.9	0	0	111.7	A176 A177 A182 Y183	A176-Q179 PolarHBondContact O-N 2.87Å; A177-Q179 VanDerWaalsContact C-N 3.35Å; A177-Q179 PolarHBondContact O-N 3.02Å; Q179-A182 PolarHBondContact O-N 2.8Å; Q179-Y183 PolarHBondContact O-N 3.37Å; Q179-Y183 VanDerWaalsContact O-N 3.08Å
180	L	97.6	Very high	97.9	Very high	30 Å²	30	65.9 Å²	65.9	16%	0.157	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-43.1	177.1	-73.1	169	0	0	0	111.2	D138 L150 W157 A176 A177 A182 Y183 L184	D138-L180 HydrophobicContact CB-CD1 4.29Å; L150-L180 HydrophobicContact CD2-CB 4.24Å; W157-L180 HydrophobicContact CH2-CD1 3.35Å; W157-L180 HydrophobicContact CZ2-CD1 3.8Å; W157-L180 HydrophobicContact CZ3-CD1 4.46Å; A176-L180 PolarHBondContact O-N 2.86Å; A176-L180 VanDerWaalsContact O-N 3.1Å; A177-L180 PolarHBondContact O-N 3.49Å; L180-A182 VanDerWaalsContact C-N 3.34Å; L180-A182 PolarHBondContact O-N 2.81Å; L180-Y183 PolarHBondContact O-N 3.33Å; L180-L184 WeakPolarHBondContact O-CB 3.35Å; L180-L184 VanDerWaalsContact O-CG 3.23Å; L180-L184 WeakPolarHBondContact O-CG 3.46Å; L180-L184 PolarHBondContact O-N 2.89Å
181	R	98.1	Very high	97.9	Very high	73 Å²	73	62.5 Å²	62.5	28%	0.275	33%	0.332	S	S	.	.	H	α-helix	trans	-58.9	-44.9	174.8	-176	173.7	-179.8	-138.5	-15.3	111.9	L154 R155 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.1Å; L154-R181 HydrophobicContact CB-CG 3.9Å; L154-R181 HydrophobicContact CD1-CG 4.19Å; R155-R181 VanDerWaalsContact NH2-NH1 3.15Å; A177-R181 WeakPolarHBondContact O-CB 3.49Å; A177-R181 PolarHBondContact O-N 3.1Å; R181-Y183 VanDerWaalsContact C-N 3.31Å; R181-Y183 PolarHBondContact O-N 3.26Å; R181-L184 PolarHBondContact O-N 2.86Å; R181-E185 HydrophobicContact CG-CG 4.07Å; R181-E185 IonicContact CZ-OE1 3.48Å; R181-E185 VanDerWaalsContact CZ-OE1 3.26Å; R181-E185 IonicContact CZ-OE2 2.87Å; R181-E185 VanDerWaalsContact NE-CD 3.31Å; R181-E185 IonicContact NE-OE1 2.79Å; R181-E185 PolarHBondContact NE-OE1 3.06Å; R181-E185 IonicContact NE-OE2 3.46Å; R181-E185 PolarHBondContact NE-OE2 3.19Å; R181-E185 IonicContact NH2-OE1 3.47Å; R181-E185 PolarHBondContact NH2-OE1 2.83Å; R181-E185 IonicContact NH2-OE2 2.76Å; R181-E185 PolarHBondContact NH2-OE2 2.75Å; R181-E185 WeakPolarHBondContact O-CB 3.34Å; R181-E185 PolarHBondContact O-N 2.86Å
182	A	98.3	Very high	97.9	Very high	63 Å²	63	60.5 Å²	60.5	52%	0.521	32%	0.321	S	S	.	.	H	α-helix	trans	-60.7	-39.4	176.7	0	0	0	0	0	112.5	E178 Q179 L180 G186	E178-A182 WeakPolarHBondContact O-CB 3.37Å; E178-A182 PolarHBondContact O-N 3.16Å; Q179-A182 PolarHBondContact O-N 2.8Å; L180-A182 VanDerWaalsContact C-N 3.34Å; L180-A182 PolarHBondContact O-N 2.81Å; A182-G186 PolarHBondContact O-N 3.43Å; A182-G186 VanDerWaalsContact O-N 3.14Å
183	Y	98	Very high	97.8	Very high	62 Å²	62	62.1 Å²	62.1	24%	0.243	32%	0.324	C	S	.	.	I	π-helix	trans	-65.9	-48.5	173.2	169.1	-97.4	0	0	0	112	Y123 Q179 L180 R181 G186 T187 C188	Y123-Y183 AromaticContact CD2-CE1 3.93Å; Y123-Y183 HydrophobicContact CD2-CE1 3.93Å; Y123-Y183 HydrophobicContact CE2-CE1 4.06Å; Q179-Y183 PolarHBondContact O-N 3.37Å; Q179-Y183 VanDerWaalsContact O-N 3.08Å; L180-Y183 PolarHBondContact O-N 3.33Å; R181-Y183 VanDerWaalsContact C-N 3.31Å; R181-Y183 PolarHBondContact O-N 3.26Å; Y183-G186 CarbonylContact O-C 3.49Å; Y183-G186 PolarHBondContact O-N 2.74Å; Y183-T187 HydrophobicContact CD2-CG2 3.97Å; Y183-T187 HydrophobicContact CE2-CG2 3.92Å; Y183-T187 PolarHBondContact O-N 3.18Å; Y183-T187 VanDerWaalsContact O-N 3.09Å; Y183-C188 HydrophobicContact CD1-CB 4.36Å; Y183-C188 HydrophobicContact CE1-CB 3.91Å; Y183-C188 WeakPolarHBondContact O-CB 3.36Å; Y183-C188 PolarHBondContact O-N 2.94Å
184	L	98.4	Very high	97.8	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.311	C	S	.	.	I	π-helix	trans	-68.9	-39.5	-174.6	-69.7	171.1	0	0	0	112.7	G124 L150 L154 L180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.3Å; L150-L184 HydrophobicContact CD2-CD1 3.91Å; L154-L184 HydrophobicContact CD2-CD1 3.96Å; L180-L184 WeakPolarHBondContact O-CB 3.35Å; L180-L184 VanDerWaalsContact O-CG 3.23Å; L180-L184 WeakPolarHBondContact O-CG 3.46Å; L180-L184 PolarHBondContact O-N 2.89Å; R181-L184 PolarHBondContact O-N 2.86Å; L184-V189 WeakPolarHBondContact O-CG2 3.16Å
185	E	97.8	Very high	97.8	Very high	88 Å²	88	60.6 Å²	60.6	41%	0.411	29%	0.285	S	S	.	.	I	π-helix	trans	-79.8	-24.1	177.7	-69.2	-178.9	166	0	0	113.1	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.37Å; L133-E185 HydrophobicContact CD2-CG 3.65Å; L154-E185 HydrophobicContact CD1-CG 4.25Å; R181-E185 HydrophobicContact CG-CG 4.07Å; R181-E185 IonicContact CZ-OE1 3.48Å; R181-E185 VanDerWaalsContact CZ-OE1 3.26Å; R181-E185 IonicContact CZ-OE2 2.87Å; R181-E185 VanDerWaalsContact NE-CD 3.31Å; R181-E185 IonicContact NE-OE1 2.79Å; R181-E185 PolarHBondContact NE-OE1 3.06Å; R181-E185 IonicContact NE-OE2 3.46Å; R181-E185 PolarHBondContact NE-OE2 3.19Å; R181-E185 IonicContact NH2-OE1 3.47Å; R181-E185 PolarHBondContact NH2-OE1 2.83Å; R181-E185 IonicContact NH2-OE2 2.76Å; R181-E185 PolarHBondContact NH2-OE2 2.75Å; R181-E185 WeakPolarHBondContact O-CB 3.34Å; R181-E185 PolarHBondContact O-N 2.86Å
186	G	97.8	Very high	97.7	Very high	23 Å²	23	53.6 Å²	53.6	24%	0.237	26%	0.259	C	S	.	.	I	π-helix	trans	-110.6	-89.7	-177	0	0	0	0	0	112.5	A182 Y183 C188 V189 E190	A182-G186 PolarHBondContact O-N 3.43Å; A182-G186 VanDerWaalsContact O-N 3.14Å; Y183-G186 CarbonylContact O-C 3.49Å; Y183-G186 PolarHBondContact O-N 2.74Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 2.86Å; G186-V189 PolarHBondContact O-N 3.09Å; G186-V189 VanDerWaalsContact O-N 3.11Å; G186-E190 WeakPolarHBondContact O-CG 3.42Å; G186-E190 PolarHBondContact O-N 3.49Å
187	T	97.7	Very high	97.6	Very high	58 Å²	58	58.7 Å²	58.7	36%	0.356	28%	0.281	S	S	.	.	I	π-helix	trans	-54.3	-43.8	-170.6	-56.6	0	0	0	0	113.2	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.97Å; Y183-T187 HydrophobicContact CE2-CG2 3.92Å; Y183-T187 PolarHBondContact O-N 3.18Å; Y183-T187 VanDerWaalsContact O-N 3.09Å; T187-V189 PolarHBondContact O-N 3.01Å; T187-E190 PolarHBondContact O-N 3.06Å; T187-W191 VanDerWaalsContact CG2-CD1 3.47Å; T187-W191 PolarHBondContact O-N 2.84Å
188	C	98.3	Very high	97.5	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.2	-47.9	179.1	-171.7	0	0	0	0	111.6	M29 C125 Y183 G186 E190 W191 L192	M29-C188 HydrophobicContact CE-CB 4.19Å; M29-C188 VanDerWaalsContact CE-O 3.24Å; M29-C188 WeakPolarHBondContact CE-O 3.4Å; M29-C188 WeakPolarHBondContact CE-SG 3.48Å; C125-C188 HydrophobicContact CB-CB 3.94Å; C125-C188 WeakPolarHBondContact CB-SG 3.37Å; C125-C188 PolarHBondContact N-SG 2.75Å; C125-C188 VanDerWaalsContact N-SG 3.36Å; C125-C188 WeakPolarHBondContact SG-CB 3.06Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.82Å; Y183-C188 HydrophobicContact CD1-CB 4.36Å; Y183-C188 HydrophobicContact CE1-CB 3.91Å; Y183-C188 WeakPolarHBondContact O-CB 3.36Å; Y183-C188 PolarHBondContact O-N 2.94Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 2.86Å; C188-E190 PolarHBondContact O-N 3.11Å; C188-W191 PolarHBondContact O-N 2.92Å; C188-L192 WeakPolarHBondContact O-CB 3.43Å; C188-L192 PolarHBondContact O-N 2.88Å
189	V	98.2	Very high	97.4	Very high	8 Å²	8	55.2 Å²	55.2	5%	0.048	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-44.3	178.1	175.4	0	0	0	0	111.2	L127 L133 L184 G186 T187 R193	L127-V189 HydrophobicContact CD2-CB 4.14Å; L127-V189 HydrophobicContact CD2-CG1 3.73Å; L127-V189 HydrophobicContact CD2-CG2 3.8Å; L133-V189 HydrophobicContact CB-CG2 4.03Å; L133-V189 HydrophobicContact CD1-CG2 4.1Å; L184-V189 WeakPolarHBondContact O-CG2 3.16Å; G186-V189 PolarHBondContact O-N 3.09Å; G186-V189 VanDerWaalsContact O-N 3.11Å; T187-V189 PolarHBondContact O-N 3.01Å; V189-R193 WeakPolarHBondContact O-CG 3.21Å; V189-R193 PolarHBondContact O-N 2.96Å
190	E	98	Very high	97.3	Very high	125 Å²	125	53.5 Å²	53.5	58%	0.584	26%	0.256	S	S	*	.	H	α-helix	trans	-61.8	-46.3	179.4	-71.8	175.1	174.3	0	0	112	G186 T187 C188 R194	G186-E190 WeakPolarHBondContact O-CG 3.42Å; G186-E190 PolarHBondContact O-N 3.49Å; T187-E190 PolarHBondContact O-N 3.06Å; C188-E190 PolarHBondContact O-N 3.11Å; E190-R194 PolarHBondContact O-N 3.28Å; E190-R194 VanDerWaalsContact O-N 3.08Å
191	W	98	Very high	96.9	Very high	47 Å²	47	60.5 Å²	60.5	18%	0.178	29%	0.288	C	S	.	.	H	α-helix	trans	-67.7	-43.2	178.2	-81.4	105.4	0	0	0	112.3	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.02Å; M29-W191 HydrophobicContact SD-CB 4.38Å; Y83-W191 AromaticContact CD2-CH2 3.54Å; Y83-W191 HydrophobicContact CD2-CH2 3.54Å; Y83-W191 HydrophobicContact CD2-CZ2 4.21Å; Y83-W191 AromaticContact CD2-CZ3 3.78Å; Y83-W191 HydrophobicContact CD2-CZ3 3.78Å; Y83-W191 HydrophobicContact CE2-CE3 4.27Å; Y83-W191 AromaticContact CE2-CH2 3.96Å; Y83-W191 HydrophobicContact CE2-CH2 3.96Å; Y83-W191 AromaticContact CE2-CZ3 3.79Å; Y83-W191 HydrophobicContact CE2-CZ3 3.79Å; T187-W191 VanDerWaalsContact CG2-CD1 3.47Å; T187-W191 PolarHBondContact O-N 2.84Å; C188-W191 PolarHBondContact O-N 2.92Å; W191-R193 VanDerWaalsContact C-N 3.34Å; W191-R193 PolarHBondContact O-N 2.84Å; W191-R194 WeakPolarHBondContact O-CB 3.14Å; W191-R194 PolarHBondContact O-N 3.18Å; W191-R194 VanDerWaalsContact O-N 3.15Å; W191-Y195 HydrophobicContact CB-CE2 3.99Å; W191-Y195 HydrophobicContact CE3-CD1 4.45Å; W191-Y195 AromaticContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE2 4.22Å; W191-Y195 AromaticContact CE3-CZ 3.41Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.41Å; W191-Y195 AromaticContact CZ3-CE1 3.95Å; W191-Y195 HydrophobicContact CZ3-CE1 3.95Å; W191-Y195 VanDerWaalsContact O-CD2 3.26Å; W191-Y195 WeakPolarHBondContact O-CD2 3.41Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 2.79Å
192	L	98.1	Very high	96.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-44.8	177.1	175.3	50.3	0	0	0	111.3	H27 M29 V52 L127 C188 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.45Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.04Å; M29-L192 HydrophobicContact CB-CD2 3.95Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.34Å; M29-L192 HydrophobicContact SD-CB 4.42Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.24Å; L127-L192 HydrophobicContact CB-CD2 4.5Å; L127-L192 HydrophobicContact CD1-CB 4.25Å; L127-L192 HydrophobicContact CD1-CD2 3.69Å; L127-L192 HydrophobicContact CD1-CG 3.72Å; L127-L192 HydrophobicContact CD2-CD2 4.48Å; L127-L192 HydrophobicContact CG-CD2 3.56Å; L127-L192 HydrophobicContact CG-CG 4.19Å; C188-L192 WeakPolarHBondContact O-CB 3.43Å; C188-L192 PolarHBondContact O-N 2.88Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.19Å; L192-Y195 PolarHBondContact O-N 3.38Å; L192-L196 HydrophobicContact CD1-CD1 3.85Å; L192-L196 HydrophobicContact CD1-CD2 4.38Å; L192-L196 HydrophobicContact CD1-CG 3.84Å; L192-L196 HydrophobicContact CG-CD1 4.03Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.38Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.31Å; L192-L196 PolarHBondContact O-N 2.83Å
193	R	96.8	Very high	96.3	Very high	120 Å²	120	56.4 Å²	56.4	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-59.6	-43	174.3	-72.5	174.9	-177.8	168.7	-0.3	112.5	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.92Å; G131-R193 VanDerWaalsContact O-CZ 3.25Å; G131-R193 PolarHBondContact O-NE 3.19Å; G131-R193 PolarHBondContact O-NH2 2.97Å; V189-R193 WeakPolarHBondContact O-CG 3.21Å; V189-R193 PolarHBondContact O-N 2.96Å; W191-R193 VanDerWaalsContact C-N 3.34Å; W191-R193 PolarHBondContact O-N 2.84Å; R193-L196 PolarHBondContact O-N 3.04Å; R193-E197 PolarHBondContact O-N 3.21Å
194	R	97.1	Very high	95.9	Very high	123 Å²	123	57.9 Å²	57.9	46%	0.464	27%	0.273	S	S	.	.	H	α-helix	trans	-61.4	-44.3	176.4	178.9	180	175.2	115.5	-5.2	111.4	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 3.37Å; E79-R194 IonicContact OE1-NE 3.74Å; E79-R194 PolarHBondContact OE1-NE 3.43Å; E79-R194 IonicContact OE1-NH2 3.29Å; E79-R194 PolarHBondContact OE1-NH2 3.42Å; E79-R194 IonicContact OE2-CZ 3.94Å; E79-R194 IonicContact OE2-NE 3.19Å; E79-R194 PolarHBondContact OE2-NE 2.93Å; E79-R194 IonicContact OE2-NH2 2.73Å; E79-R194 PolarHBondContact OE2-NH2 2.76Å; E190-R194 PolarHBondContact O-N 3.28Å; E190-R194 VanDerWaalsContact O-N 3.08Å; W191-R194 WeakPolarHBondContact O-CB 3.14Å; W191-R194 PolarHBondContact O-N 3.18Å; W191-R194 VanDerWaalsContact O-N 3.15Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.19Å; R194-E197 PolarHBondContact O-N 2.72Å; R194-N198 WeakPolarHBondContact O-CB 3.36Å; R194-N198 PolarHBondContact O-N 2.81Å; R194-N198 PolarHBondContact O-OD1 3Å
195	Y	97.4	Very high	95.5	Very high	1 Å²	1	62.2 Å²	62.2	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-67.4	-39.3	178.7	-62.2	-32.2	0	0	0	112.6	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.72Å; M29-Y195 HydrophobicContact SD-CE2 3.58Å; M29-Y195 VanDerWaalsContact SD-CE2 3.58Å; V52-Y195 HydrophobicContact CG2-CD2 3.97Å; V52-Y195 HydrophobicContact CG2-CG 4.46Å; F57-Y195 HydrophobicContact CD2-CE2 4.41Å; F57-Y195 HydrophobicContact CE2-CD2 4.24Å; F57-Y195 AromaticContact CE2-CE2 3.6Å; F57-Y195 HydrophobicContact CE2-CE2 3.6Å; F57-Y195 AromaticContact CE2-CZ 3.81Å; F57-Y195 HydrophobicContact CZ-CD2 4.32Å; F57-Y195 AromaticContact CZ-CE2 3.78Å; F57-Y195 HydrophobicContact CZ-CE2 3.78Å; W75-Y195 HydrophobicContact CE3-CD1 4.18Å; W75-Y195 HydrophobicContact CE3-CG 4.43Å; W75-Y195 HydrophobicContact CH2-CD2 4.5Å; W75-Y195 HydrophobicContact CH2-CG 4.11Å; W75-Y195 AromaticContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD2 4.26Å; W75-Y195 HydrophobicContact CZ3-CE1 4.26Å; W75-Y195 AromaticContact CZ3-CG 3.55Å; W75-Y195 HydrophobicContact CZ3-CG 3.55Å; V76-Y195 HydrophobicContact CG2-CE1 4.38Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.23Å; Y83-Y195 PolarHBondContact OH-OH 3.27Å; W191-Y195 HydrophobicContact CB-CE2 3.99Å; W191-Y195 HydrophobicContact CE3-CD1 4.45Å; W191-Y195 AromaticContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE1 3.56Å; W191-Y195 HydrophobicContact CE3-CE2 4.22Å; W191-Y195 AromaticContact CE3-CZ 3.41Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.41Å; W191-Y195 AromaticContact CZ3-CE1 3.95Å; W191-Y195 HydrophobicContact CZ3-CE1 3.95Å; W191-Y195 VanDerWaalsContact O-CD2 3.26Å; W191-Y195 WeakPolarHBondContact O-CD2 3.41Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 2.79Å; L192-Y195 PolarHBondContact O-N 3.38Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 2.86Å; Y195-N198 PolarHBondContact O-N 3.04Å; Y195-G199 WeakPolarHBondContact O-CA 3.32Å; Y195-G199 PolarHBondContact O-N 3.31Å; Y195-L203 WeakPolarHBondContact O-CD1 3.49Å
196	L	95.9	Very high	95.3	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-36	174.4	-70.9	169.1	0	0	0	112.4	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 3.99Å; H27-L196 HydrophobicContact CB-CG 4.42Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.49Å; V52-L196 HydrophobicContact CG1-CD2 4.09Å; L192-L196 HydrophobicContact CD1-CD1 3.85Å; L192-L196 HydrophobicContact CD1-CD2 4.38Å; L192-L196 HydrophobicContact CD1-CG 3.84Å; L192-L196 HydrophobicContact CG-CD1 4.03Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.38Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.31Å; L192-L196 PolarHBondContact O-N 2.83Å; R193-L196 PolarHBondContact O-N 3.04Å; L196-K200 VanDerWaalsContact O-CA 3.22Å; L196-K200 WeakPolarHBondContact O-CA 3.42Å; L196-K200 WeakPolarHBondContact O-CB 3.3Å; L196-K200 PolarHBondContact O-N 3.28Å; L196-K200 VanDerWaalsContact O-N 3.13Å; L196-L203 HydrophobicContact CD2-CB 4.13Å; L196-L203 HydrophobicContact CD2-CD1 4.34Å; L196-Q204 HydrophobicContact CD2-CG 4.49Å; L196-Q204 PolarHBondContact O-NE2 3.13Å
197	E	95.8	Very high	95.1	Very high	123 Å²	123	61.7 Å²	61.7	58%	0.575	29%	0.288	S	S	*	.	H	α-helix	trans	-72	-48	174.5	-171.7	60.1	-151.6	0	0	111.3	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.21Å; R194-E197 PolarHBondContact O-N 2.72Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 2.86Å; E197-G199 VanDerWaalsContact C-N 3.32Å; E197-G199 PolarHBondContact O-N 2.71Å; E197-K200 WeakPolarHBondContact O-CB 3.44Å; E197-K200 PolarHBondContact O-N 3Å
198	N	96.6	Very high	95.1	Very high	50 Å²	50	62.1 Å²	62.1	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-61	-40.7	179.2	-69.8	-6.2	0	0	0	112.6	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.37Å; Q78-N198 VanDerWaalsContact NE2-CB 3.29Å; Q78-N198 PolarHBondContact NE2-ND2 2.81Å; Q78-N198 PolarHBondContact NE2-OD1 2.88Å; Q78-N198 VanDerWaalsContact NE2-OD1 3.14Å; E79-N198 PolarHBondContact OE1-ND2 2.97Å; R194-N198 WeakPolarHBondContact O-CB 3.36Å; R194-N198 PolarHBondContact O-N 2.81Å; R194-N198 PolarHBondContact O-OD1 3Å; Y195-N198 PolarHBondContact O-N 3.04Å
199	G	95.4	Very high	95.1	Very high	3 Å²	3	62.6 Å²	62.6	3%	0.031	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	20	-176.1	0	0	0	0	0	113.6	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.32Å; Y195-G199 PolarHBondContact O-N 3.31Å; E197-G199 VanDerWaalsContact C-N 3.32Å; E197-G199 PolarHBondContact O-N 2.71Å; G199-E201 VanDerWaalsContact C-N 3.27Å; G199-E201 PolarHBondContact O-N 3.37Å; G199-E201 VanDerWaalsContact O-N 3.16Å; G199-T202 CarbonylContact O-C 3.58Å; G199-T202 PolarHBondContact O-N 2.88Å; G199-T202 PolarHBondContact O-OG1 2.71Å; G199-L203 WeakPolarHBondContact O-CB 3.32Å; G199-L203 PolarHBondContact O-N 3.31Å
200	K	93.3	Very high	95	Very high	110 Å²	110	69.7 Å²	69.7	48%	0.478	33%	0.325	S	S	.	.	H	α-helix	trans	-49.7	-44	-171.9	-178.1	173	-175.1	173	0	113.9	L196 E197 T202 Q204	L196-K200 VanDerWaalsContact O-CA 3.22Å; L196-K200 WeakPolarHBondContact O-CA 3.42Å; L196-K200 WeakPolarHBondContact O-CB 3.3Å; L196-K200 PolarHBondContact O-N 3.28Å; L196-K200 VanDerWaalsContact O-N 3.13Å; E197-K200 WeakPolarHBondContact O-CB 3.44Å; E197-K200 PolarHBondContact O-N 3Å; K200-T202 PolarHBondContact O-N 2.93Å; K200-Q204 WeakPolarHBondContact O-CB 3.46Å; K200-Q204 PolarHBondContact O-N 3.08Å
201	E	90.6	Very high	95	Very high	178 Å²	178	65.7 Å²	65.7	83%	0.832	31%	0.309	S	S	*	.	H	α-helix	trans	-64.4	-25.9	-180	-62.7	-174.4	165.6	0	0	113.4	G199 R205	G199-E201 VanDerWaalsContact C-N 3.27Å; G199-E201 PolarHBondContact O-N 3.37Å; G199-E201 VanDerWaalsContact O-N 3.16Å; E201-R205 WeakPolarHBondContact O-CD 3.43Å
202	T	90.3	Very high	94.9	Very high	46 Å²	46	67.3 Å²	67.3	28%	0.282	32%	0.318	S	S	.	.	H	α-helix	trans	-104.9	-34.9	-177	50.7	0	0	0	0	114.2	W75 G199 K200 R205	W75-T202 VanDerWaalsContact CD1-OG1 3.28Å; G199-T202 CarbonylContact O-C 3.58Å; G199-T202 PolarHBondContact O-N 2.88Å; G199-T202 PolarHBondContact O-OG1 2.71Å; K200-T202 PolarHBondContact O-N 2.93Å; T202-R205 WeakPolarHBondContact O-CG 3.42Å; T202-R205 PolarHBondContact O-NE 3.46Å
203	L	91.8	Very high	94.9	Very high	4 Å²	4	68.6 Å²	68.6	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-94	-31.3	-172.3	-64.3	172.8	0	0	0	112.3	V52 T55 W75 Y195 L196 G199 R205	V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.16Å; V52-L203 HydrophobicContact CG1-CD1 3.87Å; V52-L203 HydrophobicContact CG1-CD2 4.07Å; V52-L203 HydrophobicContact CG1-CG 4.5Å; T55-L203 HydrophobicContact CG2-CD2 4.11Å; W75-L203 HydrophobicContact CD2-CD1 4.42Å; W75-L203 HydrophobicContact CH2-CD1 4.39Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.16Å; W75-L203 HydrophobicContact CZ2-CG 4.41Å; Y195-L203 WeakPolarHBondContact O-CD1 3.49Å; L196-L203 HydrophobicContact CD2-CB 4.13Å; L196-L203 HydrophobicContact CD2-CD1 4.34Å; G199-L203 WeakPolarHBondContact O-CB 3.32Å; G199-L203 PolarHBondContact O-N 3.31Å; L203-R205 VanDerWaalsContact C-N 3.34Å
204	Q	89.8	Confident	94.9	Very high	92 Å²	92	64.4 Å²	64.4	43%	0.43	31%	0.314	S	S	.	.	S	Bend	trans	-100.5	23.8	178.7	-57.5	179.8	39.3	0	0	111.8	L196 K200	L196-Q204 HydrophobicContact CD2-CG 4.49Å; L196-Q204 PolarHBondContact O-NE2 3.13Å; K200-Q204 WeakPolarHBondContact O-CB 3.46Å; K200-Q204 PolarHBondContact O-N 3.08Å
205	R	90.5	Very high	94.8	Very high	92 Å²	92	61 Å²	61	35%	0.347	30%	0.303	S	S	.	.			trans	-99.5	146.9	171.7	77	-173.1	173.4	177.7	11.2	109.2	E201 T202 L203 E207 Y233	E201-R205 WeakPolarHBondContact O-CD 3.43Å; T202-R205 WeakPolarHBondContact O-CG 3.42Å; T202-R205 PolarHBondContact O-NE 3.46Å; L203-R205 VanDerWaalsContact C-N 3.34Å; R205-E207 IonicContact CZ-OE1 3.08Å; R205-E207 IonicContact NE-OE1 3.06Å; R205-E207 PolarHBondContact NE-OE1 3.16Å; R205-E207 IonicContact NH1-OE1 3.46Å; R205-E207 PolarHBondContact NH1-OE1 2.77Å; R205-E207 IonicContact NH2-OE1 3.7Å; R205-E207 PolarHBondContact NH2-OE1 3.3Å; R205-Y233 HydrophobicContact CG-CD1 4.24Å; R205-Y233 WeakPolarHBondContact O-CD1 3.35Å
206	A	93.3	Very high	94.7	Very high	40 Å²	40	64.7 Å²	64.7	33%	0.331	32%	0.32	S	S	.	.			trans	-118.4	120.8	164.5	0	0	0	0	0	108.3	Y233 E288	A206-Y233 CarbonylContact C-O 3.58Å; A206-Y233 WeakPolarHBondContact CA-O 3.18Å; A206-E288 HydrophobicContact CB-CG 4.14Å
207	E	95.1	Very high	94.6	Very high	61 Å²	61	68.7 Å²	68.7	29%	0.285	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-98.5	114.7	175.3	-68.5	-172.6	-146.9	0	0	108.5	R205 F232 Y233 H287	R205-E207 IonicContact CZ-OE1 3.08Å; R205-E207 IonicContact NE-OE1 3.06Å; R205-E207 PolarHBondContact NE-OE1 3.16Å; R205-E207 IonicContact NH1-OE1 3.46Å; R205-E207 PolarHBondContact NH1-OE1 2.77Å; R205-E207 IonicContact NH2-OE1 3.7Å; R205-E207 PolarHBondContact NH2-OE1 3.3Å; E207-F232 WeakPolarHBondContact O-CA 3.29Å; E207-F232 WeakPolarHBondContact O-CB 3.37Å; E207-Y233 PolarHBondContact N-O 2.91Å; E207-Y233 PolarHBondContact O-N 2.74Å; E207-Y233 VanDerWaalsContact O-N 3.08Å; E207-H287 PolarHBondContact O-CE1 3.47Å
208	P	96.7	Very high	94.4	Very high	67 Å²	67	67.9 Å²	67.9	44%	0.435	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-68.5	147.8	-179.6	25.8	-32.8	0	0	0	111.6	L290	P208-L290 HydrophobicContact CB-CD2 3.89Å
209	P	97.7	Very high	94.2	Very high	10 Å²	10	68.2 Å²	68.2	7%	0.065	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-65.9	136.9	178.8	26.5	-34.1	0	0	0	112.1	T211 A229 F232 I237 M285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.99Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-A229 HydrophobicContact CB-CB 3.88Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.91Å; P209-F232 HydrophobicContact CB-CG 4.18Å; P209-I237 HydrophobicContact CB-CD1 4.23Å; P209-I237 HydrophobicContact CG-CD1 4.15Å; P209-M285 HydrophobicContact CB-SD 3.88Å; P209-M285 HydrophobicContact CG-CG 4.47Å; P209-M285 HydrophobicContact CG-SD 3.4Å; P209-M285 WeakPolarHBondContact CG-SD 3.47Å; P209-H287 HydrophobicContact CG-CB 4.28Å; P209-L290 HydrophobicContact CG-CD1 4.1Å; P209-L290 HydrophobicContact CG-CD2 4.42Å; P209-L290 HydrophobicContact CG-CG 4.37Å
210	K	97.7	Very high	93.9	Very high	157 Å²	157	75.2 Å²	75.2	68%	0.683	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	118.3	161.7	-64.2	171.4	-172.1	164.9	0	107.9	L230	K210-L230 HydrophobicContact CB-CB 4.47Å; K210-L230 PolarHBondContact N-O 3.2Å; K210-L230 PolarHBondContact O-N 2.9Å
211	T	97.1	Very high	93.9	Very high	41 Å²	41	76.9 Å²	76.9	25%	0.252	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	148.5	-170.6	64	0	0	0	0	112.7	P209 W228 M285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.99Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 3.4Å; T211-M285 HydrophobicContact CG2-CE 3.5Å; T211-M285 HydrophobicContact CG2-SD 3.36Å; T211-M285 WeakPolarHBondContact CG2-SD 3.14Å; T211-L294 HydrophobicContact CG2-CD1 4.32Å; T211-L296 VanDerWaalsContact CB-CD1 3.47Å; T211-L296 HydrophobicContact CG2-CD1 4.08Å
212	H	95.9	Very high	94.1	Very high	81 Å²	81	72.8 Å²	72.8	38%	0.375	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	159.3	169.2	61.4	-73.3	0	0	0	110	W228	H212-W228 AromaticContact CD2-CD1 3.93Å; H212-W228 VanDerWaalsContact CE1-CB 3.41Å; H212-W228 WeakPolarHBondContact CE1-CB 3.45Å; H212-W228 AromaticContact CE1-CD1 3.85Å; H212-W228 AromaticContact CE1-CG 3.61Å; H212-W228 PolarHBondContact N-O 2.82Å; H212-W228 AromaticContact NE2-CD1 3.44Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 PolarHBondContact O-N 3.18Å
213	V	97.7	Very high	94.4	Very high	26 Å²	26	70.7 Å²	70.7	16%	0.158	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125.3	175	-178.4	0	0	0	0	109.3	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.45Å; V213-L225 HydrophobicContact CG1-CD2 4.48Å; V213-R226 WeakPolarHBondContact CA-O 3.46Å; V213-C227 HydrophobicContact CG2-CB 4.47Å; V213-W241 HydrophobicContact CG1-CH2 4.01Å; V213-W241 HydrophobicContact CG1-CZ2 4.44Å; V213-L296 HydrophobicContact CG2-CB 3.94Å; V213-W298 HydrophobicContact CG1-CB 3.85Å
214	T	96.4	Very high	94.6	Very high	32 Å²	32	71.3 Å²	71.3	20%	0.196	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	145.3	175	51	0	0	0	0	110.4	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-NE2 2.89Å; T214-L225 WeakPolarHBondContact O-CA 3.35Å; T214-R226 PolarHBondContact N-O 2.9Å; T214-R226 PolarHBondContact O-N 2.79Å; T214-R226 WeakPolarHBondContact OG1-CB 3.47Å; T214-R226 PolarHBondContact OG1-O 3.33Å; T214-R226 VanDerWaalsContact OG1-O 3.12Å; T214-W228 PolarHBondContact OG1-NE1 2.64Å
215	H	95.9	Very high	95	Very high	53 Å²	53	66.9 Å²	66.9	25%	0.245	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.9	178.4	169	-91.4	0	0	0	109.5	A223 T224 L225 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.47Å; H215-T224 WeakPolarHBondContact CA-O 3.37Å; H215-L225 HydrophobicContact CB-CD2 3.97Å; H215-W298 HydrophobicContact CB-CD2 4.21Å; H215-W298 HydrophobicContact CB-CG 4.24Å; H215-W298 HydrophobicContact CB-CZ2 4.04Å; H215-W298 VanDerWaalsContact CB-NE1 3.26Å; H215-W298 AromaticContact CG-CE2 3.82Å; H215-W298 AromaticContact CG-CZ2 3.83Å
216	H	94.7	Very high	95.4	Very high	77 Å²	77	65 Å²	65	36%	0.356	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	105.1	-179	-58.8	-61.9	0	0	0	109.5	T214 L218 A223 T224 R226	T214-H216 PolarHBondContact OG1-NE2 2.89Å; H216-L218 PolarHBondContact O-N 3.02Å; H216-A223 CarbonylContact O-C 3.52Å; H216-A223 WeakPolarHBondContact O-CA 3.43Å; H216-T224 PolarHBondContact N-O 3.08Å; H216-T224 PolarHBondContact O-N 3.16Å; H216-R226 PolarHBondContact CD2-NH1 2.85Å; H216-R226 VanDerWaalsContact CD2-NH1 3.31Å; H216-R226 PolarHBondContact NE2-NH1 3.34Å; H216-R226 VanDerWaalsContact NE2-NH1 3.11Å
217	P	93.9	Very high	95.6	Very high	100 Å²	100	63.1 Å²	63.1	65%	0.649	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	130.6	174.1	-19.6	29.9	0	0	0	110.7
218	L	91.7	Very high	95.8	Very high	105 Å²	105	62.4 Å²	62.4	55%	0.55	32%	0.322	S	S	.	.			trans	-100.7	-40.6	172.9	-65.2	178.3	0	0	0	110.9	H216 E222 T224 V272	H216-L218 PolarHBondContact O-N 3.02Å; L218-E222 PolarHBondContact N-O 2.93Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.35Å; L218-V272 HydrophobicContact CD1-CG1 4.2Å; L218-V272 HydrophobicContact CD1-CG2 4.24Å
219	S	92.4	Very high	95.8	Very high	57 Å²	57	59.2 Å²	59.2	40%	0.399	30%	0.301	S	S	.	.	S	Bend	trans	-151.2	-177.3	177.3	71.6	0	0	0	0	110.5	H221 E222	S219-H221 PolarHBondContact O-N 3.39Å; S219-H221 PolarHBondContact OG-N 3.06Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; S219-E222 PolarHBondContact N-O 3Å; S219-E222 VanDerWaalsContact O-O 3.13Å; S219-E222 PolarHBondContact OG-N 3.39Å
220	D	89.3	Confident	95.9	Very high	151 Å²	151	61.3 Å²	61.3	81%	0.807	31%	0.311	S	S	*	.	S	Bend	trans	-66.6	-9.1	172	-65.6	-21.3	0	0	0	113.3
221	H	92.8	Very high	95.9	Very high	144 Å²	144	54.7 Å²	54.7	67%	0.667	29%	0.288	S	S	*	.	S	Bend	trans	-117.1	-16.8	-175.1	-56.7	-41.3	0	0	0	113.5	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.39Å; S219-H221 PolarHBondContact OG-N 3.06Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; H221-P274 CarbonylContact O-C 3.57Å; H221-P274 WeakPolarHBondContact O-CA 3.46Å; H221-S275 PolarHBondContact O-N 2.98Å; H221-S275 PolarHBondContact O-OG 2.98Å
222	E	95.5	Very high	95.9	Very high	93 Å²	93	52.8 Å²	52.8	44%	0.435	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	146.2	-171.1	-66.3	-179.8	164.5	0	0	112.1	L218 S219 V272 V273 S275	L218-E222 PolarHBondContact N-O 2.93Å; S219-E222 PolarHBondContact N-O 3Å; S219-E222 VanDerWaalsContact O-O 3.13Å; S219-E222 PolarHBondContact OG-N 3.39Å; E222-V272 HydrophobicContact CB-CG1 4.17Å; E222-V272 HydrophobicContact CG-CG1 4.4Å; E222-V273 WeakPolarHBondContact CA-O 3.15Å; E222-S275 PolarHBondContact N-OG 2.91Å
223	A	95.9	Very high	95.9	Very high	1 Å²	1	49 Å²	49	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	156	171.9	0	0	0	0	0	110.6	H215 H216 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.47Å; H216-A223 CarbonylContact O-C 3.52Å; H216-A223 WeakPolarHBondContact O-CA 3.43Å; A223-V273 HydrophobicContact CB-CG2 4.48Å; A223-V273 PolarHBondContact N-O 3.37Å; A223-V273 WeakPolarHBondContact O-CG2 3.43Å; A223-V273 PolarHBondContact O-N 3.33Å
224	T	97.4	Very high	95.7	Very high	17 Å²	17	48.7 Å²	48.7	10%	0.104	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.8	168.6	-54.9	0	0	0	0	109.5	H215 H216 L218 A270 V271	H215-T224 WeakPolarHBondContact CA-O 3.37Å; H216-T224 PolarHBondContact N-O 3.08Å; H216-T224 PolarHBondContact O-N 3.16Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.35Å; T224-A270 HydrophobicContact CG2-CB 3.9Å; T224-V271 WeakPolarHBondContact CA-O 3.47Å
225	L	97.9	Very high	95.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	129	163	-63.5	-176.6	0	0	0	108.8	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.45Å; V213-L225 HydrophobicContact CG1-CD2 4.48Å; T214-L225 WeakPolarHBondContact O-CA 3.35Å; H215-L225 HydrophobicContact CB-CD2 3.97Å; L225-W241 HydrophobicContact CB-CH2 3.7Å; L225-W241 HydrophobicContact CB-CZ2 3.81Å; L225-W241 HydrophobicContact CD1-CH2 4.06Å; L225-W241 HydrophobicContact CD1-CZ3 4.25Å; L225-A270 CarbonylContact O-C 3.56Å; L225-A270 WeakPolarHBondContact O-CA 3.4Å; L225-V271 HydrophobicContact CB-CG1 4.18Å; L225-V271 PolarHBondContact N-O 3.03Å; L225-V271 PolarHBondContact O-N 3.16Å; L225-V273 HydrophobicContact CD1-CG1 4.01Å; L225-V273 HydrophobicContact CD1-CG2 4.05Å; L225-V273 HydrophobicContact CG-CG1 4.16Å; L225-V273 HydrophobicContact CG-CG2 3.83Å; L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CG 4.36Å; L225-W298 HydrophobicContact CD1-CB 4.3Å; L225-W298 HydrophobicContact CD2-CB 3.81Å; L225-W298 HydrophobicContact CD2-CD2 4.34Å; L225-W298 HydrophobicContact CD2-CG 3.89Å
226	R	98.1	Very high	95.7	Very high	52 Å²	52	52.3 Å²	52.3	20%	0.196	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.3	176.1	179.6	-175.7	-62	118.1	-0.9	110.5	V213 T214 H216 W228 W268 A269 A270	V213-R226 WeakPolarHBondContact CA-O 3.46Å; T214-R226 PolarHBondContact N-O 2.9Å; T214-R226 PolarHBondContact O-N 2.79Å; T214-R226 WeakPolarHBondContact OG1-CB 3.47Å; T214-R226 PolarHBondContact OG1-O 3.33Å; T214-R226 VanDerWaalsContact OG1-O 3.12Å; H216-R226 PolarHBondContact CD2-NH1 2.85Å; H216-R226 VanDerWaalsContact CD2-NH1 3.31Å; H216-R226 PolarHBondContact NE2-NH1 3.34Å; H216-R226 VanDerWaalsContact NE2-NH1 3.11Å; R226-W228 HydrophobicContact CG-CZ2 4.41Å; R226-W268 HydrophobicContact CG-CB 4Å; R226-W268 HydrophobicContact CG-CD2 4.11Å; R226-W268 HydrophobicContact CG-CE3 3.88Å; R226-W268 HydrophobicContact CG-CG 4.21Å; R226-A269 WeakPolarHBondContact CA-O 3.43Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.13Å
227	C	98.1	Very high	95.8	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.9	176.8	-175.8	0	0	0	0	109.5	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.47Å; C227-W241 HydrophobicContact CB-CH2 4.47Å; C227-W241 HydrophobicContact CB-CZ2 3.65Å; C227-W268 CarbonylContact O-C 3.55Å; C227-W268 WeakPolarHBondContact O-CA 3.43Å; C227-W268 WeakPolarHBondContact O-CB 3.36Å; C227-A269 PolarHBondContact N-O 3.21Å; C227-A269 PolarHBondContact O-N 2.88Å; C227-C283 HydrophobicContact CB-CB 3.54Å; C227-C283 WeakPolarHBondContact CB-SG 3.35Å; C227-C283 WeakPolarHBondContact SG-CB 3.39Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 2.85Å
228	W	98.3	Very high	95.9	Very high	47 Å²	47	47.3 Å²	47.3	18%	0.178	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.7	-177.8	-70.7	90.1	0	0	0	111.4	T211 H212 T214 R226 L230 W268	T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 3.4Å; H212-W228 AromaticContact CD2-CD1 3.93Å; H212-W228 VanDerWaalsContact CE1-CB 3.41Å; H212-W228 WeakPolarHBondContact CE1-CB 3.45Å; H212-W228 AromaticContact CE1-CD1 3.85Å; H212-W228 AromaticContact CE1-CG 3.61Å; H212-W228 PolarHBondContact N-O 2.82Å; H212-W228 AromaticContact NE2-CD1 3.44Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 PolarHBondContact O-N 3.18Å; T214-W228 PolarHBondContact OG1-NE1 2.64Å; R226-W228 HydrophobicContact CG-CZ2 4.41Å; W228-L230 HydrophobicContact CE3-CD2 3.85Å; W228-L230 HydrophobicContact CZ3-CD2 4.37Å; W228-W268 HydrophobicContact CD2-CB 3.95Å; W228-W268 HydrophobicContact CD2-CG 4.44Å; W228-W268 HydrophobicContact CE3-CB 3.87Å; W228-W268 AromaticContact CE3-CD1 3.85Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.38Å; W228-W268 AromaticContact CH2-CD1 3.6Å; W228-W268 HydrophobicContact CH2-CG 4.24Å; W228-W268 HydrophobicContact CZ2-CG 4.5Å; W228-W268 HydrophobicContact CZ3-CB 4.29Å; W228-W268 AromaticContact CZ3-CD1 3.37Å; W228-W268 HydrophobicContact CZ3-CG 4.08Å
229	A	98.3	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.8	163.1	0	0	0	0	0	107.9	P209 F232 I237 L239 Q266 K267 M285	P209-A229 HydrophobicContact CB-CB 3.88Å; A229-F232 HydrophobicContact CB-CD1 3.92Å; A229-F232 HydrophobicContact CB-CE1 3.64Å; A229-F232 WeakPolarHBondContact O-CE1 3.5Å; A229-I237 HydrophobicContact CB-CD1 3.7Å; A229-L239 HydrophobicContact CB-CD1 4.21Å; A229-L239 HydrophobicContact CB-CD2 4.24Å; A229-Q266 CarbonylContact O-C 3.58Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.48Å; A229-K267 PolarHBondContact N-O 2.64Å; A229-K267 PolarHBondContact O-N 3.06Å; A229-K267 VanDerWaalsContact O-O 3.1Å; A229-M285 HydrophobicContact CB-CE 3.67Å; A229-M285 HydrophobicContact CB-SD 3.93Å
230	L	98.2	Very high	96.3	Very high	53 Å²	53	42 Å²	42	28%	0.277	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145	-176.8	-59.2	177.3	0	0	0	111	K210 W228 F232 Q266	K210-L230 HydrophobicContact CB-CB 4.47Å; K210-L230 PolarHBondContact N-O 3.2Å; K210-L230 PolarHBondContact O-N 2.9Å; W228-L230 HydrophobicContact CE3-CD2 3.85Å; W228-L230 HydrophobicContact CZ3-CD2 4.37Å; L230-F232 PolarHBondContact O-N 2.04Å; L230-Q266 HydrophobicContact CD2-CB 3.59Å
231	G	97.4	Very high	96.7	Very high	19 Å²	19	35 Å²	35	20%	0.196	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68.5	34.6	168.4	0	0	0	0	0	113.9	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.34Å; G231-F265 PolarHBondContact N-O 2.82Å
232	F	97.3	Very high	97	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	156.1	179.2	59.6	-89.9	0	0	0	112.4	E207 P209 A229 L230 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.29Å; E207-F232 WeakPolarHBondContact O-CB 3.37Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.91Å; P209-F232 HydrophobicContact CB-CG 4.18Å; A229-F232 HydrophobicContact CB-CD1 3.92Å; A229-F232 HydrophobicContact CB-CE1 3.64Å; A229-F232 WeakPolarHBondContact O-CE1 3.5Å; L230-F232 PolarHBondContact O-N 2.04Å; F232-P234 WeakPolarHBondContact CD2-O 3.34Å; F232-I237 HydrophobicContact CD1-CD1 3.99Å; F232-I237 HydrophobicContact CD2-CB 4.32Å; F232-I237 HydrophobicContact CD2-CD1 4.02Å; F232-I237 HydrophobicContact CE1-CD1 3.89Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.76Å; F232-I237 HydrophobicContact CE2-CD1 3.94Å; F232-I237 HydrophobicContact CE2-CG1 4.44Å; F232-I237 HydrophobicContact CE2-CG2 3.57Å; F232-I237 HydrophobicContact CG-CD1 4.07Å; F232-I237 HydrophobicContact CZ-CB 4.15Å; F232-I237 HydrophobicContact CZ-CD1 3.89Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; F232-T257 HydrophobicContact CE2-CG2 4.11Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; F232-T264 WeakPolarHBondContact O-CA 3.44Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.14Å; F232-F265 HydrophobicContact CD2-CB 3.97Å; F232-F265 HydrophobicContact CE1-CB 4.27Å; F232-F265 WeakPolarHBondContact CE1-O 3.3Å; F232-F265 HydrophobicContact CE2-CB 3.51Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 2.99Å; F232-F265 PolarHBondContact O-N 3.36Å; F232-K267 HydrophobicContact CE1-CB 4.37Å; F232-K267 HydrophobicContact CZ-CB 4.12Å; F232-H287 AromaticContact CD2-CD2 3.78Å; F232-H287 AromaticContact CD2-NE2 3.62Å
233	Y	95.9	Very high	97	Very high	3 Å²	3	29.5 Å²	29.5	1%	0.012	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-151	136.7	173.7	179	-84.5	0	0	0	109.1	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.04Å; T55-Y233 PolarHBondContact OG1-OH 3.03Å; R205-Y233 HydrophobicContact CG-CD1 4.24Å; R205-Y233 WeakPolarHBondContact O-CD1 3.35Å; A206-Y233 CarbonylContact C-O 3.58Å; A206-Y233 WeakPolarHBondContact CA-O 3.18Å; E207-Y233 PolarHBondContact N-O 2.91Å; E207-Y233 PolarHBondContact O-N 2.74Å; E207-Y233 VanDerWaalsContact O-N 3.08Å; Y233-G263 WeakPolarHBondContact CD2-O 3.36Å; Y233-F265 HydrophobicContact CD2-CD2 4.47Å; Y233-F265 HydrophobicContact CD2-CE2 4.02Å; Y233-F265 HydrophobicContact CE2-CE2 4.47Å; Y233-H287 PolarHBondContact O-CE1 2.69Å
234	P	95.1	Very high	97	Very high	19 Å²	19	34.1 Å²	34.1	12%	0.123	17%	0.174	C	C	.	.	S	Bend	cis	-71.6	179.2	1.6	30.2	-36.1	0	0	0	113.2	D54 F232 E236 H287	D54-P234 VanDerWaalsContact OD2-CB 3.24Å; D54-P234 WeakPolarHBondContact OD2-CB 3.37Å; F232-P234 WeakPolarHBondContact CD2-O 3.34Å; P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 2.9Å; P234-H287 PolarHBondContact O-NE2 3.08Å
235	A	96.2	Very high	96.7	Very high	14 Å²	14	35.7 Å²	35.7	12%	0.116	19%	0.194	C	C	.	.	S	Bend	trans	-70.8	-24.8	-175.7	0	0	0	0	0	113.7	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.29Å; D54-A235 WeakPolarHBondContact OD2-CB 3.34Å; D54-A235 PolarHBondContact OD2-N 2.95Å; A235-I237 PolarHBondContact O-N 3.18Å; A235-T257 HydrophobicContact CB-CG2 4.31Å; A235-F265 HydrophobicContact CB-CD1 3.72Å; A235-F265 HydrophobicContact CB-CD2 3.68Å; A235-F265 HydrophobicContact CB-CE1 3.7Å; A235-F265 HydrophobicContact CB-CE2 3.67Å; A235-F265 HydrophobicContact CB-CG 3.73Å; A235-F265 HydrophobicContact CB-CZ 3.7Å
236	E	95.4	Very high	96.6	Very high	147 Å²	147	41.9 Å²	41.9	69%	0.687	22%	0.223	S	C	*	.			trans	-64.7	116.5	179.5	-172.1	57.8	-143.1	0	0	110.1	P234 H287	P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 2.9Å; E236-H287 PolarHBondContact O-CD2 2.9Å
237	I	95.8	Very high	96.4	Very high	11 Å²	11	44 Å²	44	6%	0.056	24%	0.238	C	C	.	.			trans	-152	138.9	-178.3	-164.9	169.9	0	0	0	109.8	P209 A229 F232 A235 L239 K267 M285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.23Å; P209-I237 HydrophobicContact CG-CD1 4.15Å; A229-I237 HydrophobicContact CB-CD1 3.7Å; F232-I237 HydrophobicContact CD1-CD1 3.99Å; F232-I237 HydrophobicContact CD2-CB 4.32Å; F232-I237 HydrophobicContact CD2-CD1 4.02Å; F232-I237 HydrophobicContact CE1-CD1 3.89Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.76Å; F232-I237 HydrophobicContact CE2-CD1 3.94Å; F232-I237 HydrophobicContact CE2-CG1 4.44Å; F232-I237 HydrophobicContact CE2-CG2 3.57Å; F232-I237 HydrophobicContact CG-CD1 4.07Å; F232-I237 HydrophobicContact CZ-CB 4.15Å; F232-I237 HydrophobicContact CZ-CD1 3.89Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; A235-I237 PolarHBondContact O-N 3.18Å; I237-L239 HydrophobicContact CB-CD1 4.37Å; I237-L239 HydrophobicContact CD1-CD1 3.61Å; I237-L239 HydrophobicContact CG1-CD1 3.54Å; I237-L239 HydrophobicContact CG2-CD1 4.01Å; I237-K267 HydrophobicContact CG2-CB 4.29Å; I237-K267 HydrophobicContact CG2-CD 3.6Å; I237-M285 HydrophobicContact CD1-CG 4.17Å; I237-M285 HydrophobicContact CD1-SD 4.05Å; I237-M285 HydrophobicContact CG1-CG 4.4Å; I237-Q286 WeakPolarHBondContact CG1-O 3.47Å; I237-H287 HydrophobicContact CD1-CB 4.15Å; I237-H287 HydrophobicContact CG1-CB 3.97Å
238	T	96.4	Very high	96.3	Very high	60 Å²	60	44.7 Å²	44.7	37%	0.368	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.3	174.6	-62.8	0	0	0	0	110.1	T240 M285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.2Å; T238-M285 VanDerWaalsContact O-CA 3.31Å; T238-M285 WeakPolarHBondContact O-CA 3.29Å; T238-Q286 PolarHBondContact N-O 2.85Å; T238-Q286 PolarHBondContact O-N 2.83Å
239	L	96.8	Very high	95.9	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.037	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.5	174	-87.4	66.4	0	0	0	108.9	A229 I237 L254 K267 A269 H284 M285	A229-L239 HydrophobicContact CB-CD1 4.21Å; A229-L239 HydrophobicContact CB-CD2 4.24Å; I237-L239 HydrophobicContact CB-CD1 4.37Å; I237-L239 HydrophobicContact CD1-CD1 3.61Å; I237-L239 HydrophobicContact CG1-CD1 3.54Å; I237-L239 HydrophobicContact CG2-CD1 4.01Å; L239-L254 HydrophobicContact CB-CD1 4.09Å; L239-K267 HydrophobicContact CD1-CD 4.21Å; L239-K267 HydrophobicContact CD2-CB 4.41Å; L239-K267 HydrophobicContact CD2-CD 4.49Å; L239-K267 HydrophobicContact CD2-CG 4.44Å; L239-A269 HydrophobicContact CB-CB 4.17Å; L239-A269 HydrophobicContact CD2-CB 4.34Å; L239-H284 WeakPolarHBondContact CA-O 3.23Å; L239-M285 HydrophobicContact CD1-CE 4.08Å; L239-M285 HydrophobicContact CD1-CG 4.02Å; L239-M285 HydrophobicContact CD1-SD 4.42Å; L239-M285 HydrophobicContact CD2-CE 4.21Å; L239-M285 HydrophobicContact CG-CE 3.96Å
240	T	97	Very high	95.4	Very high	45 Å²	45	56.7 Å²	56.7	28%	0.276	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147	177.8	51.6	0	0	0	0	110.9	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.2Å; T240-C283 CarbonylContact O-C 3.57Å; T240-C283 WeakPolarHBondContact O-CA 3.49Å; T240-H284 PolarHBondContact N-O 3.14Å; T240-H284 PolarHBondContact O-N 3.19Å; T240-H284 WeakPolarHBondContact OG1-CB 3.4Å; T240-H284 PolarHBondContact OG1-O 3.16Å
241	W	97.9	Very high	95	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.008	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	136.4	169.7	-84.1	105	0	0	0	109.7	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 4.01Å; V213-W241 HydrophobicContact CG1-CZ2 4.44Å; L225-W241 HydrophobicContact CB-CH2 3.7Å; L225-W241 HydrophobicContact CB-CZ2 3.81Å; L225-W241 HydrophobicContact CD1-CH2 4.06Å; L225-W241 HydrophobicContact CD1-CZ3 4.25Å; C227-W241 HydrophobicContact CB-CH2 4.47Å; C227-W241 HydrophobicContact CB-CZ2 3.65Å; W241-Q248 HydrophobicContact CB-CB 4.31Å; W241-Q248 PolarHBondContact O-N 3.25Å; W241-A269 PolarHBondContact NE1-O 3.27Å; W241-V271 HydrophobicContact CB-CG1 4.39Å; W241-V271 HydrophobicContact CD2-CB 4.45Å; W241-V271 HydrophobicContact CD2-CG1 3.52Å; W241-V271 HydrophobicContact CE3-CG1 3.92Å; W241-V271 HydrophobicContact CG-CB 4.17Å; W241-V271 HydrophobicContact CG-CG1 3.74Å; W241-V271 HydrophobicContact CZ2-CG1 4.15Å; W241-V271 HydrophobicContact CZ3-CG1 4.4Å; W241-T282 VanDerWaalsContact CE3-C 3.43Å; W241-C283 HydrophobicContact CD2-CB 4.18Å; W241-C283 HydrophobicContact CE3-CB 4.12Å; W241-C283 HydrophobicContact CH2-CB 4.06Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 4.05Å
242	Q	97.6	Very high	94.9	Very high	39 Å²	39	59.6 Å²	59.6	18%	0.182	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.8	171.8	-69.3	-172.3	-4.1	0	0	110.3	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.56Å; Q242-E246 VanDerWaalsContact CA-O 3.25Å; Q242-E246 WeakPolarHBondContact CA-O 3.28Å; Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.38Å; Q242-D247 PolarHBondContact NE2-OD1 2.77Å; Q242-Y281 CarbonylContact O-C 3.53Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.16Å; Q242-T282 PolarHBondContact N-O 2.82Å; Q242-T282 PolarHBondContact O-N 3.49Å; Q242-H284 PolarHBondContact OE1-CE1 3.32Å; Q242-H284 PolarHBondContact OE1-NE2 3.26Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.1Å
243	R	97.1	Very high	94.8	Very high	83 Å²	83	65 Å²	65	31%	0.313	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	116.3	168.6	-176.9	-179.2	69.8	-163.1	-4.9	108.6	G245 E246 Q248 R280 Y281	R243-G245 PolarHBondContact O-N 3Å; R243-G245 VanDerWaalsContact O-N 3.09Å; R243-E246 PolarHBondContact N-O 3.43Å; R243-E246 PolarHBondContact O-N 3.02Å; R243-Q248 HydrophobicContact CB-CG 3.94Å; R243-R280 WeakPolarHBondContact CA-O 3.35Å; R243-R280 HydrophobicContact CG-CB 4.42Å; R243-Y281 HydrophobicContact CB-CD1 4.03Å; R243-Y281 HydrophobicContact CB-CE1 3.84Å; R243-Y281 VanDerWaalsContact CD-CZ 3.48Å; R243-Y281 VanDerWaalsContact CD-OH 3.31Å; R243-Y281 WeakPolarHBondContact CD-OH 3.26Å; R243-Y281 HydrophobicContact CG-CD1 4.38Å; R243-Y281 HydrophobicContact CG-CE1 4Å; R243-Y281 HydrophobicContact CG-CE2 4.21Å
244	D	94.6	Very high	94.9	Very high	98 Å²	98	69.1 Å²	69.1	52%	0.524	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	32.3	-174.2	-47.1	-62.9	0	0	0	113.8	R280	D244-R280 PolarHBondContact N-O 3.22Å; D244-R280 IonicContact OD1-CZ 3.95Å; D244-R280 IonicContact OD1-NE 3.08Å; D244-R280 PolarHBondContact OD1-NE 2.85Å; D244-R280 VanDerWaalsContact OD1-NE 3.08Å; D244-R280 IonicContact OD1-NH2 3.95Å; D244-R280 IonicContact OD2-CZ 3.1Å; D244-R280 IonicContact OD2-NE 2.91Å; D244-R280 PolarHBondContact OD2-NE 3.46Å; D244-R280 IonicContact OD2-NH2 2.6Å; D244-R280 PolarHBondContact OD2-NH2 3.46Å
245	G	91.3	Very high	95	Very high	50 Å²	50	69.7 Å²	69.7	52%	0.515	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	0	-177.7	0	0	0	0	0	115.8	R243	R243-G245 PolarHBondContact O-N 3Å; R243-G245 VanDerWaalsContact O-N 3.09Å
246	E	95.3	Very high	95	Very high	131 Å²	131	77.2 Å²	77.2	61%	0.612	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.3	175.2	-64.2	-174.5	165.4	0	0	111.8	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.56Å; Q242-E246 VanDerWaalsContact CA-O 3.25Å; Q242-E246 WeakPolarHBondContact CA-O 3.28Å; R243-E246 PolarHBondContact N-O 3.43Å; R243-E246 PolarHBondContact O-N 3.02Å; E246-Q248 PolarHBondContact O-NE2 2.56Å
247	D	95.2	Very high	95.1	Very high	97 Å²	97	72.3 Å²	72.3	52%	0.519	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	134.2	179.3	-68.1	-23.1	0	0	0	112.5	Q242	Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.38Å; Q242-D247 PolarHBondContact NE2-OD1 2.77Å
248	Q	95	Very high	95.2	Very high	14 Å²	14	76.4 Å²	76.4	7%	0.065	40%	0.397	C	S	.	.			trans	-105.8	36.7	-178.2	-57.6	-57.8	-66.4	0	0	112.3	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.31Å; W241-Q248 PolarHBondContact O-N 3.25Å; R243-Q248 HydrophobicContact CB-CG 3.94Å; E246-Q248 PolarHBondContact O-NE2 2.56Å; Q248-Q250 VanDerWaalsContact C-N 3.29Å; Q248-Q250 PolarHBondContact O-N 3.45Å; Q248-D251 PolarHBondContact O-N 2.88Å; Q248-D251 VanDerWaalsContact O-N 3.16Å; Q248-T252 WeakPolarHBondContact O-CB 3.25Å; Q248-T252 PolarHBondContact O-N 3.06Å; Q248-T252 VanDerWaalsContact O-N 3.08Å; Q248-T252 PolarHBondContact O-OG1 2.89Å; Q248-Y281 HydrophobicContact CG-CE1 4.42Å
249	T	89.4	Confident	95.2	Very high	106 Å²	106	78.1 Å²	78.1	65%	0.65	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-36.6	-169.9	-46.4	0	0	0	0	114.1
250	Q	89.4	Confident	95.2	Very high	192 Å²	192	80.1 Å²	80.1	90%	0.897	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-31.1	-178.6	-65.6	-174.7	7.9	0	0	113.2	Q248	Q248-Q250 VanDerWaalsContact C-N 3.29Å; Q248-Q250 PolarHBondContact O-N 3.45Å
251	D	88.4	Confident	95	Very high	111 Å²	111	81.6 Å²	81.6	59%	0.594	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	1.7	-177.6	-59.3	-46.5	0	0	0	112.3	Q248	Q248-D251 PolarHBondContact O-N 2.88Å; Q248-D251 VanDerWaalsContact O-N 3.16Å
252	T	95.3	Very high	94.8	Very high	23 Å²	23	86.9 Å²	86.9	14%	0.141	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	121.8	-179.8	-63.4	0	0	0	0	110.7	Q248 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.25Å; Q248-T252 PolarHBondContact O-N 3.06Å; Q248-T252 VanDerWaalsContact O-N 3.08Å; Q248-T252 PolarHBondContact O-OG1 2.89Å; T252-L254 HydrophobicContact CG2-CB 4.42Å; T252-L254 PolarHBondContact O-N 2.79Å; T252-A269 HydrophobicContact CG2-CB 3.94Å; T252-A270 CarbonylContact C-O 3.6Å; T252-A270 WeakPolarHBondContact CA-O 3.36Å
253	E	96.8	Very high	94.5	Very high	114 Å²	114	87.1 Å²	87.1	53%	0.533	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	105.3	163.7	-173.6	-174.8	-171.9	0	0	108.9	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.23Å; E253-W268 VanDerWaalsContact CD-CH2 3.4Å; E253-W268 HydrophobicContact CG-CH2 3.91Å; E253-W268 HydrophobicContact CG-CZ3 3.84Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.15Å; E253-A269 CarbonylContact O-C 3.55Å; E253-A269 WeakPolarHBondContact O-CA 3.29Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 2.65Å; E253-A270 PolarHBondContact O-N 2.83Å
254	L	96.8	Very high	94.4	Very high	88 Å²	88	83.5 Å²	83.5	46%	0.461	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.7	177.6	-174.4	68.3	0	0	0	109.8	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.09Å; T252-L254 HydrophobicContact CG2-CB 4.42Å; T252-L254 PolarHBondContact O-N 2.79Å; L254-K267 HydrophobicContact CD1-CD 4.47Å; L254-A269 HydrophobicContact CD1-CB 3.66Å
255	V	96.8	Very high	94.6	Very high	32 Å²	32	80.1 Å²	80.1	19%	0.194	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-85	153.4	175.1	-64.7	0	0	0	0	112.3	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.4Å; V255-K267 VanDerWaalsContact O-CE 3.3Å; V255-K267 WeakPolarHBondContact O-CE 3.49Å; V255-K267 WeakPolarHBondContact O-CG 3.05Å; V255-K267 PolarHBondContact O-NZ 2.89Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.25Å; V255-W268 HydrophobicContact CG1-CH2 3.54Å; V255-W268 HydrophobicContact CG1-CZ2 3.16Å; V255-W268 HydrophobicContact CG1-CZ3 4.05Å; V255-W268 HydrophobicContact CG2-CD2 3.75Å; V255-W268 HydrophobicContact CG2-CE3 4.47Å; V255-W268 HydrophobicContact CG2-CG 3.73Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.13Å; V255-W268 PolarHBondContact N-O 3.27Å
256	E	96.8	Very high	94.9	Very high	172 Å²	172	79.8 Å²	79.8	80%	0.804	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-57.8	147.5	167.3	-68.2	-176.2	174.3	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.16Å
257	T	97.8	Very high	95.1	Very high	44 Å²	44	74.6 Å²	74.6	27%	0.27	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-68.1	129.8	174.7	-56.2	0	0	0	0	108.5	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.11Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; A235-T257 HydrophobicContact CB-CG2 4.31Å; T257-F265 HydrophobicContact CG2-CB 3.77Å; T257-F265 HydrophobicContact CG2-CD1 3.93Å; T257-F265 HydrophobicContact CG2-CG 4.12Å; T257-K267 WeakPolarHBondContact OG1-CD 3.48Å; T257-K267 PolarHBondContact OG1-NZ 3.41Å; T257-K267 VanDerWaalsContact OG1-NZ 3.16Å
258	R	97.3	Very high	95.2	Very high	97 Å²	97	71.1 Å²	71.1	37%	0.366	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	144.7	-174.4	68.6	-167.8	-179.3	-169.6	2.3	111.4	E256 F265 Q266	E256-R258 PolarHBondContact O-N 3.16Å; R258-F265 WeakPolarHBondContact O-CA 3.27Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 3.26Å; R258-Q266 WeakPolarHBondContact O-CG 3.45Å; R258-Q266 PolarHBondContact O-N 2.77Å
259	P	97.1	Very high	95.4	Very high	95 Å²	95	70.5 Å²	70.5	62%	0.617	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	144.4	178.4	28.6	-34.5	0	0	0	111.2	F265	P259-F265 HydrophobicContact CB-CE1 4.31Å
260	A	96.3	Very high	95.8	Very high	49 Å²	49	65.6 Å²	65.6	41%	0.405	37%	0.367	S	S	.	.			trans	-87.8	-17.4	173.1	0	0	0	0	0	112.9	D262 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.04Å; A260-T264 WeakPolarHBondContact CB-O 3.06Å; A260-T264 PolarHBondContact N-O 3.04Å
261	G	93	Very high	96.2	Very high	76 Å²	76	56.6 Å²	56.6	78%	0.784	33%	0.325	S	S	*	.	S	Bend	trans	96.1	-6.5	178.6	0	0	0	0	0	114.8
262	D	92.6	Very high	96.6	Very high	114 Å²	114	54.8 Å²	54.8	61%	0.61	32%	0.318	S	S	*	.	S	Bend	trans	-105.5	11.9	176.3	60.6	0.7	0	0	0	113.1	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.04Å; D262-T264 WeakPolarHBondContact OD1-CB 3.47Å; D262-T264 PolarHBondContact OD1-N 2.61Å; D262-T264 PolarHBondContact OD1-OG1 2.88Å
263	G	91.4	Very high	96.7	Very high	43 Å²	43	53.8 Å²	53.8	44%	0.443	31%	0.311	S	S	.	.	S	Bend	trans	90.1	-1.1	-174	0	0	0	0	0	114.2	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.36Å
264	T	96.4	Very high	96.6	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.049	30%	0.3	C	S	.	.			trans	-105.5	172.7	174.7	73.6	0	0	0	0	112.5	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.34Å; F232-T264 WeakPolarHBondContact O-CA 3.44Å; A260-T264 WeakPolarHBondContact CB-O 3.06Å; A260-T264 PolarHBondContact N-O 3.04Å; D262-T264 WeakPolarHBondContact OD1-CB 3.47Å; D262-T264 PolarHBondContact OD1-N 2.61Å; D262-T264 PolarHBondContact OD1-OG1 2.88Å
265	F	98	Very high	96.4	Very high	26 Å²	26	48.9 Å²	48.9	11%	0.114	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	162.7	-177.4	-63.5	-86.4	0	0	0	112.4	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.76Å; D54-F265 HydrophobicContact CB-CZ 3.7Å; G231-F265 PolarHBondContact N-O 2.82Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.14Å; F232-F265 HydrophobicContact CD2-CB 3.97Å; F232-F265 HydrophobicContact CE1-CB 4.27Å; F232-F265 WeakPolarHBondContact CE1-O 3.3Å; F232-F265 HydrophobicContact CE2-CB 3.51Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 2.99Å; F232-F265 PolarHBondContact O-N 3.36Å; Y233-F265 HydrophobicContact CD2-CD2 4.47Å; Y233-F265 HydrophobicContact CD2-CE2 4.02Å; Y233-F265 HydrophobicContact CE2-CE2 4.47Å; A235-F265 HydrophobicContact CB-CD1 3.72Å; A235-F265 HydrophobicContact CB-CD2 3.68Å; A235-F265 HydrophobicContact CB-CE1 3.7Å; A235-F265 HydrophobicContact CB-CE2 3.67Å; A235-F265 HydrophobicContact CB-CG 3.73Å; A235-F265 HydrophobicContact CB-CZ 3.7Å; T257-F265 HydrophobicContact CG2-CB 3.77Å; T257-F265 HydrophobicContact CG2-CD1 3.93Å; T257-F265 HydrophobicContact CG2-CG 4.12Å; R258-F265 WeakPolarHBondContact O-CA 3.27Å; P259-F265 HydrophobicContact CB-CE1 4.31Å
266	Q	98.2	Very high	96.1	Very high	44 Å²	44	50.6 Å²	50.6	21%	0.206	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.2	174	42.4	166.6	-21.6	0	0	110.2	A229 L230 R258	A229-Q266 CarbonylContact O-C 3.58Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.48Å; L230-Q266 HydrophobicContact CD2-CB 3.59Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 3.26Å; R258-Q266 WeakPolarHBondContact O-CG 3.45Å; R258-Q266 PolarHBondContact O-N 2.77Å
267	K	98.5	Very high	96	Very high	22 Å²	22	45.5 Å²	45.5	10%	0.096	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	155	177.4	-162.1	-175.4	-172	69.5	0	109	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 2.64Å; A229-K267 PolarHBondContact O-N 3.06Å; A229-K267 VanDerWaalsContact O-O 3.1Å; F232-K267 HydrophobicContact CE1-CB 4.37Å; F232-K267 HydrophobicContact CZ-CB 4.12Å; I237-K267 HydrophobicContact CG2-CB 4.29Å; I237-K267 HydrophobicContact CG2-CD 3.6Å; L239-K267 HydrophobicContact CD1-CD 4.21Å; L239-K267 HydrophobicContact CD2-CB 4.41Å; L239-K267 HydrophobicContact CD2-CD 4.49Å; L239-K267 HydrophobicContact CD2-CG 4.44Å; L254-K267 HydrophobicContact CD1-CD 4.47Å; V255-K267 HydrophobicContact CG2-CG 4.4Å; V255-K267 VanDerWaalsContact O-CE 3.3Å; V255-K267 WeakPolarHBondContact O-CE 3.49Å; V255-K267 WeakPolarHBondContact O-CG 3.05Å; V255-K267 PolarHBondContact O-NZ 2.89Å; T257-K267 WeakPolarHBondContact OG1-CD 3.48Å; T257-K267 PolarHBondContact OG1-NZ 3.41Å; T257-K267 VanDerWaalsContact OG1-NZ 3.16Å
268	W	98.2	Very high	95.9	Very high	24 Å²	24	44.3 Å²	44.3	9%	0.091	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	157.2	169.4	58.4	-98.1	0	0	0	111.5	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4Å; R226-W268 HydrophobicContact CG-CD2 4.11Å; R226-W268 HydrophobicContact CG-CE3 3.88Å; R226-W268 HydrophobicContact CG-CG 4.21Å; C227-W268 CarbonylContact O-C 3.55Å; C227-W268 WeakPolarHBondContact O-CA 3.43Å; C227-W268 WeakPolarHBondContact O-CB 3.36Å; W228-W268 HydrophobicContact CD2-CB 3.95Å; W228-W268 HydrophobicContact CD2-CG 4.44Å; W228-W268 HydrophobicContact CE3-CB 3.87Å; W228-W268 AromaticContact CE3-CD1 3.85Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.38Å; W228-W268 AromaticContact CH2-CD1 3.6Å; W228-W268 HydrophobicContact CH2-CG 4.24Å; W228-W268 HydrophobicContact CZ2-CG 4.5Å; W228-W268 HydrophobicContact CZ3-CB 4.29Å; W228-W268 AromaticContact CZ3-CD1 3.37Å; W228-W268 HydrophobicContact CZ3-CG 4.08Å; E253-W268 HydrophobicContact CB-CZ3 4.23Å; E253-W268 VanDerWaalsContact CD-CH2 3.4Å; E253-W268 HydrophobicContact CG-CH2 3.91Å; E253-W268 HydrophobicContact CG-CZ3 3.84Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.15Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.25Å; V255-W268 HydrophobicContact CG1-CH2 3.54Å; V255-W268 HydrophobicContact CG1-CZ2 3.16Å; V255-W268 HydrophobicContact CG1-CZ3 4.05Å; V255-W268 HydrophobicContact CG2-CD2 3.75Å; V255-W268 HydrophobicContact CG2-CE3 4.47Å; V255-W268 HydrophobicContact CG2-CG 3.73Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.13Å; V255-W268 PolarHBondContact N-O 3.27Å; W268-A270 HydrophobicContact CE3-CB 3.94Å; W268-A270 HydrophobicContact CZ3-CB 3.64Å
269	A	98.1	Very high	95.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	132.5	173.6	0	0	0	0	0	108.6	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.43Å; C227-A269 PolarHBondContact N-O 3.21Å; C227-A269 PolarHBondContact O-N 2.88Å; L239-A269 HydrophobicContact CB-CB 4.17Å; L239-A269 HydrophobicContact CD2-CB 4.34Å; W241-A269 PolarHBondContact NE1-O 3.27Å; T252-A269 HydrophobicContact CG2-CB 3.94Å; E253-A269 CarbonylContact O-C 3.55Å; E253-A269 WeakPolarHBondContact O-CA 3.29Å; L254-A269 HydrophobicContact CD1-CB 3.66Å
270	A	97.8	Very high	95.7	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.025	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	145.7	179.9	0	0	0	0	0	112.2	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.9Å; L225-A270 CarbonylContact O-C 3.56Å; L225-A270 WeakPolarHBondContact O-CA 3.4Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.13Å; T252-A270 CarbonylContact C-O 3.6Å; T252-A270 WeakPolarHBondContact CA-O 3.36Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 2.65Å; E253-A270 PolarHBondContact O-N 2.83Å; W268-A270 HydrophobicContact CE3-CB 3.94Å; W268-A270 HydrophobicContact CZ3-CB 3.64Å
271	V	97.8	Very high	95.7	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.024	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	141.2	177.4	56.9	0	0	0	0	109	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.47Å; L225-V271 HydrophobicContact CB-CG1 4.18Å; L225-V271 PolarHBondContact N-O 3.03Å; L225-V271 PolarHBondContact O-N 3.16Å; W241-V271 HydrophobicContact CB-CG1 4.39Å; W241-V271 HydrophobicContact CD2-CB 4.45Å; W241-V271 HydrophobicContact CD2-CG1 3.52Å; W241-V271 HydrophobicContact CE3-CG1 3.92Å; W241-V271 HydrophobicContact CG-CB 4.17Å; W241-V271 HydrophobicContact CG-CG1 3.74Å; W241-V271 HydrophobicContact CZ2-CG1 4.15Å; W241-V271 HydrophobicContact CZ3-CG1 4.4Å; V271-V273 HydrophobicContact CG1-CG1 3.85Å; V271-V273 HydrophobicContact CG2-CG1 4.16Å; V271-Y281 HydrophobicContact CG1-CD1 4.16Å; V271-Y281 HydrophobicContact CG2-CD1 4.2Å; V271-Y281 HydrophobicContact CG2-CE1 3.95Å
272	V	97.4	Very high	95.9	Very high	73 Å²	73	41.4 Å²	41.4	44%	0.442	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	125.8	170.9	-179.8	0	0	0	0	108.3	L218 E222	L218-V272 HydrophobicContact CD1-CG1 4.2Å; L218-V272 HydrophobicContact CD1-CG2 4.24Å; E222-V272 HydrophobicContact CB-CG1 4.17Å; E222-V272 HydrophobicContact CG-CG1 4.4Å
273	V	96.6	Very high	96.2	Very high	1 Å²	1	36 Å²	36	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.1	-175.4	-53.2	0	0	0	0	110.5	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.15Å; A223-V273 HydrophobicContact CB-CG2 4.48Å; A223-V273 PolarHBondContact N-O 3.37Å; A223-V273 WeakPolarHBondContact O-CG2 3.43Å; A223-V273 PolarHBondContact O-N 3.33Å; L225-V273 HydrophobicContact CD1-CG1 4.01Å; L225-V273 HydrophobicContact CD1-CG2 4.05Å; L225-V273 HydrophobicContact CG-CG1 4.16Å; L225-V273 HydrophobicContact CG-CG2 3.83Å; V271-V273 HydrophobicContact CG1-CG1 3.85Å; V271-V273 HydrophobicContact CG2-CG1 4.16Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; V273-Y281 HydrophobicContact CB-CD2 3.95Å; V273-Y281 HydrophobicContact CB-CE2 3.65Å; V273-Y281 HydrophobicContact CG1-CD1 3.73Å; V273-Y281 HydrophobicContact CG1-CD2 3.52Å; V273-Y281 HydrophobicContact CG1-CE1 3.72Å; V273-Y281 HydrophobicContact CG1-CE2 3.51Å; V273-Y281 HydrophobicContact CG1-CG 3.63Å
274	P	96.3	Very high	96.4	Very high	46 Å²	46	36 Å²	36	30%	0.299	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	139.7	170.3	-19.9	32.2	0	0	0	111.1	H221 G276 Q277	H221-P274 CarbonylContact O-C 3.57Å; H221-P274 WeakPolarHBondContact O-CA 3.46Å; P274-G276 PolarHBondContact O-N 3.34Å; P274-Q277 HydrophobicContact CB-CB 4.41Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.38Å; P274-Q277 PolarHBondContact O-N 3.26Å
275	S	92.3	Very high	96.4	Very high	53 Å²	53	35.6 Å²	35.6	37%	0.371	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	132.5	176.7	-61.6	0	0	0	0	111.4	H221 E222 Q277 E278	H221-S275 PolarHBondContact O-N 2.98Å; H221-S275 PolarHBondContact O-OG 2.98Å; E222-S275 PolarHBondContact N-OG 2.91Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; S275-E278 WeakPolarHBondContact CA-OE1 3.36Å
276	G	91.1	Very high	96.4	Very high	68 Å²	68	38.6 Å²	38.6	70%	0.701	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.7	-2.7	-176.4	0	0	0	0	0	114.8	P274 E278	P274-G276 PolarHBondContact O-N 3.34Å; G276-E278 WeakPolarHBondContact CA-OE2 3.36Å; G276-E278 VanDerWaalsContact N-CD 3.29Å; G276-E278 PolarHBondContact N-OE1 2.87Å; G276-E278 PolarHBondContact N-OE2 2.76Å
277	Q	94.6	Very high	96.2	Very high	65 Å²	65	36.7 Å²	36.7	30%	0.304	20%	0.201	S	C	.	.			trans	-106.6	6.6	175	-60.3	-168.5	38.4	0	0	113.2	P274 S275 Q279 R280 Y281	P274-Q277 HydrophobicContact CB-CB 4.41Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.38Å; P274-Q277 PolarHBondContact O-N 3.26Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; Q277-Q279 PolarHBondContact O-N 3.32Å; Q277-Q279 VanDerWaalsContact O-N 3.14Å; Q277-R280 WeakPolarHBondContact O-CB 3.33Å; Q277-R280 PolarHBondContact O-N 3.04Å; Q277-Y281 HydrophobicContact CB-CE2 4.37Å; Q277-Y281 VanDerWaalsContact O-CD2 3.29Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.37Å
278	E	94.3	Very high	95.9	Very high	19 Å²	19	39.1 Å²	39.1	9%	0.089	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-57	-35.8	-173.3	-58.5	81.1	-179.1	0	0	112.2	L225 V273 S275 G276 R280 Y281 W298	L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CG 4.36Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; S275-E278 WeakPolarHBondContact CA-OE1 3.36Å; G276-E278 WeakPolarHBondContact CA-OE2 3.36Å; G276-E278 VanDerWaalsContact N-CD 3.29Å; G276-E278 PolarHBondContact N-OE1 2.87Å; G276-E278 PolarHBondContact N-OE2 2.76Å; E278-R280 PolarHBondContact O-N 3.1Å; E278-Y281 PolarHBondContact O-N 3.05Å; E278-Y281 VanDerWaalsContact O-N 3.15Å; E278-W298 HydrophobicContact CB-CD2 4.34Å; E278-W298 HydrophobicContact CB-CE3 3.36Å; E278-W298 HydrophobicContact CB-CZ3 3.76Å; E278-W298 HydrophobicContact CG-CE3 3.74Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å
279	Q	94	Very high	95.6	Very high	108 Å²	108	39.1 Å²	39.1	51%	0.505	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-69.7	-15.7	179.7	-63.7	-58.1	-40.6	0	0	114.2	Q277 W298	Q277-Q279 PolarHBondContact O-N 3.32Å; Q277-Q279 VanDerWaalsContact O-N 3.14Å; Q279-W298 PolarHBondContact NE2-O 3.36Å
280	R	96.1	Very high	95.4	Very high	109 Å²	109	40 Å²	40	41%	0.411	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-78.9	-13.5	174.5	-63.7	175.4	68	-176	8.7	112.3	R243 D244 Q277 E278	R243-R280 WeakPolarHBondContact CA-O 3.35Å; R243-R280 HydrophobicContact CG-CB 4.42Å; D244-R280 PolarHBondContact N-O 3.22Å; D244-R280 IonicContact OD1-CZ 3.95Å; D244-R280 IonicContact OD1-NE 3.08Å; D244-R280 PolarHBondContact OD1-NE 2.85Å; D244-R280 VanDerWaalsContact OD1-NE 3.08Å; D244-R280 IonicContact OD1-NH2 3.95Å; D244-R280 IonicContact OD2-CZ 3.1Å; D244-R280 IonicContact OD2-NE 2.91Å; D244-R280 PolarHBondContact OD2-NE 3.46Å; D244-R280 IonicContact OD2-NH2 2.6Å; D244-R280 PolarHBondContact OD2-NH2 3.46Å; Q277-R280 WeakPolarHBondContact O-CB 3.33Å; Q277-R280 PolarHBondContact O-N 3.04Å; E278-R280 PolarHBondContact O-N 3.1Å
281	Y	97.2	Very high	95.1	Very high	7 Å²	7	49.5 Å²	49.5	3%	0.027	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	128.1	-178.3	-66.9	-98.8	0	0	0	110.6	Q242 R243 Q248 V271 V273 Q277 E278	Q242-Y281 CarbonylContact O-C 3.53Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.16Å; R243-Y281 HydrophobicContact CB-CD1 4.03Å; R243-Y281 HydrophobicContact CB-CE1 3.84Å; R243-Y281 VanDerWaalsContact CD-CZ 3.48Å; R243-Y281 VanDerWaalsContact CD-OH 3.31Å; R243-Y281 WeakPolarHBondContact CD-OH 3.26Å; R243-Y281 HydrophobicContact CG-CD1 4.38Å; R243-Y281 HydrophobicContact CG-CE1 4Å; R243-Y281 HydrophobicContact CG-CE2 4.21Å; Q248-Y281 HydrophobicContact CG-CE1 4.42Å; V271-Y281 HydrophobicContact CG1-CD1 4.16Å; V271-Y281 HydrophobicContact CG2-CD1 4.2Å; V271-Y281 HydrophobicContact CG2-CE1 3.95Å; V273-Y281 HydrophobicContact CB-CD2 3.95Å; V273-Y281 HydrophobicContact CB-CE2 3.65Å; V273-Y281 HydrophobicContact CG1-CD1 3.73Å; V273-Y281 HydrophobicContact CG1-CD2 3.52Å; V273-Y281 HydrophobicContact CG1-CE1 3.72Å; V273-Y281 HydrophobicContact CG1-CE2 3.51Å; V273-Y281 HydrophobicContact CG1-CG 3.63Å; Q277-Y281 HydrophobicContact CB-CE2 4.37Å; Q277-Y281 VanDerWaalsContact O-CD2 3.29Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.37Å; E278-Y281 PolarHBondContact O-N 3.05Å; E278-Y281 VanDerWaalsContact O-N 3.15Å
282	T	97.6	Very high	94.8	Very high	32 Å²	32	56.7 Å²	56.7	20%	0.196	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	133.8	176.7	50.6	0	0	0	0	110.2	W241 Q242 H284 T295 L296	W241-T282 VanDerWaalsContact CE3-C 3.43Å; Q242-T282 PolarHBondContact N-O 2.82Å; Q242-T282 PolarHBondContact O-N 3.49Å; T282-H284 PolarHBondContact OG1-NE2 3.4Å; T282-T295 HydrophobicContact CG2-CG2 4.06Å; T282-L296 CarbonylContact C-O 3.53Å; T282-L296 WeakPolarHBondContact CA-O 3.24Å
283	C	97.8	Very high	94.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.5	171.8	174.9	0	0	0	0	109.1	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.54Å; C227-C283 WeakPolarHBondContact CB-SG 3.35Å; C227-C283 WeakPolarHBondContact SG-CB 3.39Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 2.85Å; T240-C283 CarbonylContact O-C 3.57Å; T240-C283 WeakPolarHBondContact O-CA 3.49Å; W241-C283 HydrophobicContact CD2-CB 4.18Å; W241-C283 HydrophobicContact CE3-CB 4.12Å; W241-C283 HydrophobicContact CH2-CB 4.06Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 4.05Å; C283-T295 CarbonylContact O-C 3.54Å; C283-T295 WeakPolarHBondContact O-CA 3.25Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 2.98Å; C283-L296 PolarHBondContact O-N 3.24Å
284	H	97.1	Very high	94.6	Very high	43 Å²	43	59.3 Å²	59.3	20%	0.199	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.5	176.8	-67.2	-101.6	0	0	0	109.7	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.23Å; T240-H284 PolarHBondContact N-O 3.14Å; T240-H284 PolarHBondContact O-N 3.19Å; T240-H284 WeakPolarHBondContact OG1-CB 3.4Å; T240-H284 PolarHBondContact OG1-O 3.16Å; Q242-H284 PolarHBondContact OE1-CE1 3.32Å; Q242-H284 PolarHBondContact OE1-NE2 3.26Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.1Å; T282-H284 PolarHBondContact OG1-NE2 3.4Å; H284-L294 WeakPolarHBondContact CA-O 3.43Å; H284-T295 PolarHBondContact ND1-OG1 3.44Å
285	M	96.4	Very high	94.6	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	131.1	-174.2	-173.6	176.2	-57.3	0	0	111.6	P209 T211 A229 I237 T238 L239 L290 P293 L294 L296	P209-M285 HydrophobicContact CB-SD 3.88Å; P209-M285 HydrophobicContact CG-CG 4.47Å; P209-M285 HydrophobicContact CG-SD 3.4Å; P209-M285 WeakPolarHBondContact CG-SD 3.47Å; T211-M285 HydrophobicContact CG2-CE 3.5Å; T211-M285 HydrophobicContact CG2-SD 3.36Å; T211-M285 WeakPolarHBondContact CG2-SD 3.14Å; A229-M285 HydrophobicContact CB-CE 3.67Å; A229-M285 HydrophobicContact CB-SD 3.93Å; I237-M285 HydrophobicContact CD1-CG 4.17Å; I237-M285 HydrophobicContact CD1-SD 4.05Å; I237-M285 HydrophobicContact CG1-CG 4.4Å; T238-M285 VanDerWaalsContact O-CA 3.31Å; T238-M285 WeakPolarHBondContact O-CA 3.29Å; L239-M285 HydrophobicContact CD1-CE 4.08Å; L239-M285 HydrophobicContact CD1-CG 4.02Å; L239-M285 HydrophobicContact CD1-SD 4.42Å; L239-M285 HydrophobicContact CD2-CE 4.21Å; L239-M285 HydrophobicContact CG-CE 3.96Å; M285-L290 HydrophobicContact CG-CD1 4.34Å; M285-P293 CarbonylContact O-C 3.57Å; M285-P293 WeakPolarHBondContact O-CA 3.43Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 3.49Å; M285-L294 PolarHBondContact O-N 2.94Å; M285-L296 HydrophobicContact CE-CD1 4.38Å
286	Q	96.1	Very high	94.8	Very high	90 Å²	90	60.1 Å²	60.1	42%	0.421	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	132.7	175.3	-58.9	-179.8	6.6	0	0	109.5	I237 T238 P293	I237-Q286 WeakPolarHBondContact CG1-O 3.47Å; T238-Q286 PolarHBondContact N-O 2.85Å; T238-Q286 PolarHBondContact O-N 2.83Å; Q286-P293 HydrophobicContact CG-CB 3.99Å; Q286-P293 HydrophobicContact CG-CG 4.12Å
287	H	95.2	Very high	94.9	Very high	4 Å²	4	59.6 Å²	59.6	2%	0.019	30%	0.303	C	S	.	.			trans	-161.2	137.7	-176.9	-178.1	-97.8	0	0	0	111.8	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 WeakPolarHBondContact CH2-O 3.29Å; W23-H287 VanDerWaalsContact CZ3-O 3.3Å; W23-H287 WeakPolarHBondContact CZ3-O 3.34Å; E207-H287 PolarHBondContact O-CE1 3.47Å; P209-H287 HydrophobicContact CG-CB 4.28Å; F232-H287 AromaticContact CD2-CD2 3.78Å; F232-H287 AromaticContact CD2-NE2 3.62Å; Y233-H287 PolarHBondContact O-CE1 2.69Å; P234-H287 PolarHBondContact O-NE2 3.08Å; E236-H287 PolarHBondContact O-CD2 2.9Å; I237-H287 HydrophobicContact CD1-CB 4.15Å; I237-H287 HydrophobicContact CG1-CB 3.97Å; H287-G289 PolarHBondContact CE1-N 3.01Å; H287-G289 PolarHBondContact ND1-N 3.19Å; H287-G289 PolarHBondContact O-N 2.83Å; H287-L290 HydrophobicContact CB-CD1 3.93Å; H287-L290 HydrophobicContact CB-CG 4.15Å; H287-L290 WeakPolarHBondContact O-CB 3.34Å; H287-L290 PolarHBondContact O-N 3.49Å
288	E	91.9	Very high	94.9	Very high	72 Å²	72	58.7 Å²	58.7	34%	0.336	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-10.6	-54.1	160	174.2	-136.9	-144.4	0	0	119.2	W23 C25 A206	W23-E288 HydrophobicContact CD2-CB 4.39Å; W23-E288 HydrophobicContact CE3-CB 3.47Å; W23-E288 VanDerWaalsContact CE3-CB 3.47Å; W23-E288 HydrophobicContact CE3-CG 3.94Å; W23-E288 HydrophobicContact CH2-CB 4.19Å; W23-E288 VanDerWaalsContact CZ3-CA 3.42Å; W23-E288 HydrophobicContact CZ3-CB 3.42Å; W23-E288 VanDerWaalsContact CZ3-CB 3.42Å; W23-E288 HydrophobicContact CZ3-CG 4.16Å; W23-E288 WeakPolarHBondContact CZ3-O 3.35Å; C25-E288 PolarHBondContact SG-OE1 3.09Å; A206-E288 HydrophobicContact CB-CG 4.14Å
289	G	92.3	Very high	94.5	Very high	24 Å²	24	65.6 Å²	65.6	25%	0.247	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-7.5	-172.1	0	0	0	0	0	114.1	H287	H287-G289 PolarHBondContact CE1-N 3.01Å; H287-G289 PolarHBondContact ND1-N 3.19Å; H287-G289 PolarHBondContact O-N 2.83Å
290	L	93.9	Very high	93.9	Very high	19 Å²	19	63.9 Å²	63.9	10%	0.099	33%	0.327	C	S	.	.			trans	-94.6	129.3	-176.6	-62.8	173.7	0	0	0	110.8	W23 P208 P209 M285 H287 E292 L294	W23-L290 WeakPolarHBondContact CH2-O 3.23Å; W23-L290 VanDerWaalsContact CZ3-O 3.31Å; W23-L290 WeakPolarHBondContact CZ3-O 3.41Å; P208-L290 HydrophobicContact CB-CD2 3.89Å; P209-L290 HydrophobicContact CG-CD1 4.1Å; P209-L290 HydrophobicContact CG-CD2 4.42Å; P209-L290 HydrophobicContact CG-CG 4.37Å; M285-L290 HydrophobicContact CG-CD1 4.34Å; H287-L290 HydrophobicContact CB-CD1 3.93Å; H287-L290 HydrophobicContact CB-CG 4.15Å; H287-L290 WeakPolarHBondContact O-CB 3.34Å; H287-L290 PolarHBondContact O-N 3.49Å; L290-E292 VanDerWaalsContact C-N 3.29Å; L290-E292 PolarHBondContact O-N 3.11Å; L290-L294 HydrophobicContact CD1-CB 4.45Å; L290-L294 HydrophobicContact CD1-CD1 3.89Å; L290-L294 HydrophobicContact CD1-CG 3.88Å; L290-L294 HydrophobicContact CD2-CD1 3.54Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.38Å; L290-L294 HydrophobicContact CG-CG 4.48Å
291	Q	90.9	Very high	92.3	Very high	203 Å²	203	63.5 Å²	63.5	95%	0.949	34%	0.341	S	S	*	.	S	Bend	trans	-65.2	-36.1	175	-67.3	-178.3	-5.3	0	0	112.2
292	E	92.1	Very high	90	Very high	154 Å²	154	68.4 Å²	68.4	72%	0.72	38%	0.377	S	S	*	.	S	Bend	trans	-139.4	151.4	176.8	-65.9	-176.9	178.6	0	0	109.1	L290 L294	L290-E292 VanDerWaalsContact C-N 3.29Å; L290-E292 PolarHBondContact O-N 3.11Å; E292-L294 PolarHBondContact O-N 3.43Å
293	P	94.1	Very high	87.4	Confident	71 Å²	71	74.4 Å²	74.4	46%	0.461	40%	0.403	S	S	.	.			trans	-52.8	133.7	172.7	-26.9	35.8	0	0	0	112	M285 Q286	M285-P293 CarbonylContact O-C 3.57Å; M285-P293 WeakPolarHBondContact O-CA 3.43Å; Q286-P293 HydrophobicContact CG-CB 3.99Å; Q286-P293 HydrophobicContact CG-CG 4.12Å
294	L	95.1	Very high	84.9	Confident	58 Å²	58	79.4 Å²	79.4	30%	0.304	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	139.6	177.2	-68.4	178.1	0	0	0	110.6	T211 H284 M285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.32Å; H284-L294 WeakPolarHBondContact CA-O 3.43Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 3.49Å; M285-L294 PolarHBondContact O-N 2.94Å; L290-L294 HydrophobicContact CD1-CB 4.45Å; L290-L294 HydrophobicContact CD1-CD1 3.89Å; L290-L294 HydrophobicContact CD1-CG 3.88Å; L290-L294 HydrophobicContact CD2-CD1 3.54Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.38Å; L290-L294 HydrophobicContact CG-CG 4.48Å; E292-L294 PolarHBondContact O-N 3.43Å
295	T	96.5	Very high	82.6	Confident	82 Å²	82	83.7 Å²	83.7	50%	0.503	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121.3	170.3	-55.8	0	0	0	0	108.5	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 4.06Å; C283-T295 CarbonylContact O-C 3.54Å; C283-T295 WeakPolarHBondContact O-CA 3.25Å; H284-T295 PolarHBondContact ND1-OG1 3.44Å
296	L	95.8	Very high	80.7	Confident	35 Å²	35	88.7 Å²	88.7	18%	0.183	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.9	-174.5	-59.2	163.6	0	0	0	109.6	T211 V213 T282 C283 M285	T211-L296 VanDerWaalsContact CB-CD1 3.47Å; T211-L296 HydrophobicContact CG2-CD1 4.08Å; V213-L296 HydrophobicContact CG2-CB 3.94Å; T282-L296 CarbonylContact C-O 3.53Å; T282-L296 WeakPolarHBondContact CA-O 3.24Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 2.98Å; C283-L296 PolarHBondContact O-N 3.24Å; M285-L296 HydrophobicContact CE-CD1 4.38Å
297	S	93.9	Very high	78.7	Confident	57 Å²	57	88.4 Å²	88.4	40%	0.399	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	162.3	166.5	55.5	0	0	0	0	110	E299	S297-E299 PolarHBondContact O-N 2.97Å
298	W	94.4	Very high	77	Confident	46 Å²	46	94 Å²	94	17%	0.174	53%	0.525	C	S	.	.			trans	-71.8	126.7	169.9	169.9	61.2	0	0	0	110.1	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CG1-CB 3.85Å; H215-W298 HydrophobicContact CB-CD2 4.21Å; H215-W298 HydrophobicContact CB-CG 4.24Å; H215-W298 HydrophobicContact CB-CZ2 4.04Å; H215-W298 VanDerWaalsContact CB-NE1 3.26Å; H215-W298 AromaticContact CG-CE2 3.82Å; H215-W298 AromaticContact CG-CZ2 3.83Å; L225-W298 HydrophobicContact CD1-CB 4.3Å; L225-W298 HydrophobicContact CD2-CB 3.81Å; L225-W298 HydrophobicContact CD2-CD2 4.34Å; L225-W298 HydrophobicContact CD2-CG 3.89Å; E278-W298 HydrophobicContact CB-CD2 4.34Å; E278-W298 HydrophobicContact CB-CE3 3.36Å; E278-W298 HydrophobicContact CB-CZ3 3.76Å; E278-W298 HydrophobicContact CG-CE3 3.74Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å; Q279-W298 PolarHBondContact NE2-O 3.36Å; W298-P300 HydrophobicContact CE3-CG 4.41Å; W298-P300 HydrophobicContact CH2-CB 4.27Å; W298-P300 HydrophobicContact CH2-CG 3.92Å; W298-P300 HydrophobicContact CZ2-CB 4.17Å; W298-P300 HydrophobicContact CZ2-CG 4.16Å; W298-P300 HydrophobicContact CZ3-CG 4.03Å
299	E	87.1	Confident	75.3	Confident	164 Å²	164	98.4 Å²	98.4	77%	0.766	55%	0.548	S	S	*	.			trans	-107.7	121.5	173.6	-162.7	150.4	-156.8	0	0	109.8	S297 S301	S297-E299 PolarHBondContact O-N 2.97Å; E299-S301 PolarHBondContact O-N 3.42Å
300	P	80	Confident	73.8	Confident	71 Å²	71	99.4 Å²	99.4	46%	0.461	56%	0.558	S	S	.	*			trans	-58.5	128.2	175.3	-21.1	31.2	0	0	0	109.5	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.41Å; W298-P300 HydrophobicContact CH2-CB 4.27Å; W298-P300 HydrophobicContact CH2-CG 3.92Å; W298-P300 HydrophobicContact CZ2-CB 4.17Å; W298-P300 HydrophobicContact CZ2-CG 4.16Å; W298-P300 HydrophobicContact CZ3-CG 4.03Å; P300-S302 PolarHBondContact O-N 3.02Å
301	S	63	Low	72.7	Confident	101 Å²	101	103.2 Å²	103.2	71%	0.706	58%	0.577	S	S	*	*			trans	-52.2	107	177	174.9	0	0	0	0	110.3	E299 Q303	E299-S301 PolarHBondContact O-N 3.42Å; S301-Q303 PolarHBondContact O-N 2.88Å
302	S	48.9	Very low	71.8	Confident	111 Å²	111	97.8 Å²	97.8	78%	0.776	56%	0.558	S	S	*	*			trans	-78.4	67.8	165.1	62.9	0	0	0	0	108	P300 P304	P300-S302 PolarHBondContact O-N 3.02Å; S302-P304 WeakPolarHBondContact O-CD 3.36Å
303	Q	43.8	Very low	70.7	Confident	157 Å²	157	93.1 Å²	93.1	73%	0.734	55%	0.546	S	S	*	.			trans	-66.3	112.6	154.9	-84.5	-172.4	-14.4	0	0	105.6	S301 T305	S301-Q303 PolarHBondContact O-N 2.88Å; Q303-T305 PolarHBondContact O-N 3.23Å
304	P	43.5	Very low	69.9	Low	106 Å²	106	91.3 Å²	91.3	69%	0.688	54%	0.54	S	S	*	.			trans	-61.7	114.1	166.5	26.9	-30.4	0	0	0	104.9	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.36Å; P304-I306 PolarHBondContact O-N 3.4Å
305	T	50.4	Low	69.2	Low	133 Å²	133	93.4 Å²	93.4	82%	0.816	55%	0.551	S	S	*	*			trans	-62.1	84.3	161.3	-43.8	0	0	0	0	105.2	Q303 P307	Q303-T305 PolarHBondContact O-N 3.23Å; T305-P307 VanDerWaalsContact O-CD 3.28Å; T305-P307 WeakPolarHBondContact O-CD 3.45Å
306	I	54.9	Low	68.4	Low	104 Å²	104	92.1 Å²	92.1	53%	0.533	55%	0.549	S	S	.	.			trans	-51	118.9	167.4	-63.8	175.4	0	0	0	103.1	P304 I308 I311	P304-I306 PolarHBondContact O-N 3.4Å; I306-I308 HydrophobicContact CG2-CG1 4.33Å; I306-I308 PolarHBondContact O-N 3.15Å; I306-I311 HydrophobicContact CG2-CD1 4.23Å
307	P	54.8	Low	67.8	Low	85 Å²	85	94.7 Å²	94.7	55%	0.552	57%	0.566	S	S	*	*			trans	-74	77.7	-176.2	29.9	-33	0	0	0	106.9	T305 M309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.28Å; T305-P307 WeakPolarHBondContact O-CD 3.45Å; P307-M309 PolarHBondContact O-N 3.06Å; P307-M309 VanDerWaalsContact O-N 3.14Å; P307-G310 WeakPolarHBondContact O-CA 3.33Å; P307-G310 PolarHBondContact O-N 3.43Å; P307-I311 PolarHBondContact O-N 2.86Å
308	I	60.2	Low	67.2	Low	121 Å²	121	97.3 Å²	97.3	62%	0.621	58%	0.575	S	S	*	*	H	α-helix	trans	-54.6	-33.2	175.9	-65.7	169	0	0	0	108.4	I306 G310 I311 V312	I306-I308 HydrophobicContact CG2-CG1 4.33Å; I306-I308 PolarHBondContact O-N 3.15Å; I308-G310 PolarHBondContact O-N 3.28Å; I308-I311 PolarHBondContact O-N 3.13Å; I308-V312 HydrophobicContact CG2-CG2 4.29Å; I308-V312 WeakPolarHBondContact O-CB 3.35Å; I308-V312 VanDerWaalsContact O-CG2 3.23Å; I308-V312 WeakPolarHBondContact O-CG2 3.44Å; I308-V312 PolarHBondContact O-N 3.34Å
309	M	55.4	Low	66.6	Low	164 Å²	164	99.4 Å²	99.4	81%	0.808	59%	0.593	S	S	*	*	H	α-helix	trans	-59.2	-39.8	172.3	-158.5	99.4	73.6	0	0	113.5	P307 A313	P307-M309 PolarHBondContact O-N 3.06Å; P307-M309 VanDerWaalsContact O-N 3.14Å; M309-A313 VanDerWaalsContact O-CB 3.29Å; M309-A313 WeakPolarHBondContact O-CB 3.22Å; M309-A313 PolarHBondContact O-N 3.42Å
310	G	61.3	Low	66.4	Low	45 Å²	45	95.6 Å²	95.6	46%	0.464	58%	0.58	S	S	.	*	H	α-helix	trans	-72	-36.8	-179.8	0	0	0	0	0	112.7	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.33Å; P307-G310 PolarHBondContact O-N 3.43Å; I308-G310 PolarHBondContact O-N 3.28Å; G310-G314 PolarHBondContact O-N 2.91Å
311	I	70.3	Confident	66.5	Low	99 Å²	99	97.2 Å²	97.2	51%	0.508	59%	0.585	S	S	.	*	H	α-helix	trans	-70.1	-42.4	176.1	-61.4	173.9	0	0	0	110.4	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 4.23Å; P307-I311 PolarHBondContact O-N 2.86Å; I308-I311 PolarHBondContact O-N 3.13Å; I311-G314 PolarHBondContact O-N 3.16Å; I311-L315 HydrophobicContact CG2-CD1 3.95Å; I311-L315 WeakPolarHBondContact O-CB 3.46Å; I311-L315 WeakPolarHBondContact O-CG 3.26Å; I311-L315 PolarHBondContact O-N 3.33Å
312	V	71.3	Confident	67.3	Low	89 Å²	89	95.5 Å²	95.5	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-66.3	-42.9	177.4	173.5	0	0	0	0	111.3	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.29Å; I308-V312 WeakPolarHBondContact O-CB 3.35Å; I308-V312 VanDerWaalsContact O-CG2 3.23Å; I308-V312 WeakPolarHBondContact O-CG2 3.44Å; I308-V312 PolarHBondContact O-N 3.34Å; V312-L315 PolarHBondContact O-N 2.91Å; V312-A316 WeakPolarHBondContact O-CB 3.49Å; V312-A316 PolarHBondContact O-N 3.28Å
313	A	70.6	Confident	68.8	Low	56 Å²	56	94.3 Å²	94.3	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-63.5	-43.1	174.9	0	0	0	0	0	111.9	M309 A316 V317	M309-A313 VanDerWaalsContact O-CB 3.29Å; M309-A313 WeakPolarHBondContact O-CB 3.22Å; M309-A313 PolarHBondContact O-N 3.42Å; A313-A316 PolarHBondContact O-N 3.38Å; A313-V317 WeakPolarHBondContact O-CG2 3.18Å; A313-V317 PolarHBondContact O-N 3.17Å
314	G	76.5	Confident	70.5	Confident	34 Å²	34	91.6 Å²	91.6	35%	0.351	55%	0.554	S	S	.	*	H	α-helix	trans	-62	-43.2	176.6	0	0	0	0	0	113	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 2.91Å; I311-G314 PolarHBondContact O-N 3.16Å; G314-V317 PolarHBondContact O-N 2.86Å; G314-L318 PolarHBondContact O-N 2.78Å
315	L	81.3	Confident	72.1	Confident	102 Å²	102	88.2 Å²	88.2	53%	0.534	54%	0.539	S	S	.	.	H	α-helix	trans	-65.8	-41.1	175.8	-80.1	165.1	0	0	0	112.3	I311 V312 V317 L318 V319	I311-L315 HydrophobicContact CG2-CD1 3.95Å; I311-L315 WeakPolarHBondContact O-CB 3.46Å; I311-L315 WeakPolarHBondContact O-CG 3.26Å; I311-L315 PolarHBondContact O-N 3.33Å; V312-L315 PolarHBondContact O-N 2.91Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 3.35Å; L315-L318 PolarHBondContact O-N 3.24Å; L315-V319 WeakPolarHBondContact O-CG2 3.48Å; L315-V319 PolarHBondContact O-N 3.47Å
316	A	79.1	Confident	73.4	Confident	55 Å²	55	84.7 Å²	84.7	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-61.4	-42.7	176.7	0	0	0	0	0	111.6	V312 A313 V319 V320	V312-A316 WeakPolarHBondContact O-CB 3.49Å; V312-A316 PolarHBondContact O-N 3.28Å; A313-A316 PolarHBondContact O-N 3.38Å; A316-V319 PolarHBondContact O-N 3.06Å; A316-V320 VanDerWaalsContact O-CG2 3.3Å; A316-V320 WeakPolarHBondContact O-CG2 3.39Å; A316-V320 PolarHBondContact O-N 3.39Å
317	V	82.4	Confident	74.3	Confident	88 Å²	88	83.4 Å²	83.4	53%	0.533	52%	0.52	S	S	.	.	H	α-helix	trans	-64	-42.6	176.3	173	0	0	0	0	111.4	A313 G314 L315 V319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.18Å; A313-V317 PolarHBondContact O-N 3.17Å; G314-V317 PolarHBondContact O-N 2.86Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 3.35Å; V317-V319 PolarHBondContact O-N 3.42Å; V317-V320 PolarHBondContact O-N 3.4Å; V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.41Å; V317-L321 WeakPolarHBondContact O-CG 3.34Å; V317-L321 PolarHBondContact O-N 3.09Å
318	L	81.8	Confident	75.3	Confident	112 Å²	112	83.2 Å²	83.2	59%	0.586	52%	0.517	S	S	*	.	H	α-helix	trans	-62.2	-41.5	176.7	-83.9	164.3	0	0	0	112.6	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 2.78Å; L315-L318 PolarHBondContact O-N 3.24Å; L318-L321 PolarHBondContact O-N 3.24Å; L318-A322 WeakPolarHBondContact O-CB 3.47Å; L318-A322 PolarHBondContact O-N 2.95Å
319	V	82.1	Confident	75.8	Confident	91 Å²	91	81.6 Å²	81.6	55%	0.552	51%	0.513	S	S	*	.	H	α-helix	trans	-64	-44.5	175.8	172.6	0	0	0	0	110.7	L315 A316 V317 L321 A322 V323	L315-V319 WeakPolarHBondContact O-CG2 3.48Å; L315-V319 PolarHBondContact O-N 3.47Å; A316-V319 PolarHBondContact O-N 3.06Å; V317-V319 PolarHBondContact O-N 3.42Å; V319-L321 PolarHBondContact O-N 3.26Å; V319-A322 PolarHBondContact O-N 3.22Å; V319-V323 HydrophobicContact CG1-CG2 4.45Å; V319-V323 VanDerWaalsContact O-CG2 3.3Å; V319-V323 WeakPolarHBondContact O-CG2 3.41Å; V319-V323 PolarHBondContact O-N 3.48Å
320	V	82.3	Confident	76.4	Confident	84 Å²	84	76.4 Å²	76.4	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-44.3	177.1	171.6	0	0	0	0	111.3	A316 V317 A322 V323 L324	A316-V320 VanDerWaalsContact O-CG2 3.3Å; A316-V320 WeakPolarHBondContact O-CG2 3.39Å; A316-V320 PolarHBondContact O-N 3.39Å; V317-V320 PolarHBondContact O-N 3.4Å; V320-A322 PolarHBondContact O-N 2.91Å; V320-V323 PolarHBondContact O-N 3.34Å; V320-L324 HydrophobicContact CG1-CD1 3.96Å; V320-L324 HydrophobicContact CG1-CG 4.46Å; V320-L324 WeakPolarHBondContact O-CB 3.46Å; V320-L324 VanDerWaalsContact O-CG 3.32Å; V320-L324 WeakPolarHBondContact O-CG 3.35Å; V320-L324 PolarHBondContact O-N 3.08Å
321	L	82.8	Confident	76.7	Confident	105 Å²	105	80.5 Å²	80.5	55%	0.55	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-40	177	-72.7	171.5	0	0	0	112.3	V317 L318 V319 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.96Å; V317-L321 HydrophobicContact CG1-CG 4.41Å; V317-L321 WeakPolarHBondContact O-CG 3.34Å; V317-L321 PolarHBondContact O-N 3.09Å; L318-L321 PolarHBondContact O-N 3.24Å; V319-L321 PolarHBondContact O-N 3.26Å; L321-L324 PolarHBondContact O-N 2.71Å; L321-G325 PolarHBondContact O-N 3.47Å
322	A	80.1	Confident	76.5	Confident	65 Å²	65	82 Å²	82	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-42.2	176.2	0	0	0	0	0	111.9	L318 V319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.47Å; L318-A322 PolarHBondContact O-N 2.95Å; V319-A322 PolarHBondContact O-N 3.22Å; V320-A322 PolarHBondContact O-N 2.91Å; A322-G325 PolarHBondContact O-N 3.39Å; A322-A326 WeakPolarHBondContact O-CB 3Å; A322-A326 PolarHBondContact O-N 2.94Å
323	V	80.9	Confident	75.9	Confident	85 Å²	85	81.6 Å²	81.6	52%	0.515	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-45.5	176	173.3	0	0	0	0	110.8	V319 V320 G325 A326 V327	V319-V323 HydrophobicContact CG1-CG2 4.45Å; V319-V323 VanDerWaalsContact O-CG2 3.3Å; V319-V323 WeakPolarHBondContact O-CG2 3.41Å; V319-V323 PolarHBondContact O-N 3.48Å; V320-V323 PolarHBondContact O-N 3.34Å; V323-G325 PolarHBondContact O-N 3.48Å; V323-A326 PolarHBondContact O-N 2.73Å; V323-V327 HydrophobicContact CG1-CG2 4.48Å; V323-V327 VanDerWaalsContact O-CG2 3.3Å; V323-V327 WeakPolarHBondContact O-CG2 3.25Å; V323-V327 PolarHBondContact O-N 3.1Å
324	L	79.3	Confident	75.3	Confident	100 Å²	100	88.7 Å²	88.7	52%	0.524	53%	0.526	S	S	.	.	H	α-helix	trans	-61.7	-43.3	176.1	-71.3	171.1	0	0	0	111.5	V320 L321 A326 V327 V328	V320-L324 HydrophobicContact CG1-CD1 3.96Å; V320-L324 HydrophobicContact CG1-CG 4.46Å; V320-L324 WeakPolarHBondContact O-CB 3.46Å; V320-L324 VanDerWaalsContact O-CG 3.32Å; V320-L324 WeakPolarHBondContact O-CG 3.35Å; V320-L324 PolarHBondContact O-N 3.08Å; L321-L324 PolarHBondContact O-N 2.71Å; L324-A326 PolarHBondContact O-N 3.42Å; L324-V327 PolarHBondContact O-N 3.1Å; L324-V328 VanDerWaalsContact O-CG2 3.32Å; L324-V328 WeakPolarHBondContact O-CG2 3.2Å; L324-V328 PolarHBondContact O-N 2.9Å
325	G	77.1	Confident	74.3	Confident	36 Å²	36	97.6 Å²	97.6	37%	0.371	55%	0.549	S	S	.	.	H	α-helix	trans	-60.3	-42.3	174.9	0	0	0	0	0	112.9	L321 A322 V323 V328 T329	L321-G325 PolarHBondContact O-N 3.47Å; A322-G325 PolarHBondContact O-N 3.39Å; V323-G325 PolarHBondContact O-N 3.48Å; G325-V328 PolarHBondContact O-N 3.2Å; G325-T329 WeakPolarHBondContact O-CB 3.38Å; G325-T329 PolarHBondContact O-N 3.47Å; G325-T329 PolarHBondContact O-OG1 2.79Å
326	A	76.3	Confident	72.7	Confident	59 Å²	59	101.7 Å²	101.7	49%	0.488	56%	0.563	S	S	.	*	H	α-helix	trans	-65.4	-41.4	175.8	0	0	0	0	0	112.2	A322 V323 L324 T329 A330	A322-A326 WeakPolarHBondContact O-CB 3Å; A322-A326 PolarHBondContact O-N 2.94Å; V323-A326 PolarHBondContact O-N 2.73Å; L324-A326 PolarHBondContact O-N 3.42Å; A326-T329 PolarHBondContact O-N 3.29Å; A326-A330 VanDerWaalsContact O-CB 3.31Å; A326-A330 WeakPolarHBondContact O-CB 3.28Å; A326-A330 PolarHBondContact O-N 3.21Å
327	V	75.5	Confident	71.3	Confident	76 Å²	76	103.4 Å²	103.4	46%	0.461	57%	0.572	S	S	.	*	H	α-helix	trans	-64.6	-44.1	176.7	171.6	0	0	0	0	111.2	V323 L324 A330 M331	V323-V327 HydrophobicContact CG1-CG2 4.48Å; V323-V327 VanDerWaalsContact O-CG2 3.3Å; V323-V327 WeakPolarHBondContact O-CG2 3.25Å; V323-V327 PolarHBondContact O-N 3.1Å; L324-V327 PolarHBondContact O-N 3.1Å; V327-A330 PolarHBondContact O-N 3.14Å; V327-M331 HydrophobicContact CG1-CG 4.34Å; V327-M331 WeakPolarHBondContact O-CB 3.34Å; V327-M331 WeakPolarHBondContact O-CG 3.39Å; V327-M331 PolarHBondContact O-N 3.04Å
328	V	74.9	Confident	69.8	Low	82 Å²	82	104.4 Å²	104.4	50%	0.497	58%	0.582	S	S	.	*	H	α-helix	trans	-62	-44.6	176	172.1	0	0	0	0	110.6	L324 G325 A330 M331 M332	L324-V328 VanDerWaalsContact O-CG2 3.32Å; L324-V328 WeakPolarHBondContact O-CG2 3.2Å; L324-V328 PolarHBondContact O-N 2.9Å; G325-V328 PolarHBondContact O-N 3.2Å; V328-A330 PolarHBondContact O-N 2.98Å; V328-M331 PolarHBondContact O-N 3.42Å; V328-M332 HydrophobicContact CG1-SD 4.25Å; V328-M332 WeakPolarHBondContact O-CG 3.31Å; V328-M332 PolarHBondContact O-N 2.72Å
329	T	70.1	Confident	67.7	Low	87 Å²	87	102.2 Å²	102.2	53%	0.534	59%	0.587	S	S	.	*	H	α-helix	trans	-62.3	-44.7	177.4	-53.1	0	0	0	0	111.4	G325 A326 M331 M332 C333	G325-T329 WeakPolarHBondContact O-CB 3.38Å; G325-T329 PolarHBondContact O-N 3.47Å; G325-T329 PolarHBondContact O-OG1 2.79Å; A326-T329 PolarHBondContact O-N 3.29Å; T329-M331 PolarHBondContact O-N 2.92Å; T329-M332 PolarHBondContact O-N 3.07Å; T329-C333 WeakPolarHBondContact O-CB 3.18Å; T329-C333 PolarHBondContact O-N 2.85Å; T329-C333 PolarHBondContact O-SG 3.21Å; T329-C333 VanDerWaalsContact O-SG 3.37Å
330	A	69.4	Low	65.5	Low	55 Å²	55	101.6 Å²	101.6	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-65	-37.6	176.5	0	0	0	0	0	112.5	A326 V327 V328 C333 R334	A326-A330 VanDerWaalsContact O-CB 3.31Å; A326-A330 WeakPolarHBondContact O-CB 3.28Å; A326-A330 PolarHBondContact O-N 3.21Å; V327-A330 PolarHBondContact O-N 3.14Å; V328-A330 PolarHBondContact O-N 2.98Å; A330-C333 PolarHBondContact O-N 3.05Å; A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 3.02Å
331	M	66.9	Low	63.2	Low	130 Å²	130	108.2 Å²	108.2	64%	0.64	62%	0.621	S	S	*	*	H	α-helix	trans	-67.6	-38.4	174.8	-73.4	-119.4	-71	0	0	112.1	V327 V328 T329 R334 R335	V327-M331 HydrophobicContact CG1-CG 4.34Å; V327-M331 WeakPolarHBondContact O-CB 3.34Å; V327-M331 WeakPolarHBondContact O-CG 3.39Å; V327-M331 PolarHBondContact O-N 3.04Å; V328-M331 PolarHBondContact O-N 3.42Å; T329-M331 PolarHBondContact O-N 2.92Å; M331-R334 PolarHBondContact O-N 3.39Å; M331-R335 WeakPolarHBondContact O-CB 3.39Å; M331-R335 PolarHBondContact O-N 2.85Å
332	M	66.8	Low	60.8	Low	130 Å²	130	107 Å²	107	64%	0.64	63%	0.634	S	S	*	*	H	α-helix	trans	-67.5	-39.7	173.5	-70.6	-176.2	78.4	0	0	111.8	V328 T329 R334 R335 K336	V328-M332 HydrophobicContact CG1-SD 4.25Å; V328-M332 WeakPolarHBondContact O-CG 3.31Å; V328-M332 PolarHBondContact O-N 2.72Å; T329-M332 PolarHBondContact O-N 3.07Å; M332-R334 VanDerWaalsContact C-N 3.35Å; M332-R335 PolarHBondContact O-N 3.2Å; M332-K336 WeakPolarHBondContact O-CB 3.4Å; M332-K336 PolarHBondContact O-N 3.33Å
333	C	58.8	Low	58.5	Low	81 Å²	81	108.1 Å²	108.1	55%	0.547	65%	0.652	S	S	.	*	H	α-helix	trans	-65.1	-35.8	172.6	-72.6	0	0	0	0	112.5	T329 A330 K336 S337	T329-C333 WeakPolarHBondContact O-CB 3.18Å; T329-C333 PolarHBondContact O-N 2.85Å; T329-C333 PolarHBondContact O-SG 3.21Å; T329-C333 VanDerWaalsContact O-SG 3.37Å; A330-C333 PolarHBondContact O-N 3.05Å; C333-K336 PolarHBondContact O-N 3.08Å; C333-S337 PolarHBondContact O-N 3.18Å; C333-S337 PolarHBondContact O-OG 3.41Å
334	R	57.3	Low	56.3	Low	206 Å²	206	109.4 Å²	109.4	78%	0.777	67%	0.665	S	S	*	*	H	α-helix	trans	-72	-34.1	173.2	-84.6	-171.8	161.4	-178	-3.6	113.2	A330 M331 M332 K336 S337	A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 3.02Å; M331-R334 PolarHBondContact O-N 3.39Å; M332-R334 VanDerWaalsContact C-N 3.35Å; R334-K336 VanDerWaalsContact C-N 3.31Å; R334-S337 WeakPolarHBondContact CA-OG 3.32Å; R334-S337 PolarHBondContact O-OG 3.33Å
335	R	54.9	Low	53.9	Low	221 Å²	221	109.9 Å²	109.9	83%	0.834	68%	0.675	S	S	*	*	H	α-helix	trans	-70	-27.6	171.7	-107.3	-177.7	173.3	175.5	-1.5	112.8	M331 M332	M331-R335 WeakPolarHBondContact O-CB 3.39Å; M331-R335 PolarHBondContact O-N 2.85Å; M332-R335 PolarHBondContact O-N 3.2Å
336	K	48.6	Very low	51.7	Low	188 Å²	188	114 Å²	114	82%	0.817	70%	0.698	S	S	*	*	H	α-helix	trans	-88.5	-7.6	-179.8	-161.4	160.1	-179.4	176	0	114.2	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.4Å; M332-K336 PolarHBondContact O-N 3.33Å; C333-K336 PolarHBondContact O-N 3.08Å; R334-K336 VanDerWaalsContact C-N 3.31Å
337	S	50.2	Low	50	Low	91 Å²	91	120.4 Å²	120.4	64%	0.636	72%	0.718	S	S	*	*	S	Bend	trans	-101.3	4.1	179.8	41.2	0	0	0	0	114.9	C333 R334 G339	C333-S337 PolarHBondContact O-N 3.18Å; C333-S337 PolarHBondContact O-OG 3.41Å; R334-S337 WeakPolarHBondContact CA-OG 3.32Å; R334-S337 PolarHBondContact O-OG 3.33Å; S337-G339 PolarHBondContact O-N 3.2Å
338	S	49.3	Very low	47.8	Very low	108 Å²	108	121.5 Å²	121.5	76%	0.755	74%	0.735	S	S	*	*	S	Bend	trans	-95.4	44.8	173.3	75	0	0	0	0	113.7
339	G	38.5	Very low	45.7	Very low	67 Å²	67	122.1 Å²	122.1	69%	0.691	75%	0.749	S	S	*	*	S	Bend	trans	-165.8	90.4	177	0	0	0	0	0	114.8	S337	S337-G339 PolarHBondContact O-N 3.2Å
340	G	36.2	Very low	44	Very low	78 Å²	78	124.1 Å²	124.1	80%	0.804	77%	0.765	S	S	*	*			trans	79.3	90.6	139.4	0	0	0	0	0	120.9
341	K	34.2	Very low	42.2	Very low	222 Å²	222	127.2 Å²	127.2	97%	0.965	78%	0.783	S	S	*	*				42.2	120.3	118.1	-147.5	155.9	-175.9	170.9	0	120.5
342	G	32.3	Very low	40.8	Very low	80 Å²	80	129 Å²	129	83%	0.825	80%	0.795	S	S	*	*			trans	143.8	121.7	139.5	0	0	0	0	0	117.7
343	G	31.2	Very low	39.3	Very low	89 Å²	89	128.8 Å²	128.8	92%	0.918	81%	0.806	S	S	*	*			trans	110.6	119.9	137.8	0	0	0	0	0	118.9
344	S	33.8	Very low	38.2	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	82%	0.819	S	S	*	*			trans	-87.9	165.7	-173.5	-173	0	0	0	0	116.8
345	C	30.4	Very low	37.1	Very low	111 Å²	111	129.4 Å²	129.4	75%	0.75	83%	0.827	S	S	*	*			trans	66.9	133	154.9	-79.8	0	0	0	0	118.7
346	S	31.2	Very low	35.9	Very low	122 Å²	122	122.1 Å²	122.1	85%	0.853	82%	0.82	S	S	*	*				-166.9	161.5	61.4	-48.2	0	0	0	0	113.3
347	Q	38.9	Very low	35.4	Very low	194 Å²	194	118.3 Å²	118.3	91%	0.907	82%	0.817	S	S	*	*			trans	-79.5	147.3	178.3	-178.4	178.1	6.7	0	0	113.9
348	A	29.7	Very low	34.7	Very low	98 Å²	98	121.4 Å²	121.4	81%	0.81	83%	0.827	S	S	*	*			trans	155.8	146.5	153.4	0	0	0	0	0	109.2
349	A	30.6	Very low	33.9	Very low	96 Å²	96	124.6 Å²	124.6	79%	0.793	83%	0.83	S	S	*	*			cis	-167.1	150.7	-7.6	0	0	0	0	0	107.5
350	C	34.9	Very low	33.6	Very low	129 Å²	129	126.1 Å²	126.1	87%	0.872	83%	0.83	S	S	*	*			trans	-80.1	146.7	160	-66.8	0	0	0	0	110
351	S	32.7	Very low	33.5	Very low	119 Å²	119	130 Å²	130	83%	0.832	83%	0.831	S	S	*	*			trans	-170.2	134	139.7	36.3	0	0	0	0	113
352	N	35.5	Very low	33.6	Very low	168 Å²	168	126.6 Å²	126.6	90%	0.898	82%	0.822	S	S	*	*			trans	-75.7	154.2	163.1	-78.2	-28.8	0	0	0	110.5
353	S	35.7	Very low	33.5	Very low	125 Å²	125	128.8 Å²	128.8	87%	0.874	82%	0.819	S	S	*	*			trans	-137.4	133.1	153.1	27.9	0	0	0	0	109.9
354	A	35.6	Very low	33.5	Very low	97 Å²	97	130.6 Å²	130.6	80%	0.802	82%	0.817	S	S	*	*			trans	-105.9	-179.8	175.2	0	0	0	0	0	109.9
355	Q	34.9	Very low	33.4	Very low	204 Å²	204	135 Å²	135	95%	0.953	82%	0.822	S	S	*	*			trans	92.4	128.2	163.5	-131.6	160	28.1	0	0	115.3
356	G	30.7	Very low	33.6	Very low	67 Å²	67	138 Å²	138	69%	0.691	85%	0.854	S	S	*	*			cis	-169.4	173.4	-1.6	0	0	0	0	0	105.3
357	S	36.6	Very low	33.8	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	85%	0.854	S	S	*	*			cis	-171.5	152.7	29	-49.7	0	0	0	0	109.6
358	D	35.6	Very low	33.5	Very low	156 Å²	156	135.8 Å²	135.8	83%	0.834	85%	0.851	S	S	*	*			trans	55.4	142.8	147.8	-55.3	-30.1	0	0	0	120.2
359	E	32.1	Very low	33.7	Very low	175 Å²	175	137.9 Å²	137.9	82%	0.818	85%	0.854	S	S	*	*			cis	-166.2	149.1	38.5	-155.3	176.5	169.7	0	0	113.3
360	S	33.3	Very low	33.9	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	86%	0.857	S	S	*	*			trans	57.4	109.4	156	64	0	0	0	0	120.9
361	L	33.4	Very low	33.8	Very low	161 Å²	161	141.1 Å²	141.1	84%	0.843	86%	0.856	S	S	*	*				54.5	116.1	83.2	-83.1	166.5	0	0	0	115.8
362	I	35.8	Very low	33.9	Very low	150 Å²	150	142.6 Å²	142.6	77%	0.769	86%	0.858	S	S	*	*				171.5	112.1	118.6	-84.1	160.3	0	0	0	112.4
363	T	30.4	Very low	33.8	Very low	125 Å²	125	140.8 Å²	140.8	77%	0.767	86%	0.855	S	S	*	*			trans	47.1	129.9	141.9	64.8	0	0	0	0	124.6
364	C	31.7	Very low	33.6	Very low	128 Å²	128	142 Å²	142	87%	0.865	85%	0.854	S	S	*	*			trans	-95.9	125.9	139.3	-79.3	0	0	0	0	110.3
365	K	31.9	Very low	33.5	Very low	204 Å²	204	145.8 Å²	145.8	89%	0.887	86%	0.858	S	S	*	*			trans	150.4	121.5	134.4	-95.6	-174.1	170.6	179.2	0	112.1
366	A	35.5	Very low	33.3	Very low	172 Å²	172	140.5 Å²	140.5	100%	1.421	85%	0.849	S	S	*	*				-135.2	0	115.4	0	0	0	0	0	107

Retrieved 366 of 366 residues in 1608.2 ms (Link to these results)

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