A0A060VCX7_HUMAN Loading...

MHC class I antigen

AlphaFold DB , UniProt , Accession A0A060VCX7, 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	33.6	Very low	41.5	Very low	243 Å²	243	149.4 Å²	149.4	100%	1.197	77%	0.766	S	S	*	*				0	100.6	0	-75.7	163.4	138.3	0	0	108.6
2	R	34.5	Very low	41.8	Very low	253 Å²	253	148.8 Å²	148.8	96%	0.955	76%	0.764	S	S	*	*			trans	-119	102.7	165	-96.5	-176.7	174.1	166.9	-1.7	105.5	M4	R2-M4 PolarHBondContact O-N 3.34Å
3	V	36.7	Very low	41.5	Very low	143 Å²	143	146 Å²	146	87%	0.867	75%	0.751	S	S	*	*			trans	-73.9	109.8	174	178.1	0	0	0	0	106.2	A5	V3-A5 PolarHBondContact O-N 3.26Å
4	M	40.4	Very low	41.4	Very low	179 Å²	179	139.9 Å²	139.9	88%	0.882	73%	0.728	S	S	*	*			trans	-82.3	101	175.4	-165.3	163.1	64.3	0	0	107	R2	R2-M4 PolarHBondContact O-N 3.34Å
5	A	42.1	Very low	41.3	Very low	73 Å²	73	132.9 Å²	132.9	60%	0.603	70%	0.703	S	S	*	*			trans	-64	141.9	174.7	0	0	0	0	0	109.9	V3 R7	V3-A5 PolarHBondContact O-N 3.26Å; A5-R7 PolarHBondContact O-N 3.31Å
6	P	45.8	Very low	41.1	Very low	87 Å²	87	127 Å²	127	57%	0.565	68%	0.684	S	S	*	*			trans	-72.6	123.1	-174.1	-5.6	21.9	0	0	0	110	A8 L9	P6-A8 PolarHBondContact O-N 3.1Å; P6-L9 PolarHBondContact O-N 2.93Å; P6-L9 VanDerWaalsContact O-N 3.1Å
7	R	48.7	Very low	40.7	Very low	226 Å²	226	126.4 Å²	126.4	85%	0.853	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-12	172.7	-85.7	177.2	163.5	166.8	-6.3	114.5	A5	A5-R7 PolarHBondContact O-N 3.31Å
8	A	47.7	Very low	40.5	Very low	68 Å²	68	122.6 Å²	122.6	56%	0.562	67%	0.668	S	S	*	*	H	α-helix	trans	-73.4	-28.8	175.6	0	0	0	0	0	113.7	P6	P6-A8 PolarHBondContact O-N 3.1Å
9	L	41.6	Very low	40.5	Very low	116 Å²	116	120.9 Å²	120.9	61%	0.607	66%	0.658	S	S	*	*	H	α-helix	trans	-74.2	-28.3	-179.7	-118.8	96.5	0	0	0	112.9	P6	P6-L9 PolarHBondContact O-N 2.93Å; P6-L9 VanDerWaalsContact O-N 3.1Å
10	L	40.3	Very low	40.4	Very low	126 Å²	126	119.6 Å²	119.6	66%	0.66	65%	0.654	S	S	*	*	H	α-helix	trans	-73.3	-27.6	-179.3	-94.5	129.6	0	0	0	113.2	S14	L10-S14 PolarHBondContact O-N 2.61Å; L10-S14 PolarHBondContact O-OG 2.92Å
11	L	45.4	Very low	40.2	Very low	129 Å²	129	121.4 Å²	121.4	68%	0.675	66%	0.658	S	S	*	*	H	α-helix	trans	-77.5	-32.2	179.3	-76.2	165.5	0	0	0	112.9	S14 G15	L11-S14 WeakPolarHBondContact CA-OG 3.46Å; L11-S14 PolarHBondContact O-N 3.12Å; L11-S14 PolarHBondContact O-OG 2.91Å; L11-G15 PolarHBondContact O-N 3.02Å
12	L	44.4	Very low	40.7	Very low	142 Å²	142	114.7 Å²	114.7	74%	0.743	63%	0.631	S	S	*	*	H	α-helix	trans	-70.1	-34.6	175.1	-75.2	163	0	0	0	111.9	G15 G16	L12-G15 PolarHBondContact O-N 3.03Å; L12-G16 PolarHBondContact O-N 3.16Å
13	L	38.3	Very low	41.5	Very low	113 Å²	113	106.9 Å²	106.9	59%	0.592	60%	0.601	S	S	*	*	H	α-helix	trans	-70.9	-32.6	174.9	-74.8	161.7	0	0	0	112.5	L17	L13-L17 WeakPolarHBondContact O-CB 3.37Å; L13-L17 WeakPolarHBondContact O-CD1 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.35Å; L13-L17 PolarHBondContact O-N 3.43Å
14	S	40.2	Very low	42.3	Very low	61 Å²	61	102.2 Å²	102.2	43%	0.427	58%	0.578	S	S	.	*	H	α-helix	trans	-72.8	-30.9	174.4	48.4	0	0	0	0	113.6	L10 L11 A18	L10-S14 PolarHBondContact O-N 2.61Å; L10-S14 PolarHBondContact O-OG 2.92Å; L11-S14 WeakPolarHBondContact CA-OG 3.46Å; L11-S14 PolarHBondContact O-N 3.12Å; L11-S14 PolarHBondContact O-OG 2.91Å; S14-A18 WeakPolarHBondContact O-CB 3.45Å; S14-A18 PolarHBondContact O-N 2.87Å; S14-A18 VanDerWaalsContact O-N 3.11Å
15	G	39.9	Very low	43.8	Very low	34 Å²	34	96.8 Å²	96.8	35%	0.351	56%	0.557	S	S	.	*	H	α-helix	trans	-66.6	-44.4	173	0	0	0	0	0	111.9	L11 L12 L19	L11-G15 PolarHBondContact O-N 3.02Å; L12-G15 PolarHBondContact O-N 3.03Å; G15-L19 WeakPolarHBondContact O-CB 3.07Å; G15-L19 WeakPolarHBondContact O-CD1 3.49Å; G15-L19 PolarHBondContact O-N 3.19Å
16	G	37.8	Very low	46.1	Very low	39 Å²	39	96.6 Å²	96.6	40%	0.402	55%	0.551	S	S	.	*	H	α-helix	trans	-64.4	-41.8	175.4	0	0	0	0	0	113.5	L12 L19 T20	L12-G16 PolarHBondContact O-N 3.16Å; G16-L19 PolarHBondContact O-N 3.19Å; G16-T20 WeakPolarHBondContact O-CG2 3.25Å; G16-T20 PolarHBondContact O-N 2.82Å; G16-T20 PolarHBondContact O-OG1 3.09Å
17	L	35.1	Very low	48.4	Very low	116 Å²	116	94 Å²	94	61%	0.607	53%	0.532	S	S	*	.	H	α-helix	trans	-67	-38.4	178.8	-80.3	161.3	0	0	0	113	L13 L19 T20 E21	L13-L17 WeakPolarHBondContact O-CB 3.37Å; L13-L17 WeakPolarHBondContact O-CD1 3.34Å; L13-L17 WeakPolarHBondContact O-CG 3.35Å; L13-L17 PolarHBondContact O-N 3.43Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 3.44Å; L17-T20 WeakPolarHBondContact CA-OG1 3.37Å; L17-T20 PolarHBondContact O-N 3.3Å; L17-T20 PolarHBondContact O-OG1 3.08Å; L17-E21 PolarHBondContact O-N 3.3Å
18	A	37.3	Very low	50.7	Low	58 Å²	58	84.4 Å²	84.4	48%	0.479	50%	0.499	S	S	.	.	H	α-helix	trans	-68.4	-29.5	175	0	0	0	0	0	112.8	S14	S14-A18 WeakPolarHBondContact O-CB 3.45Å; S14-A18 PolarHBondContact O-N 2.87Å; S14-A18 VanDerWaalsContact O-N 3.11Å
19	L	39.5	Very low	53.1	Low	92 Å²	92	81.2 Å²	81.2	48%	0.482	47%	0.473	S	S	.	.	H	α-helix	trans	-82	-24.4	177.3	-94.6	140.3	0	0	0	113.5	G15 G16 L17 T22	G15-L19 WeakPolarHBondContact O-CB 3.07Å; G15-L19 WeakPolarHBondContact O-CD1 3.49Å; G15-L19 PolarHBondContact O-N 3.19Å; G16-L19 PolarHBondContact O-N 3.19Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 3.44Å; L19-T22 PolarHBondContact O-OG1 2.91Å
20	T	37.7	Very low	55.9	Low	94 Å²	94	78 Å²	78	58%	0.577	45%	0.452	S	S	*	.	H	α-helix	trans	-81.5	-25.8	173.4	50.5	0	0	0	0	113.2	G16 L17 T22	G16-T20 WeakPolarHBondContact O-CG2 3.25Å; G16-T20 PolarHBondContact O-N 2.82Å; G16-T20 PolarHBondContact O-OG1 3.09Å; L17-T20 WeakPolarHBondContact CA-OG1 3.37Å; L17-T20 PolarHBondContact O-N 3.3Å; L17-T20 PolarHBondContact O-OG1 3.08Å; T20-T22 VanDerWaalsContact C-N 3.31Å; T20-T22 PolarHBondContact O-N 3.48Å
21	E	37.5	Very low	58.6	Low	158 Å²	158	72.9 Å²	72.9	74%	0.738	42%	0.424	S	S	*	.	H	α-helix	trans	-70.6	-25.2	177	-107.2	-177.1	168.5	0	0	113	L17 W23	L17-E21 PolarHBondContact O-N 3.3Å; E21-W23 PolarHBondContact O-N 2.83Å
22	T	42.9	Very low	61.2	Low	102 Å²	102	70.7 Å²	70.7	63%	0.626	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-4.9	-178.9	46.8	0	0	0	0	114.3	L19 T20	L19-T22 PolarHBondContact O-OG1 2.91Å; T20-T22 VanDerWaalsContact C-N 3.31Å; T20-T22 PolarHBondContact O-N 3.48Å
23	W	51.4	Low	63.8	Low	88 Å²	88	64.4 Å²	64.4	33%	0.333	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	14.8	-177.8	-68.6	66.1	0	0	0	112.8	E21 C25 Q286 H287 E288	E21-W23 PolarHBondContact O-N 2.83Å; W23-C25 PolarHBondContact O-N 3.02Å; W23-C25 VanDerWaalsContact O-N 3.1Å; W23-Q286 HydrophobicContact CZ2-CB 4.22Å; W23-H287 WeakPolarHBondContact CH2-O 3.25Å; W23-H287 WeakPolarHBondContact CZ3-O 3.35Å; W23-E288 HydrophobicContact CD2-CB 4.22Å; W23-E288 HydrophobicContact CE3-CB 3.43Å; W23-E288 VanDerWaalsContact CE3-CB 3.43Å; W23-E288 HydrophobicContact CE3-CG 4.22Å; W23-E288 HydrophobicContact CH2-CB 4.43Å; W23-E288 VanDerWaalsContact CH2-N 3.29Å; W23-E288 VanDerWaalsContact CZ3-C 3.42Å; W23-E288 HydrophobicContact CZ3-CB 3.59Å; W23-E288 WeakPolarHBondContact CZ3-O 3.34Å
24	A	53.5	Low	66.6	Low	46 Å²	46	61 Å²	61	38%	0.38	36%	0.36	S	S	.	.	S	Bend	trans	-72.6	105.4	170.3	0	0	0	0	0	107	S26 P129	A24-S26 PolarHBondContact O-N 2.86Å; A24-P129 HydrophobicContact CB-CB 4.31Å; A24-P129 HydrophobicContact CB-CG 3.29Å
25	C	71.8	Confident	69.4	Low	64 Å²	64	58.1 Å²	58.1	43%	0.432	34%	0.341	S	S	.	.			trans	-45.9	98.1	-173.6	-59.2	0	0	0	0	111.5	W23 P129 E288	W23-C25 PolarHBondContact O-N 3.02Å; W23-C25 VanDerWaalsContact O-N 3.1Å; C25-P129 WeakPolarHBondContact O-CA 3.25Å; C25-E288 PolarHBondContact SG-OE1 2.91Å
26	S	90.3	Very high	72.2	Confident	70 Å²	70	58.9 Å²	58.9	49%	0.49	34%	0.338	S	S	.	.			trans	-99.4	143.6	172.7	62.4	0	0	0	0	108.4	A24 L127	A24-S26 PolarHBondContact O-N 2.86Å; S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.38Å; S26-L127 WeakPolarHBondContact CB-O 3.44Å
27	H	95.3	Very high	75.1	Confident	33 Å²	33	57.9 Å²	57.9	15%	0.153	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	150.3	178.6	-67.3	-75.1	0	0	0	110.5	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.24Å; H27-D53 WeakPolarHBondContact CA-OD1 3.4Å; H27-D53 IonicContact CE1-OD2 2.61Å; H27-D53 IonicContact CG-OD2 2.92Å; H27-D53 IonicContact ND1-OD1 3.49Å; H27-D53 IonicContact ND1-OD2 3.89Å; H27-D53 PolarHBondContact ND1-OD2 2.77Å; H27-D126 CarbonylContact O-C 3.54Å; H27-D126 WeakPolarHBondContact O-CA 3.34Å; H27-L127 PolarHBondContact N-O 2.87Å; H27-L127 VanDerWaalsContact N-O 3.14Å; H27-L127 PolarHBondContact O-N 2.8Å; H27-L192 HydrophobicContact CB-CD1 4.42Å; H27-L196 HydrophobicContact CB-CD1 3.66Å; H27-L196 HydrophobicContact CB-CD2 3.97Å; H27-L196 HydrophobicContact CB-CG 4.39Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.35Å
28	S	97.3	Very high	78	Confident	24 Å²	24	55.8 Å²	55.8	17%	0.168	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.4	-179.8	66.8	0	0	0	0	111.4	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.29Å; S28-V52 WeakPolarHBondContact O-CA 3.4Å; S28-D53 PolarHBondContact N-OD1 3.21Å; S28-D53 PolarHBondContact O-N 3.12Å; S28-D53 PolarHBondContact OG-OD1 3.29Å; S28-C125 CarbonylContact C-O 3.56Å; S28-C125 WeakPolarHBondContact CA-O 3.41Å; S28-D126 WeakPolarHBondContact CB-OD1 3.06Å
29	M	98.5	Very high	80.6	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	121.1	167.4	-175.6	171.3	61.8	0	0	108.1	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.29Å; M29-Y31 HydrophobicContact CG-CE2 4.13Å; M29-Y31 HydrophobicContact SD-CE2 4.13Å; M29-Y51 CarbonylContact C-O 3.51Å; M29-Y51 WeakPolarHBondContact CA-O 3.41Å; M29-V52 HydrophobicContact CG-CG2 4.32Å; M29-F57 HydrophobicContact CG-CE1 4.41Å; M29-F57 HydrophobicContact SD-CZ 4.3Å; M29-G124 CarbonylContact O-C 3.6Å; M29-G124 WeakPolarHBondContact O-CA 3.39Å; M29-C125 PolarHBondContact N-O 2.63Å; M29-C125 PolarHBondContact O-N 2.8Å; M29-C188 HydrophobicContact CE-CB 4.19Å; M29-C188 WeakPolarHBondContact CE-O 3.16Å; M29-C188 WeakPolarHBondContact CE-SG 3.01Å; M29-W191 HydrophobicContact CE-CB 4.03Å; M29-W191 HydrophobicContact SD-CB 4.41Å; M29-L192 HydrophobicContact CB-CB 4.05Å; M29-L192 HydrophobicContact CB-CD1 4.03Å; M29-L192 HydrophobicContact CB-CD2 3.95Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.29Å; M29-L192 HydrophobicContact SD-CB 4.41Å; M29-Y195 HydrophobicContact SD-CD2 3.68Å; M29-Y195 HydrophobicContact SD-CE2 3.54Å; M29-Y195 VanDerWaalsContact SD-CE2 3.54Å
30	R	98.5	Very high	83	Confident	48 Å²	48	55.3 Å²	55.3	18%	0.181	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	134.1	-175.5	-56.1	-62.2	-177.1	74.5	3.5	110.7	F32 G50 Y51 S123 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.43Å; R30-F32 HydrophobicContact CB-CE2 3.62Å; R30-F32 HydrophobicContact CB-CZ 3.92Å; R30-G50 CarbonylContact O-C 3.57Å; R30-G50 WeakPolarHBondContact O-CA 3.44Å; R30-Y51 PolarHBondContact N-O 2.98Å; R30-Y51 PolarHBondContact O-N 3.14Å; R30-S123 WeakPolarHBondContact CA-O 3.47Å; R30-D126 IonicContact CZ-OD1 2.74Å; R30-D126 IonicContact NE-OD1 3.54Å; R30-D126 PolarHBondContact NE-OD1 2.77Å; R30-D126 VanDerWaalsContact NE-OD1 3.14Å; R30-D126 VanDerWaalsContact NH2-CG 3.25Å; R30-D126 IonicContact NH2-OD1 2.85Å; R30-D126 PolarHBondContact NH2-OD1 2.71Å; R30-D126 IonicContact NH2-OD2 3.15Å; R30-D126 PolarHBondContact NH2-OD2 3.42Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.28Å; R30-Y137 PolarHBondContact NH2-OH 2.92Å
31	Y	98.6	Very high	85.7	Confident	18 Å²	18	60.7 Å²	60.7	7%	0.071	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134.2	168.6	-68.6	-91.9	0	0	0	109.3	M29 V49 F57 V58 M122 S123	M29-Y31 HydrophobicContact CE-CE2 4.29Å; M29-Y31 HydrophobicContact CG-CE2 4.13Å; M29-Y31 HydrophobicContact SD-CE2 4.13Å; Y31-V49 CarbonylContact C-O 3.47Å; Y31-V49 WeakPolarHBondContact CA-O 3.36Å; Y31-F57 HydrophobicContact CE1-CZ 4.11Å; Y31-F57 AromaticContact CZ-CZ 3.79Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.03Å; Y31-V58 HydrophobicContact CE1-CG2 3.93Å; Y31-M122 WeakPolarHBondContact O-CA 3.46Å; Y31-S123 PolarHBondContact N-O 3.1Å; Y31-S123 PolarHBondContact O-N 3.08Å
32	F	98.8	Very high	88.2	Confident	84 Å²	84	56 Å²	56	37%	0.368	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112	176.3	-57.6	-93.3	0	0	0	108.9	R30 S48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.43Å; R30-F32 HydrophobicContact CB-CE2 3.62Å; R30-F32 HydrophobicContact CB-CZ 3.92Å; F32-S48 WeakPolarHBondContact O-CA 3.35Å; F32-V49 HydrophobicContact CB-CG2 3.87Å; F32-V49 HydrophobicContact CD2-CG2 4.35Å; F32-V49 PolarHBondContact N-O 2.79Å; F32-V49 PolarHBondContact O-N 3.46Å; F32-Y51 HydrophobicContact CD2-CD2 4.14Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; F32-R121 WeakPolarHBondContact CA-O 3.21Å; F32-M122 HydrophobicContact CD1-CB 4.04Å; F32-M122 HydrophobicContact CD1-CG 3.69Å; F32-M122 HydrophobicContact CE1-CB 4.15Å; F32-M122 HydrophobicContact CE1-CG 3.4Å; F32-M122 HydrophobicContact CZ-CG 4.04Å
33	D	98.8	Very high	90.7	Very high	9 Å²	9	55.4 Å²	55.4	5%	0.048	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.6	176	-60.8	-31.2	0	0	0	109.1	F46 I47 S48 Q120 R121	D33-F46 HydrophobicContact CB-CE2 3.85Å; D33-F46 HydrophobicContact CB-CZ 4.07Å; D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.23Å; D33-S48 WeakPolarHBondContact OD1-CB 3.43Å; D33-S48 PolarHBondContact OD1-OG 2.93Å; D33-Q120 CarbonylContact O-C 3.57Å; D33-Q120 VanDerWaalsContact O-CA 3.27Å; D33-Q120 WeakPolarHBondContact O-CA 3.4Å; D33-R121 HydrophobicContact CB-CB 4.27Å; D33-R121 PolarHBondContact N-O 2.82Å; D33-R121 PolarHBondContact O-N 3.12Å; D33-R121 IonicContact OD2-NH1 3.99Å
34	T	98.9	Very high	92.9	Very high	41 Å²	41	52.5 Å²	52.5	25%	0.252	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	119.3	175.2	-60.7	0	0	0	0	109.7	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 4Å; T34-F46 WeakPolarHBondContact O-CA 3.38Å; T34-I47 PolarHBondContact N-O 3.18Å; T34-I47 PolarHBondContact O-N 3.25Å; T34-T118 HydrophobicContact CG2-CG2 4.14Å; T34-L119 WeakPolarHBondContact CA-O 3.44Å; T34-Q120 HydrophobicContact CG2-CG 4.1Å
35	A	98.7	Very high	95	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125	174.3	0	0	0	0	0	110.1	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.55Å; A35-R45 VanDerWaalsContact CA-O 3.29Å; A35-R45 WeakPolarHBondContact CA-O 3.43Å; A35-F46 HydrophobicContact CB-CD2 4.25Å; A35-D98 HydrophobicContact CB-CB 3.67Å; A35-L102 HydrophobicContact CB-CD1 3.88Å; A35-T118 WeakPolarHBondContact O-CA 3.44Å; A35-L119 HydrophobicContact CB-CB 4.46Å; A35-L119 PolarHBondContact N-O 2.65Å; A35-L119 PolarHBondContact O-N 3.46Å
36	V	98.6	Very high	96.3	Very high	50 Å²	50	51.8 Å²	51.8	30%	0.303	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	115.8	-178.8	-173.1	0	0	0	0	109.3	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 4Å; V36-P44 CarbonylContact O-C 3.53Å; V36-P44 WeakPolarHBondContact O-CA 3.33Å; V36-P44 WeakPolarHBondContact O-CB 3.31Å; V36-R45 PolarHBondContact N-O 2.82Å; V36-R45 PolarHBondContact O-N 2.97Å; V36-H117 WeakPolarHBondContact CA-O 3.47Å; V36-T118 HydrophobicContact CG2-CG2 4.26Å
37	S	97.9	Very high	96.7	Very high	18 Å²	18	50.8 Å²	50.8	13%	0.126	28%	0.276	C	S	.	.			trans	-68.8	146.6	173.6	71.5	0	0	0	0	110.2	S116 H117	S37-S116 PolarHBondContact O-OG 2.84Å; S37-H117 PolarHBondContact N-O 2.87Å; S37-H117 PolarHBondContact OG-N 3.35Å; S37-H117 PolarHBondContact OG-O 2.84Å
38	R	96	Very high	96.9	Very high	73 Å²	73	49.2 Å²	49.2	28%	0.275	27%	0.269	S	S	.	.			trans	-139.6	75.2	180	52.5	174.6	176.2	-160.5	-10.3	110.9	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 2.91Å; R38-R41 HydrophobicContact CB-CB 4.1Å; R38-R41 WeakPolarHBondContact CD-O 3.46Å; R38-R41 HydrophobicContact CG-CB 4.15Å; R38-R41 PolarHBondContact NE-O 2.93Å; R38-R41 PolarHBondContact O-N 3.35Å; R38-E43 VanDerWaalsContact CZ-O 3.29Å; R38-E43 PolarHBondContact NE-O 3.04Å; R38-E43 PolarHBondContact NH2-O 3.22Å; R38-D63 IonicContact CZ-OD1 2.73Å; R38-D63 IonicContact CZ-OD2 2.63Å; R38-D63 IonicContact NH1-OD1 3.39Å; R38-D63 PolarHBondContact NH1-OD1 3.46Å; R38-D63 IonicContact NH1-OD2 3.02Å; R38-D63 PolarHBondContact NH1-OD2 3Å; R38-D63 IonicContact NH2-OD1 3.44Å; R38-D63 PolarHBondContact NH2-OD1 3.49Å; R38-D63 IonicContact NH2-OD2 3.22Å
39	P	92.1	Very high	97	Very high	50 Å²	50	49.5 Å²	49.5	33%	0.325	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	132.9	-177.5	-27.2	35.5	0	0	0	112.2	R41 E113 G115	P39-R41 PolarHBondContact O-N 3.21Å; P39-E113 WeakPolarHBondContact CB-O 3.29Å; P39-E113 WeakPolarHBondContact CG-O 3.49Å; P39-G115 VanDerWaalsContact CG-O 3.25Å; P39-G115 WeakPolarHBondContact CG-O 3.39Å
40	G	90.8	Very high	97	Very high	89 Å²	89	49.5 Å²	49.5	92%	0.918	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	0.2	-177.2	0	0	0	0	0	116.1	R38	R38-G40 PolarHBondContact O-N 2.91Å
41	R	92.8	Very high	97	Very high	208 Å²	208	50.6 Å²	50.6	79%	0.785	27%	0.274	S	S	*	.	S	Bend	trans	-123.6	23.7	-178.7	-58	-174.7	-179.3	-168.7	0.7	113.6	R38 P39	R38-R41 HydrophobicContact CB-CB 4.1Å; R38-R41 WeakPolarHBondContact CD-O 3.46Å; R38-R41 HydrophobicContact CG-CB 4.15Å; R38-R41 PolarHBondContact NE-O 2.93Å; R38-R41 PolarHBondContact O-N 3.35Å; P39-R41 PolarHBondContact O-N 3.21Å
42	G	91.8	Very high	96.9	Very high	58 Å²	58	49.7 Å²	49.7	60%	0.598	27%	0.27	S	S	*	.	S	Bend	trans	95.9	-159.2	178.1	0	0	0	0	0	113.8
43	E	94.7	Very high	96.8	Very high	91 Å²	91	47.1 Å²	47.1	43%	0.425	26%	0.261	S	S	.	.	S	Bend	trans	-71	154.7	-178	-63.5	-58.2	166	0	0	112.6	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.29Å; R38-E43 PolarHBondContact NE-O 3.04Å; R38-E43 PolarHBondContact NH2-O 3.22Å; E43-R45 PolarHBondContact O-N 3.49Å; E43-R99 IonicContact OE1-CZ 3.8Å; E43-R99 IonicContact OE1-NE 2.71Å; E43-R99 IonicContact OE1-NH1 3.22Å; E43-R99 PolarHBondContact OE1-NH1 3.38Å; E43-R99 IonicContact OE1-NH2 3.35Å; E43-R99 PolarHBondContact OE1-NH2 3.35Å; E43-R99 VanDerWaalsContact OE2-CD 3.31Å; E43-R99 WeakPolarHBondContact OE2-CD 3.3Å; E43-R99 IonicContact OE2-CZ 3.85Å; E43-R99 IonicContact OE2-NE 2.77Å; E43-R99 PolarHBondContact OE2-NE 3.01Å; E43-R99 IonicContact OE2-NH1 3.38Å; E43-R99 PolarHBondContact OE2-NH1 2.99Å; E43-R99 IonicContact OE2-NH2 3.58Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å
44	P	97.3	Very high	96.7	Very high	27 Å²	27	49.7 Å²	49.7	18%	0.175	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-51.6	133.7	172.6	-25.6	34.8	0	0	0	111.6	V36 R99 L102	V36-P44 CarbonylContact O-C 3.53Å; V36-P44 WeakPolarHBondContact O-CA 3.33Å; V36-P44 WeakPolarHBondContact O-CB 3.31Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.16Å; P44-L102 HydrophobicContact CB-CD1 3.69Å; P44-L102 HydrophobicContact CG-CD1 3.87Å
45	R	98.4	Very high	96.5	Very high	91 Å²	91	49.3 Å²	49.3	34%	0.343	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	130.3	173.3	-176.9	-178.8	-177	-177.8	-1.9	108.4	A35 V36 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.55Å; A35-R45 VanDerWaalsContact CA-O 3.29Å; A35-R45 WeakPolarHBondContact CA-O 3.43Å; V36-R45 PolarHBondContact N-O 2.82Å; V36-R45 PolarHBondContact O-N 2.97Å; E43-R45 PolarHBondContact O-N 3.49Å; R45-I47 HydrophobicContact CG-CG1 4.39Å; R45-D61 IonicContact CZ-OD1 2.76Å; R45-D61 IonicContact CZ-OD2 2.75Å; R45-D61 IonicContact NE-OD1 2.97Å; R45-D61 PolarHBondContact NE-OD1 2.91Å; R45-D61 IonicContact NE-OD2 3.51Å; R45-D61 IonicContact NH2-OD1 2.98Å; R45-D61 PolarHBondContact NH2-OD1 2.8Å; R45-D61 IonicContact NH2-OD2 3.17Å; R45-D61 PolarHBondContact NH2-OD2 3Å; R45-S62 WeakPolarHBondContact CA-OG 3.44Å; R45-D63 VanDerWaalsContact CD-OD2 3.27Å; R45-D63 WeakPolarHBondContact CD-OD2 3.41Å; R45-D63 HydrophobicContact CG-CB 4.4Å; R45-D63 IonicContact NE-OD2 3.56Å
46	F	98.8	Very high	96.5	Very high	3 Å²	3	51.8 Å²	51.8	1%	0.013	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.6	176.9	176.1	-91.9	0	0	0	110.1	D33 T34 A35 F60 S62 Y91 Q94 A95 D98	D33-F46 HydrophobicContact CB-CE2 3.85Å; D33-F46 HydrophobicContact CB-CZ 4.07Å; T34-F46 WeakPolarHBondContact O-CA 3.38Å; A35-F46 HydrophobicContact CB-CD2 4.25Å; 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 3.89Å; F46-F60 HydrophobicContact CE1-CD1 3.89Å; F46-F60 HydrophobicContact CE1-CE1 4.28Å; F46-S62 PolarHBondContact N-OG 3.26Å; F46-S62 PolarHBondContact O-N 3.11Å; F46-S62 PolarHBondContact O-OG 3.06Å; F46-Y91 HydrophobicContact CE1-CD1 4.49Å; F46-Q94 HydrophobicContact CE2-CB 4.24Å; F46-Q94 HydrophobicContact CE2-CG 3.75Å; F46-Q94 HydrophobicContact CZ-CB 3.9Å; F46-Q94 HydrophobicContact CZ-CG 3.73Å; F46-A95 HydrophobicContact CB-CB 3.65Å; F46-A95 HydrophobicContact CD1-CB 3.73Å; F46-A95 HydrophobicContact CD2-CB 4.07Å; F46-A95 HydrophobicContact CE1-CB 4.4Å; F46-A95 HydrophobicContact CG-CB 3.54Å; F46-D98 HydrophobicContact CD2-CB 4.48Å; F46-D98 VanDerWaalsContact CE2-OD2 3.23Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.35Å
47	I	98.8	Very high	96.5	Very high	50 Å²	50	49.4 Å²	49.4	26%	0.256	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.1	174.7	-59.1	173.4	0	0	0	107.5	D33 T34 R45 V49 F60	D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.23Å; T34-I47 PolarHBondContact N-O 3.18Å; T34-I47 PolarHBondContact O-N 3.25Å; R45-I47 HydrophobicContact CG-CG1 4.39Å; I47-V49 HydrophobicContact CG2-CG1 4.39Å; I47-F60 WeakPolarHBondContact CA-O 3.16Å
48	S	98.8	Very high	96.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.9	170.7	-174.6	0	0	0	0	109.5	F32 D33 R59 F60 Y91	F32-S48 WeakPolarHBondContact O-CA 3.35Å; D33-S48 WeakPolarHBondContact OD1-CB 3.43Å; D33-S48 PolarHBondContact OD1-OG 2.93Å; S48-R59 CarbonylContact O-C 3.59Å; S48-R59 WeakPolarHBondContact O-CA 3.39Å; S48-F60 PolarHBondContact N-O 2.81Å; S48-F60 PolarHBondContact O-N 3.38Å; S48-Y91 VanDerWaalsContact OG-CE1 3.25Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.45Å
49	V	98.8	Very high	96.6	Very high	30 Å²	30	49.1 Å²	49.1	18%	0.182	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	138.8	173.6	-63.5	0	0	0	0	109.8	Y31 F32 I47 Y51 Q56 V58 R59	Y31-V49 CarbonylContact C-O 3.47Å; Y31-V49 WeakPolarHBondContact CA-O 3.36Å; F32-V49 HydrophobicContact CB-CG2 3.87Å; F32-V49 HydrophobicContact CD2-CG2 4.35Å; F32-V49 PolarHBondContact N-O 2.79Å; F32-V49 PolarHBondContact O-N 3.46Å; I47-V49 HydrophobicContact CG2-CG1 4.39Å; V49-Y51 HydrophobicContact CB-CE2 4.12Å; V49-Y51 HydrophobicContact CG2-CD2 4.38Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; V49-V58 WeakPolarHBondContact CA-O 3.46Å; V49-R59 HydrophobicContact CG1-CB 4.48Å; V49-R59 HydrophobicContact CG1-CG 4.26Å
50	G	98.6	Very high	96.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.1	177.5	0	0	0	0	0	110.8	R30 Q56 F57 V58	R30-G50 CarbonylContact O-C 3.57Å; R30-G50 WeakPolarHBondContact O-CA 3.44Å; G50-Q56 WeakPolarHBondContact O-CA 3.45Å; G50-F57 WeakPolarHBondContact O-CD1 2.96Å; G50-F57 PolarHBondContact O-N 3.23Å; G50-V58 PolarHBondContact N-O 3.39Å; G50-V58 PolarHBondContact O-N 2.98Å
51	Y	98.6	Very high	97.3	Very high	71 Å²	71	43.4 Å²	43.4	28%	0.278	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.1	178.2	-76.3	-102.6	0	0	0	110.5	M29 R30 F32 V49 T55 Q56	M29-Y51 CarbonylContact C-O 3.51Å; M29-Y51 WeakPolarHBondContact CA-O 3.41Å; R30-Y51 PolarHBondContact N-O 2.98Å; R30-Y51 PolarHBondContact O-N 3.14Å; F32-Y51 HydrophobicContact CD2-CD2 4.14Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; V49-Y51 HydrophobicContact CB-CE2 4.12Å; V49-Y51 HydrophobicContact CG2-CD2 4.38Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; Y51-T55 WeakPolarHBondContact CA-O 3.35Å; Y51-T55 VanDerWaalsContact CD1-C 3.49Å; Y51-Q56 HydrophobicContact CD1-CB 4.02Å; Y51-Q56 VanDerWaalsContact CD1-N 3.32Å; Y51-Q56 HydrophobicContact CD2-CG 4.34Å; Y51-Q56 HydrophobicContact CE1-CB 3.53Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.06Å; Y51-Q56 HydrophobicContact CE2-CG 3.84Å; Y51-Q56 HydrophobicContact CG-CB 4.48Å
52	V	98.1	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	-109.7	118.8	156.1	177	0	0	0	0	105.9	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.29Å; S28-V52 WeakPolarHBondContact O-CA 3.4Å; M29-V52 HydrophobicContact CG-CG2 4.32Å; V52-D54 PolarHBondContact O-N 2.79Å; V52-T55 PolarHBondContact N-O 2.82Å; V52-T55 WeakPolarHBondContact O-CB 3.37Å; V52-T55 PolarHBondContact O-N 3.32Å; V52-F57 HydrophobicContact CG2-CD1 4.02Å; V52-F57 HydrophobicContact CG2-CE1 4.03Å; V52-W75 HydrophobicContact CB-CH2 4.4Å; V52-W75 HydrophobicContact CB-CZ2 4.45Å; V52-W75 HydrophobicContact CG2-CH2 3.86Å; V52-W75 HydrophobicContact CG2-CZ2 4.39Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.25Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; V52-Y195 HydrophobicContact CG2-CG 4.44Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CB-CD1 4.26Å; V52-L203 HydrophobicContact CB-CD2 4.13Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CG 4.49Å
53	D	95.7	Very high	97.8	Very high	30 Å²	30	35.5 Å²	35.5	16%	0.16	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	-125.6	-166.9	-53.8	-41	0	0	0	110.4	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.24Å; H27-D53 WeakPolarHBondContact CA-OD1 3.4Å; H27-D53 IonicContact CE1-OD2 2.61Å; H27-D53 IonicContact CG-OD2 2.92Å; H27-D53 IonicContact ND1-OD1 3.49Å; H27-D53 IonicContact ND1-OD2 3.89Å; H27-D53 PolarHBondContact ND1-OD2 2.77Å; S28-D53 PolarHBondContact N-OD1 3.21Å; S28-D53 PolarHBondContact O-N 3.12Å; S28-D53 PolarHBondContact OG-OD1 3.29Å; D53-T55 VanDerWaalsContact C-N 3.33Å
54	D	95.7	Very high	97.9	Very high	63 Å²	63	32.8 Å²	32.8	34%	0.337	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	8.4	178.5	-61.6	-54.8	0	0	0	114	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 2.79Å; D54-Y233 HydrophobicContact CB-CE2 3.98Å; D54-P234 VanDerWaalsContact OD2-CB 3.31Å; D54-P234 WeakPolarHBondContact OD2-CB 3.41Å; D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.33Å; D54-A235 PolarHBondContact OD2-N 2.97Å; D54-F265 HydrophobicContact CB-CE2 3.77Å; D54-F265 HydrophobicContact CB-CZ 3.7Å
55	T	96.7	Very high	97.9	Very high	32 Å²	32	37.1 Å²	37.1	20%	0.196	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	112.7	-176	-61.8	0	0	0	0	111.8	Y51 V52 D53 F57 A73 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.35Å; Y51-T55 VanDerWaalsContact CD1-C 3.49Å; V52-T55 PolarHBondContact N-O 2.82Å; V52-T55 WeakPolarHBondContact O-CB 3.37Å; V52-T55 PolarHBondContact O-N 3.32Å; D53-T55 VanDerWaalsContact C-N 3.33Å; T55-F57 PolarHBondContact O-N 3.1Å; T55-A73 HydrophobicContact CG2-CB 4.48Å; T55-L203 HydrophobicContact CG2-CD2 4.05Å; T55-Y233 PolarHBondContact OG1-OH 3.44Å
56	Q	97.6	Very high	97.8	Very high	54 Å²	54	36.6 Å²	36.6	25%	0.252	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	129.5	173.3	-166.3	-179.3	2.2	0	0	110.4	V49 G50 Y51 V58 R72	V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; G50-Q56 WeakPolarHBondContact O-CA 3.45Å; Y51-Q56 HydrophobicContact CD1-CB 4.02Å; Y51-Q56 VanDerWaalsContact CD1-N 3.32Å; Y51-Q56 HydrophobicContact CD2-CG 4.34Å; Y51-Q56 HydrophobicContact CE1-CB 3.53Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.06Å; Y51-Q56 HydrophobicContact CE2-CG 3.84Å; Y51-Q56 HydrophobicContact CG-CB 4.48Å; Q56-V58 PolarHBondContact NE2-O 2.84Å; Q56-R72 HydrophobicContact CG-CB 4.13Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.58Å
57	F	98.1	Very high	97.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-22.8	-179.6	76.1	-82.6	0	0	0	114.4	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.41Å; M29-F57 HydrophobicContact SD-CZ 4.3Å; Y31-F57 HydrophobicContact CE1-CZ 4.11Å; Y31-F57 AromaticContact CZ-CZ 3.79Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.03Å; G50-F57 WeakPolarHBondContact O-CD1 2.96Å; G50-F57 PolarHBondContact O-N 3.23Å; V52-F57 HydrophobicContact CG2-CD1 4.02Å; V52-F57 HydrophobicContact CG2-CE1 4.03Å; T55-F57 PolarHBondContact O-N 3.1Å; F57-R72 PolarHBondContact O-N 2.68Å; F57-A73 HydrophobicContact CB-CB 4.06Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.32Å; F57-W75 HydrophobicContact CB-CZ3 3.9Å; F57-W75 AromaticContact CD1-CH2 3.99Å; F57-W75 HydrophobicContact CD1-CH2 3.99Å; F57-W75 AromaticContact CD2-CH2 3.7Å; F57-W75 HydrophobicContact CD2-CH2 3.7Å; F57-W75 AromaticContact CD2-CZ3 3.94Å; F57-W75 HydrophobicContact CD2-CZ3 3.94Å; F57-W75 AromaticContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CZ2 4.05Å; F57-W75 HydrophobicContact CG-CZ3 4.06Å; F57-V76 HydrophobicContact CB-CG1 4.39Å; F57-V76 HydrophobicContact CD2-CB 4.33Å; F57-V76 HydrophobicContact CD2-CG1 4.47Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 VanDerWaalsContact O-CG1 3.23Å; F57-V76 WeakPolarHBondContact O-CG1 3.28Å; F57-Y195 HydrophobicContact CD2-CE2 4.42Å; F57-Y195 HydrophobicContact CE2-CD2 4.23Å; F57-Y195 AromaticContact CE2-CE2 3.59Å; F57-Y195 HydrophobicContact CE2-CE2 3.59Å; F57-Y195 AromaticContact CE2-CZ 3.78Å; F57-Y195 HydrophobicContact CZ-CD2 4.28Å; F57-Y195 AromaticContact CZ-CE2 3.74Å; F57-Y195 HydrophobicContact CZ-CE2 3.74Å
58	V	98.3	Very high	97.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	153.5	177.2	-73.8	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 3.46Å; G50-V58 PolarHBondContact N-O 3.39Å; G50-V58 PolarHBondContact O-N 2.98Å; Q56-V58 PolarHBondContact NE2-O 2.84Å; V58-E70 WeakPolarHBondContact CA-O 3.46Å; V58-W84 HydrophobicContact CG1-CH2 3.92Å; V58-W84 HydrophobicContact CG1-CZ3 3.84Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.19Å
59	R	98.4	Very high	97.6	Very high	84 Å²	84	43.4 Å²	43.4	32%	0.317	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.5	170.9	178.7	174.3	169.2	-177.8	-3.7	110.9	S48 V49 D61 E70 R72	S48-R59 CarbonylContact O-C 3.59Å; S48-R59 WeakPolarHBondContact O-CA 3.39Å; V49-R59 HydrophobicContact CG1-CB 4.48Å; V49-R59 HydrophobicContact CG1-CG 4.26Å; R59-D61 IonicContact NH2-OD2 2.78Å; R59-D61 PolarHBondContact NH2-OD2 3.22Å; R59-D61 VanDerWaalsContact NH2-OD2 3.09Å; R59-E70 PolarHBondContact N-O 2.93Å; R59-E70 PolarHBondContact O-N 2.8Å; R59-R72 HydrophobicContact CB-CG 3.92Å
60	F	98.8	Very high	97.6	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142	164.9	178.6	-86	0	0	0	109.5	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 3.89Å; F46-F60 HydrophobicContact CE1-CD1 3.89Å; F46-F60 HydrophobicContact CE1-CE1 4.28Å; I47-F60 WeakPolarHBondContact CA-O 3.16Å; S48-F60 PolarHBondContact N-O 2.81Å; S48-F60 PolarHBondContact O-N 3.38Å; F60-P67 HydrophobicContact CE2-CB 3.86Å; F60-P67 HydrophobicContact CZ-CB 3.66Å; F60-Y91 HydrophobicContact CB-CD1 4.15Å; F60-Y91 HydrophobicContact CB-CD2 3.58Å; F60-Y91 HydrophobicContact CB-CE2 4.01Å; F60-Y91 HydrophobicContact CB-CG 3.67Å; F60-Y91 HydrophobicContact CD1-CG 4.33Å; F60-Y91 AromaticContact CD2-CD2 3.66Å; F60-Y91 HydrophobicContact CD2-CD2 3.66Å; F60-Y91 AromaticContact CD2-CG 3.89Å; F60-Y91 HydrophobicContact CD2-CG 3.89Å; F60-Y91 AromaticContact CG-CD2 3.8Å; F60-Y91 HydrophobicContact CG-CD2 3.8Å; F60-Y91 AromaticContact CG-CG 3.71Å; F60-Y91 HydrophobicContact CG-CG 3.71Å; F60-K92 HydrophobicContact CE2-CG 4.36Å; F60-K92 HydrophobicContact CZ-CG 4.1Å
61	D	98.6	Very high	97.5	Very high	15 Å²	15	47 Å²	47	8%	0.08	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	119.8	175.8	-163.8	-26.5	0	0	0	109.4	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 2.76Å; R45-D61 IonicContact CZ-OD2 2.75Å; R45-D61 IonicContact NE-OD1 2.97Å; R45-D61 PolarHBondContact NE-OD1 2.91Å; R45-D61 IonicContact NE-OD2 3.51Å; R45-D61 IonicContact NH2-OD1 2.98Å; R45-D61 PolarHBondContact NH2-OD1 2.8Å; R45-D61 IonicContact NH2-OD2 3.17Å; R45-D61 PolarHBondContact NH2-OD2 3Å; R59-D61 IonicContact NH2-OD2 2.78Å; R59-D61 PolarHBondContact NH2-OD2 3.22Å; R59-D61 VanDerWaalsContact NH2-OD2 3.09Å; D61-D63 PolarHBondContact O-N 2.93Å; D61-D63 PolarHBondContact OD1-N 3.38Å; D61-D63 VanDerWaalsContact OD1-N 3.17Å; D61-A64 HydrophobicContact CB-CB 4.45Å; D61-A64 WeakPolarHBondContact O-CB 3.37Å; D61-A64 PolarHBondContact O-N 2.96Å
62	S	98.3	Very high	97.5	Very high	33 Å²	33	49 Å²	49	23%	0.231	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22.1	-178.8	68.2	0	0	0	0	113.3	R45 F46 P67	R45-S62 WeakPolarHBondContact CA-OG 3.44Å; F46-S62 PolarHBondContact N-OG 3.26Å; F46-S62 PolarHBondContact O-N 3.11Å; F46-S62 PolarHBondContact O-OG 3.06Å; S62-P67 WeakPolarHBondContact O-CG 3.42Å
63	D	97.5	Very high	97.4	Very high	68 Å²	68	49.1 Å²	49.1	36%	0.364	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-2.7	-180	-78.6	4.8	0	0	0	112.8	R38 R45 D61	R38-D63 IonicContact CZ-OD1 2.73Å; R38-D63 IonicContact CZ-OD2 2.63Å; R38-D63 IonicContact NH1-OD1 3.39Å; R38-D63 PolarHBondContact NH1-OD1 3.46Å; R38-D63 IonicContact NH1-OD2 3.02Å; R38-D63 PolarHBondContact NH1-OD2 3Å; R38-D63 IonicContact NH2-OD1 3.44Å; R38-D63 PolarHBondContact NH2-OD1 3.49Å; R38-D63 IonicContact NH2-OD2 3.22Å; R45-D63 VanDerWaalsContact CD-OD2 3.27Å; R45-D63 WeakPolarHBondContact CD-OD2 3.41Å; R45-D63 HydrophobicContact CG-CB 4.4Å; R45-D63 IonicContact NE-OD2 3.56Å; D61-D63 PolarHBondContact O-N 2.93Å; D61-D63 PolarHBondContact OD1-N 3.38Å; D61-D63 VanDerWaalsContact OD1-N 3.17Å
64	A	97.3	Very high	97.4	Very high	33 Å²	33	52.5 Å²	52.5	27%	0.273	29%	0.294	S	S	.	.	S	Bend	trans	-61.9	149	172.9	0	0	0	0	0	110.9	D61 S66 P67	D61-A64 HydrophobicContact CB-CB 4.45Å; D61-A64 WeakPolarHBondContact O-CB 3.37Å; D61-A64 PolarHBondContact O-N 2.96Å; A64-S66 PolarHBondContact O-N 3.29Å; A64-S66 VanDerWaalsContact O-N 3.15Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.17Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 2.96Å
65	A	96.7	Very high	97.4	Very high	119 Å²	119	50.3 Å²	50.3	98%	0.983	28%	0.281	S	S	*	.	S	Bend	trans	-58.5	-31.5	179.8	0	0	0	0	0	113.1
66	S	95.9	Very high	97.4	Very high	80 Å²	80	48.8 Å²	48.8	56%	0.559	27%	0.272	S	S	*	.	S	Bend	trans	-134.1	89.8	171.1	-173.9	0	0	0	0	109	A64 R68	A64-S66 PolarHBondContact O-N 3.29Å; A64-S66 VanDerWaalsContact O-N 3.15Å; S66-R68 PolarHBondContact O-N 2.85Å; S66-R68 VanDerWaalsContact O-N 3.09Å
67	P	97	Very high	97.3	Very high	36 Å²	36	52 Å²	52	23%	0.234	29%	0.287	C	S	.	.			trans	-64.3	111.9	-175.1	-24	35.2	0	0	0	112	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.86Å; F60-P67 HydrophobicContact CZ-CB 3.66Å; S62-P67 WeakPolarHBondContact O-CG 3.42Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.17Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 2.96Å; P67-K92 VanDerWaalsContact O-CE 3.25Å; P67-K92 WeakPolarHBondContact O-CE 3.23Å; P67-K92 PolarHBondContact O-NZ 3.49Å
68	R	97.8	Very high	97.2	Very high	153 Å²	153	57.9 Å²	57.9	58%	0.577	31%	0.314	S	S	*	.			trans	-145.8	159.4	177.2	62.6	-175.4	169.8	178.2	-1.2	110.6	S66 E70 T88	S66-R68 PolarHBondContact O-N 2.85Å; S66-R68 VanDerWaalsContact O-N 3.09Å; R68-E70 HydrophobicContact CG-CG 4.39Å; R68-E70 PolarHBondContact O-N 2.92Å; R68-T88 HydrophobicContact CB-CG2 4.21Å
69	G	97.4	Very high	97.1	Very high	6 Å²	6	58.5 Å²	58.5	6%	0.062	32%	0.317	C	S	.	.			trans	-64.5	129.4	168.4	0	0	0	0	0	109.6	T88	G69-T88 PolarHBondContact N-OG1 3.43Å
70	E	97.8	Very high	97	Very high	57 Å²	57	56.1 Å²	56.1	27%	0.266	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.1	-179.2	-64.1	178.1	161.7	0	0	109.8	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.46Å; R59-E70 PolarHBondContact N-O 2.93Å; R59-E70 PolarHBondContact O-N 2.8Å; R68-E70 HydrophobicContact CG-CG 4.39Å; R68-E70 PolarHBondContact O-N 2.92Å; E70-R72 IonicContact OE2-CZ 3Å; E70-R72 IonicContact OE2-NH2 3.94Å; E70-R72 PolarHBondContact OE2-NH2 2.04Å
71	P	97.9	Very high	96.9	Very high	48 Å²	48	60.7 Å²	60.7	31%	0.312	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	145.5	172.7	28.8	-33.9	0	0	0	110.7	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.78Å; P71-E77 HydrophobicContact CB-CG 3.66Å; P71-E77 HydrophobicContact CG-CG 3.9Å; P71-W84 HydrophobicContact CB-CH2 3.63Å; P71-W84 HydrophobicContact CB-CZ2 3.83Å; P71-W84 HydrophobicContact CG-CH2 4.25Å; P71-W84 HydrophobicContact CG-CZ2 4.27Å
72	R	97.4	Very high	96.8	Very high	113 Å²	113	67.9 Å²	67.9	43%	0.426	38%	0.382	S	S	.	.			trans	-128	-1.4	174.8	-60.8	-64.6	171.4	178.5	-2.9	113.1	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CG-CB 4.13Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.58Å; F57-R72 PolarHBondContact O-N 2.68Å; R59-R72 HydrophobicContact CB-CG 3.92Å; E70-R72 IonicContact OE2-CZ 3Å; E70-R72 IonicContact OE2-NH2 3.94Å; E70-R72 PolarHBondContact OE2-NH2 2.04Å
73	A	96.1	Very high	96.8	Very high	4 Å²	4	66.7 Å²	66.7	3%	0.033	37%	0.373	C	S	.	.	S	Bend	trans	-136.7	143.4	172.8	0	0	0	0	0	110.9	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.48Å; F57-A73 HydrophobicContact CB-CB 4.06Å; A73-W75 VanDerWaalsContact C-N 3.29Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.35Å; A73-W75 HydrophobicContact CB-CZ2 4Å; A73-W75 PolarHBondContact O-N 2.84Å; A73-V76 WeakPolarHBondContact O-CG1 3.32Å; A73-V76 PolarHBondContact O-N 2.92Å
74	P	96.1	Very high	96.8	Very high	101 Å²	101	65.3 Å²	65.3	66%	0.656	36%	0.362	S	S	*	.	H	α-helix	trans	-58.1	-37.3	-177.6	-26.9	35.1	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 2.84Å; P74-E77 WeakPolarHBondContact O-CB 3.22Å; P74-E77 PolarHBondContact O-N 3.42Å; P74-E77 VanDerWaalsContact O-N 3.1Å
75	W	95.9	Very high	96.8	Very high	16 Å²	16	68.9 Å²	68.9	6%	0.061	38%	0.377	C	S	.	.	H	α-helix	trans	-70.2	-13.6	-176.1	53.8	-107.1	0	0	0	114.5	V52 F57 A73 Q78 Y195 N198 T202 L203	V52-W75 HydrophobicContact CB-CH2 4.4Å; V52-W75 HydrophobicContact CB-CZ2 4.45Å; V52-W75 HydrophobicContact CG2-CH2 3.86Å; V52-W75 HydrophobicContact CG2-CZ2 4.39Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.32Å; F57-W75 HydrophobicContact CB-CZ3 3.9Å; F57-W75 AromaticContact CD1-CH2 3.99Å; F57-W75 HydrophobicContact CD1-CH2 3.99Å; F57-W75 AromaticContact CD2-CH2 3.7Å; F57-W75 HydrophobicContact CD2-CH2 3.7Å; F57-W75 AromaticContact CD2-CZ3 3.94Å; F57-W75 HydrophobicContact CD2-CZ3 3.94Å; F57-W75 AromaticContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CH2 3.35Å; F57-W75 HydrophobicContact CG-CZ2 4.05Å; F57-W75 HydrophobicContact CG-CZ3 4.06Å; A73-W75 VanDerWaalsContact C-N 3.29Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.35Å; A73-W75 HydrophobicContact CB-CZ2 4Å; A73-W75 PolarHBondContact O-N 2.84Å; W75-Q78 WeakPolarHBondContact O-CG 3.47Å; W75-Q78 PolarHBondContact O-NE2 3Å; W75-Y195 HydrophobicContact CE3-CD1 4.21Å; W75-Y195 HydrophobicContact CE3-CG 4.46Å; W75-Y195 HydrophobicContact CH2-CD1 4.49Å; W75-Y195 HydrophobicContact CH2-CD2 4.49Å; W75-Y195 HydrophobicContact CH2-CG 4.1Å; W75-Y195 AromaticContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD2 4.28Å; W75-Y195 HydrophobicContact CZ3-CE1 4.26Å; W75-Y195 AromaticContact CZ3-CG 3.56Å; W75-Y195 HydrophobicContact CZ3-CG 3.56Å; W75-N198 HydrophobicContact CB-CB 4.41Å; W75-T202 VanDerWaalsContact CD1-OG1 3.23Å; W75-L203 HydrophobicContact CD2-CD1 4.42Å; W75-L203 HydrophobicContact CH2-CD1 4.37Å; W75-L203 HydrophobicContact CZ2-CD1 3.82Å; W75-L203 HydrophobicContact CZ2-CD2 4.12Å; W75-L203 HydrophobicContact CZ2-CG 4.4Å
76	V	97.2	Very high	96.9	Very high	0 Å²	0	68 Å²	68	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-94.3	-17.3	172.2	72.6	0	0	0	0	112.1	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.39Å; F57-V76 HydrophobicContact CD2-CB 4.33Å; F57-V76 HydrophobicContact CD2-CG1 4.47Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 VanDerWaalsContact O-CG1 3.23Å; F57-V76 WeakPolarHBondContact O-CG1 3.28Å; P71-V76 HydrophobicContact CB-CG1 3.78Å; A73-V76 WeakPolarHBondContact O-CG1 3.32Å; A73-V76 PolarHBondContact O-N 2.92Å; P74-V76 PolarHBondContact O-N 2.84Å; V76-Q78 PolarHBondContact O-N 3.09Å; V76-E79 HydrophobicContact CG2-CG 3.92Å; V76-E79 WeakPolarHBondContact O-CB 3.34Å; V76-E79 WeakPolarHBondContact O-CG 3.49Å; V76-E79 PolarHBondContact O-N 2.83Å; V76-Y83 HydrophobicContact CG2-CE1 4.07Å; V76-W84 HydrophobicContact CG1-CH2 4.03Å; V76-W84 HydrophobicContact CG1-CZ2 4.3Å; V76-W84 HydrophobicContact CG2-CH2 3.95Å; V76-W84 HydrophobicContact CG2-CZ2 4.04Å; V76-W84 WeakPolarHBondContact O-CZ2 3.22Å; V76-Y195 HydrophobicContact CG2-CE1 4.37Å
77	E	95.5	Very high	96.9	Very high	123 Å²	123	64.7 Å²	64.7	58%	0.575	32%	0.324	S	S	*	.	H	α-helix	trans	-62.5	-26.4	-179.9	-65.8	-178.1	-177.2	0	0	112.8	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.66Å; P71-E77 HydrophobicContact CG-CG 3.9Å; P74-E77 WeakPolarHBondContact O-CB 3.22Å; P74-E77 PolarHBondContact O-N 3.42Å; P74-E77 VanDerWaalsContact O-N 3.1Å; E77-E79 PolarHBondContact O-N 3.27Å
78	Q	94.8	Very high	97	Very high	123 Å²	123	63.5 Å²	63.5	58%	0.575	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-11.2	175.5	66.8	-179	10.9	0	0	114.1	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.47Å; W75-Q78 PolarHBondContact O-NE2 3Å; V76-Q78 PolarHBondContact O-N 3.09Å; Q78-N198 PolarHBondContact NE2-ND2 2.84Å; Q78-N198 PolarHBondContact NE2-OD1 2.94Å
79	E	96.7	Very high	97	Very high	12 Å²	12	61.1 Å²	61.1	6%	0.056	31%	0.311	C	S	.	.	S	Bend	trans	-65.9	136.1	174.5	-65.7	-62.1	158.1	0	0	110.8	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 3.92Å; V76-E79 WeakPolarHBondContact O-CB 3.34Å; V76-E79 WeakPolarHBondContact O-CG 3.49Å; V76-E79 PolarHBondContact O-N 2.83Å; E77-E79 PolarHBondContact O-N 3.27Å; E79-Y83 HydrophobicContact CB-CD1 3.48Å; E79-Y83 VanDerWaalsContact CB-CD1 3.48Å; E79-Y83 HydrophobicContact CB-CD2 4.47Å; E79-Y83 HydrophobicContact CB-CE1 4.09Å; E79-Y83 HydrophobicContact CB-CG 3.72Å; E79-Y83 HydrophobicContact CG-CD1 4.03Å; E79-Y83 HydrophobicContact CG-CD2 4.43Å; E79-Y83 HydrophobicContact CG-CE1 4.23Å; E79-Y83 HydrophobicContact CG-CG 4.14Å; E79-W84 PolarHBondContact O-NE1 2.81Å; E79-R194 IonicContact OE1-CZ 2.71Å; E79-R194 IonicContact OE1-NE 2.81Å; E79-R194 PolarHBondContact OE1-NE 2.61Å; E79-R194 IonicContact OE1-NH2 3.14Å; E79-R194 PolarHBondContact OE1-NH2 2.86Å; E79-R194 IonicContact OE2-CZ 2.99Å; E79-R194 IonicContact OE2-NE 3.68Å; E79-R194 IonicContact OE2-NH2 3.34Å; E79-R194 PolarHBondContact OE2-NH2 2.81Å; E79-N198 PolarHBondContact OE1-ND2 2.83Å
80	G	95.8	Very high	97	Very high	35 Å²	35	64 Å²	64	36%	0.361	32%	0.322	S	S	.	.			trans	-70.2	169.8	-174.8	0	0	0	0	0	114.3	E82 Y83 W84	G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 3.28Å; G80-Y83 WeakPolarHBondContact O-CB 3.37Å; G80-Y83 PolarHBondContact O-N 3.01Å; G80-W84 PolarHBondContact O-N 2.88Å
81	P	96.8	Very high	97	Very high	100 Å²	100	61.8 Å²	61.8	65%	0.649	31%	0.311	S	S	*	.	H	α-helix	trans	-57.7	-35.4	-178.2	22.7	-33.5	0	0	0	113.3	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 2.94Å; P81-W84 PolarHBondContact O-N 2.7Å; P81-W84 VanDerWaalsContact O-N 3.16Å; P81-D85 WeakPolarHBondContact O-CB 3.06Å; P81-D85 PolarHBondContact O-N 2.85Å
82	E	97.4	Very high	97.1	Very high	165 Å²	165	63.4 Å²	63.4	77%	0.771	31%	0.314	S	S	*	.	H	α-helix	trans	-60.6	-34.8	177.8	-63.2	-177.7	178	0	0	113	G80 R86	G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 3.28Å; E82-R86 WeakPolarHBondContact O-CB 2.82Å; E82-R86 PolarHBondContact O-N 3.14Å
83	Y	97.3	Very high	97.1	Very high	8 Å²	8	65.3 Å²	65.3	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-52.2	174.3	168.4	-92.6	0	0	0	110.1	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.07Å; E79-Y83 HydrophobicContact CB-CD1 3.48Å; E79-Y83 VanDerWaalsContact CB-CD1 3.48Å; E79-Y83 HydrophobicContact CB-CD2 4.47Å; E79-Y83 HydrophobicContact CB-CE1 4.09Å; E79-Y83 HydrophobicContact CB-CG 3.72Å; E79-Y83 HydrophobicContact CG-CD1 4.03Å; E79-Y83 HydrophobicContact CG-CD2 4.43Å; E79-Y83 HydrophobicContact CG-CE1 4.23Å; E79-Y83 HydrophobicContact CG-CG 4.14Å; G80-Y83 WeakPolarHBondContact O-CB 3.37Å; G80-Y83 PolarHBondContact O-N 3.01Å; P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 2.94Å; Y83-D85 VanDerWaalsContact C-N 3.35Å; Y83-D85 PolarHBondContact O-N 2.71Å; Y83-R86 PolarHBondContact O-N 3.36Å; Y83-E87 HydrophobicContact CD1-CG 4.38Å; Y83-E87 HydrophobicContact CD2-CG 4.11Å; Y83-E87 HydrophobicContact CE1-CG 4Å; Y83-E87 HydrophobicContact CE2-CG 3.67Å; Y83-E87 HydrophobicContact CG-CG 4.42Å; Y83-E87 WeakPolarHBondContact O-CG 3.32Å; Y83-E87 PolarHBondContact O-N 3.2Å; Y83-W191 AromaticContact CD2-CH2 3.46Å; Y83-W191 HydrophobicContact CD2-CH2 3.46Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.46Å; Y83-W191 HydrophobicContact CD2-CZ2 4.19Å; Y83-W191 AromaticContact CD2-CZ3 3.7Å; Y83-W191 HydrophobicContact CD2-CZ3 3.7Å; Y83-W191 HydrophobicContact CE2-CE3 4.18Å; Y83-W191 AromaticContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CZ2 4.48Å; Y83-W191 AromaticContact CE2-CZ3 3.66Å; Y83-W191 HydrophobicContact CE2-CZ3 3.66Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.49Å; Y83-Y195 PolarHBondContact OH-OH 2.81Å
84	W	98	Very high	97.2	Very high	39 Å²	39	67.5 Å²	67.5	15%	0.148	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-38.9	-177.6	-66.8	112	0	0	0	113	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.92Å; V58-W84 HydrophobicContact CG1-CZ3 3.84Å; P71-W84 HydrophobicContact CB-CH2 3.63Å; P71-W84 HydrophobicContact CB-CZ2 3.83Å; P71-W84 HydrophobicContact CG-CH2 4.25Å; P71-W84 HydrophobicContact CG-CZ2 4.27Å; V76-W84 HydrophobicContact CG1-CH2 4.03Å; V76-W84 HydrophobicContact CG1-CZ2 4.3Å; V76-W84 HydrophobicContact CG2-CH2 3.95Å; V76-W84 HydrophobicContact CG2-CZ2 4.04Å; V76-W84 WeakPolarHBondContact O-CZ2 3.22Å; E79-W84 PolarHBondContact O-NE1 2.81Å; G80-W84 PolarHBondContact O-N 2.88Å; P81-W84 PolarHBondContact O-N 2.7Å; P81-W84 VanDerWaalsContact O-N 3.16Å; W84-T88 WeakPolarHBondContact O-CB 3.5Å; W84-T88 PolarHBondContact O-N 2.96Å; W84-T88 PolarHBondContact O-OG1 3.12Å
85	D	97.9	Very high	97.3	Very high	108 Å²	108	63.8 Å²	63.8	58%	0.578	31%	0.308	S	S	*	.	H	α-helix	trans	-64.5	-46.7	174.8	-75.3	-22.5	0	0	0	110.8	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.06Å; P81-D85 PolarHBondContact O-N 2.85Å; Y83-D85 VanDerWaalsContact C-N 3.35Å; Y83-D85 PolarHBondContact O-N 2.71Å; D85-T88 PolarHBondContact O-N 3.06Å; D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.46Å; D85-Q89 PolarHBondContact O-N 3.02Å
86	R	97.4	Very high	97.4	Very high	102 Å²	102	69.4 Å²	69.4	39%	0.385	34%	0.335	S	S	.	.	H	α-helix	trans	-62.7	-47	178.5	-176.2	-178.1	65	-138.7	-5.4	112.1	E82 Y83 Q89 K90	E82-R86 WeakPolarHBondContact O-CB 2.82Å; E82-R86 PolarHBondContact O-N 3.14Å; Y83-R86 PolarHBondContact O-N 3.36Å; R86-Q89 PolarHBondContact O-N 3.38Å; R86-K90 WeakPolarHBondContact O-CG 3.24Å; R86-K90 PolarHBondContact O-N 3.3Å
87	E	97.4	Very high	97.4	Very high	9 Å²	9	71.6 Å²	71.6	4%	0.042	35%	0.353	C	S	.	.	H	α-helix	trans	-65.3	-41.9	178.5	-65.2	-43.3	117.7	0	0	111.1	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.38Å; Y83-E87 HydrophobicContact CD2-CG 4.11Å; Y83-E87 HydrophobicContact CE1-CG 4Å; Y83-E87 HydrophobicContact CE2-CG 3.67Å; Y83-E87 HydrophobicContact CG-CG 4.42Å; Y83-E87 WeakPolarHBondContact O-CG 3.32Å; Y83-E87 PolarHBondContact O-N 3.2Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 3.06Å; E87-K90 WeakPolarHBondContact O-CB 3.36Å; E87-K90 PolarHBondContact O-N 3.47Å; E87-K90 WeakPolarHBondContact OE1-CE 3.4Å; E87-K90 IonicContact OE1-NZ 3.98Å; E87-K90 PolarHBondContact OE1-NZ 2.86Å; E87-K90 WeakPolarHBondContact OE2-CD 3.45Å; E87-K90 IonicContact OE2-NZ 3.12Å; E87-K90 PolarHBondContact OE2-NZ 3.44Å; E87-Y91 HydrophobicContact CB-CE2 4.02Å; E87-Y91 WeakPolarHBondContact O-CD2 3.34Å; E87-Y91 PolarHBondContact O-N 3.43Å
88	T	98.4	Very high	97.5	Very high	11 Å²	11	66 Å²	66	7%	0.067	33%	0.327	C	S	.	.	H	α-helix	trans	-56.6	-43.8	173.5	-64.2	0	0	0	0	112.1	R68 G69 W84 D85 Y91 K92	R68-T88 HydrophobicContact CB-CG2 4.21Å; G69-T88 PolarHBondContact N-OG1 3.43Å; W84-T88 WeakPolarHBondContact O-CB 3.5Å; W84-T88 PolarHBondContact O-N 2.96Å; W84-T88 PolarHBondContact O-OG1 3.12Å; D85-T88 PolarHBondContact O-N 3.06Å; T88-Y91 PolarHBondContact O-N 3.47Å; T88-K92 HydrophobicContact CG2-CD 4.19Å; T88-K92 WeakPolarHBondContact O-CG 3.44Å; T88-K92 PolarHBondContact O-N 3.27Å
89	Q	98.3	Very high	97.7	Very high	103 Å²	103	64.8 Å²	64.8	48%	0.481	32%	0.317	S	S	.	.	H	α-helix	trans	-69.5	-31.2	177.1	-67.6	-58.3	-26.1	0	0	112.9	D85 R86 E87 R93	D85-Q89 VanDerWaalsContact O-CG 3.31Å; D85-Q89 WeakPolarHBondContact O-CG 3.46Å; D85-Q89 PolarHBondContact O-N 3.02Å; R86-Q89 PolarHBondContact O-N 3.38Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 3.06Å; Q89-R93 WeakPolarHBondContact O-CB 3.33Å; Q89-R93 WeakPolarHBondContact O-CG 3.49Å; Q89-R93 PolarHBondContact O-N 3.29Å; Q89-R93 VanDerWaalsContact O-N 3.09Å; Q89-R93 PolarHBondContact O-NE 3.48Å
90	K	97.2	Very high	97.7	Very high	67 Å²	67	67.7 Å²	67.7	29%	0.291	34%	0.336	S	S	.	.	H	α-helix	trans	-64.5	-49.1	171.4	-73.2	171.8	178	173.8	0	110.9	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.24Å; R86-K90 PolarHBondContact O-N 3.3Å; E87-K90 WeakPolarHBondContact O-CB 3.36Å; E87-K90 PolarHBondContact O-N 3.47Å; E87-K90 WeakPolarHBondContact OE1-CE 3.4Å; E87-K90 IonicContact OE1-NZ 3.98Å; E87-K90 PolarHBondContact OE1-NZ 2.86Å; E87-K90 WeakPolarHBondContact OE2-CD 3.45Å; E87-K90 IonicContact OE2-NZ 3.12Å; E87-K90 PolarHBondContact OE2-NZ 3.44Å; K90-K92 VanDerWaalsContact C-N 3.34Å; K90-K92 PolarHBondContact O-N 2.91Å; K90-R93 PolarHBondContact O-N 3.46Å; K90-Q94 PolarHBondContact O-N 2.97Å
91	Y	98.4	Very high	97.8	Very high	10 Å²	10	68.1 Å²	68.1	4%	0.039	33%	0.333	C	S	.	.	H	α-helix	trans	-59.4	-42.8	177.6	-61.9	-51.2	0	0	0	112.3	F46 S48 V58 F60 E87 T88 R93 Q94 A95	F46-Y91 HydrophobicContact CE1-CD1 4.49Å; S48-Y91 VanDerWaalsContact OG-CE1 3.25Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.45Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.19Å; F60-Y91 HydrophobicContact CB-CD1 4.15Å; F60-Y91 HydrophobicContact CB-CD2 3.58Å; F60-Y91 HydrophobicContact CB-CE2 4.01Å; F60-Y91 HydrophobicContact CB-CG 3.67Å; F60-Y91 HydrophobicContact CD1-CG 4.33Å; F60-Y91 AromaticContact CD2-CD2 3.66Å; F60-Y91 HydrophobicContact CD2-CD2 3.66Å; F60-Y91 AromaticContact CD2-CG 3.89Å; F60-Y91 HydrophobicContact CD2-CG 3.89Å; F60-Y91 AromaticContact CG-CD2 3.8Å; F60-Y91 HydrophobicContact CG-CD2 3.8Å; F60-Y91 AromaticContact CG-CG 3.71Å; F60-Y91 HydrophobicContact CG-CG 3.71Å; E87-Y91 HydrophobicContact CB-CE2 4.02Å; E87-Y91 WeakPolarHBondContact O-CD2 3.34Å; E87-Y91 PolarHBondContact O-N 3.43Å; T88-Y91 PolarHBondContact O-N 3.47Å; Y91-R93 PolarHBondContact O-N 3.42Å; Y91-Q94 PolarHBondContact O-N 2.98Å; Y91-A95 WeakPolarHBondContact O-CB 3.12Å; Y91-A95 PolarHBondContact O-N 2.87Å
92	K	98.3	Very high	97.9	Very high	83 Å²	83	63.8 Å²	63.8	36%	0.361	30%	0.304	S	S	.	.	H	α-helix	trans	-62.6	-40.6	176.6	-73.8	177.5	178.9	176.2	0	112.7	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.36Å; F60-K92 HydrophobicContact CZ-CG 4.1Å; P67-K92 VanDerWaalsContact O-CE 3.25Å; P67-K92 WeakPolarHBondContact O-CE 3.23Å; P67-K92 PolarHBondContact O-NZ 3.49Å; T88-K92 HydrophobicContact CG2-CD 4.19Å; T88-K92 WeakPolarHBondContact O-CG 3.44Å; T88-K92 PolarHBondContact O-N 3.27Å; K90-K92 VanDerWaalsContact C-N 3.34Å; K90-K92 PolarHBondContact O-N 2.91Å; K92-Q96 WeakPolarHBondContact O-CG 3.45Å; K92-Q96 PolarHBondContact O-N 2.96Å
93	R	98.1	Very high	97.9	Very high	153 Å²	153	62.5 Å²	62.5	58%	0.577	29%	0.292	S	S	*	.	H	α-helix	trans	-66.7	-41.4	174.8	-75.7	-175.4	-69.4	161.6	-3.2	111.9	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.33Å; Q89-R93 WeakPolarHBondContact O-CG 3.49Å; Q89-R93 PolarHBondContact O-N 3.29Å; Q89-R93 VanDerWaalsContact O-N 3.09Å; Q89-R93 PolarHBondContact O-NE 3.48Å; K90-R93 PolarHBondContact O-N 3.46Å; Y91-R93 PolarHBondContact O-N 3.42Å; R93-Q96 PolarHBondContact O-N 3.38Å; R93-A97 PolarHBondContact O-N 3.39Å
94	Q	98.2	Very high	97.9	Very high	50 Å²	50	65.3 Å²	65.3	23%	0.234	31%	0.308	C	S	.	.	H	α-helix	trans	-63.7	-44.8	176.5	-170	61.1	47.9	0	0	111.4	F46 K90 Y91 Q96 A97 D98	F46-Q94 HydrophobicContact CE2-CB 4.24Å; F46-Q94 HydrophobicContact CE2-CG 3.75Å; F46-Q94 HydrophobicContact CZ-CB 3.9Å; F46-Q94 HydrophobicContact CZ-CG 3.73Å; K90-Q94 PolarHBondContact O-N 2.97Å; Y91-Q94 PolarHBondContact O-N 2.98Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 2.75Å; Q94-A97 WeakPolarHBondContact O-CB 3.43Å; Q94-A97 PolarHBondContact O-N 2.88Å; Q94-A97 VanDerWaalsContact O-N 3.07Å; Q94-D98 PolarHBondContact NE2-OD1 3.47Å; Q94-D98 WeakPolarHBondContact O-CB 3.49Å; Q94-D98 PolarHBondContact O-N 3.26Å
95	A	98.3	Very high	97.9	Very high	23 Å²	23	63.7 Å²	63.7	19%	0.19	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-40.2	175.8	0	0	0	0	0	112.6	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.65Å; F46-A95 HydrophobicContact CD1-CB 3.73Å; F46-A95 HydrophobicContact CD2-CB 4.07Å; F46-A95 HydrophobicContact CE1-CB 4.4Å; F46-A95 HydrophobicContact CG-CB 3.54Å; Y91-A95 WeakPolarHBondContact O-CB 3.12Å; Y91-A95 PolarHBondContact O-N 2.87Å; A95-R99 WeakPolarHBondContact O-CB 3.29Å; A95-R99 PolarHBondContact O-N 2.93Å
96	Q	98	Very high	97.9	Very high	134 Å²	134	61.3 Å²	61.3	63%	0.626	29%	0.285	S	S	*	.	H	α-helix	trans	-67.1	-42.8	174.6	-72.7	179.2	-10.1	0	0	112.3	K92 R93 Q94 R99 V100	K92-Q96 WeakPolarHBondContact O-CG 3.45Å; K92-Q96 PolarHBondContact O-N 2.96Å; R93-Q96 PolarHBondContact O-N 3.38Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 2.75Å; Q96-R99 PolarHBondContact O-N 3.46Å; Q96-V100 WeakPolarHBondContact O-CG2 3.32Å; Q96-V100 PolarHBondContact O-N 3.49Å
97	A	97.5	Very high	97.9	Very high	45 Å²	45	58.5 Å²	58.5	37%	0.372	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-46.3	176.1	0	0	0	0	0	111.1	R93 Q94 R99 V100 S101	R93-A97 PolarHBondContact O-N 3.39Å; Q94-A97 WeakPolarHBondContact O-CB 3.43Å; Q94-A97 PolarHBondContact O-N 2.88Å; Q94-A97 VanDerWaalsContact O-N 3.07Å; A97-R99 VanDerWaalsContact C-N 3.34Å; A97-R99 PolarHBondContact O-N 3.38Å; A97-V100 WeakPolarHBondContact O-CB 3.47Å; A97-V100 PolarHBondContact O-N 3.28Å; A97-V100 VanDerWaalsContact O-N 3.09Å; A97-S101 PolarHBondContact O-N 2.92Å; A97-S101 PolarHBondContact O-OG 3.48Å; A97-S101 VanDerWaalsContact O-OG 3.11Å
98	D	98.1	Very high	97.9	Very high	7 Å²	7	60.8 Å²	60.8	4%	0.037	30%	0.297	C	S	.	.	H	α-helix	trans	-66.1	-35.9	-179.7	-74.1	-0.9	0	0	0	112.4	A35 F46 Q94 V100 S101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.67Å; F46-D98 HydrophobicContact CD2-CB 4.48Å; F46-D98 VanDerWaalsContact CE2-OD2 3.23Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.35Å; Q94-D98 PolarHBondContact NE2-OD1 3.47Å; Q94-D98 WeakPolarHBondContact O-CB 3.49Å; Q94-D98 PolarHBondContact O-N 3.26Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 3.02Å; D98-S101 PolarHBondContact O-N 3.31Å; D98-L102 WeakPolarHBondContact O-CB 3.4Å; D98-L102 WeakPolarHBondContact O-CG 3.39Å; D98-L102 PolarHBondContact O-N 3.27Å; D98-L119 HydrophobicContact CB-CD2 4.15Å
99	R	97.9	Very high	97.9	Very high	97 Å²	97	63.4 Å²	63.4	37%	0.366	31%	0.306	S	S	.	.	H	α-helix	trans	-57.5	-45	170.6	174.8	-171.6	170.2	169.3	12.4	111.6	E43 P44 A95 Q96 A97 R103	E43-R99 IonicContact OE1-CZ 3.8Å; E43-R99 IonicContact OE1-NE 2.71Å; E43-R99 IonicContact OE1-NH1 3.22Å; E43-R99 PolarHBondContact OE1-NH1 3.38Å; E43-R99 IonicContact OE1-NH2 3.35Å; E43-R99 PolarHBondContact OE1-NH2 3.35Å; E43-R99 VanDerWaalsContact OE2-CD 3.31Å; E43-R99 WeakPolarHBondContact OE2-CD 3.3Å; E43-R99 IonicContact OE2-CZ 3.85Å; E43-R99 IonicContact OE2-NE 2.77Å; E43-R99 PolarHBondContact OE2-NE 3.01Å; E43-R99 IonicContact OE2-NH1 3.38Å; E43-R99 PolarHBondContact OE2-NH1 2.99Å; E43-R99 IonicContact OE2-NH2 3.58Å; E43-R99 PolarHBondContact OE2-NH2 2.96Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.16Å; A95-R99 WeakPolarHBondContact O-CB 3.29Å; A95-R99 PolarHBondContact O-N 2.93Å; Q96-R99 PolarHBondContact O-N 3.46Å; A97-R99 VanDerWaalsContact C-N 3.34Å; A97-R99 PolarHBondContact O-N 3.38Å; R99-R103 PolarHBondContact O-N 2.96Å
100	V	97.7	Very high	97.8	Very high	73 Å²	73	65.7 Å²	65.7	44%	0.442	32%	0.321	S	S	.	.	H	α-helix	trans	-68.5	-41.8	177.6	174.7	0	0	0	0	110.3	Q96 A97 D98 R103 N104	Q96-V100 WeakPolarHBondContact O-CG2 3.32Å; Q96-V100 PolarHBondContact O-N 3.49Å; A97-V100 WeakPolarHBondContact O-CB 3.47Å; A97-V100 PolarHBondContact O-N 3.28Å; A97-V100 VanDerWaalsContact O-N 3.09Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 3.02Å; V100-R103 PolarHBondContact O-N 2.93Å; V100-N104 PolarHBondContact O-N 2.9Å; V100-N104 PolarHBondContact O-ND2 3.49Å
101	S	98.1	Very high	97.8	Very high	44 Å²	44	65.4 Å²	65.4	31%	0.308	32%	0.321	S	S	.	.	H	α-helix	trans	-59.5	-46.1	176.6	-64.6	0	0	0	0	112	A97 D98 R103 N104 L105	A97-S101 PolarHBondContact O-N 2.92Å; A97-S101 PolarHBondContact O-OG 3.48Å; A97-S101 VanDerWaalsContact O-OG 3.11Å; D98-S101 PolarHBondContact O-N 3.31Å; S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 2.9Å; S101-N104 PolarHBondContact O-N 3.47Å; S101-N104 VanDerWaalsContact O-N 3.1Å; S101-L105 WeakPolarHBondContact O-CB 3.31Å; S101-L105 WeakPolarHBondContact O-CG 3.29Å; S101-L105 PolarHBondContact O-N 2.84Å
102	L	98.3	Very high	97.6	Very high	8 Å²	8	68.5 Å²	68.5	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-56.4	-41.1	175.6	-77.9	168.1	0	0	0	112.1	A35 P44 D98 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.88Å; 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 3.39Å; D98-L102 PolarHBondContact O-N 3.27Å; L102-R106 WeakPolarHBondContact O-CB 3.37Å; L102-R106 PolarHBondContact O-N 3.36Å; L102-R106 VanDerWaalsContact O-N 3.09Å; L102-H117 HydrophobicContact CD2-CB 4.25Å; L102-L119 HydrophobicContact CD2-CB 3.68Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L102-Y142 HydrophobicContact CD2-CE2 4.01Å
103	R	96.7	Very high	97.3	Very high	138 Å²	138	70.6 Å²	70.6	52%	0.521	36%	0.355	S	S	.	.	H	α-helix	trans	-66.1	-43.1	175.8	-173.2	-174.3	-63.7	159.1	-0.6	112	R99 V100 S101 G107	R99-R103 PolarHBondContact O-N 2.96Å; V100-R103 PolarHBondContact O-N 2.93Å; S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 2.9Å; R103-G107 PolarHBondContact O-N 3.39Å
104	N	97.6	Very high	97	Very high	67 Å²	67	70.2 Å²	70.2	36%	0.358	37%	0.365	S	S	.	.	H	α-helix	trans	-65.4	-46.2	179.2	-69.1	-22.2	0	0	0	111.4	V100 S101 G107 Y108	V100-N104 PolarHBondContact O-N 2.9Å; V100-N104 PolarHBondContact O-ND2 3.49Å; S101-N104 PolarHBondContact O-N 3.47Å; S101-N104 VanDerWaalsContact O-N 3.1Å; N104-G107 CarbonylContact O-C 3.57Å; N104-G107 WeakPolarHBondContact O-CA 3.4Å; N104-G107 PolarHBondContact O-N 3.4Å; N104-G107 VanDerWaalsContact O-N 3.11Å; N104-Y108 HydrophobicContact CB-CE2 4.44Å; N104-Y108 WeakPolarHBondContact O-CD1 3.29Å; N104-Y108 VanDerWaalsContact O-CG 3.3Å; N104-Y108 PolarHBondContact O-N 2.92Å
105	L	98.2	Very high	96.7	Very high	6 Å²	6	68.8 Å²	68.8	3%	0.031	36%	0.363	C	S	.	.	H	α-helix	trans	-59.6	-48.6	179.4	-71.1	165	0	0	0	110.9	S101 G107 Y108 Y109 L119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.31Å; S101-L105 WeakPolarHBondContact O-CG 3.29Å; S101-L105 PolarHBondContact O-N 2.84Å; L105-G107 PolarHBondContact O-N 2.94Å; L105-Y108 PolarHBondContact O-N 3.29Å; L105-Y109 HydrophobicContact CD2-CE2 4.2Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.43Å; L105-Y109 PolarHBondContact O-N 3.49Å; L105-L119 HydrophobicContact CD1-CD1 3.89Å; L105-L119 HydrophobicContact CD1-CD2 4.25Å; L105-Y142 HydrophobicContact CB-CD1 4.33Å; L105-Y142 HydrophobicContact CB-CD2 4.21Å; L105-Y142 HydrophobicContact CB-CE1 3.95Å; L105-Y142 HydrophobicContact CB-CE2 3.84Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.91Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CD2-CG 4.49Å; L105-Y142 HydrophobicContact CG-CD2 4.4Å; L105-Y142 HydrophobicContact CG-CE2 4.47Å; L105-Y147 HydrophobicContact CD2-CD1 4.35Å; L105-Y147 HydrophobicContact CD2-CD2 3.99Å; L105-Y147 HydrophobicContact CD2-CE1 3.77Å; L105-Y147 HydrophobicContact CD2-CE2 3.34Å; L105-Y147 HydrophobicContact CD2-CG 4.45Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.45Å
106	R	97.2	Very high	96.7	Very high	58 Å²	58	71.3 Å²	71.3	22%	0.219	38%	0.379	C	S	.	.	H	α-helix	trans	-52.3	-42.6	174	-172.5	-172.9	66.6	174.8	9.9	112.1	L102 N110 Q111 S112 E113	L102-R106 WeakPolarHBondContact O-CB 3.37Å; L102-R106 PolarHBondContact O-N 3.36Å; L102-R106 VanDerWaalsContact O-N 3.09Å; R106-N110 PolarHBondContact O-N 3.47Å; R106-N110 VanDerWaalsContact O-N 3.15Å; R106-Q111 HydrophobicContact CG-CB 3.83Å; R106-Q111 PolarHBondContact O-N 2.72Å; R106-S112 WeakPolarHBondContact CD-O 3.41Å; R106-E113 IonicContact CZ-OE1 3.62Å; R106-E113 IonicContact NH1-OE1 3.64Å; R106-E113 IonicContact NH2-OE1 3.59Å; R106-E113 PolarHBondContact NH2-OE1 3.24Å
107	G	97.3	Very high	96.7	Very high	43 Å²	43	65.6 Å²	65.6	44%	0.443	35%	0.353	S	S	.	.	H	α-helix	trans	-66.4	-45.6	175.4	0	0	0	0	0	113.4	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 3.39Å; N104-G107 CarbonylContact O-C 3.57Å; N104-G107 WeakPolarHBondContact O-CA 3.4Å; N104-G107 PolarHBondContact O-N 3.4Å; N104-G107 VanDerWaalsContact O-N 3.11Å; L105-G107 PolarHBondContact O-N 2.94Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.34Å; G107-N110 PolarHBondContact O-N 2.96Å; G107-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-OD1 3.34Å
108	Y	98	Very high	96.8	Very high	56 Å²	56	65.3 Å²	65.3	22%	0.22	35%	0.346	C	S	.	.	H	α-helix	trans	-61.8	-34.8	179.2	-62.4	-16.1	0	0	0	112.8	N104 L105 I166 K170	N104-Y108 HydrophobicContact CB-CE2 4.44Å; N104-Y108 WeakPolarHBondContact O-CD1 3.29Å; N104-Y108 VanDerWaalsContact O-CG 3.3Å; N104-Y108 PolarHBondContact O-N 2.92Å; L105-Y108 PolarHBondContact O-N 3.29Å; Y108-I166 HydrophobicContact CD1-CD1 4.14Å; Y108-I166 HydrophobicContact CE1-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.07Å; Y108-I166 HydrophobicContact CE2-CB 4.26Å; Y108-I166 HydrophobicContact CE2-CG2 4.12Å; Y108-I166 HydrophobicContact CG-CD1 4.19Å; Y108-K170 PolarHBondContact OH-NZ 2.86Å
109	Y	97.9	Very high	96.8	Very high	67 Å²	67	65.4 Å²	65.4	26%	0.263	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	3.6	178.2	-69.2	-71.6	0	0	0	114	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.2Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.43Å; L105-Y109 PolarHBondContact O-N 3.49Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.34Å; Y109-Q111 PolarHBondContact O-N 2.88Å; Y109-Y142 AromaticContact CD2-CD1 3.75Å; Y109-Y142 HydrophobicContact CD2-CD1 3.75Å; Y109-Y142 AromaticContact CD2-CE1 3.53Å; Y109-Y142 HydrophobicContact CD2-CE1 3.53Å; Y109-Y142 AromaticContact CE2-CD1 3.52Å; Y109-Y142 HydrophobicContact CE2-CD1 3.52Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.45Å; Y109-Y147 HydrophobicContact CE2-CD2 4.38Å; Y109-Y147 HydrophobicContact CE2-CE2 4.07Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.34Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.37Å; Y109-D161 VanDerWaalsContact CE1-OD2 3.25Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.41Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.81Å; Y109-D161 PolarHBondContact OH-OD2 3.07Å; Y109-A163 HydrophobicContact CD1-CB 4.15Å; Y109-A163 HydrophobicContact CD2-CB 4.4Å; Y109-A163 HydrophobicContact CE1-CB 3.6Å; Y109-A163 HydrophobicContact CE2-CB 3.88Å; Y109-A163 VanDerWaalsContact CZ-CB 3.45Å
110	N	96.9	Very high	96.9	Very high	150 Å²	150	64.5 Å²	64.5	80%	0.802	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	40.5	-177.6	-56.5	-57.7	0	0	0	113.4	R106 G107	R106-N110 PolarHBondContact O-N 3.47Å; R106-N110 VanDerWaalsContact O-N 3.15Å; G107-N110 PolarHBondContact O-N 2.96Å; G107-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-OD1 3.34Å
111	Q	97.2	Very high	96.9	Very high	62 Å²	62	63.2 Å²	63.2	29%	0.29	33%	0.334	S	S	.	.			trans	-86.6	155.3	-177.7	-69.9	165	-37.2	0	0	111.8	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.83Å; R106-Q111 PolarHBondContact O-N 2.72Å; Y109-Q111 PolarHBondContact O-N 2.88Å; Q111-H117 PolarHBondContact NE2-CE1 3.34Å; Q111-H117 PolarHBondContact OE1-CE1 3.49Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.29Å; Q111-Y142 PolarHBondContact OE1-OH 2.94Å; Q111-D143 PolarHBondContact NE2-OD2 3.09Å
112	S	94.8	Very high	96.9	Very high	75 Å²	75	62.1 Å²	62.1	52%	0.524	32%	0.324	S	S	.	.			trans	-70	156.5	-179.5	66.1	0	0	0	0	112.5	R106 D114	R106-S112 WeakPolarHBondContact CD-O 3.41Å; S112-D114 VanDerWaalsContact C-N 3.3Å; S112-D114 PolarHBondContact O-N 3.11Å
113	E	91.4	Very high	96.9	Very high	127 Å²	127	62 Å²	62	59%	0.593	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-23.3	178.7	-59.4	-150.5	125.9	0	0	113.7	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.29Å; P39-E113 WeakPolarHBondContact CG-O 3.49Å; R106-E113 IonicContact CZ-OE1 3.62Å; R106-E113 IonicContact NH1-OE1 3.64Å; R106-E113 IonicContact NH2-OE1 3.59Å; R106-E113 PolarHBondContact NH2-OE1 3.24Å; E113-G115 VanDerWaalsContact C-N 3.29Å
114	D	91.4	Very high	97	Very high	145 Å²	145	55.5 Å²	55.5	78%	0.775	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.3	-178.4	-57	-42.1	0	0	0	112.9	S112	S112-D114 VanDerWaalsContact C-N 3.3Å; S112-D114 PolarHBondContact O-N 3.11Å
115	G	93.3	Very high	97	Very high	19 Å²	19	52.3 Å²	52.3	20%	0.196	28%	0.282	C	S	.	.			trans	-73.1	130.8	177.6	0	0	0	0	0	113.1	P39 E113 H117	P39-G115 VanDerWaalsContact CG-O 3.25Å; P39-G115 WeakPolarHBondContact CG-O 3.39Å; E113-G115 VanDerWaalsContact C-N 3.29Å; G115-H117 PolarHBondContact O-CD2 3.43Å
116	S	97.3	Very high	97	Very high	77 Å²	77	53 Å²	53	54%	0.538	29%	0.286	S	S	.	.			trans	-78.8	133.7	164	-175.7	0	0	0	0	109.1	S37	S37-S116 PolarHBondContact O-OG 2.84Å
117	H	98.4	Very high	96.9	Very high	14 Å²	14	50.4 Å²	50.4	7%	0.065	28%	0.277	C	S	.	.			trans	-133.2	151.7	-177.8	-64.3	-73.3	0	0	0	110.5	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 WeakPolarHBondContact CA-O 3.47Å; S37-H117 PolarHBondContact N-O 2.87Å; S37-H117 PolarHBondContact OG-N 3.35Å; S37-H117 PolarHBondContact OG-O 2.84Å; L102-H117 HydrophobicContact CD2-CB 4.25Å; Q111-H117 PolarHBondContact NE2-CE1 3.34Å; Q111-H117 PolarHBondContact OE1-CE1 3.49Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.29Å; G115-H117 PolarHBondContact O-CD2 3.43Å; H117-Y142 HydrophobicContact CB-CE2 3.77Å; H117-Y142 WeakPolarHBondContact CB-OH 3.33Å; H117-Y142 AromaticContact CG-CZ 3.96Å; H117-Y142 AromaticContact ND1-CZ 3.89Å; H117-Y142 PolarHBondContact ND1-OH 3Å; H117-D143 WeakPolarHBondContact CA-OD1 3.4Å; H117-D143 WeakPolarHBondContact CB-OD1 3.41Å; H117-D143 IonicContact CE1-OD2 3.92Å; H117-D143 IonicContact CG-OD1 3.05Å; H117-D143 IonicContact CG-OD2 3.4Å; H117-D143 IonicContact ND1-OD1 3.42Å; H117-D143 IonicContact ND1-OD2 3.59Å; H117-D143 PolarHBondContact ND1-OD2 2.92Å
118	T	98.8	Very high	96.7	Very high	39 Å²	39	48.7 Å²	48.7	24%	0.239	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.4	-175.6	-60.2	0	0	0	0	109.8	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.14Å; A35-T118 WeakPolarHBondContact O-CA 3.44Å; V36-T118 HydrophobicContact CG2-CG2 4.26Å; T118-Q120 HydrophobicContact CG2-CG 3.89Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.33Å; T118-Y142 VanDerWaalsContact O-CD2 3.31Å; T118-Y142 WeakPolarHBondContact O-CD2 3.4Å; T118-D143 PolarHBondContact N-OD1 2.94Å; T118-D143 PolarHBondContact O-N 2.94Å
119	L	98.8	Very high	96.3	Very high	8 Å²	8	50.3 Å²	50.3	4%	0.042	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.5	169.8	175.7	62.2	0	0	0	108.2	T34 A35 D98 L102 L105 A141	T34-L119 WeakPolarHBondContact CA-O 3.44Å; A35-L119 HydrophobicContact CB-CB 4.46Å; A35-L119 PolarHBondContact N-O 2.65Å; A35-L119 PolarHBondContact O-N 3.46Å; D98-L119 HydrophobicContact CB-CD2 4.15Å; L102-L119 HydrophobicContact CD2-CB 3.68Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L105-L119 HydrophobicContact CD1-CD1 3.89Å; L105-L119 HydrophobicContact CD1-CD2 4.25Å; L119-A141 WeakPolarHBondContact CD1-O 3.35Å
120	Q	98.8	Very high	95.8	Very high	78 Å²	78	52 Å²	52	36%	0.364	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	143.2	177.1	-63.8	173.2	-82	0	0	109.3	D33 T34 T118 S140 A141	D33-Q120 CarbonylContact O-C 3.57Å; D33-Q120 VanDerWaalsContact O-CA 3.27Å; D33-Q120 WeakPolarHBondContact O-CA 3.4Å; T34-Q120 HydrophobicContact CG2-CG 4.1Å; T118-Q120 HydrophobicContact CG2-CG 3.89Å; Q120-S140 CarbonylContact O-C 3.58Å; Q120-S140 WeakPolarHBondContact O-CA 3.5Å; Q120-A141 HydrophobicContact CB-CB 4.44Å; Q120-A141 PolarHBondContact N-O 2.89Å; Q120-A141 PolarHBondContact O-N 3.15Å
121	R	98.5	Very high	95.4	Very high	47 Å²	47	45.8 Å²	45.8	18%	0.177	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.3	172.9	177.3	172.5	172.1	-105.1	4.9	109.9	F32 D33 D138 Q139	F32-R121 WeakPolarHBondContact CA-O 3.21Å; D33-R121 HydrophobicContact CB-CB 4.27Å; D33-R121 PolarHBondContact N-O 2.82Å; D33-R121 PolarHBondContact O-N 3.12Å; D33-R121 IonicContact OD2-NH1 3.99Å; R121-D138 IonicContact CZ-OD1 3.38Å; R121-D138 IonicContact NE-OD1 2.71Å; R121-D138 PolarHBondContact NE-OD1 3.49Å; R121-D138 IonicContact NE-OD2 2.75Å; R121-D138 IonicContact NH2-OD1 3.67Å; R121-D138 PolarHBondContact NH2-OD1 2.82Å; R121-Q139 CarbonylContact C-O 3.53Å; R121-Q139 VanDerWaalsContact CA-O 3.3Å; R121-Q139 WeakPolarHBondContact CA-O 3.47Å
122	M	98.6	Very high	95.2	Very high	20 Å²	20	51 Å²	51	10%	0.099	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128	168.6	-173.6	-79.2	-73.7	0	0	108.1	Y31 F32 Y137 D138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.46Å; F32-M122 HydrophobicContact CD1-CB 4.04Å; F32-M122 HydrophobicContact CD1-CG 3.69Å; F32-M122 HydrophobicContact CE1-CB 4.15Å; F32-M122 HydrophobicContact CE1-CG 3.4Å; F32-M122 HydrophobicContact CZ-CG 4.04Å; M122-Y137 HydrophobicContact CE-CD1 3.88Å; M122-Y137 HydrophobicContact CE-CG 3.9Å; M122-Y137 HydrophobicContact SD-CG 4.38Å; M122-D138 WeakPolarHBondContact O-CA 3.49Å; M122-Q139 HydrophobicContact CB-CG 4.04Å; M122-Q139 HydrophobicContact CE-CG 3.93Å; M122-Q139 PolarHBondContact N-O 2.6Å; M122-Q139 PolarHBondContact O-N 3.01Å
123	S	97.9	Very high	95.3	Very high	7 Å²	7	49.9 Å²	49.9	5%	0.049	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	150.5	174.9	64.3	0	0	0	0	110.9	R30 Y31 Y137	R30-S123 WeakPolarHBondContact CA-O 3.47Å; Y31-S123 PolarHBondContact N-O 3.1Å; Y31-S123 PolarHBondContact O-N 3.08Å; S123-Y137 VanDerWaalsContact CA-O 3.24Å; S123-Y137 WeakPolarHBondContact CA-O 3.37Å
124	G	98.1	Very high	95.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.7	-176.4	-177.7	0	0	0	0	0	114.6	M29 G136 Y137 L184	M29-G124 CarbonylContact O-C 3.6Å; M29-G124 WeakPolarHBondContact O-CA 3.39Å; G124-G136 CarbonylContact O-C 3.58Å; G124-Y137 PolarHBondContact N-O 3.39Å; G124-Y137 PolarHBondContact O-N 3.3Å; G124-L184 WeakPolarHBondContact O-CD2 3.28Å
125	C	98.3	Very high	95.7	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	149.3	-177.8	53.5	0	0	0	0	111.2	S28 M29 L133 R135 C188	S28-C125 CarbonylContact C-O 3.56Å; S28-C125 WeakPolarHBondContact CA-O 3.41Å; M29-C125 PolarHBondContact N-O 2.63Å; M29-C125 PolarHBondContact O-N 2.8Å; C125-L133 HydrophobicContact CB-CD1 3.56Å; C125-R135 CarbonylContact C-O 3.58Å; C125-R135 WeakPolarHBondContact CA-O 3.13Å; C125-C188 HydrophobicContact CB-CB 3.92Å; C125-C188 WeakPolarHBondContact CB-SG 3.34Å; C125-C188 PolarHBondContact N-SG 3.43Å; C125-C188 WeakPolarHBondContact SG-CB 3.42Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.48Å
126	D	97.6	Very high	95.9	Very high	20 Å²	20	46.8 Å²	46.8	11%	0.107	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136.9	171.7	-59.7	-11	0	0	0	108.7	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.54Å; H27-D126 WeakPolarHBondContact O-CA 3.34Å; S28-D126 WeakPolarHBondContact CB-OD1 3.06Å; R30-D126 IonicContact CZ-OD1 2.74Å; R30-D126 IonicContact NE-OD1 3.54Å; R30-D126 PolarHBondContact NE-OD1 2.77Å; R30-D126 VanDerWaalsContact NE-OD1 3.14Å; R30-D126 VanDerWaalsContact NH2-CG 3.25Å; R30-D126 IonicContact NH2-OD1 2.85Å; R30-D126 PolarHBondContact NH2-OD1 2.71Å; R30-D126 IonicContact NH2-OD2 3.15Å; R30-D126 PolarHBondContact NH2-OD2 3.42Å; D126-L134 HydrophobicContact CB-CB 4.38Å; D126-L134 PolarHBondContact O-N 3.17Å; D126-R135 HydrophobicContact CB-CB 4.41Å; D126-R135 PolarHBondContact N-O 3.03Å; D126-R135 PolarHBondContact O-N 3.21Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.36Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.28Å; D126-Y137 PolarHBondContact OD2-OH 3.18Å
127	L	96.3	Very high	95.9	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.4	172.8	-56.2	-176.8	0	0	0	109.9	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.38Å; S26-L127 WeakPolarHBondContact CB-O 3.44Å; H27-L127 PolarHBondContact N-O 2.87Å; H27-L127 VanDerWaalsContact N-O 3.14Å; H27-L127 PolarHBondContact O-N 2.8Å; L127-R132 CarbonylContact C-O 3.53Å; L127-R132 VanDerWaalsContact CA-O 3.24Å; L127-R132 WeakPolarHBondContact CA-O 3.42Å; L127-V189 HydrophobicContact CD1-CG1 4.48Å; L127-V189 HydrophobicContact CD2-CB 4.14Å; L127-V189 HydrophobicContact CD2-CG1 3.74Å; L127-V189 HydrophobicContact CD2-CG2 3.81Å; L127-L192 HydrophobicContact CB-CD2 4.5Å; L127-L192 HydrophobicContact CD1-CB 4.24Å; L127-L192 HydrophobicContact CD1-CD2 3.7Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CG-CD2 3.58Å; L127-L192 HydrophobicContact CG-CG 4.21Å; L127-R193 HydrophobicContact CD1-CG 3.92Å
128	G	92.9	Very high	95.9	Very high	8 Å²	8	44.6 Å²	44.6	8%	0.082	22%	0.224	C	C	.	.			trans	-70.2	175	165.7	0	0	0	0	0	111.9	D130 G131 R132	G128-D130 PolarHBondContact O-N 2.99Å; G128-G131 WeakPolarHBondContact O-CA 3.31Å; G128-G131 PolarHBondContact O-N 2.83Å; G128-R132 PolarHBondContact N-O 2.94Å
129	P	88.3	Confident	95.9	Very high	89 Å²	89	47.1 Å²	47.1	58%	0.578	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.5	178.5	-19.1	28.2	0	0	0	113.8	A24 C25 G131	A24-P129 HydrophobicContact CB-CB 4.31Å; A24-P129 HydrophobicContact CB-CG 3.29Å; C25-P129 WeakPolarHBondContact O-CA 3.25Å; P129-G131 PolarHBondContact O-N 3.2Å
130	D	88.3	Confident	95.9	Very high	103 Å²	103	47.8 Å²	47.8	55%	0.551	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	3.2	174.5	70.4	-14.2	0	0	0	112.9	G128 R132	G128-D130 PolarHBondContact O-N 2.99Å; D130-R132 PolarHBondContact O-N 3.47Å; D130-R132 WeakPolarHBondContact OD1-CB 3.38Å; D130-R132 PolarHBondContact OD1-N 2.97Å; D130-R132 WeakPolarHBondContact OD2-CD 3.26Å; D130-R132 WeakPolarHBondContact OD2-CG 3.37Å; D130-R132 IonicContact OD2-NE 3.11Å
131	G	88.7	Confident	95.9	Very high	20 Å²	20	45.1 Å²	45.1	21%	0.206	23%	0.229	C	C	.	.	S	Bend	trans	72	8.8	-178.5	0	0	0	0	0	114	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.31Å; G128-G131 PolarHBondContact O-N 2.83Å; P129-G131 PolarHBondContact O-N 3.2Å; G131-R193 VanDerWaalsContact O-CZ 3.29Å; G131-R193 PolarHBondContact O-NE 3.48Å; G131-R193 VanDerWaalsContact O-NE 3.07Å; G131-R193 PolarHBondContact O-NH2 3.25Å
132	R	93.4	Very high	95.9	Very high	170 Å²	170	43.3 Å²	43.3	64%	0.642	22%	0.222	S	C	*	.	S	Bend	trans	-88.2	155.6	178.7	-61.6	-173.6	-175.4	170.9	-1.7	111.2	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.53Å; L127-R132 VanDerWaalsContact CA-O 3.24Å; L127-R132 WeakPolarHBondContact CA-O 3.42Å; G128-R132 PolarHBondContact N-O 2.94Å; D130-R132 PolarHBondContact O-N 3.47Å; D130-R132 WeakPolarHBondContact OD1-CB 3.38Å; D130-R132 PolarHBondContact OD1-N 2.97Å; D130-R132 WeakPolarHBondContact OD2-CD 3.26Å; D130-R132 WeakPolarHBondContact OD2-CG 3.37Å; D130-R132 IonicContact OD2-NE 3.11Å; R132-L134 PolarHBondContact O-N 3.18Å; R132-L134 VanDerWaalsContact O-N 3.09Å
133	L	96.2	Very high	95.9	Very high	52 Å²	52	45.4 Å²	45.4	27%	0.272	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	117.3	174.8	-176.7	72.9	0	0	0	109.6	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.56Å; L133-R135 WeakPolarHBondContact CD1-O 3.32Å; L133-L154 HydrophobicContact CD2-CD1 4.13Å; L133-E185 HydrophobicContact CD2-CB 4.36Å; L133-E185 HydrophobicContact CD2-CG 3.63Å; L133-V189 HydrophobicContact CB-CG2 4.01Å; L133-V189 HydrophobicContact CD1-CG2 4.04Å
134	L	95.8	Very high	95.9	Very high	123 Å²	123	47.9 Å²	47.9	64%	0.644	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	-45.9	170.6	-179.1	63.6	0	0	0	110.1	D126 R132	D126-L134 HydrophobicContact CB-CB 4.38Å; D126-L134 PolarHBondContact O-N 3.17Å; R132-L134 PolarHBondContact O-N 3.18Å; R132-L134 VanDerWaalsContact O-N 3.09Å
135	R	96.1	Very high	95.9	Very high	97 Å²	97	55.5 Å²	55.5	37%	0.366	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	143.5	-177.4	-171.9	161.7	169.6	148.9	12.1	112.2	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.58Å; C125-R135 WeakPolarHBondContact CA-O 3.13Å; D126-R135 HydrophobicContact CB-CB 4.41Å; D126-R135 PolarHBondContact N-O 3.03Å; D126-R135 PolarHBondContact O-N 3.21Å; L133-R135 WeakPolarHBondContact CD1-O 3.32Å; R135-Y137 HydrophobicContact CB-CE2 4.02Å; R135-Y137 VanDerWaalsContact CD-CZ 3.45Å; R135-Y137 WeakPolarHBondContact CD-OH 3.24Å; R135-Y137 HydrophobicContact CG-CD2 4.42Å; R135-Y137 HydrophobicContact CG-CE1 4.02Å; R135-Y137 HydrophobicContact CG-CE2 3.73Å; R135-E152 IonicContact CZ-OE1 3.09Å; R135-E152 IonicContact NH1-OE1 2.86Å; R135-E152 PolarHBondContact NH1-OE1 3.41Å; R135-E152 VanDerWaalsContact NH2-CG 3.34Å; R135-E152 IonicContact NH2-OE1 2.61Å; R135-E152 PolarHBondContact NH2-OE1 2.8Å
136	G	97.7	Very high	95.9	Very high	6 Å²	6	59.3 Å²	59.3	6%	0.062	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	150.6	170.9	0	0	0	0	0	111.3	G124	G124-G136 CarbonylContact O-C 3.58Å
137	Y	97.7	Very high	96	Very high	36 Å²	36	58.8 Å²	58.8	14%	0.141	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	138.3	-178	-54.5	-96.1	0	0	0	110.9	R30 M122 S123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.28Å; R30-Y137 PolarHBondContact NH2-OH 2.92Å; M122-Y137 HydrophobicContact CE-CD1 3.88Å; M122-Y137 HydrophobicContact CE-CG 3.9Å; M122-Y137 HydrophobicContact SD-CG 4.38Å; S123-Y137 VanDerWaalsContact CA-O 3.24Å; S123-Y137 WeakPolarHBondContact CA-O 3.37Å; G124-Y137 PolarHBondContact N-O 3.39Å; G124-Y137 PolarHBondContact O-N 3.3Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.36Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.28Å; D126-Y137 PolarHBondContact OD2-OH 3.18Å; R135-Y137 HydrophobicContact CB-CE2 4.02Å; R135-Y137 VanDerWaalsContact CD-CZ 3.45Å; R135-Y137 WeakPolarHBondContact CD-OH 3.24Å; R135-Y137 HydrophobicContact CG-CD2 4.42Å; R135-Y137 HydrophobicContact CG-CE1 4.02Å; R135-Y137 HydrophobicContact CG-CE2 3.73Å
138	D	98.3	Very high	96.1	Very high	10 Å²	10	59.1 Å²	59.1	5%	0.053	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	106.3	161.5	-171.9	83.9	0	0	0	107.8	R121 M122 L150 L180	R121-D138 IonicContact CZ-OD1 3.38Å; R121-D138 IonicContact NE-OD1 2.71Å; R121-D138 PolarHBondContact NE-OD1 3.49Å; R121-D138 IonicContact NE-OD2 2.75Å; R121-D138 IonicContact NH2-OD1 3.67Å; R121-D138 PolarHBondContact NH2-OD1 2.82Å; M122-D138 WeakPolarHBondContact O-CA 3.49Å; D138-L150 HydrophobicContact CB-CB 3.92Å; D138-L150 HydrophobicContact CB-CD2 4.15Å; D138-L150 WeakPolarHBondContact O-CB 3.13Å; D138-L150 PolarHBondContact O-N 3.28Å; D138-L180 HydrophobicContact CB-CD1 4.26Å
139	Q	98.5	Very high	96.4	Very high	91 Å²	91	60 Å²	60	43%	0.425	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	142.4	-177.4	64.1	-173	50.7	0	0	110.9	R121 M122 I148 A149	R121-Q139 CarbonylContact C-O 3.53Å; R121-Q139 VanDerWaalsContact CA-O 3.3Å; R121-Q139 WeakPolarHBondContact CA-O 3.47Å; M122-Q139 HydrophobicContact CB-CG 4.04Å; M122-Q139 HydrophobicContact CE-CG 3.93Å; M122-Q139 PolarHBondContact N-O 2.6Å; M122-Q139 PolarHBondContact O-N 3.01Å; Q139-I148 WeakPolarHBondContact CA-O 3.32Å; Q139-A149 HydrophobicContact CB-CB 3.86Å
140	S	98.6	Very high	96.9	Very high	23 Å²	23	56.5 Å²	56.5	16%	0.161	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	146.4	179.9	-57.1	0	0	0	0	111.4	Q120 Y147 I148	Q120-S140 CarbonylContact O-C 3.58Å; Q120-S140 WeakPolarHBondContact O-CA 3.5Å; S140-Y147 WeakPolarHBondContact O-CB 3.39Å; S140-Y147 PolarHBondContact O-N 3.18Å; S140-I148 PolarHBondContact N-O 3.17Å; S140-I148 PolarHBondContact O-N 2.82Å
141	A	98.8	Very high	97.3	Very high	21 Å²	21	53.7 Å²	53.7	17%	0.174	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144.4	174.4	0	0	0	0	0	110.3	L119 Q120 K145	L119-A141 WeakPolarHBondContact CD1-O 3.35Å; Q120-A141 HydrophobicContact CB-CB 4.44Å; Q120-A141 PolarHBondContact N-O 2.89Å; Q120-A141 PolarHBondContact O-N 3.15Å; A141-K145 CarbonylContact C-O 3.51Å; A141-K145 WeakPolarHBondContact CA-O 3.28Å; A141-K145 VanDerWaalsContact CB-O 3.24Å; A141-K145 WeakPolarHBondContact CB-O 3.26Å
142	Y	98.8	Very high	97.7	Very high	10 Å²	10	59.2 Å²	59.2	4%	0.039	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.8	176.9	-174.7	-121.7	0	0	0	109.9	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.01Å; L105-Y142 HydrophobicContact CB-CD1 4.33Å; L105-Y142 HydrophobicContact CB-CD2 4.21Å; L105-Y142 HydrophobicContact CB-CE1 3.95Å; L105-Y142 HydrophobicContact CB-CE2 3.84Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.91Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CD2-CG 4.49Å; L105-Y142 HydrophobicContact CG-CD2 4.4Å; L105-Y142 HydrophobicContact CG-CE2 4.47Å; Y109-Y142 AromaticContact CD2-CD1 3.75Å; Y109-Y142 HydrophobicContact CD2-CD1 3.75Å; Y109-Y142 AromaticContact CD2-CE1 3.53Å; Y109-Y142 HydrophobicContact CD2-CE1 3.53Å; Y109-Y142 AromaticContact CE2-CD1 3.52Å; Y109-Y142 HydrophobicContact CE2-CD1 3.52Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.45Å; Q111-Y142 PolarHBondContact OE1-OH 2.94Å; H117-Y142 HydrophobicContact CB-CE2 3.77Å; H117-Y142 WeakPolarHBondContact CB-OH 3.33Å; H117-Y142 AromaticContact CG-CZ 3.96Å; H117-Y142 AromaticContact ND1-CZ 3.89Å; H117-Y142 PolarHBondContact ND1-OH 3Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.33Å; T118-Y142 VanDerWaalsContact O-CD2 3.31Å; T118-Y142 WeakPolarHBondContact O-CD2 3.4Å; Y142-G144 PolarHBondContact O-N 3.42Å; Y142-K145 PolarHBondContact N-O 3Å; Y142-K145 PolarHBondContact O-N 2.85Å
143	D	98.3	Very high	97.9	Very high	63 Å²	63	54.9 Å²	54.9	34%	0.337	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	41.8	-174.1	-65.1	-21.8	0	0	0	113	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 3.09Å; H117-D143 WeakPolarHBondContact CA-OD1 3.4Å; H117-D143 WeakPolarHBondContact CB-OD1 3.41Å; H117-D143 IonicContact CE1-OD2 3.92Å; H117-D143 IonicContact CG-OD1 3.05Å; H117-D143 IonicContact CG-OD2 3.4Å; H117-D143 IonicContact ND1-OD1 3.42Å; H117-D143 IonicContact ND1-OD2 3.59Å; H117-D143 PolarHBondContact ND1-OD2 2.92Å; T118-D143 PolarHBondContact N-OD1 2.94Å; T118-D143 PolarHBondContact O-N 2.94Å; D143-K145 VanDerWaalsContact C-N 3.27Å; D143-K145 PolarHBondContact O-N 3.34Å
144	G	97.4	Very high	98	Very high	59 Å²	59	52.8 Å²	52.8	61%	0.608	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	3	178.7	0	0	0	0	0	115.3	Y142	Y142-G144 PolarHBondContact O-N 3.42Å
145	K	98.4	Very high	98.1	Very high	161 Å²	161	54.8 Å²	54.8	70%	0.7	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	143.9	178.4	-62.9	178.6	-177	175.9	0	110.9	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.51Å; A141-K145 WeakPolarHBondContact CA-O 3.28Å; A141-K145 VanDerWaalsContact CB-O 3.24Å; A141-K145 WeakPolarHBondContact CB-O 3.26Å; Y142-K145 PolarHBondContact N-O 3Å; Y142-K145 PolarHBondContact O-N 2.85Å; D143-K145 VanDerWaalsContact C-N 3.27Å; D143-K145 PolarHBondContact O-N 3.34Å; K145-Y147 PolarHBondContact O-N 2.86Å
146	A	98.5	Very high	98.2	Very high	80 Å²	80	52.1 Å²	52.1	66%	0.661	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.9	134.3	173.7	0	0	0	0	0	110.4	A160	A146-A160 HydrophobicContact CB-CB 4.46Å; A146-A160 WeakPolarHBondContact O-CB 3.2Å
147	Y	98.8	Very high	98.2	Very high	9 Å²	9	52.5 Å²	52.5	4%	0.035	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	-62.1	-179.9	179.2	-108.4	0	0	0	110.6	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.35Å; L105-Y147 HydrophobicContact CD2-CD2 3.99Å; L105-Y147 HydrophobicContact CD2-CE1 3.77Å; L105-Y147 HydrophobicContact CD2-CE2 3.34Å; L105-Y147 HydrophobicContact CD2-CG 4.45Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.45Å; Y109-Y147 HydrophobicContact CE2-CD2 4.38Å; Y109-Y147 HydrophobicContact CE2-CE2 4.07Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.34Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.37Å; S140-Y147 WeakPolarHBondContact O-CB 3.39Å; S140-Y147 PolarHBondContact O-N 3.18Å; K145-Y147 PolarHBondContact O-N 2.86Å; Y147-A160 WeakPolarHBondContact O-CB 3.35Å; Y147-A160 PolarHBondContact O-N 3.36Å; Y147-A163 HydrophobicContact CE2-CB 4.49Å; Y147-A163 PolarHBondContact OH-O 3.23Å; Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.46Å; Y147-A164 HydrophobicContact CE2-CB 3.7Å; Y147-A164 HydrophobicContact CG-CB 4.31Å; Y147-A164 WeakPolarHBondContact O-CB 3.47Å; Y147-T167 HydrophobicContact CE1-CG2 4.17Å; Y147-T167 WeakPolarHBondContact OH-CB 3.48Å; Y147-T167 PolarHBondContact OH-OG1 3.27Å
148	I	98.7	Very high	98.3	Very high	10 Å²	10	54.5 Å²	54.5	5%	0.051	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	143.5	179.8	-161.3	169.2	0	0	0	110.5	Q139 S140 W157 T158 T167 Q168 L171	Q139-I148 WeakPolarHBondContact CA-O 3.32Å; S140-I148 PolarHBondContact N-O 3.17Å; S140-I148 PolarHBondContact O-N 2.82Å; I148-W157 HydrophobicContact CD1-CB 4.43Å; I148-W157 HydrophobicContact CD1-CE3 4.18Å; I148-W157 HydrophobicContact CG1-CB 4.46Å; I148-W157 HydrophobicContact CG1-CE3 4.03Å; I148-T158 WeakPolarHBondContact CA-O 3.43Å; I148-T167 HydrophobicContact CD1-CG2 3.98Å; I148-Q168 HydrophobicContact CD1-CB 4.01Å; I148-L171 HydrophobicContact CD1-CD1 3.74Å
149	A	98.7	Very high	98.3	Very high	28 Å²	28	55.1 Å²	55.1	23%	0.231	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	140	177.5	0	0	0	0	0	111.4	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.86Å; A149-W157 CarbonylContact O-C 3.56Å; A149-W157 WeakPolarHBondContact O-CA 3.31Å; A149-T158 PolarHBondContact N-O 3.13Å; A149-T158 PolarHBondContact O-N 3.42Å
150	L	98.7	Very high	98.3	Very high	15 Å²	15	53.7 Å²	53.7	8%	0.079	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	129.6	166.7	-175.6	68.9	0	0	0	108.6	D138 L154 W157 A177 L180 L184	D138-L150 HydrophobicContact CB-CB 3.92Å; D138-L150 HydrophobicContact CB-CD2 4.15Å; D138-L150 WeakPolarHBondContact O-CB 3.13Å; D138-L150 PolarHBondContact O-N 3.28Å; L150-L154 HydrophobicContact CD2-CB 4.49Å; L150-L154 HydrophobicContact CD2-CD2 3.78Å; L150-L154 HydrophobicContact CG-CD2 4.34Å; L150-W157 HydrophobicContact CB-CE3 4.11Å; L150-W157 HydrophobicContact CB-CH2 4.29Å; L150-W157 HydrophobicContact CB-CZ3 3.86Å; L150-W157 HydrophobicContact CD1-CD2 4.23Å; L150-W157 HydrophobicContact CD1-CE3 4.38Å; L150-W157 HydrophobicContact CD1-CH2 4.19Å; L150-W157 HydrophobicContact CD1-CZ2 3.99Å; L150-W157 HydrophobicContact CD1-CZ3 4.36Å; L150-A177 HydrophobicContact CD1-CB 4.02Å; L150-L180 HydrophobicContact CD2-CB 4.29Å; L150-L184 HydrophobicContact CD2-CD1 3.91Å
151	N	98.4	Very high	98.3	Very high	43 Å²	43	55.1 Å²	55.1	23%	0.23	32%	0.318	C	S	.	.			trans	-73.8	163.7	-179.7	-67.5	-27.5	0	0	0	111.3	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 3.14Å; N151-D153 VanDerWaalsContact O-N 3.08Å; N151-L154 WeakPolarHBondContact O-CA 3.34Å; N151-L154 PolarHBondContact O-N 2.75Å; N151-S156 WeakPolarHBondContact CB-O 3.15Å; N151-S156 WeakPolarHBondContact CB-OG 3.32Å; N151-S156 PolarHBondContact N-O 2.61Å; N151-S156 PolarHBondContact ND2-OG 3.29Å; N151-T158 PolarHBondContact ND2-OG1 2.9Å; N151-T158 WeakPolarHBondContact OD1-CB 3.24Å; N151-T158 PolarHBondContact OD1-OG1 2.81Å
152	E	97.1	Very high	98.2	Very high	136 Å²	136	59.4 Å²	59.4	64%	0.636	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.3	-179.7	-66.3	178.5	-168.7	0	0	113.4	R135 L154	R135-E152 IonicContact CZ-OE1 3.09Å; R135-E152 IonicContact NH1-OE1 2.86Å; R135-E152 PolarHBondContact NH1-OE1 3.41Å; R135-E152 VanDerWaalsContact NH2-CG 3.34Å; R135-E152 IonicContact NH2-OE1 2.61Å; R135-E152 PolarHBondContact NH2-OE1 2.8Å; E152-L154 PolarHBondContact O-N 3.11Å
153	D	97.2	Very high	98.2	Very high	80 Å²	80	59.1 Å²	59.1	43%	0.428	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.9	174.3	70.3	4.9	0	0	0	114	N151 R155 S156	N151-D153 PolarHBondContact O-N 3.14Å; N151-D153 VanDerWaalsContact O-N 3.08Å; D153-R155 WeakPolarHBondContact O-CG 3.45Å; D153-R155 PolarHBondContact O-N 2.88Å; D153-R155 VanDerWaalsContact O-N 3.17Å; D153-R155 PolarHBondContact OD1-N 2.87Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 2.8Å; D153-S156 PolarHBondContact OD1-OG 2.99Å; D153-S156 VanDerWaalsContact OD1-OG 3.12Å; D153-S156 WeakPolarHBondContact OD2-CB 3.32Å; D153-S156 PolarHBondContact OD2-OG 2.71Å
154	L	97.8	Very high	98.2	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.042	33%	0.326	C	S	.	.	S	Bend	trans	53.5	27.4	-175.5	-53.5	-178.8	0	0	0	113.8	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.13Å; L150-L154 HydrophobicContact CD2-CB 4.49Å; L150-L154 HydrophobicContact CD2-CD2 3.78Å; L150-L154 HydrophobicContact CG-CD2 4.34Å; N151-L154 WeakPolarHBondContact O-CA 3.34Å; N151-L154 PolarHBondContact O-N 2.75Å; E152-L154 PolarHBondContact O-N 3.11Å; L154-R181 HydrophobicContact CB-CB 4.11Å; L154-R181 HydrophobicContact CB-CG 3.87Å; L154-R181 HydrophobicContact CD1-CG 4.18Å; L154-L184 HydrophobicContact CD2-CD1 3.98Å; L154-E185 HydrophobicContact CD1-CG 4.21Å
155	R	97.4	Very high	98.3	Very high	165 Å²	165	57 Å²	57	62%	0.623	31%	0.314	S	S	*	.	S	Bend	trans	-134.5	-33.4	-173.5	-71.6	168.9	-175.8	-101.8	13.2	112.6	D153 A177 R181	D153-R155 WeakPolarHBondContact O-CG 3.45Å; D153-R155 PolarHBondContact O-N 2.88Å; D153-R155 VanDerWaalsContact O-N 3.17Å; D153-R155 PolarHBondContact OD1-N 2.87Å; R155-A177 WeakPolarHBondContact O-CB 3.34Å; R155-R181 VanDerWaalsContact CZ-NH1 3.29Å
156	S	97.9	Very high	98.2	Very high	41 Å²	41	52 Å²	52	29%	0.287	29%	0.294	S	S	.	.			trans	-114.4	164.4	-177.2	65	0	0	0	0	111.9	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.15Å; N151-S156 WeakPolarHBondContact CB-OG 3.32Å; N151-S156 PolarHBondContact N-O 2.61Å; N151-S156 PolarHBondContact ND2-OG 3.29Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 2.8Å; D153-S156 PolarHBondContact OD1-OG 2.99Å; D153-S156 VanDerWaalsContact OD1-OG 3.12Å; D153-S156 WeakPolarHBondContact OD2-CB 3.32Å; D153-S156 PolarHBondContact OD2-OG 2.71Å
157	W	98.6	Very high	98.2	Very high	13 Å²	13	49.7 Å²	49.7	5%	0.049	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145	-176.3	-60.7	90.1	0	0	0	110.7	I148 A149 L150 Q168 L171 A176 A177 L180	I148-W157 HydrophobicContact CD1-CB 4.43Å; I148-W157 HydrophobicContact CD1-CE3 4.18Å; I148-W157 HydrophobicContact CG1-CB 4.46Å; I148-W157 HydrophobicContact CG1-CE3 4.03Å; A149-W157 CarbonylContact O-C 3.56Å; A149-W157 WeakPolarHBondContact O-CA 3.31Å; L150-W157 HydrophobicContact CB-CE3 4.11Å; L150-W157 HydrophobicContact CB-CH2 4.29Å; L150-W157 HydrophobicContact CB-CZ3 3.86Å; L150-W157 HydrophobicContact CD1-CD2 4.23Å; L150-W157 HydrophobicContact CD1-CE3 4.38Å; L150-W157 HydrophobicContact CD1-CH2 4.19Å; L150-W157 HydrophobicContact CD1-CZ2 3.99Å; L150-W157 HydrophobicContact CD1-CZ3 4.36Å; W157-Q168 HydrophobicContact CB-CG 4.1Å; W157-Q168 PolarHBondContact O-NE2 3.14Å; W157-L171 HydrophobicContact CD2-CD1 3.94Å; W157-L171 HydrophobicContact CE3-CD1 3.99Å; W157-L171 HydrophobicContact CH2-CD1 3.8Å; W157-L171 HydrophobicContact CZ2-CB 4.21Å; W157-L171 HydrophobicContact CZ2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CG 4.43Å; W157-L171 HydrophobicContact CZ3-CD1 3.92Å; W157-A176 HydrophobicContact CZ2-CB 4.35Å; W157-A177 HydrophobicContact CZ2-CB 4.36Å; W157-L180 HydrophobicContact CH2-CD1 3.36Å; W157-L180 HydrophobicContact CZ2-CD1 3.77Å; W157-L180 HydrophobicContact CZ3-CD1 4.49Å
158	T	98.6	Very high	98.2	Very high	78 Å²	78	51.2 Å²	51.2	48%	0.479	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.4	165.9	-66.8	0	0	0	0	109	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.43Å; A149-T158 PolarHBondContact N-O 3.13Å; A149-T158 PolarHBondContact O-N 3.42Å; N151-T158 PolarHBondContact ND2-OG1 2.9Å; N151-T158 WeakPolarHBondContact OD1-CB 3.24Å; N151-T158 PolarHBondContact OD1-OG1 2.81Å
159	A	98.6	Very high	98.2	Very high	23 Å²	23	57.7 Å²	57.7	19%	0.19	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	132.9	174.7	0	0	0	0	0	110.4	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.73Å; A159-Q165 HydrophobicContact CB-CG 4.01Å; A159-Q168 HydrophobicContact CB-CB 4.4Å
160	A	98.4	Very high	98.2	Very high	61 Å²	61	61.9 Å²	61.9	50%	0.504	32%	0.316	S	S	.	.	S	Bend	trans	-75.8	-30.6	-176.4	0	0	0	0	0	113.5	A146 Y147	A146-A160 HydrophobicContact CB-CB 4.46Å; A146-A160 WeakPolarHBondContact O-CB 3.2Å; Y147-A160 WeakPolarHBondContact O-CB 3.35Å; Y147-A160 PolarHBondContact O-N 3.36Å
161	D	98.3	Very high	98.2	Very high	54 Å²	54	63.1 Å²	63.1	29%	0.289	32%	0.323	S	S	.	.	S	Bend	trans	-151.8	-175.2	-178.1	66.7	28.9	0	0	0	112.9	Y109 A163 A164 Q165	Y109-D161 VanDerWaalsContact CE1-OD2 3.25Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.41Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.81Å; Y109-D161 PolarHBondContact OH-OD2 3.07Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.85Å; D161-A163 WeakPolarHBondContact OD1-CA 3.01Å; D161-A163 WeakPolarHBondContact OD1-CB 3.26Å; D161-A163 PolarHBondContact OD1-N 2.83Å; D161-A164 PolarHBondContact O-N 2.8Å; D161-A164 PolarHBondContact OD1-N 2.99Å; D161-Q165 WeakPolarHBondContact O-CG 3.49Å; D161-Q165 PolarHBondContact O-N 2.89Å
162	T	98.1	Very high	98.1	Very high	110 Å²	110	65.6 Å²	65.6	68%	0.675	33%	0.333	S	S	*	.	H	α-helix	trans	-65.2	-29	-179.1	50.8	0	0	0	0	113.9
163	A	98	Very high	98.2	Very high	5 Å²	5	63.4 Å²	63.4	4%	0.041	34%	0.338	C	S	.	.	H	α-helix	trans	-72.9	-43.4	175.4	0	0	0	0	0	110	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.15Å; Y109-A163 HydrophobicContact CD2-CB 4.4Å; Y109-A163 HydrophobicContact CE1-CB 3.6Å; Y109-A163 HydrophobicContact CE2-CB 3.88Å; Y109-A163 VanDerWaalsContact CZ-CB 3.45Å; Y147-A163 HydrophobicContact CE2-CB 4.49Å; Y147-A163 PolarHBondContact OH-O 3.23Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.85Å; D161-A163 WeakPolarHBondContact OD1-CA 3.01Å; D161-A163 WeakPolarHBondContact OD1-CB 3.26Å; D161-A163 PolarHBondContact OD1-N 2.83Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 3.05Å; A163-I166 VanDerWaalsContact O-CB 3.26Å; A163-I166 WeakPolarHBondContact O-CB 3.16Å; A163-I166 PolarHBondContact O-N 2.84Å
164	A	98.4	Very high	98.2	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-34.4	173.9	0	0	0	0	0	113.1	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.46Å; Y147-A164 HydrophobicContact CE2-CB 3.7Å; Y147-A164 HydrophobicContact CG-CB 4.31Å; Y147-A164 WeakPolarHBondContact O-CB 3.47Å; A159-A164 HydrophobicContact CB-CB 3.73Å; D161-A164 PolarHBondContact O-N 2.8Å; D161-A164 PolarHBondContact OD1-N 2.99Å; A164-I166 PolarHBondContact O-N 3.37Å; A164-T167 PolarHBondContact O-N 3.32Å; A164-Q168 PolarHBondContact O-N 3.36Å
165	Q	98.7	Very high	98.2	Very high	76 Å²	76	70.1 Å²	70.1	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-28.4	173.4	-72.7	174.4	10.7	0	0	113	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 4.01Å; D161-Q165 WeakPolarHBondContact O-CG 3.49Å; D161-Q165 PolarHBondContact O-N 2.89Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 3.05Å; Q165-R169 WeakPolarHBondContact O-CG 3.46Å; Q165-R169 PolarHBondContact O-N 2.93Å; Q165-R169 VanDerWaalsContact O-N 3.13Å
166	I	98.3	Very high	98.2	Very high	58 Å²	58	63 Å²	63	30%	0.297	35%	0.348	S	S	.	.	H	α-helix	trans	-66.7	-44.9	174.2	-56.7	171	0	0	0	109.7	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.14Å; Y108-I166 HydrophobicContact CE1-CD1 4.45Å; Y108-I166 HydrophobicContact CE1-CG2 4.07Å; Y108-I166 HydrophobicContact CE2-CB 4.26Å; Y108-I166 HydrophobicContact CE2-CG2 4.12Å; Y108-I166 HydrophobicContact CG-CD1 4.19Å; A163-I166 VanDerWaalsContact O-CB 3.26Å; A163-I166 WeakPolarHBondContact O-CB 3.16Å; A163-I166 PolarHBondContact O-N 2.84Å; A164-I166 PolarHBondContact O-N 3.37Å; I166-K170 WeakPolarHBondContact O-CG 3.45Å; I166-K170 PolarHBondContact O-N 2.83Å
167	T	98.2	Very high	98.2	Very high	30 Å²	30	61.5 Å²	61.5	18%	0.184	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-44.2	174.8	-69.4	0	0	0	0	111.3	Y147 I148 A164 R169 K170 L171	Y147-T167 HydrophobicContact CE1-CG2 4.17Å; Y147-T167 WeakPolarHBondContact OH-CB 3.48Å; Y147-T167 PolarHBondContact OH-OG1 3.27Å; I148-T167 HydrophobicContact CD1-CG2 3.98Å; A164-T167 PolarHBondContact O-N 3.32Å; T167-R169 PolarHBondContact O-N 2.82Å; T167-K170 WeakPolarHBondContact O-CB 3.38Å; T167-K170 PolarHBondContact O-N 2.83Å; T167-L171 HydrophobicContact CG2-CD1 3.8Å; T167-L171 HydrophobicContact CG2-CG 4.05Å; T167-L171 WeakPolarHBondContact O-CG 3.35Å; T167-L171 PolarHBondContact O-N 3.33Å
168	Q	98.6	Very high	98.1	Very high	41 Å²	41	66.6 Å²	66.6	19%	0.192	36%	0.362	C	S	.	.	H	α-helix	trans	-52.1	-52	177.3	175.7	175.8	9.5	0	0	111.8	I148 W157 A159 A164 K170 L171 E172	I148-Q168 HydrophobicContact CD1-CB 4.01Å; W157-Q168 HydrophobicContact CB-CG 4.1Å; W157-Q168 PolarHBondContact O-NE2 3.14Å; A159-Q168 HydrophobicContact CB-CB 4.4Å; A164-Q168 PolarHBondContact O-N 3.36Å; Q168-K170 VanDerWaalsContact C-N 3.25Å; Q168-K170 PolarHBondContact O-N 2.85Å; Q168-L171 PolarHBondContact O-N 2.9Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; Q168-E172 HydrophobicContact CG-CG 4.35Å; Q168-E172 VanDerWaalsContact CG-OE1 3.26Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.24Å; Q168-E172 PolarHBondContact NE2-OE1 3.14Å; Q168-E172 WeakPolarHBondContact O-CG 3.42Å; Q168-E172 PolarHBondContact O-N 3.37Å
169	R	98.6	Very high	98	Very high	147 Å²	147	70 Å²	70	56%	0.555	37%	0.373	S	S	*	.	H	α-helix	trans	-58.6	-36.8	178.7	-68.3	172.9	-165.9	125.9	6.3	112.5	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.46Å; Q165-R169 PolarHBondContact O-N 2.93Å; Q165-R169 VanDerWaalsContact O-N 3.13Å; T167-R169 PolarHBondContact O-N 2.82Å; R169-A173 VanDerWaalsContact O-CB 3.26Å; R169-A173 WeakPolarHBondContact O-CB 3.1Å; R169-A173 PolarHBondContact O-N 3.15Å
170	K	97.9	Very high	97.9	Very high	116 Å²	116	70.4 Å²	70.4	50%	0.504	37%	0.372	S	S	.	.	H	α-helix	trans	-68	-43	176.4	-70.5	178.5	175.7	-174.5	0	111.7	Y108 I166 T167 Q168 A174	Y108-K170 PolarHBondContact OH-NZ 2.86Å; I166-K170 WeakPolarHBondContact O-CG 3.45Å; I166-K170 PolarHBondContact O-N 2.83Å; T167-K170 WeakPolarHBondContact O-CB 3.38Å; T167-K170 PolarHBondContact O-N 2.83Å; Q168-K170 VanDerWaalsContact C-N 3.25Å; Q168-K170 PolarHBondContact O-N 2.85Å; K170-A174 VanDerWaalsContact O-CB 3.29Å; K170-A174 WeakPolarHBondContact O-CB 3.5Å; K170-A174 PolarHBondContact O-N 3.28Å
171	L	98	Very high	97.9	Very high	41 Å²	41	71 Å²	71	22%	0.215	36%	0.361	C	S	.	.	H	α-helix	trans	-65.9	-41.6	178.1	-67	174.9	0	0	0	111.6	I148 W157 T167 Q168 A174 R175 A176	I148-L171 HydrophobicContact CD1-CD1 3.74Å; W157-L171 HydrophobicContact CD2-CD1 3.94Å; W157-L171 HydrophobicContact CE3-CD1 3.99Å; W157-L171 HydrophobicContact CH2-CD1 3.8Å; W157-L171 HydrophobicContact CZ2-CB 4.21Å; W157-L171 HydrophobicContact CZ2-CD1 3.78Å; W157-L171 HydrophobicContact CZ2-CG 4.43Å; W157-L171 HydrophobicContact CZ3-CD1 3.92Å; T167-L171 HydrophobicContact CG2-CD1 3.8Å; T167-L171 HydrophobicContact CG2-CG 4.05Å; T167-L171 WeakPolarHBondContact O-CG 3.35Å; T167-L171 PolarHBondContact O-N 3.33Å; Q168-L171 PolarHBondContact O-N 2.9Å; Q168-L171 VanDerWaalsContact O-N 3.1Å; L171-A174 CarbonylContact O-C 3.54Å; L171-A174 PolarHBondContact O-N 2.62Å; L171-R175 PolarHBondContact O-N 2.83Å; L171-A176 HydrophobicContact CB-CB 4.07Å; L171-A176 HydrophobicContact CD2-CB 3.66Å; L171-A176 HydrophobicContact CG-CB 4.46Å; L171-A176 PolarHBondContact O-N 3.01Å
172	E	98.3	Very high	97.9	Very high	94 Å²	94	71.5 Å²	71.5	44%	0.439	37%	0.372	S	S	.	.	H	α-helix	trans	-64.3	-47.2	175.7	-72.1	170.1	175.8	0	0	111.4	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.35Å; Q168-E172 VanDerWaalsContact CG-OE1 3.26Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.24Å; Q168-E172 PolarHBondContact NE2-OE1 3.14Å; Q168-E172 WeakPolarHBondContact O-CG 3.42Å; Q168-E172 PolarHBondContact O-N 3.37Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 3.2Å; E172-R175 PolarHBondContact O-N 3.46Å
173	A	98.3	Very high	97.8	Very high	90 Å²	90	69.4 Å²	69.4	74%	0.744	35%	0.353	S	S	*	.	H	α-helix	trans	-60.8	-35.5	176.5	0	0	0	0	0	112.5	R169 R175	R169-A173 VanDerWaalsContact O-CB 3.26Å; R169-A173 WeakPolarHBondContact O-CB 3.1Å; R169-A173 PolarHBondContact O-N 3.15Å; A173-R175 VanDerWaalsContact C-N 3.32Å
174	A	97.6	Very high	97.8	Very high	69 Å²	69	69.2 Å²	69.2	57%	0.57	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-2.7	176.4	0	0	0	0	0	113.9	K170 L171 E172 A176	K170-A174 VanDerWaalsContact O-CB 3.29Å; K170-A174 WeakPolarHBondContact O-CB 3.5Å; K170-A174 PolarHBondContact O-N 3.28Å; L171-A174 CarbonylContact O-C 3.54Å; L171-A174 PolarHBondContact O-N 2.62Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 3.2Å; A174-A176 PolarHBondContact O-N 2.97Å
175	R	97.4	Very high	97.8	Very high	161 Å²	161	73.4 Å²	73.4	61%	0.608	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	37.1	-172.9	-56.3	-175.2	178.2	-165.3	1.2	113.5	L171 E172 A173 A177 E178	L171-R175 PolarHBondContact O-N 2.83Å; E172-R175 PolarHBondContact O-N 3.46Å; A173-R175 VanDerWaalsContact C-N 3.32Å; R175-A177 PolarHBondContact O-N 3.34Å; R175-A177 VanDerWaalsContact O-N 3.14Å; R175-E178 HydrophobicContact CB-CG 4.29Å; R175-E178 IonicContact NH1-OE1 2.71Å; R175-E178 WeakPolarHBondContact O-CB 3.24Å; R175-E178 PolarHBondContact O-N 3.34Å
176	A	97.3	Very high	97.7	Very high	16 Å²	16	70.9 Å²	70.9	13%	0.132	37%	0.365	C	S	.	.	H	α-helix	trans	-59.1	-30.8	-174.7	0	0	0	0	0	113.1	W157 L171 A174 E178 Q179 L180	W157-A176 HydrophobicContact CZ2-CB 4.35Å; L171-A176 HydrophobicContact CB-CB 4.07Å; L171-A176 HydrophobicContact CD2-CB 3.66Å; L171-A176 HydrophobicContact CG-CB 4.46Å; L171-A176 PolarHBondContact O-N 3.01Å; A174-A176 PolarHBondContact O-N 2.97Å; A176-E178 VanDerWaalsContact C-N 3.27Å; A176-E178 PolarHBondContact O-N 3.35Å; A176-Q179 PolarHBondContact O-N 2.84Å; A176-L180 PolarHBondContact O-N 3.44Å; A176-L180 VanDerWaalsContact O-N 3.09Å
177	A	97.8	Very high	97.7	Very high	9 Å²	9	70.5 Å²	70.5	7%	0.074	37%	0.365	C	S	.	.	H	α-helix	trans	-60.7	-34	176.8	0	0	0	0	0	112.7	L150 R155 W157 R175 Q179 L180 R181	L150-A177 HydrophobicContact CD1-CB 4.02Å; R155-A177 WeakPolarHBondContact O-CB 3.34Å; W157-A177 HydrophobicContact CZ2-CB 4.36Å; R175-A177 PolarHBondContact O-N 3.34Å; R175-A177 VanDerWaalsContact O-N 3.14Å; A177-Q179 PolarHBondContact O-N 2.81Å; A177-L180 PolarHBondContact O-N 3.37Å; A177-R181 WeakPolarHBondContact O-CB 3.35Å; A177-R181 PolarHBondContact O-N 2.81Å
178	E	97.6	Very high	97.7	Very high	120 Å²	120	69.1 Å²	69.1	56%	0.561	36%	0.357	S	S	*	.	H	α-helix	trans	-64.6	-41.4	178.5	-64.3	178.2	-179.5	0	0	111.4	R175 A176 A182	R175-E178 HydrophobicContact CB-CG 4.29Å; R175-E178 IonicContact NH1-OE1 2.71Å; R175-E178 WeakPolarHBondContact O-CB 3.24Å; R175-E178 PolarHBondContact O-N 3.34Å; A176-E178 VanDerWaalsContact C-N 3.27Å; A176-E178 PolarHBondContact O-N 3.35Å; E178-A182 WeakPolarHBondContact O-CB 3.16Å; E178-A182 PolarHBondContact O-N 3.38Å
179	Q	95.8	Very high	97.7	Very high	149 Å²	149	67.5 Å²	67.5	70%	0.696	35%	0.35	S	S	*	.	H	α-helix	trans	-69	-43.8	177.9	-65.3	-178.6	-11	0	0	111.8	A176 A177 A182 Y183	A176-Q179 PolarHBondContact O-N 2.84Å; A177-Q179 PolarHBondContact O-N 2.81Å; Q179-A182 PolarHBondContact O-N 3.03Å; Q179-Y183 PolarHBondContact O-N 3.44Å
180	L	97	Very high	97.6	Very high	32 Å²	32	66.4 Å²	66.4	17%	0.168	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-43.6	177	-73.9	169.2	0	0	0	111.3	D138 L150 W157 A176 A177 A182 Y183 L184	D138-L180 HydrophobicContact CB-CD1 4.26Å; L150-L180 HydrophobicContact CD2-CB 4.29Å; W157-L180 HydrophobicContact CH2-CD1 3.36Å; W157-L180 HydrophobicContact CZ2-CD1 3.77Å; W157-L180 HydrophobicContact CZ3-CD1 4.49Å; A176-L180 PolarHBondContact O-N 3.44Å; A176-L180 VanDerWaalsContact O-N 3.09Å; A177-L180 PolarHBondContact O-N 3.37Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 3.47Å; L180-Y183 WeakPolarHBondContact O-CB 3.39Å; L180-Y183 PolarHBondContact O-N 2.84Å; L180-L184 WeakPolarHBondContact O-CB 3.03Å; L180-L184 VanDerWaalsContact O-CG 3.23Å; L180-L184 WeakPolarHBondContact O-CG 3.42Å; L180-L184 PolarHBondContact O-N 2.76Å
181	R	97.9	Very high	97.6	Very high	72 Å²	72	63.1 Å²	63.1	27%	0.272	34%	0.335	S	S	.	.	H	α-helix	trans	-59.4	-45	175.5	-175.7	172.5	-179.7	-132.2	-13.3	111.9	L154 R155 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.11Å; L154-R181 HydrophobicContact CB-CG 3.87Å; L154-R181 HydrophobicContact CD1-CG 4.18Å; R155-R181 VanDerWaalsContact CZ-NH1 3.29Å; A177-R181 WeakPolarHBondContact O-CB 3.35Å; A177-R181 PolarHBondContact O-N 2.81Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.7Å; R181-L184 PolarHBondContact O-N 3.07Å; R181-E185 HydrophobicContact CG-CG 4.08Å; R181-E185 IonicContact CZ-OE1 2.68Å; R181-E185 IonicContact CZ-OE2 3.51Å; R181-E185 VanDerWaalsContact NE-CD 3.33Å; R181-E185 IonicContact NE-OE1 2.86Å; R181-E185 PolarHBondContact NE-OE1 3.25Å; R181-E185 IonicContact NE-OE2 3.35Å; R181-E185 PolarHBondContact NE-OE2 2.04Å; R181-E185 IonicContact NH2-OE1 3.69Å; R181-E185 PolarHBondContact NH2-OE1 2.84Å; R181-E185 IonicContact NH2-OE2 2.73Å; R181-E185 PolarHBondContact NH2-OE2 2.95Å; R181-E185 WeakPolarHBondContact O-CB 3.45Å; R181-E185 PolarHBondContact O-N 3.34Å
182	A	97.9	Very high	97.6	Very high	65 Å²	65	61.1 Å²	61.1	54%	0.537	33%	0.325	S	S	.	.	H	α-helix	trans	-60.7	-39.3	176.4	0	0	0	0	0	112.5	E178 Q179 L180 G186	E178-A182 WeakPolarHBondContact O-CB 3.16Å; E178-A182 PolarHBondContact O-N 3.38Å; Q179-A182 PolarHBondContact O-N 3.03Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 3.47Å; A182-G186 PolarHBondContact O-N 2.99Å; A182-G186 VanDerWaalsContact O-N 3.12Å
183	Y	97.1	Very high	97.5	Very high	67 Å²	67	62.5 Å²	62.5	26%	0.263	33%	0.326	S	S	.	.	I	π-helix	trans	-65.9	-47.6	173.4	167.6	-99.9	0	0	0	112.1	Q179 L180 R181 T187 C188	Q179-Y183 PolarHBondContact O-N 3.44Å; L180-Y183 WeakPolarHBondContact O-CB 3.39Å; L180-Y183 PolarHBondContact O-N 2.84Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.7Å; Y183-T187 HydrophobicContact CD2-CG2 3.91Å; Y183-T187 HydrophobicContact CE2-CG2 3.84Å; Y183-T187 PolarHBondContact O-N 3.32Å; Y183-T187 VanDerWaalsContact O-N 3.09Å; Y183-C188 HydrophobicContact CE1-CB 4.09Å; Y183-C188 WeakPolarHBondContact O-CB 3.06Å; Y183-C188 PolarHBondContact O-N 3.39Å
184	L	98.1	Very high	97.5	Very high	1 Å²	1	64 Å²	64	1%	0.005	31%	0.313	C	S	.	.	I	π-helix	trans	-69.5	-39.8	-175	-70	172.1	0	0	0	112.7	G124 L150 L154 L180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.28Å; L150-L184 HydrophobicContact CD2-CD1 3.91Å; L154-L184 HydrophobicContact CD2-CD1 3.98Å; L180-L184 WeakPolarHBondContact O-CB 3.03Å; L180-L184 VanDerWaalsContact O-CG 3.23Å; L180-L184 WeakPolarHBondContact O-CG 3.42Å; L180-L184 PolarHBondContact O-N 2.76Å; R181-L184 PolarHBondContact O-N 3.07Å; L184-V189 WeakPolarHBondContact O-CG2 3.44Å
185	E	97.5	Very high	97.5	Very high	87 Å²	87	60.8 Å²	60.8	41%	0.407	29%	0.286	S	S	.	.	I	π-helix	trans	-79.6	-25.2	178	-69.2	-179.1	166.8	0	0	113.1	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.36Å; L133-E185 HydrophobicContact CD2-CG 3.63Å; L154-E185 HydrophobicContact CD1-CG 4.21Å; R181-E185 HydrophobicContact CG-CG 4.08Å; R181-E185 IonicContact CZ-OE1 2.68Å; R181-E185 IonicContact CZ-OE2 3.51Å; R181-E185 VanDerWaalsContact NE-CD 3.33Å; R181-E185 IonicContact NE-OE1 2.86Å; R181-E185 PolarHBondContact NE-OE1 3.25Å; R181-E185 IonicContact NE-OE2 3.35Å; R181-E185 PolarHBondContact NE-OE2 2.04Å; R181-E185 IonicContact NH2-OE1 3.69Å; R181-E185 PolarHBondContact NH2-OE1 2.84Å; R181-E185 IonicContact NH2-OE2 2.73Å; R181-E185 PolarHBondContact NH2-OE2 2.95Å; R181-E185 WeakPolarHBondContact O-CB 3.45Å; R181-E185 PolarHBondContact O-N 3.34Å
186	G	97.4	Very high	97.4	Very high	23 Å²	23	53.8 Å²	53.8	24%	0.237	26%	0.26	C	S	.	.	I	π-helix	trans	-108.2	-88.9	-178.1	0	0	0	0	0	112.4	A182 C188 V189 E190	A182-G186 PolarHBondContact O-N 2.99Å; A182-G186 VanDerWaalsContact O-N 3.12Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 3.01Å; G186-V189 PolarHBondContact O-N 2.9Å; G186-V189 VanDerWaalsContact O-N 3.13Å; G186-E190 WeakPolarHBondContact O-CG 3.35Å; G186-E190 PolarHBondContact O-N 2.91Å
187	T	97.3	Very high	97.3	Very high	51 Å²	51	59.1 Å²	59.1	31%	0.313	28%	0.283	S	S	.	.	I	π-helix	trans	-53.8	-44.9	-171	-56.7	0	0	0	0	113.1	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.91Å; Y183-T187 HydrophobicContact CE2-CG2 3.84Å; Y183-T187 PolarHBondContact O-N 3.32Å; Y183-T187 VanDerWaalsContact O-N 3.09Å; T187-V189 PolarHBondContact O-N 2.99Å; T187-E190 PolarHBondContact O-N 3.03Å; T187-W191 VanDerWaalsContact CG2-CD1 3.47Å; T187-W191 WeakPolarHBondContact O-CB 3.26Å; T187-W191 PolarHBondContact O-N 2.88Å
188	C	98.1	Very high	97.3	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.292	C	S	.	.	I	π-helix	trans	-60.4	-48	-179.8	-171.2	0	0	0	0	111.5	M29 C125 Y183 G186 E190 W191 L192	M29-C188 HydrophobicContact CE-CB 4.19Å; M29-C188 WeakPolarHBondContact CE-O 3.16Å; M29-C188 WeakPolarHBondContact CE-SG 3.01Å; C125-C188 HydrophobicContact CB-CB 3.92Å; C125-C188 WeakPolarHBondContact CB-SG 3.34Å; C125-C188 PolarHBondContact N-SG 3.43Å; C125-C188 WeakPolarHBondContact SG-CB 3.42Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.48Å; Y183-C188 HydrophobicContact CE1-CB 4.09Å; Y183-C188 WeakPolarHBondContact O-CB 3.06Å; Y183-C188 PolarHBondContact O-N 3.39Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 3.01Å; C188-E190 PolarHBondContact O-N 3.34Å; C188-W191 PolarHBondContact O-N 2.73Å; C188-L192 WeakPolarHBondContact O-CB 3.24Å; C188-L192 PolarHBondContact O-N 2.89Å
189	V	98	Very high	97.2	Very high	7 Å²	7	55.5 Å²	55.5	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-45.6	177.8	175.9	0	0	0	0	111.4	L127 L133 L184 G186 T187 L192 R193	L127-V189 HydrophobicContact CD1-CG1 4.48Å; L127-V189 HydrophobicContact CD2-CB 4.14Å; L127-V189 HydrophobicContact CD2-CG1 3.74Å; L127-V189 HydrophobicContact CD2-CG2 3.81Å; L133-V189 HydrophobicContact CB-CG2 4.01Å; L133-V189 HydrophobicContact CD1-CG2 4.04Å; L184-V189 WeakPolarHBondContact O-CG2 3.44Å; G186-V189 PolarHBondContact O-N 2.9Å; G186-V189 VanDerWaalsContact O-N 3.13Å; T187-V189 PolarHBondContact O-N 2.99Å; V189-L192 PolarHBondContact O-N 3.38Å; V189-R193 VanDerWaalsContact CG1-CZ 3.48Å; V189-R193 WeakPolarHBondContact O-CG 3.48Å; V189-R193 PolarHBondContact O-N 3.06Å
190	E	97.9	Very high	97.1	Very high	125 Å²	125	53.6 Å²	53.6	58%	0.584	26%	0.255	S	S	*	.	H	α-helix	trans	-61.5	-46.1	179.7	-71.9	173.6	175.5	0	0	112.2	G186 T187 C188 R194	G186-E190 WeakPolarHBondContact O-CG 3.35Å; G186-E190 PolarHBondContact O-N 2.91Å; T187-E190 PolarHBondContact O-N 3.03Å; C188-E190 PolarHBondContact O-N 3.34Å; E190-R194 PolarHBondContact O-N 3.05Å; E190-R194 VanDerWaalsContact O-N 3.08Å
191	W	97.8	Very high	96.8	Very high	46 Å²	46	60.6 Å²	60.6	17%	0.174	29%	0.287	C	S	.	.	H	α-helix	trans	-68.7	-42	178.9	-82.5	99.7	0	0	0	112.2	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.03Å; M29-W191 HydrophobicContact SD-CB 4.41Å; Y83-W191 AromaticContact CD2-CH2 3.46Å; Y83-W191 HydrophobicContact CD2-CH2 3.46Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.46Å; Y83-W191 HydrophobicContact CD2-CZ2 4.19Å; Y83-W191 AromaticContact CD2-CZ3 3.7Å; Y83-W191 HydrophobicContact CD2-CZ3 3.7Å; Y83-W191 HydrophobicContact CE2-CE3 4.18Å; Y83-W191 AromaticContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CZ2 4.48Å; Y83-W191 AromaticContact CE2-CZ3 3.66Å; Y83-W191 HydrophobicContact CE2-CZ3 3.66Å; T187-W191 VanDerWaalsContact CG2-CD1 3.47Å; T187-W191 WeakPolarHBondContact O-CB 3.26Å; T187-W191 PolarHBondContact O-N 2.88Å; C188-W191 PolarHBondContact O-N 2.73Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 3.35Å; W191-R194 WeakPolarHBondContact O-CB 3.33Å; W191-R194 PolarHBondContact O-N 3.1Å; W191-R194 VanDerWaalsContact O-N 3.17Å; W191-Y195 HydrophobicContact CB-CE2 4.04Å; W191-Y195 HydrophobicContact CE3-CD1 4.4Å; W191-Y195 AromaticContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE2 4.19Å; W191-Y195 AromaticContact CE3-CZ 3.37Å; W191-Y195 AromaticContact CZ3-CE1 3.88Å; W191-Y195 HydrophobicContact CZ3-CE1 3.88Å; W191-Y195 VanDerWaalsContact O-CD2 3.26Å; W191-Y195 WeakPolarHBondContact O-CD2 3.29Å; W191-Y195 VanDerWaalsContact O-CG 3.24Å; W191-Y195 PolarHBondContact O-N 2.75Å
192	L	98.1	Very high	96.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-45.2	176.3	175	50.2	0	0	0	111.2	H27 M29 V52 L127 C188 V189 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.42Å; M29-L192 HydrophobicContact CB-CB 4.05Å; M29-L192 HydrophobicContact CB-CD1 4.03Å; M29-L192 HydrophobicContact CB-CD2 3.95Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.29Å; M29-L192 HydrophobicContact SD-CB 4.41Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.25Å; L127-L192 HydrophobicContact CB-CD2 4.5Å; L127-L192 HydrophobicContact CD1-CB 4.24Å; L127-L192 HydrophobicContact CD1-CD2 3.7Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CG-CD2 3.58Å; L127-L192 HydrophobicContact CG-CG 4.21Å; C188-L192 WeakPolarHBondContact O-CB 3.24Å; C188-L192 PolarHBondContact O-N 2.89Å; V189-L192 PolarHBondContact O-N 3.38Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 2.92Å; L192-Y195 PolarHBondContact O-N 3.15Å; L192-L196 HydrophobicContact CD1-CD1 3.85Å; L192-L196 HydrophobicContact CD1-CD2 4.37Å; L192-L196 HydrophobicContact CD1-CG 3.83Å; L192-L196 HydrophobicContact CG-CD1 4.03Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.42Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 2.8Å
193	R	96.8	Very high	96.1	Very high	122 Å²	122	56.2 Å²	56.2	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-43.2	174.3	-71.9	176	-174.4	159.2	-0.5	112.5	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.92Å; G131-R193 VanDerWaalsContact O-CZ 3.29Å; G131-R193 PolarHBondContact O-NE 3.48Å; G131-R193 VanDerWaalsContact O-NE 3.07Å; G131-R193 PolarHBondContact O-NH2 3.25Å; V189-R193 VanDerWaalsContact CG1-CZ 3.48Å; V189-R193 WeakPolarHBondContact O-CG 3.48Å; V189-R193 PolarHBondContact O-N 3.06Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 3.35Å; R193-L196 PolarHBondContact O-N 2.92Å; R193-E197 PolarHBondContact O-N 3.01Å
194	R	97	Very high	95.8	Very high	122 Å²	122	57.4 Å²	57.4	46%	0.46	27%	0.27	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176.4	177.7	178.4	174.5	121.4	-2	111.6	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 2.71Å; E79-R194 IonicContact OE1-NE 2.81Å; E79-R194 PolarHBondContact OE1-NE 2.61Å; E79-R194 IonicContact OE1-NH2 3.14Å; E79-R194 PolarHBondContact OE1-NH2 2.86Å; E79-R194 IonicContact OE2-CZ 2.99Å; E79-R194 IonicContact OE2-NE 3.68Å; E79-R194 IonicContact OE2-NH2 3.34Å; E79-R194 PolarHBondContact OE2-NH2 2.81Å; E190-R194 PolarHBondContact O-N 3.05Å; E190-R194 VanDerWaalsContact O-N 3.08Å; W191-R194 WeakPolarHBondContact O-CB 3.33Å; W191-R194 PolarHBondContact O-N 3.1Å; W191-R194 VanDerWaalsContact O-N 3.17Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 2.92Å; R194-E197 PolarHBondContact O-N 2.91Å; R194-N198 WeakPolarHBondContact O-CB 3.41Å; R194-N198 PolarHBondContact O-N 2.84Å; R194-N198 PolarHBondContact O-OD1 2.84Å
195	Y	97.4	Very high	95.5	Very high	1 Å²	1	61.6 Å²	61.6	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-67.7	-39.5	178.6	-62.3	-32.2	0	0	0	112.5	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.68Å; M29-Y195 HydrophobicContact SD-CE2 3.54Å; M29-Y195 VanDerWaalsContact SD-CE2 3.54Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; V52-Y195 HydrophobicContact CG2-CG 4.44Å; F57-Y195 HydrophobicContact CD2-CE2 4.42Å; F57-Y195 HydrophobicContact CE2-CD2 4.23Å; F57-Y195 AromaticContact CE2-CE2 3.59Å; F57-Y195 HydrophobicContact CE2-CE2 3.59Å; F57-Y195 AromaticContact CE2-CZ 3.78Å; F57-Y195 HydrophobicContact CZ-CD2 4.28Å; F57-Y195 AromaticContact CZ-CE2 3.74Å; F57-Y195 HydrophobicContact CZ-CE2 3.74Å; W75-Y195 HydrophobicContact CE3-CD1 4.21Å; W75-Y195 HydrophobicContact CE3-CG 4.46Å; W75-Y195 HydrophobicContact CH2-CD1 4.49Å; W75-Y195 HydrophobicContact CH2-CD2 4.49Å; W75-Y195 HydrophobicContact CH2-CG 4.1Å; W75-Y195 AromaticContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD1 3.55Å; W75-Y195 HydrophobicContact CZ3-CD2 4.28Å; W75-Y195 HydrophobicContact CZ3-CE1 4.26Å; W75-Y195 AromaticContact CZ3-CG 3.56Å; W75-Y195 HydrophobicContact CZ3-CG 3.56Å; V76-Y195 HydrophobicContact CG2-CE1 4.37Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.49Å; Y83-Y195 PolarHBondContact OH-OH 2.81Å; W191-Y195 HydrophobicContact CB-CE2 4.04Å; W191-Y195 HydrophobicContact CE3-CD1 4.4Å; W191-Y195 AromaticContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE2 4.19Å; W191-Y195 AromaticContact CE3-CZ 3.37Å; W191-Y195 AromaticContact CZ3-CE1 3.88Å; W191-Y195 HydrophobicContact CZ3-CE1 3.88Å; W191-Y195 VanDerWaalsContact O-CD2 3.26Å; W191-Y195 WeakPolarHBondContact O-CD2 3.29Å; W191-Y195 VanDerWaalsContact O-CG 3.24Å; W191-Y195 PolarHBondContact O-N 2.75Å; L192-Y195 PolarHBondContact O-N 3.15Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 3.29Å; Y195-N198 PolarHBondContact O-N 2.71Å; Y195-G199 WeakPolarHBondContact O-CA 3.41Å; Y195-G199 PolarHBondContact O-N 3.02Å; Y195-L203 WeakPolarHBondContact O-CD1 3.43Å
196	L	96	Very high	95.3	Very high	15 Å²	15	59.5 Å²	59.5	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-36.1	174.3	-71	169.6	0	0	0	112.3	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.66Å; H27-L196 HydrophobicContact CB-CD2 3.97Å; H27-L196 HydrophobicContact CB-CG 4.39Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.35Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; L192-L196 HydrophobicContact CD1-CD1 3.85Å; L192-L196 HydrophobicContact CD1-CD2 4.37Å; L192-L196 HydrophobicContact CD1-CG 3.83Å; L192-L196 HydrophobicContact CG-CD1 4.03Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.42Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 2.8Å; R193-L196 PolarHBondContact O-N 2.92Å; L196-K200 WeakPolarHBondContact O-CA 3.48Å; L196-K200 WeakPolarHBondContact O-CB 3.34Å; L196-K200 PolarHBondContact O-N 2.99Å; L196-K200 VanDerWaalsContact O-N 3.11Å; L196-L203 HydrophobicContact CD2-CB 4.11Å; L196-L203 HydrophobicContact CD2-CD1 4.35Å; L196-Q204 HydrophobicContact CD2-CG 4.47Å; L196-Q204 PolarHBondContact O-NE2 3.04Å
197	E	95.8	Very high	95.1	Very high	128 Å²	128	61.5 Å²	61.5	60%	0.598	29%	0.286	S	S	*	.	H	α-helix	trans	-71.9	-48.6	174.7	-171.4	60	-150.9	0	0	111.3	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.01Å; R194-E197 PolarHBondContact O-N 2.91Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 3.29Å; E197-G199 VanDerWaalsContact C-N 3.3Å; E197-G199 PolarHBondContact O-N 2.85Å; E197-K200 WeakPolarHBondContact O-CB 3.46Å; E197-K200 PolarHBondContact O-N 2.74Å
198	N	96.5	Very high	95.1	Very high	50 Å²	50	62.2 Å²	62.2	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-60	-40.1	178.9	-71.8	-4.5	0	0	0	112.7	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.41Å; Q78-N198 PolarHBondContact NE2-ND2 2.84Å; Q78-N198 PolarHBondContact NE2-OD1 2.94Å; E79-N198 PolarHBondContact OE1-ND2 2.83Å; R194-N198 WeakPolarHBondContact O-CB 3.41Å; R194-N198 PolarHBondContact O-N 2.84Å; R194-N198 PolarHBondContact O-OD1 2.84Å; Y195-N198 PolarHBondContact O-N 2.71Å
199	G	95.4	Very high	95.1	Very high	2 Å²	2	62.7 Å²	62.7	2%	0.021	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	18.2	-175.2	0	0	0	0	0	113.6	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.41Å; Y195-G199 PolarHBondContact O-N 3.02Å; E197-G199 VanDerWaalsContact C-N 3.3Å; E197-G199 PolarHBondContact O-N 2.85Å; G199-E201 VanDerWaalsContact C-N 3.29Å; G199-E201 PolarHBondContact O-N 2.99Å; G199-E201 VanDerWaalsContact O-N 3.15Å; G199-T202 CarbonylContact O-C 3.55Å; G199-T202 WeakPolarHBondContact O-CA 3.38Å; G199-T202 PolarHBondContact O-N 2.82Å; G199-T202 PolarHBondContact O-OG1 2.87Å; G199-L203 PolarHBondContact O-N 2.87Å
200	K	93.4	Very high	95.1	Very high	109 Å²	109	69.9 Å²	69.9	47%	0.474	33%	0.326	S	S	.	.	H	α-helix	trans	-49.1	-44.7	-170.9	-177.4	172.9	-175.8	173.4	0	114.1	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.48Å; L196-K200 WeakPolarHBondContact O-CB 3.34Å; L196-K200 PolarHBondContact O-N 2.99Å; L196-K200 VanDerWaalsContact O-N 3.11Å; E197-K200 WeakPolarHBondContact O-CB 3.46Å; E197-K200 PolarHBondContact O-N 2.74Å; K200-T202 PolarHBondContact O-N 3.11Å; K200-Q204 HydrophobicContact CG-CB 4.48Å; K200-Q204 WeakPolarHBondContact O-CB 3.38Å; K200-Q204 PolarHBondContact O-N 2.81Å; K200-Q204 VanDerWaalsContact O-N 3.15Å
201	E	90.9	Very high	95	Very high	179 Å²	179	65.9 Å²	65.9	84%	0.836	31%	0.31	S	S	*	.	H	α-helix	trans	-64.2	-22.4	179.3	-62.1	-174.9	165	0	0	113.5	G199 R205	G199-E201 VanDerWaalsContact C-N 3.29Å; G199-E201 PolarHBondContact O-N 2.99Å; G199-E201 VanDerWaalsContact O-N 3.15Å; E201-R205 WeakPolarHBondContact O-CD 3.46Å
202	T	90.6	Very high	94.9	Very high	42 Å²	42	67.7 Å²	67.7	26%	0.258	32%	0.32	S	S	.	.	H	α-helix	trans	-106.7	-37.3	-177.2	58.4	0	0	0	0	114.1	W75 G199 K200 R205	W75-T202 VanDerWaalsContact CD1-OG1 3.23Å; G199-T202 CarbonylContact O-C 3.55Å; G199-T202 WeakPolarHBondContact O-CA 3.38Å; G199-T202 PolarHBondContact O-N 2.82Å; G199-T202 PolarHBondContact O-OG1 2.87Å; K200-T202 PolarHBondContact O-N 3.11Å; T202-R205 WeakPolarHBondContact O-CG 3.3Å
203	L	91.9	Very high	94.9	Very high	4 Å²	4	68.8 Å²	68.8	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-93.8	-27.9	-172.5	-63.2	172.2	0	0	0	112.6	V52 T55 W75 Y195 L196 G199	V52-L203 HydrophobicContact CB-CD1 4.26Å; V52-L203 HydrophobicContact CB-CD2 4.13Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CG 4.49Å; T55-L203 HydrophobicContact CG2-CD2 4.05Å; W75-L203 HydrophobicContact CD2-CD1 4.42Å; W75-L203 HydrophobicContact CH2-CD1 4.37Å; W75-L203 HydrophobicContact CZ2-CD1 3.82Å; W75-L203 HydrophobicContact CZ2-CD2 4.12Å; W75-L203 HydrophobicContact CZ2-CG 4.4Å; Y195-L203 WeakPolarHBondContact O-CD1 3.43Å; L196-L203 HydrophobicContact CD2-CB 4.11Å; L196-L203 HydrophobicContact CD2-CD1 4.35Å; G199-L203 PolarHBondContact O-N 2.87Å
204	Q	89.9	Confident	94.9	Very high	92 Å²	92	64.6 Å²	64.6	43%	0.43	32%	0.315	S	S	.	.	S	Bend	trans	-103.6	23.5	178.4	-58.4	179.2	38.5	0	0	111.5	L196 K200	L196-Q204 HydrophobicContact CD2-CG 4.47Å; L196-Q204 PolarHBondContact O-NE2 3.04Å; K200-Q204 HydrophobicContact CG-CB 4.48Å; K200-Q204 WeakPolarHBondContact O-CB 3.38Å; K200-Q204 PolarHBondContact O-N 2.81Å; K200-Q204 VanDerWaalsContact O-N 3.15Å
205	R	91	Very high	94.8	Very high	89 Å²	89	61.4 Å²	61.4	34%	0.336	31%	0.305	S	S	.	.			trans	-98.5	146.8	172.7	81.8	-174.1	-172.5	-136.4	1.1	109.3	E201 T202 E207 Y233	E201-R205 WeakPolarHBondContact O-CD 3.46Å; T202-R205 WeakPolarHBondContact O-CG 3.3Å; R205-E207 HydrophobicContact CG-CG 4.49Å; R205-E207 IonicContact CZ-OE1 3.81Å; R205-E207 IonicContact NE-OE1 3.66Å; R205-E207 PolarHBondContact NE-OE1 3.29Å; R205-E207 IonicContact NH2-OE1 3.09Å; R205-E207 PolarHBondContact NH2-OE1 2.82Å; R205-Y233 HydrophobicContact CG-CD1 4.2Å; R205-Y233 VanDerWaalsContact O-CD1 3.32Å; R205-Y233 WeakPolarHBondContact O-CD1 3.39Å
206	A	93.4	Very high	94.7	Very high	42 Å²	42	65.1 Å²	65.1	35%	0.347	32%	0.322	S	S	.	.			trans	-119.8	119.3	166.8	0	0	0	0	0	108.3	Y233 E288	A206-Y233 CarbonylContact C-O 3.55Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å; A206-E288 HydrophobicContact CB-CG 3.96Å
207	E	95.1	Very high	94.5	Very high	65 Å²	65	69 Å²	69	30%	0.304	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-98.7	114.4	175.9	-68.2	-175.7	-118.2	0	0	108.6	R205 F232 Y233 H287	R205-E207 HydrophobicContact CG-CG 4.49Å; R205-E207 IonicContact CZ-OE1 3.81Å; R205-E207 IonicContact NE-OE1 3.66Å; R205-E207 PolarHBondContact NE-OE1 3.29Å; R205-E207 IonicContact NH2-OE1 3.09Å; R205-E207 PolarHBondContact NH2-OE1 2.82Å; E207-F232 WeakPolarHBondContact O-CA 3.21Å; E207-F232 WeakPolarHBondContact O-CB 3.5Å; E207-Y233 PolarHBondContact N-O 2.82Å; E207-Y233 PolarHBondContact O-N 3.09Å; E207-Y233 VanDerWaalsContact O-N 3.07Å; E207-H287 PolarHBondContact O-CE1 3.06Å
208	P	96.6	Very high	94.3	Very high	67 Å²	67	67.9 Å²	67.9	44%	0.435	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-68.4	147.9	-179.8	26.2	-33.1	0	0	0	111.5	L290	P208-L290 HydrophobicContact CB-CD2 3.86Å
209	P	97.6	Very high	94.1	Very high	10 Å²	10	68 Å²	68	7%	0.065	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-65.9	137.7	178.8	26.5	-34.1	0	0	0	112.1	T211 A229 F232 I237 M285 H287 L290	P209-T211 HydrophobicContact CB-CG2 4Å; P209-T211 HydrophobicContact CG-CG2 4.1Å; 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 4.17Å; P209-I237 HydrophobicContact CB-CD1 4.23Å; P209-I237 HydrophobicContact CG-CD1 4.14Å; P209-M285 HydrophobicContact CB-SD 3.88Å; P209-M285 HydrophobicContact CG-CG 4.49Å; P209-M285 HydrophobicContact CG-SD 3.41Å; P209-M285 WeakPolarHBondContact CG-SD 3.27Å; P209-H287 HydrophobicContact CG-CB 4.22Å; P209-L290 HydrophobicContact CG-CD1 4.11Å; P209-L290 HydrophobicContact CG-CD2 4.43Å; P209-L290 HydrophobicContact CG-CG 4.38Å
210	K	97.6	Very high	93.7	Very high	157 Å²	157	75.1 Å²	75.1	68%	0.683	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	116.6	162.3	-64.9	172.1	-172.7	165.3	0	108.1	L230	K210-L230 HydrophobicContact CB-CB 4.49Å; K210-L230 PolarHBondContact N-O 3.36Å; K210-L230 PolarHBondContact O-N 3.45Å
211	T	97	Very high	93.7	Very high	42 Å²	42	76.9 Å²	76.9	26%	0.258	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	144.5	-169.5	62.4	0	0	0	0	113.3	P209 W228 M285 L294 L296	P209-T211 HydrophobicContact CB-CG2 4Å; P209-T211 HydrophobicContact CG-CG2 4.1Å; T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 3.46Å; T211-M285 HydrophobicContact CG2-CE 3.48Å; T211-M285 VanDerWaalsContact CG2-CE 3.48Å; T211-M285 HydrophobicContact CG2-SD 3.36Å; T211-M285 WeakPolarHBondContact CG2-SD 3.19Å; T211-L294 HydrophobicContact CG2-CD1 4.26Å; T211-L296 VanDerWaalsContact CB-CD1 3.47Å; T211-L296 HydrophobicContact CG2-CD1 4.06Å
212	H	95.6	Very high	93.9	Very high	83 Å²	83	72.8 Å²	72.8	38%	0.384	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	158.1	168.8	61.3	-73.6	0	0	0	110.6	W228	H212-W228 AromaticContact CD2-CD1 3.92Å; H212-W228 VanDerWaalsContact CE1-CB 3.45Å; H212-W228 WeakPolarHBondContact CE1-CB 3.48Å; H212-W228 AromaticContact CE1-CD1 3.89Å; H212-W228 AromaticContact CE1-CG 3.65Å; H212-W228 PolarHBondContact N-O 3.06Å; H212-W228 AromaticContact NE2-CD1 3.46Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 PolarHBondContact O-N 3.19Å
213	V	97.6	Very high	94.1	Very high	24 Å²	24	70.9 Å²	70.9	15%	0.145	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127.7	175	-177.7	0	0	0	0	109	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.42Å; V213-L225 HydrophobicContact CG1-CD2 4.46Å; V213-R226 WeakPolarHBondContact CA-O 3.45Å; V213-C227 HydrophobicContact CG2-CB 4.46Å; V213-W241 HydrophobicContact CG1-CH2 3.92Å; V213-W241 HydrophobicContact CG1-CZ2 4.41Å; V213-W241 HydrophobicContact CG2-CH2 4.46Å; V213-L296 HydrophobicContact CG2-CB 3.91Å; V213-W298 HydrophobicContact CB-CB 4.48Å; V213-W298 HydrophobicContact CG1-CB 3.83Å
214	T	96.3	Very high	94.4	Very high	34 Å²	34	71.5 Å²	71.5	21%	0.209	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143	177.2	53.4	0	0	0	0	110.2	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3.2Å; T214-H216 VanDerWaalsContact OG1-CE1 3.28Å; T214-L225 WeakPolarHBondContact O-CA 3.21Å; T214-R226 PolarHBondContact N-O 3.26Å; T214-R226 PolarHBondContact O-N 3.14Å; T214-R226 WeakPolarHBondContact OG1-CB 3.43Å; T214-R226 PolarHBondContact OG1-O 3.04Å; T214-R226 VanDerWaalsContact OG1-O 3.09Å; T214-W228 PolarHBondContact OG1-NE1 3.24Å; T214-W228 VanDerWaalsContact OG1-NE1 3.14Å
215	H	95.6	Very high	94.7	Very high	55 Å²	55	67.1 Å²	67.1	26%	0.255	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	124.7	-179.7	170	-90.4	0	0	0	109.9	A223 L225 E278 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.37Å; H215-L225 HydrophobicContact CB-CD2 4Å; H215-E278 IonicContact NE2-OE1 3.91Å; H215-W298 HydrophobicContact CB-CD2 4.2Å; H215-W298 HydrophobicContact CB-CG 4.23Å; H215-W298 HydrophobicContact CB-CZ2 4.05Å; H215-W298 VanDerWaalsContact CB-NE1 3.27Å; H215-W298 AromaticContact CG-CE2 3.83Å; H215-W298 AromaticContact CG-CZ2 3.86Å
216	H	94.1	Very high	95.1	Very high	79 Å²	79	65.3 Å²	65.3	37%	0.366	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	105.5	-179.3	-57.6	84.1	0	0	0	109.1	T214 L218 A223 T224 R226	T214-H216 PolarHBondContact OG1-CE1 3.2Å; T214-H216 VanDerWaalsContact OG1-CE1 3.28Å; H216-L218 PolarHBondContact O-N 2.94Å; H216-A223 CarbonylContact O-C 3.42Å; H216-A223 WeakPolarHBondContact O-CA 3.31Å; H216-T224 PolarHBondContact N-O 3.12Å; H216-T224 PolarHBondContact O-N 2.85Å; H216-R226 PolarHBondContact CE1-NH1 3.09Å
217	P	93.5	Very high	95.3	Very high	96 Å²	96	63.3 Å²	63.3	62%	0.623	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	130.9	173.6	-19.1	29.5	0	0	0	110.6
218	L	90.6	Very high	95.4	Very high	104 Å²	104	62.6 Å²	62.6	55%	0.545	32%	0.322	S	S	.	.			trans	-101	-41.2	173	-65.4	178.1	0	0	0	110.9	H216 E222 T224 V272	H216-L218 PolarHBondContact O-N 2.94Å; L218-E222 PolarHBondContact N-O 3.22Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.47Å; L218-V272 HydrophobicContact CD1-CG1 4.23Å; L218-V272 HydrophobicContact CD1-CG2 4.23Å
219	S	91.6	Very high	95.5	Very high	54 Å²	54	59.4 Å²	59.4	38%	0.378	30%	0.301	S	S	.	.	S	Bend	trans	-150.3	-178.3	176.6	71.6	0	0	0	0	110.2	H221 E222	S219-H221 PolarHBondContact O-N 2.82Å; S219-H221 PolarHBondContact OG-N 2.85Å; S219-H221 VanDerWaalsContact OG-N 3.16Å; S219-E222 PolarHBondContact N-O 2.82Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 3.48Å
220	D	88.5	Confident	95.5	Very high	150 Å²	150	61.5 Å²	61.5	80%	0.802	31%	0.312	S	S	*	.	S	Bend	trans	-63	-19.1	172.4	-65.7	-22	0	0	0	112.7	S275	D220-S275 WeakPolarHBondContact O-CB 3.41Å; D220-S275 PolarHBondContact O-OG 3.27Å
221	H	92.4	Very high	95.5	Very high	146 Å²	146	55 Å²	55	68%	0.676	29%	0.288	S	S	*	.	S	Bend	trans	-107.4	-16.5	-174	-56.5	-47.4	0	0	0	114.1	S219 P274 S275	S219-H221 PolarHBondContact O-N 2.82Å; S219-H221 PolarHBondContact OG-N 2.85Å; S219-H221 VanDerWaalsContact OG-N 3.16Å; H221-P274 CarbonylContact O-C 3.58Å; H221-P274 WeakPolarHBondContact O-CA 3.42Å; H221-S275 PolarHBondContact O-N 2.86Å; H221-S275 PolarHBondContact O-OG 3.38Å
222	E	95.2	Very high	95.5	Very high	94 Å²	94	53 Å²	53	44%	0.439	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	146	-172.1	-66.3	-179.2	167.7	0	0	112.3	L218 S219 V272 V273 S275	L218-E222 PolarHBondContact N-O 3.22Å; S219-E222 PolarHBondContact N-O 2.82Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 3.48Å; E222-V272 HydrophobicContact CB-CG1 4.15Å; E222-V272 HydrophobicContact CG-CG1 4.37Å; E222-V273 WeakPolarHBondContact CA-O 3.32Å; E222-S275 PolarHBondContact N-OG 3.26Å
223	A	95.6	Very high	95.5	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	157.8	171.6	0	0	0	0	0	110.9	H215 H216 V272 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.37Å; H216-A223 CarbonylContact O-C 3.42Å; H216-A223 WeakPolarHBondContact O-CA 3.31Å; A223-V272 WeakPolarHBondContact O-CA 3.46Å; A223-V273 HydrophobicContact CB-CG2 4.5Å; A223-V273 PolarHBondContact N-O 2.81Å; A223-V273 PolarHBondContact O-N 3.22Å
224	T	97.1	Very high	95.4	Very high	17 Å²	17	48.9 Å²	48.9	10%	0.104	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.4	170	-55.2	0	0	0	0	109.7	H216 L218 A270 V271	H216-T224 PolarHBondContact N-O 3.12Å; H216-T224 PolarHBondContact O-N 2.85Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.47Å; T224-A270 HydrophobicContact CG2-CB 3.9Å; T224-V271 WeakPolarHBondContact CA-O 3.38Å
225	L	97.8	Very high	95.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.3	163.8	-63	-175.9	0	0	0	108.8	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.42Å; V213-L225 HydrophobicContact CG1-CD2 4.46Å; T214-L225 WeakPolarHBondContact O-CA 3.21Å; H215-L225 HydrophobicContact CB-CD2 4Å; L225-W241 HydrophobicContact CB-CH2 3.69Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CB-CZ3 4.47Å; L225-W241 HydrophobicContact CD1-CH2 4.08Å; L225-W241 HydrophobicContact CD1-CZ3 4.23Å; L225-A270 CarbonylContact O-C 3.49Å; L225-A270 WeakPolarHBondContact O-CA 3.33Å; L225-V271 HydrophobicContact CB-CG1 4.25Å; L225-V271 PolarHBondContact N-O 3.31Å; L225-V271 PolarHBondContact O-N 3.01Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.09Å; L225-V273 HydrophobicContact CG-CG1 4.14Å; L225-V273 HydrophobicContact CG-CG2 3.86Å; L225-E278 HydrophobicContact CD1-CB 4.09Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.3Å; L225-W298 HydrophobicContact CD1-CB 4.34Å; L225-W298 HydrophobicContact CD2-CB 3.82Å; L225-W298 HydrophobicContact CD2-CD2 4.38Å; L225-W298 HydrophobicContact CD2-CG 3.93Å
226	R	98	Very high	95.4	Very high	52 Å²	52	52.3 Å²	52.3	20%	0.196	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.7	175.7	-179.9	-176.1	-61.5	118.7	3.3	110.3	V213 T214 H216 W228 W268 A269 A270	V213-R226 WeakPolarHBondContact CA-O 3.45Å; T214-R226 PolarHBondContact N-O 3.26Å; T214-R226 PolarHBondContact O-N 3.14Å; T214-R226 WeakPolarHBondContact OG1-CB 3.43Å; T214-R226 PolarHBondContact OG1-O 3.04Å; T214-R226 VanDerWaalsContact OG1-O 3.09Å; H216-R226 PolarHBondContact CE1-NH1 3.09Å; R226-W228 HydrophobicContact CG-CZ2 4.38Å; R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.08Å; R226-W268 HydrophobicContact CG-CE3 3.86Å; R226-W268 HydrophobicContact CG-CG 4.19Å; R226-A269 WeakPolarHBondContact CA-O 3.25Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.13Å
227	C	97.9	Very high	95.4	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.2	176.9	-177	0	0	0	0	109.4	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.46Å; C227-W241 HydrophobicContact CB-CH2 4.38Å; C227-W241 HydrophobicContact CB-CZ2 3.6Å; C227-W268 CarbonylContact O-C 3.6Å; C227-W268 WeakPolarHBondContact O-CA 3.45Å; C227-W268 WeakPolarHBondContact O-CB 3.15Å; C227-A269 PolarHBondContact N-O 3.44Å; C227-A269 PolarHBondContact O-N 2.88Å; C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.32Å; C227-C283 WeakPolarHBondContact SG-CB 3.34Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 3.36Å
228	W	98.3	Very high	95.6	Very high	50 Å²	50	47.3 Å²	47.3	19%	0.189	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.4	-177.6	-69	88.8	0	0	0	111.1	T211 H212 T214 R226 L230 W268	T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 3.46Å; H212-W228 AromaticContact CD2-CD1 3.92Å; H212-W228 VanDerWaalsContact CE1-CB 3.45Å; H212-W228 WeakPolarHBondContact CE1-CB 3.48Å; H212-W228 AromaticContact CE1-CD1 3.89Å; H212-W228 AromaticContact CE1-CG 3.65Å; H212-W228 PolarHBondContact N-O 3.06Å; H212-W228 AromaticContact NE2-CD1 3.46Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 PolarHBondContact O-N 3.19Å; T214-W228 PolarHBondContact OG1-NE1 3.24Å; T214-W228 VanDerWaalsContact OG1-NE1 3.14Å; R226-W228 HydrophobicContact CG-CZ2 4.38Å; W228-L230 HydrophobicContact CB-CG 4.5Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.44Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.9Å; W228-W268 AromaticContact CE3-CD1 3.83Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.72Å; W228-W268 HydrophobicContact CH2-CG 4.34Å; W228-W268 HydrophobicContact CZ3-CB 4.35Å; W228-W268 AromaticContact CZ3-CD1 3.41Å; W228-W268 VanDerWaalsContact CZ3-CD1 3.41Å; W228-W268 HydrophobicContact CZ3-CG 4.11Å
229	A	98.3	Very high	95.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.2	163.2	0	0	0	0	0	107.8	P209 F232 I237 L239 Q266 K267 M285	P209-A229 HydrophobicContact CB-CB 3.88Å; A229-F232 HydrophobicContact CB-CD1 3.93Å; A229-F232 HydrophobicContact CB-CE1 3.64Å; A229-F232 WeakPolarHBondContact O-CE1 3.43Å; A229-I237 HydrophobicContact CB-CD1 3.71Å; A229-L239 HydrophobicContact CB-CD1 4.11Å; A229-L239 HydrophobicContact CB-CD2 4.24Å; A229-Q266 CarbonylContact O-C 3.59Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.47Å; A229-K267 PolarHBondContact N-O 2.83Å; A229-K267 PolarHBondContact O-N 2.98Å; A229-K267 VanDerWaalsContact O-O 3.09Å; A229-M285 HydrophobicContact CB-CE 3.69Å; A229-M285 HydrophobicContact CB-SD 3.87Å
230	L	98.1	Very high	96.1	Very high	54 Å²	54	42.1 Å²	42.1	28%	0.283	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	144.9	-176.7	-58.7	177.3	0	0	0	111	K210 W228 F232 Q266	K210-L230 HydrophobicContact CB-CB 4.49Å; K210-L230 PolarHBondContact N-O 3.36Å; K210-L230 PolarHBondContact O-N 3.45Å; W228-L230 HydrophobicContact CB-CG 4.5Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.44Å; L230-F232 PolarHBondContact O-N 2.83Å; L230-Q266 HydrophobicContact CD2-CB 3.6Å
231	G	97.4	Very high	96.5	Very high	19 Å²	19	35 Å²	35	20%	0.196	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	69.5	32.8	168.4	0	0	0	0	0	114	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.47Å; G231-F265 PolarHBondContact N-O 2.79Å
232	F	97.1	Very high	96.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	156.1	179.8	59.7	-89.6	0	0	0	112.4	E207 P209 A229 L230 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.21Å; E207-F232 WeakPolarHBondContact O-CB 3.5Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.91Å; P209-F232 HydrophobicContact CB-CG 4.17Å; A229-F232 HydrophobicContact CB-CD1 3.93Å; A229-F232 HydrophobicContact CB-CE1 3.64Å; A229-F232 WeakPolarHBondContact O-CE1 3.43Å; L230-F232 PolarHBondContact O-N 2.83Å; F232-P234 WeakPolarHBondContact CD2-O 3.47Å; F232-I237 HydrophobicContact CD1-CD1 4.01Å; F232-I237 HydrophobicContact CD2-CB 4.33Å; F232-I237 HydrophobicContact CD2-CD1 4.02Å; F232-I237 HydrophobicContact CE1-CD1 3.9Å; F232-I237 HydrophobicContact CE1-CG2 4.48Å; F232-I237 HydrophobicContact CE2-CB 3.77Å; F232-I237 HydrophobicContact CE2-CD1 3.94Å; F232-I237 HydrophobicContact CE2-CG1 4.43Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; 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 3.56Å; F232-T257 HydrophobicContact CE2-CG2 4.11Å; F232-T257 HydrophobicContact CZ-CG2 3.91Å; F232-T264 WeakPolarHBondContact O-CA 3.2Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.25Å; F232-F265 HydrophobicContact CD2-CB 3.96Å; F232-F265 HydrophobicContact CE1-CB 4.26Å; F232-F265 WeakPolarHBondContact CE1-O 3.35Å; F232-F265 HydrophobicContact CE2-CB 3.51Å; F232-F265 HydrophobicContact CG-CB 4.49Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 2.57Å; F232-F265 PolarHBondContact O-N 3.11Å; F232-K267 HydrophobicContact CE1-CB 4.36Å; F232-K267 HydrophobicContact CZ-CB 4.1Å; F232-H287 AromaticContact CD2-CD2 3.73Å; F232-H287 AromaticContact CD2-NE2 3.63Å
233	Y	95.7	Very high	96.8	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.016	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-151.3	136	173.9	179.5	-87.7	0	0	0	109.2	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 3.98Å; T55-Y233 PolarHBondContact OG1-OH 3.44Å; R205-Y233 HydrophobicContact CG-CD1 4.2Å; R205-Y233 VanDerWaalsContact O-CD1 3.32Å; R205-Y233 WeakPolarHBondContact O-CD1 3.39Å; A206-Y233 CarbonylContact C-O 3.55Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å; E207-Y233 PolarHBondContact N-O 2.82Å; E207-Y233 PolarHBondContact O-N 3.09Å; E207-Y233 VanDerWaalsContact O-N 3.07Å; Y233-G263 WeakPolarHBondContact CD2-O 3.47Å; Y233-F265 HydrophobicContact CD2-CD2 4.39Å; Y233-F265 AromaticContact CD2-CE2 3.95Å; Y233-F265 HydrophobicContact CD2-CE2 3.95Å; Y233-F265 HydrophobicContact CE2-CE2 4.37Å; Y233-H287 PolarHBondContact O-CE1 3.21Å
234	P	95	Very high	96.8	Very high	17 Å²	17	34 Å²	34	11%	0.11	17%	0.173	C	C	.	.	S	Bend	cis	-72.6	179.8	2.8	30.9	-36.7	0	0	0	113.3	D54 F232 E236 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.31Å; D54-P234 WeakPolarHBondContact OD2-CB 3.41Å; F232-P234 WeakPolarHBondContact CD2-O 3.47Å; P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.5Å; P234-H287 PolarHBondContact O-NE2 3.44Å; P234-E288 WeakPolarHBondContact CG-OE2 3.36Å
235	A	96	Very high	96.4	Very high	15 Å²	15	35.6 Å²	35.6	12%	0.124	19%	0.193	C	C	.	.	S	Bend	trans	-71.1	-24.8	-175.4	0	0	0	0	0	113.8	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.33Å; D54-A235 PolarHBondContact OD2-N 2.97Å; A235-I237 PolarHBondContact O-N 3.37Å; A235-T257 HydrophobicContact CB-CG2 4.29Å; 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	Very high	96.3	Very high	146 Å²	146	41.8 Å²	41.8	68%	0.682	22%	0.222	S	C	*	.			trans	-64.9	116.9	179.9	-171.2	58.5	-143.3	0	0	110.1	P234 H287	P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.5Å; E236-H287 PolarHBondContact O-CD2 2.81Å
237	I	95.4	Very high	96.1	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.056	24%	0.236	C	C	.	.			trans	-152.1	138.9	-178.4	-164	170.5	0	0	0	109.7	P209 A229 F232 A235 L239 K267 M285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.23Å; P209-I237 HydrophobicContact CG-CD1 4.14Å; A229-I237 HydrophobicContact CB-CD1 3.71Å; F232-I237 HydrophobicContact CD1-CD1 4.01Å; F232-I237 HydrophobicContact CD2-CB 4.33Å; F232-I237 HydrophobicContact CD2-CD1 4.02Å; F232-I237 HydrophobicContact CE1-CD1 3.9Å; F232-I237 HydrophobicContact CE1-CG2 4.48Å; F232-I237 HydrophobicContact CE2-CB 3.77Å; F232-I237 HydrophobicContact CE2-CD1 3.94Å; F232-I237 HydrophobicContact CE2-CG1 4.43Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; 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 3.56Å; A235-I237 PolarHBondContact O-N 3.37Å; I237-L239 HydrophobicContact CB-CD1 4.35Å; I237-L239 HydrophobicContact CD1-CD1 3.6Å; I237-L239 HydrophobicContact CG1-CD1 3.58Å; I237-L239 HydrophobicContact CG2-CD1 3.93Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.56Å; I237-M285 HydrophobicContact CD1-CG 4.15Å; I237-M285 HydrophobicContact CD1-SD 4.02Å; I237-M285 HydrophobicContact CG1-CG 4.38Å; I237-Q286 WeakPolarHBondContact CG1-O 3.34Å; I237-H287 HydrophobicContact CD1-CB 4.09Å; I237-H287 HydrophobicContact CG1-CB 3.92Å
238	T	96.1	Very high	96	Very high	60 Å²	60	44.4 Å²	44.4	37%	0.368	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125	174.5	-61.9	0	0	0	0	110	T240 M285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.16Å; T238-M285 WeakPolarHBondContact O-CA 3.5Å; T238-Q286 PolarHBondContact N-O 3.35Å; T238-Q286 PolarHBondContact O-N 2.73Å
239	L	96.5	Very high	95.5	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.037	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124	175.7	-89.1	76.8	0	0	0	108.6	A229 I237 L254 K267 A269 M285	A229-L239 HydrophobicContact CB-CD1 4.11Å; A229-L239 HydrophobicContact CB-CD2 4.24Å; I237-L239 HydrophobicContact CB-CD1 4.35Å; I237-L239 HydrophobicContact CD1-CD1 3.6Å; I237-L239 HydrophobicContact CG1-CD1 3.58Å; I237-L239 HydrophobicContact CG2-CD1 3.93Å; L239-L254 HydrophobicContact CB-CD1 4.1Å; L239-K267 HydrophobicContact CD1-CD 4.11Å; L239-A269 HydrophobicContact CB-CB 4.18Å; L239-A269 HydrophobicContact CD2-CB 4.31Å; L239-M285 HydrophobicContact CD1-CE 4.14Å; L239-M285 HydrophobicContact CD1-CG 4.05Å; L239-M285 HydrophobicContact CD1-SD 4.41Å; L239-M285 HydrophobicContact CD2-CE 4.05Å; L239-M285 HydrophobicContact CG-CE 3.96Å; L239-M285 HydrophobicContact CG-CG 4.39Å
240	T	96.7	Very high	95	Very high	42 Å²	42	56.3 Å²	56.3	26%	0.258	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	142.6	-179.9	50.9	0	0	0	0	110.6	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.16Å; T240-C283 CarbonylContact O-C 3.58Å; T240-C283 WeakPolarHBondContact O-CA 3.49Å; T240-H284 PolarHBondContact N-O 3.4Å; T240-H284 PolarHBondContact O-N 2.97Å; T240-H284 WeakPolarHBondContact OG1-CB 3.23Å; T240-H284 PolarHBondContact OG1-O 3.03Å
241	W	97.8	Very high	94.4	Very high	1 Å²	1	59 Å²	59	0%	0.004	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	136.6	169.2	-82.8	105.4	0	0	0	109.7	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.92Å; V213-W241 HydrophobicContact CG1-CZ2 4.41Å; V213-W241 HydrophobicContact CG2-CH2 4.46Å; L225-W241 HydrophobicContact CB-CH2 3.69Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CB-CZ3 4.47Å; L225-W241 HydrophobicContact CD1-CH2 4.08Å; L225-W241 HydrophobicContact CD1-CZ3 4.23Å; C227-W241 HydrophobicContact CB-CH2 4.38Å; C227-W241 HydrophobicContact CB-CZ2 3.6Å; W241-Q248 HydrophobicContact CB-CB 4.29Å; W241-Q248 PolarHBondContact O-N 2.86Å; W241-A269 VanDerWaalsContact NE1-C 3.34Å; W241-A269 PolarHBondContact NE1-O 3.46Å; W241-V271 HydrophobicContact CB-CG1 4.36Å; W241-V271 HydrophobicContact CD2-CB 4.44Å; W241-V271 HydrophobicContact CD2-CG1 3.58Å; W241-V271 HydrophobicContact CE3-CG1 4Å; W241-V271 HydrophobicContact CG-CB 4.12Å; W241-V271 HydrophobicContact CG-CG1 3.75Å; W241-V271 HydrophobicContact CZ2-CG1 4.3Å; W241-T282 VanDerWaalsContact CE3-C 3.43Å; W241-C283 HydrophobicContact CD2-CB 4.18Å; W241-C283 HydrophobicContact CE3-CB 4.08Å; W241-C283 HydrophobicContact CH2-CB 4.01Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 3.99Å
242	Q	97.3	Very high	94.2	Very high	40 Å²	40	59.3 Å²	59.3	19%	0.187	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147	171.8	-68.8	-172.6	-4.6	0	0	110.2	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.25Å; Q242-E246 WeakPolarHBondContact CA-O 3.34Å; Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.49Å; Q242-D247 PolarHBondContact NE2-OD1 3.22Å; Q242-Y281 CarbonylContact O-C 3.57Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.48Å; Q242-T282 PolarHBondContact N-O 3.49Å; Q242-T282 PolarHBondContact O-N 3.48Å; Q242-H284 PolarHBondContact OE1-CE1 3.13Å; Q242-H284 PolarHBondContact OE1-NE2 2.94Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.08Å
243	R	96.8	Very high	94.2	Very high	83 Å²	83	64.7 Å²	64.7	31%	0.313	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	116.7	168.4	-177.7	-178.2	67.8	-164.5	-6	108.5	G245 E246 Q248 R280 Y281	R243-G245 PolarHBondContact O-N 3.44Å; R243-G245 VanDerWaalsContact O-N 3.09Å; R243-E246 PolarHBondContact N-O 2.88Å; R243-E246 PolarHBondContact O-N 3.24Å; R243-Q248 HydrophobicContact CB-CG 3.96Å; R243-R280 WeakPolarHBondContact CA-O 3.45Å; R243-R280 HydrophobicContact CG-CB 4.4Å; R243-Y281 HydrophobicContact CB-CD1 4.12Å; R243-Y281 HydrophobicContact CB-CE1 3.95Å; R243-Y281 WeakPolarHBondContact CD-OH 3.21Å; R243-Y281 HydrophobicContact CG-CD2 4.46Å; R243-Y281 HydrophobicContact CG-CE1 4.19Å; R243-Y281 HydrophobicContact CG-CE2 4.1Å
244	D	94.1	Very high	94.2	Very high	97 Å²	97	68.7 Å²	68.7	52%	0.519	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	32.3	-174.4	-47.9	-60.4	0	0	0	113.8	R280	D244-R280 PolarHBondContact N-O 3.22Å; D244-R280 IonicContact OD1-CZ 3.7Å; D244-R280 IonicContact OD1-NE 3.85Å; D244-R280 PolarHBondContact OD1-NE 3.39Å; D244-R280 VanDerWaalsContact OD1-NE 3.12Å; D244-R280 IonicContact OD1-NH2 2.75Å; D244-R280 IonicContact OD2-CZ 2.84Å; D244-R280 IonicContact OD2-NE 3.72Å; D244-R280 PolarHBondContact OD2-NE 3.17Å; D244-R280 IonicContact OD2-NH2 2.76Å; D244-R280 PolarHBondContact OD2-NH2 3.08Å
245	G	90.4	Very high	94.3	Very high	49 Å²	49	69.4 Å²	69.4	51%	0.505	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	0	-177.6	0	0	0	0	0	115.8	R243	R243-G245 PolarHBondContact O-N 3.44Å; R243-G245 VanDerWaalsContact O-N 3.09Å
246	E	94.8	Very high	94.3	Very high	131 Å²	131	76.9 Å²	76.9	61%	0.612	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	126.8	175.1	-64.1	-174.9	165.4	0	0	111.9	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.25Å; Q242-E246 WeakPolarHBondContact CA-O 3.34Å; R243-E246 PolarHBondContact N-O 2.88Å; R243-E246 PolarHBondContact O-N 3.24Å; E246-Q248 PolarHBondContact O-NE2 3.36Å
247	D	94.5	Very high	94.4	Very high	93 Å²	93	72.1 Å²	72.1	50%	0.497	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	134	179.1	-68.6	-22.2	0	0	0	112.6	Q242	Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.49Å; Q242-D247 PolarHBondContact NE2-OD1 3.22Å
248	Q	94.4	Very high	94.5	Very high	14 Å²	14	76.2 Å²	76.2	7%	0.065	40%	0.396	C	S	.	.			trans	-105.7	39.3	-178	-57.4	-58.7	-67.7	0	0	112.2	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.29Å; W241-Q248 PolarHBondContact O-N 2.86Å; R243-Q248 HydrophobicContact CB-CG 3.96Å; E246-Q248 PolarHBondContact O-NE2 3.36Å; Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.41Å; Q248-D251 PolarHBondContact O-N 3.11Å; Q248-T252 WeakPolarHBondContact O-CB 3.48Å; Q248-T252 PolarHBondContact O-N 3.41Å; Q248-T252 VanDerWaalsContact O-N 3.1Å; Q248-T252 PolarHBondContact O-OG1 3.03Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å
249	T	87.8	Confident	94.6	Very high	108 Å²	108	77.9 Å²	77.9	66%	0.663	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-36.7	-169.9	-45.2	0	0	0	0	114.1
250	Q	87.7	Confident	94.6	Very high	191 Å²	191	80 Å²	80	89%	0.893	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.9	-178.5	-66.5	-175.1	10.8	0	0	113.1	Q248 T252	Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.41Å; Q250-T252 VanDerWaalsContact C-N 3.34Å
251	D	85.8	Confident	94.4	Very high	111 Å²	111	81.7 Å²	81.7	59%	0.594	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	2.4	-177.6	-58.4	-46.5	0	0	0	112.3	Q248	Q248-D251 PolarHBondContact O-N 3.11Å
252	T	94.1	Very high	94.1	Very high	25 Å²	25	87 Å²	87	15%	0.153	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.2	-179.7	-64.1	0	0	0	0	110.8	Q248 Q250 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.48Å; Q248-T252 PolarHBondContact O-N 3.41Å; Q248-T252 VanDerWaalsContact O-N 3.1Å; Q248-T252 PolarHBondContact O-OG1 3.03Å; Q250-T252 VanDerWaalsContact C-N 3.34Å; T252-L254 HydrophobicContact CG2-CB 4.4Å; T252-L254 PolarHBondContact O-N 3Å; T252-A269 HydrophobicContact CG2-CB 3.94Å; T252-A270 CarbonylContact C-O 3.53Å; T252-A270 VanDerWaalsContact CA-O 3.31Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å
253	E	96.3	Very high	93.8	Very high	113 Å²	113	87.2 Å²	87.2	53%	0.528	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	106.1	163.2	-173.8	-174.4	-172.3	0	0	108.9	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.23Å; E253-W268 HydrophobicContact CG-CH2 3.91Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; E253-A269 CarbonylContact O-C 3.49Å; E253-A269 WeakPolarHBondContact O-CA 3.44Å; E253-A270 HydrophobicContact CB-CB 4.4Å; E253-A270 PolarHBondContact N-O 3.23Å; E253-A270 PolarHBondContact O-N 3.1Å
254	L	96.4	Very high	93.8	Very high	88 Å²	88	83.6 Å²	83.6	46%	0.461	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.3	177.6	-174.3	68.3	0	0	0	109.9	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.1Å; T252-L254 HydrophobicContact CG2-CB 4.4Å; T252-L254 PolarHBondContact O-N 3Å; L254-K267 HydrophobicContact CD1-CD 4.46Å; L254-A269 HydrophobicContact CD1-CB 3.67Å
255	V	96.6	Very high	94	Very high	33 Å²	33	80.2 Å²	80.2	20%	0.2	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-83.1	153.2	174.8	-64.5	0	0	0	0	112.2	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.43Å; V255-K267 WeakPolarHBondContact O-CE 3.37Å; V255-K267 WeakPolarHBondContact O-CG 3.26Å; V255-K267 PolarHBondContact O-NZ 3.29Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.4Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.25Å; V255-W268 HydrophobicContact CG1-CH2 3.55Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.06Å; V255-W268 HydrophobicContact CG2-CD2 3.75Å; V255-W268 HydrophobicContact CG2-CE3 4.46Å; V255-W268 HydrophobicContact CG2-CG 3.73Å; V255-W268 HydrophobicContact CG2-CZ2 4.4Å; V255-W268 WeakPolarHBondContact CG2-O 3.14Å; V255-W268 PolarHBondContact N-O 3.09Å
256	E	96.6	Very high	94.4	Very high	172 Å²	172	80 Å²	80	80%	0.804	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-57.9	147.7	167.6	-67.7	-176.2	173.2	0	0	111.1	R258	E256-R258 PolarHBondContact O-N 2.84Å
257	T	97.5	Very high	94.6	Very high	45 Å²	45	74.7 Å²	74.7	28%	0.276	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-67.6	129.6	174.1	-55.7	0	0	0	0	108.3	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.11Å; F232-T257 HydrophobicContact CZ-CG2 3.91Å; A235-T257 HydrophobicContact CB-CG2 4.29Å; T257-F265 HydrophobicContact CG2-CB 3.77Å; T257-F265 HydrophobicContact CG2-CD1 3.91Å; T257-F265 HydrophobicContact CG2-CG 4.11Å; T257-K267 WeakPolarHBondContact OG1-CD 3.44Å; T257-K267 PolarHBondContact OG1-NZ 2.78Å
258	R	97.1	Very high	94.7	Very high	98 Å²	98	71.4 Å²	71.4	37%	0.37	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.9	-174.7	68.6	-167.5	-179.9	-174.5	3.5	111.3	E256 F265 Q266	E256-R258 PolarHBondContact O-N 2.84Å; R258-F265 WeakPolarHBondContact O-CA 3.4Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 3.21Å; R258-Q266 WeakPolarHBondContact O-CG 3.44Å; R258-Q266 PolarHBondContact O-N 3.05Å
259	P	97	Very high	94.9	Very high	95 Å²	95	70.8 Å²	70.8	62%	0.617	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	144.5	178.1	28.5	-34.5	0	0	0	111	F265	P259-F265 HydrophobicContact CB-CE1 4.31Å
260	A	96.3	Very high	95.4	Very high	50 Å²	50	65.8 Å²	65.8	41%	0.413	37%	0.369	S	S	.	.			trans	-87.7	-18	172.9	0	0	0	0	0	112.8	D262 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.45Å; A260-T264 WeakPolarHBondContact CB-O 3.29Å; A260-T264 PolarHBondContact N-O 3.15Å
261	G	92.9	Very high	95.8	Very high	78 Å²	78	56.8 Å²	56.8	80%	0.804	33%	0.327	S	S	*	.	S	Bend	trans	96.8	-6.8	178.5	0	0	0	0	0	114.9
262	D	92.5	Very high	96.4	Very high	113 Å²	113	54.8 Å²	54.8	60%	0.604	32%	0.318	S	S	*	.	S	Bend	trans	-104.8	11.1	176.3	60.4	1.1	0	0	0	113.1	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.45Å; D262-T264 WeakPolarHBondContact OD1-CB 3.46Å; D262-T264 PolarHBondContact OD1-N 2.83Å; D262-T264 PolarHBondContact OD1-OG1 3.44Å
263	G	91.3	Very high	96.5	Very high	44 Å²	44	53.6 Å²	53.6	45%	0.454	31%	0.311	S	S	.	.	S	Bend	trans	92.3	-4.3	-173.9	0	0	0	0	0	114.2	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.47Å
264	T	96.4	Very high	96.5	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.049	30%	0.3	C	S	.	.			trans	-103.5	173.1	175.7	73.6	0	0	0	0	112.6	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.47Å; F232-T264 WeakPolarHBondContact O-CA 3.2Å; A260-T264 WeakPolarHBondContact CB-O 3.29Å; A260-T264 PolarHBondContact N-O 3.15Å; D262-T264 WeakPolarHBondContact OD1-CB 3.46Å; D262-T264 PolarHBondContact OD1-N 2.83Å; D262-T264 PolarHBondContact OD1-OG1 3.44Å
265	F	98	Very high	96.2	Very high	25 Å²	25	48.7 Å²	48.7	11%	0.11	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	162.8	-177.4	-63.9	-85.9	0	0	0	112.4	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.77Å; D54-F265 HydrophobicContact CB-CZ 3.7Å; G231-F265 PolarHBondContact N-O 2.79Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.25Å; F232-F265 HydrophobicContact CD2-CB 3.96Å; F232-F265 HydrophobicContact CE1-CB 4.26Å; F232-F265 WeakPolarHBondContact CE1-O 3.35Å; F232-F265 HydrophobicContact CE2-CB 3.51Å; F232-F265 HydrophobicContact CG-CB 4.49Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 2.57Å; F232-F265 PolarHBondContact O-N 3.11Å; Y233-F265 HydrophobicContact CD2-CD2 4.39Å; Y233-F265 AromaticContact CD2-CE2 3.95Å; Y233-F265 HydrophobicContact CD2-CE2 3.95Å; Y233-F265 HydrophobicContact CE2-CE2 4.37Å; 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 3.91Å; T257-F265 HydrophobicContact CG2-CG 4.11Å; R258-F265 WeakPolarHBondContact O-CA 3.4Å; P259-F265 HydrophobicContact CB-CE1 4.31Å
266	Q	98.1	Very high	96	Very high	44 Å²	44	50.4 Å²	50.4	21%	0.206	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	145.4	174.1	41.6	166.4	-20.2	0	0	110	A229 L230 R258	A229-Q266 CarbonylContact O-C 3.59Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.47Å; L230-Q266 HydrophobicContact CD2-CB 3.6Å; R258-Q266 HydrophobicContact CG-CG 3.58Å; R258-Q266 PolarHBondContact N-O 3.21Å; R258-Q266 WeakPolarHBondContact O-CG 3.44Å; R258-Q266 PolarHBondContact O-N 3.05Å
267	K	98.4	Very high	95.8	Very high	21 Å²	21	45.3 Å²	45.3	9%	0.091	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	154.5	177.1	-163.1	-176.8	-171.3	69.9	0	108.8	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 2.83Å; A229-K267 PolarHBondContact O-N 2.98Å; A229-K267 VanDerWaalsContact O-O 3.09Å; F232-K267 HydrophobicContact CE1-CB 4.36Å; F232-K267 HydrophobicContact CZ-CB 4.1Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.56Å; L239-K267 HydrophobicContact CD1-CD 4.11Å; L254-K267 HydrophobicContact CD1-CD 4.46Å; V255-K267 HydrophobicContact CG2-CG 4.43Å; V255-K267 WeakPolarHBondContact O-CE 3.37Å; V255-K267 WeakPolarHBondContact O-CG 3.26Å; V255-K267 PolarHBondContact O-NZ 3.29Å; T257-K267 WeakPolarHBondContact OG1-CD 3.44Å; T257-K267 PolarHBondContact OG1-NZ 2.78Å
268	W	98.1	Very high	95.7	Very high	24 Å²	24	44 Å²	44	9%	0.091	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	156.8	169.3	58.6	-99.1	0	0	0	111.4	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.08Å; R226-W268 HydrophobicContact CG-CE3 3.86Å; R226-W268 HydrophobicContact CG-CG 4.19Å; C227-W268 CarbonylContact O-C 3.6Å; C227-W268 WeakPolarHBondContact O-CA 3.45Å; C227-W268 WeakPolarHBondContact O-CB 3.15Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.9Å; W228-W268 AromaticContact CE3-CD1 3.83Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.72Å; W228-W268 HydrophobicContact CH2-CG 4.34Å; W228-W268 HydrophobicContact CZ3-CB 4.35Å; W228-W268 AromaticContact CZ3-CD1 3.41Å; W228-W268 VanDerWaalsContact CZ3-CD1 3.41Å; W228-W268 HydrophobicContact CZ3-CG 4.11Å; E253-W268 HydrophobicContact CB-CZ3 4.23Å; E253-W268 HydrophobicContact CG-CH2 3.91Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; V255-W268 HydrophobicContact CB-CD2 4.49Å; V255-W268 HydrophobicContact CB-CZ2 4.4Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.25Å; V255-W268 HydrophobicContact CG1-CH2 3.55Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.06Å; V255-W268 HydrophobicContact CG2-CD2 3.75Å; V255-W268 HydrophobicContact CG2-CE3 4.46Å; V255-W268 HydrophobicContact CG2-CG 3.73Å; V255-W268 HydrophobicContact CG2-CZ2 4.4Å; V255-W268 WeakPolarHBondContact CG2-O 3.14Å; V255-W268 PolarHBondContact N-O 3.09Å; W268-A270 HydrophobicContact CE3-CB 3.92Å; W268-A270 HydrophobicContact CZ3-CB 3.6Å
269	A	98	Very high	95.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	132.5	173.3	0	0	0	0	0	108.5	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.25Å; C227-A269 PolarHBondContact N-O 3.44Å; C227-A269 PolarHBondContact O-N 2.88Å; L239-A269 HydrophobicContact CB-CB 4.18Å; L239-A269 HydrophobicContact CD2-CB 4.31Å; W241-A269 VanDerWaalsContact NE1-C 3.34Å; W241-A269 PolarHBondContact NE1-O 3.46Å; T252-A269 HydrophobicContact CG2-CB 3.94Å; E253-A269 CarbonylContact O-C 3.49Å; E253-A269 WeakPolarHBondContact O-CA 3.44Å; L254-A269 HydrophobicContact CD1-CB 3.67Å
270	A	97.6	Very high	95.5	Very high	3 Å²	3	45.3 Å²	45.3	3%	0.025	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.3	179	0	0	0	0	0	111.9	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.9Å; L225-A270 CarbonylContact O-C 3.49Å; L225-A270 WeakPolarHBondContact O-CA 3.33Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.13Å; T252-A270 CarbonylContact C-O 3.53Å; T252-A270 VanDerWaalsContact CA-O 3.31Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å; E253-A270 HydrophobicContact CB-CB 4.4Å; E253-A270 PolarHBondContact N-O 3.23Å; E253-A270 PolarHBondContact O-N 3.1Å; W268-A270 HydrophobicContact CE3-CB 3.92Å; W268-A270 HydrophobicContact CZ3-CB 3.6Å
271	V	97.6	Very high	95.5	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141.5	176.9	63	0	0	0	0	109	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.38Å; L225-V271 HydrophobicContact CB-CG1 4.25Å; L225-V271 PolarHBondContact N-O 3.31Å; L225-V271 PolarHBondContact O-N 3.01Å; W241-V271 HydrophobicContact CB-CG1 4.36Å; W241-V271 HydrophobicContact CD2-CB 4.44Å; W241-V271 HydrophobicContact CD2-CG1 3.58Å; W241-V271 HydrophobicContact CE3-CG1 4Å; W241-V271 HydrophobicContact CG-CB 4.12Å; W241-V271 HydrophobicContact CG-CG1 3.75Å; W241-V271 HydrophobicContact CZ2-CG1 4.3Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.44Å; V271-Y281 HydrophobicContact CG1-CD1 3.99Å; V271-Y281 HydrophobicContact CG1-CE1 4.42Å; V271-Y281 HydrophobicContact CG2-CD1 4.32Å; V271-Y281 HydrophobicContact CG2-CE1 3.97Å
272	V	97.1	Very high	95.7	Very high	69 Å²	69	41.1 Å²	41.1	42%	0.418	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	127.8	171.7	-179.7	0	0	0	0	108.2	L218 E222 A223	L218-V272 HydrophobicContact CD1-CG1 4.23Å; L218-V272 HydrophobicContact CD1-CG2 4.23Å; E222-V272 HydrophobicContact CB-CG1 4.15Å; E222-V272 HydrophobicContact CG-CG1 4.37Å; A223-V272 WeakPolarHBondContact O-CA 3.46Å
273	V	96.3	Very high	95.9	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.6	-175.9	-51.9	0	0	0	0	110.5	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.32Å; A223-V273 HydrophobicContact CB-CG2 4.5Å; A223-V273 PolarHBondContact N-O 2.81Å; A223-V273 PolarHBondContact O-N 3.22Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.09Å; L225-V273 HydrophobicContact CG-CG1 4.14Å; L225-V273 HydrophobicContact CG-CG2 3.86Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.44Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; V273-Y281 HydrophobicContact CB-CD2 4Å; V273-Y281 HydrophobicContact CB-CE2 3.72Å; V273-Y281 HydrophobicContact CG1-CD1 3.67Å; V273-Y281 HydrophobicContact CG1-CD2 3.59Å; V273-Y281 HydrophobicContact CG1-CE1 3.63Å; V273-Y281 HydrophobicContact CG1-CE2 3.58Å; V273-Y281 HydrophobicContact CG1-CG 3.64Å
274	P	95.8	Very high	96.2	Very high	45 Å²	45	35.6 Å²	35.6	29%	0.292	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	138.8	170.5	-19.3	32	0	0	0	111.2	H221 G276 Q277	H221-P274 CarbonylContact O-C 3.58Å; H221-P274 WeakPolarHBondContact O-CA 3.42Å; P274-G276 PolarHBondContact O-N 2.84Å; P274-Q277 HydrophobicContact CB-CB 4.39Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.29Å; P274-Q277 PolarHBondContact O-N 3.43Å
275	S	91.8	Very high	96.2	Very high	52 Å²	52	35.2 Å²	35.2	36%	0.364	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	130.6	175.6	-61.9	0	0	0	0	111.1	D220 H221 E222 Q277 E278	D220-S275 WeakPolarHBondContact O-CB 3.41Å; D220-S275 PolarHBondContact O-OG 3.27Å; H221-S275 PolarHBondContact O-N 2.86Å; H221-S275 PolarHBondContact O-OG 3.38Å; E222-S275 PolarHBondContact N-OG 3.26Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; S275-E278 WeakPolarHBondContact CA-OE1 3.36Å
276	G	90.6	Very high	96.1	Very high	69 Å²	69	37 Å²	37	71%	0.711	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.7	-2	-178.2	0	0	0	0	0	114.9	P274 E278	P274-G276 PolarHBondContact O-N 2.84Å; G276-E278 WeakPolarHBondContact CA-OE2 3.23Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.81Å; G276-E278 PolarHBondContact N-OE2 2.87Å
277	Q	94.3	Very high	95.9	Very high	66 Å²	66	35 Å²	35	31%	0.308	19%	0.193	S	C	.	.			trans	-106.4	6.7	175.1	-60.5	-168.2	41.3	0	0	113.2	P274 S275 Q279 R280 Y281	P274-Q277 HydrophobicContact CB-CB 4.39Å; P274-Q277 HydrophobicContact CB-CG 4.19Å; P274-Q277 WeakPolarHBondContact O-CB 3.29Å; P274-Q277 PolarHBondContact O-N 3.43Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; Q277-Q279 PolarHBondContact O-N 3.02Å; Q277-Q279 VanDerWaalsContact O-N 3.14Å; Q277-R280 WeakPolarHBondContact O-CB 3.41Å; Q277-R280 PolarHBondContact O-N 2.87Å; Q277-Y281 HydrophobicContact CB-CE2 4.5Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.13Å
278	E	94.1	Very high	95.6	Very high	18 Å²	18	37.6 Å²	37.6	8%	0.084	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-57.1	-35.2	-173.4	-57.9	80.2	-176.6	0	0	112.3	H215 L225 V273 S275 G276 R280 Y281 W298	H215-E278 IonicContact NE2-OE1 3.91Å; L225-E278 HydrophobicContact CD1-CB 4.09Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.3Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; S275-E278 WeakPolarHBondContact CA-OE1 3.36Å; G276-E278 WeakPolarHBondContact CA-OE2 3.23Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.81Å; G276-E278 PolarHBondContact N-OE2 2.87Å; E278-R280 PolarHBondContact O-N 2.71Å; E278-Y281 PolarHBondContact O-N 3.29Å; E278-Y281 VanDerWaalsContact O-N 3.12Å; E278-W298 HydrophobicContact CB-CD2 4.34Å; E278-W298 HydrophobicContact CB-CE3 3.37Å; E278-W298 HydrophobicContact CB-CZ3 3.78Å; E278-W298 HydrophobicContact CG-CE3 3.72Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å
279	Q	93.7	Very high	95.3	Very high	109 Å²	109	37.6 Å²	37.6	51%	0.509	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-69.6	-16.1	180	-63.3	-57.7	-40.1	0	0	114.2	Q277 W298	Q277-Q279 PolarHBondContact O-N 3.02Å; Q277-Q279 VanDerWaalsContact O-N 3.14Å; Q279-W298 PolarHBondContact NE2-O 2.94Å
280	R	95.7	Very high	95.1	Very high	111 Å²	111	38.7 Å²	38.7	42%	0.419	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-78.7	-13.5	174.1	-63.2	175.1	68.3	-178.4	8.6	112.3	R243 D244 Q277 E278	R243-R280 WeakPolarHBondContact CA-O 3.45Å; R243-R280 HydrophobicContact CG-CB 4.4Å; D244-R280 PolarHBondContact N-O 3.22Å; D244-R280 IonicContact OD1-CZ 3.7Å; D244-R280 IonicContact OD1-NE 3.85Å; D244-R280 PolarHBondContact OD1-NE 3.39Å; D244-R280 VanDerWaalsContact OD1-NE 3.12Å; D244-R280 IonicContact OD1-NH2 2.75Å; D244-R280 IonicContact OD2-CZ 2.84Å; D244-R280 IonicContact OD2-NE 3.72Å; D244-R280 PolarHBondContact OD2-NE 3.17Å; D244-R280 IonicContact OD2-NH2 2.76Å; D244-R280 PolarHBondContact OD2-NH2 3.08Å; Q277-R280 WeakPolarHBondContact O-CB 3.41Å; Q277-R280 PolarHBondContact O-N 2.87Å; E278-R280 PolarHBondContact O-N 2.71Å
281	Y	96.8	Very high	94.8	Very high	7 Å²	7	48.1 Å²	48.1	3%	0.027	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.2	-177.5	-70.2	-101.4	0	0	0	110.6	Q242 R243 Q248 V271 V273 Q277 E278	Q242-Y281 CarbonylContact O-C 3.57Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.48Å; R243-Y281 HydrophobicContact CB-CD1 4.12Å; R243-Y281 HydrophobicContact CB-CE1 3.95Å; R243-Y281 WeakPolarHBondContact CD-OH 3.21Å; R243-Y281 HydrophobicContact CG-CD2 4.46Å; R243-Y281 HydrophobicContact CG-CE1 4.19Å; R243-Y281 HydrophobicContact CG-CE2 4.1Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å; V271-Y281 HydrophobicContact CG1-CD1 3.99Å; V271-Y281 HydrophobicContact CG1-CE1 4.42Å; V271-Y281 HydrophobicContact CG2-CD1 4.32Å; V271-Y281 HydrophobicContact CG2-CE1 3.97Å; V273-Y281 HydrophobicContact CB-CD2 4Å; V273-Y281 HydrophobicContact CB-CE2 3.72Å; V273-Y281 HydrophobicContact CG1-CD1 3.67Å; V273-Y281 HydrophobicContact CG1-CD2 3.59Å; V273-Y281 HydrophobicContact CG1-CE1 3.63Å; V273-Y281 HydrophobicContact CG1-CE2 3.58Å; V273-Y281 HydrophobicContact CG1-CG 3.64Å; Q277-Y281 HydrophobicContact CB-CE2 4.5Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.13Å; E278-Y281 PolarHBondContact O-N 3.29Å; E278-Y281 VanDerWaalsContact O-N 3.12Å
282	T	97.4	Very high	94.5	Very high	32 Å²	32	55.3 Å²	55.3	20%	0.196	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	134.6	177.1	51.1	0	0	0	0	110.4	W241 Q242 H284 T295 L296	W241-T282 VanDerWaalsContact CE3-C 3.43Å; Q242-T282 PolarHBondContact N-O 3.49Å; Q242-T282 PolarHBondContact O-N 3.48Å; T282-H284 PolarHBondContact OG1-NE2 3.36Å; T282-T295 HydrophobicContact CG2-CG2 4.05Å; T282-L296 CarbonylContact C-O 3.59Å; T282-L296 WeakPolarHBondContact CA-O 3.15Å
283	C	97.6	Very high	94.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	120.3	171.9	175.4	0	0	0	0	109	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.32Å; C227-C283 WeakPolarHBondContact SG-CB 3.34Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 3.36Å; T240-C283 CarbonylContact O-C 3.58Å; T240-C283 WeakPolarHBondContact O-CA 3.49Å; W241-C283 HydrophobicContact CD2-CB 4.18Å; W241-C283 HydrophobicContact CE3-CB 4.08Å; W241-C283 HydrophobicContact CH2-CB 4.01Å; W241-C283 HydrophobicContact CZ2-CB 4.12Å; W241-C283 HydrophobicContact CZ3-CB 3.99Å; C283-T295 CarbonylContact O-C 3.53Å; C283-T295 WeakPolarHBondContact O-CA 3.23Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.2Å; C283-L296 PolarHBondContact O-N 2.9Å
284	H	96.8	Very high	94.3	Very high	42 Å²	42	58.7 Å²	58.7	19%	0.194	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.9	176.3	-68.3	-101.8	0	0	0	109.7	T240 Q242 T282 L294 T295	T240-H284 PolarHBondContact N-O 3.4Å; T240-H284 PolarHBondContact O-N 2.97Å; T240-H284 WeakPolarHBondContact OG1-CB 3.23Å; T240-H284 PolarHBondContact OG1-O 3.03Å; Q242-H284 PolarHBondContact OE1-CE1 3.13Å; Q242-H284 PolarHBondContact OE1-NE2 2.94Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.08Å; T282-H284 PolarHBondContact OG1-NE2 3.36Å; H284-L294 WeakPolarHBondContact CA-O 3.22Å; H284-T295 PolarHBondContact CE1-OG1 3.28Å; H284-T295 PolarHBondContact ND1-OG1 2.88Å
285	M	96.1	Very high	94.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.1	-174.3	-172	176.9	-56.5	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 4.49Å; P209-M285 HydrophobicContact CG-SD 3.41Å; P209-M285 WeakPolarHBondContact CG-SD 3.27Å; T211-M285 HydrophobicContact CG2-CE 3.48Å; T211-M285 VanDerWaalsContact CG2-CE 3.48Å; T211-M285 HydrophobicContact CG2-SD 3.36Å; T211-M285 WeakPolarHBondContact CG2-SD 3.19Å; A229-M285 HydrophobicContact CB-CE 3.69Å; A229-M285 HydrophobicContact CB-SD 3.87Å; I237-M285 HydrophobicContact CD1-CG 4.15Å; I237-M285 HydrophobicContact CD1-SD 4.02Å; I237-M285 HydrophobicContact CG1-CG 4.38Å; T238-M285 WeakPolarHBondContact O-CA 3.5Å; L239-M285 HydrophobicContact CD1-CE 4.14Å; L239-M285 HydrophobicContact CD1-CG 4.05Å; L239-M285 HydrophobicContact CD1-SD 4.41Å; L239-M285 HydrophobicContact CD2-CE 4.05Å; L239-M285 HydrophobicContact CG-CE 3.96Å; L239-M285 HydrophobicContact CG-CG 4.39Å; M285-L290 HydrophobicContact CG-CD1 4.43Å; M285-P293 CarbonylContact O-C 3.58Å; M285-P293 WeakPolarHBondContact O-CA 3.42Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.81Å; M285-L294 PolarHBondContact O-N 3.28Å; M285-L296 HydrophobicContact CE-CD1 4.29Å
286	Q	95.9	Very high	94.5	Very high	63 Å²	63	59.6 Å²	59.6	29%	0.294	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.3	176.7	-59.9	-179.1	13.3	0	0	109.3	W23 I237 T238 P293	W23-Q286 HydrophobicContact CZ2-CB 4.22Å; I237-Q286 WeakPolarHBondContact CG1-O 3.34Å; T238-Q286 PolarHBondContact N-O 3.35Å; T238-Q286 PolarHBondContact O-N 2.73Å; Q286-P293 HydrophobicContact CG-CB 4.02Å; Q286-P293 HydrophobicContact CG-CG 4.17Å
287	H	94.9	Very high	94.6	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.009	30%	0.302	C	S	.	.			trans	-160.1	132.6	-176.9	-179.1	-96.5	0	0	0	112.5	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 WeakPolarHBondContact CH2-O 3.25Å; W23-H287 WeakPolarHBondContact CZ3-O 3.35Å; E207-H287 PolarHBondContact O-CE1 3.06Å; P209-H287 HydrophobicContact CG-CB 4.22Å; F232-H287 AromaticContact CD2-CD2 3.73Å; F232-H287 AromaticContact CD2-NE2 3.63Å; Y233-H287 PolarHBondContact O-CE1 3.21Å; P234-H287 PolarHBondContact O-NE2 3.44Å; E236-H287 PolarHBondContact O-CD2 2.81Å; I237-H287 HydrophobicContact CD1-CB 4.09Å; I237-H287 HydrophobicContact CG1-CB 3.92Å; H287-G289 PolarHBondContact CE1-N 3.25Å; H287-G289 PolarHBondContact ND1-N 3.21Å; H287-G289 PolarHBondContact O-N 3.24Å; H287-L290 HydrophobicContact CB-CD1 3.94Å; H287-L290 HydrophobicContact CB-CG 4.16Å; H287-L290 WeakPolarHBondContact O-CB 3.41Å; H287-L290 PolarHBondContact O-N 3.1Å
288	E	91.5	Very high	94.6	Very high	74 Å²	74	58.2 Å²	58.2	35%	0.346	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	5.3	-70.7	156.6	179.1	-145.6	-141.8	0	0	117.9	W23 C25 A206 P234 L290	W23-E288 HydrophobicContact CD2-CB 4.22Å; W23-E288 HydrophobicContact CE3-CB 3.43Å; W23-E288 VanDerWaalsContact CE3-CB 3.43Å; W23-E288 HydrophobicContact CE3-CG 4.22Å; W23-E288 HydrophobicContact CH2-CB 4.43Å; W23-E288 VanDerWaalsContact CH2-N 3.29Å; W23-E288 VanDerWaalsContact CZ3-C 3.42Å; W23-E288 HydrophobicContact CZ3-CB 3.59Å; W23-E288 WeakPolarHBondContact CZ3-O 3.34Å; C25-E288 PolarHBondContact SG-OE1 2.91Å; A206-E288 HydrophobicContact CB-CG 3.96Å; P234-E288 WeakPolarHBondContact CG-OE2 3.36Å; E288-L290 VanDerWaalsContact C-N 3.31Å; E288-L290 PolarHBondContact O-N 3.07Å
289	G	91.8	Very high	94.3	Very high	24 Å²	24	65.4 Å²	65.4	25%	0.247	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.8	-169.9	0	0	0	0	0	114.7	H287	H287-G289 PolarHBondContact CE1-N 3.25Å; H287-G289 PolarHBondContact ND1-N 3.21Å; H287-G289 PolarHBondContact O-N 3.24Å
290	L	93.7	Very high	93.6	Very high	23 Å²	23	63.4 Å²	63.4	12%	0.12	33%	0.326	C	S	.	.			trans	-91.7	129.2	179.3	-63.4	174.6	0	0	0	110.7	P208 P209 M285 H287 E288 E292 L294	P208-L290 HydrophobicContact CB-CD2 3.86Å; P209-L290 HydrophobicContact CG-CD1 4.11Å; P209-L290 HydrophobicContact CG-CD2 4.43Å; P209-L290 HydrophobicContact CG-CG 4.38Å; M285-L290 HydrophobicContact CG-CD1 4.43Å; H287-L290 HydrophobicContact CB-CD1 3.94Å; H287-L290 HydrophobicContact CB-CG 4.16Å; H287-L290 WeakPolarHBondContact O-CB 3.41Å; H287-L290 PolarHBondContact O-N 3.1Å; E288-L290 VanDerWaalsContact C-N 3.31Å; E288-L290 PolarHBondContact O-N 3.07Å; L290-E292 VanDerWaalsContact C-N 3.3Å; L290-E292 PolarHBondContact O-N 2.97Å; L290-L294 HydrophobicContact CD1-CB 4.43Å; L290-L294 HydrophobicContact CD1-CD1 3.89Å; L290-L294 HydrophobicContact CD1-CG 3.89Å; L290-L294 HydrophobicContact CD2-CD1 3.53Å; L290-L294 HydrophobicContact CD2-CG 3.93Å; L290-L294 HydrophobicContact CG-CD1 4.37Å
291	Q	90.6	Very high	92	Very high	202 Å²	202	62.8 Å²	62.8	94%	0.944	34%	0.339	S	S	*	.	S	Bend	trans	-65.4	-36.6	174.8	-67.1	-177.8	-3.1	0	0	112.2
292	E	91.9	Very high	89.7	Confident	153 Å²	153	67.6 Å²	67.6	72%	0.715	37%	0.373	S	S	*	.	S	Bend	trans	-139.5	151.6	176.5	-66.1	-176.3	177.7	0	0	109.2	L290 L294	L290-E292 VanDerWaalsContact C-N 3.3Å; L290-E292 PolarHBondContact O-N 2.97Å; E292-L294 PolarHBondContact O-N 2.87Å
293	P	94	Very high	87.1	Confident	81 Å²	81	73.8 Å²	73.8	53%	0.526	40%	0.4	S	S	.	.			trans	-52.7	134	172.9	-27.1	35.8	0	0	0	112.1	M285 Q286	M285-P293 CarbonylContact O-C 3.58Å; M285-P293 WeakPolarHBondContact O-CA 3.42Å; Q286-P293 HydrophobicContact CG-CB 4.02Å; Q286-P293 HydrophobicContact CG-CG 4.17Å
294	L	94.8	Very high	84.6	Confident	60 Å²	60	78.4 Å²	78.4	31%	0.314	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	139.5	177.4	-69.7	177.6	0	0	0	110.6	T211 H284 M285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.26Å; H284-L294 WeakPolarHBondContact CA-O 3.22Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.81Å; M285-L294 PolarHBondContact O-N 3.28Å; L290-L294 HydrophobicContact CD1-CB 4.43Å; L290-L294 HydrophobicContact CD1-CD1 3.89Å; L290-L294 HydrophobicContact CD1-CG 3.89Å; L290-L294 HydrophobicContact CD2-CD1 3.53Å; L290-L294 HydrophobicContact CD2-CG 3.93Å; L290-L294 HydrophobicContact CG-CD1 4.37Å; E292-L294 PolarHBondContact O-N 2.87Å
295	T	96.4	Very high	82.3	Confident	81 Å²	81	82.7 Å²	82.7	50%	0.497	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.3	170.8	-55.9	0	0	0	0	108.5	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 4.05Å; C283-T295 CarbonylContact O-C 3.53Å; C283-T295 WeakPolarHBondContact O-CA 3.23Å; H284-T295 PolarHBondContact CE1-OG1 3.28Å; H284-T295 PolarHBondContact ND1-OG1 2.88Å
296	L	95.7	Very high	80.3	Confident	34 Å²	34	87.5 Å²	87.5	18%	0.178	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.2	-174.3	-60	161	0	0	0	109.8	T211 V213 T282 C283 M285	T211-L296 VanDerWaalsContact CB-CD1 3.47Å; T211-L296 HydrophobicContact CG2-CD1 4.06Å; V213-L296 HydrophobicContact CG2-CB 3.91Å; T282-L296 CarbonylContact C-O 3.59Å; T282-L296 WeakPolarHBondContact CA-O 3.15Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.2Å; C283-L296 PolarHBondContact O-N 2.9Å; M285-L296 HydrophobicContact CE-CD1 4.29Å
297	S	93.8	Very high	78.2	Confident	59 Å²	59	88.6 Å²	88.6	41%	0.413	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	162.2	166.4	55.3	0	0	0	0	110.1	E299	S297-E299 PolarHBondContact O-N 3.32Å
298	W	94.1	Very high	76.6	Confident	48 Å²	48	94 Å²	94	18%	0.182	53%	0.525	C	S	.	.			trans	-71.7	124.7	170.1	169.4	61.1	0	0	0	110.1	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.48Å; V213-W298 HydrophobicContact CG1-CB 3.83Å; H215-W298 HydrophobicContact CB-CD2 4.2Å; H215-W298 HydrophobicContact CB-CG 4.23Å; H215-W298 HydrophobicContact CB-CZ2 4.05Å; H215-W298 VanDerWaalsContact CB-NE1 3.27Å; H215-W298 AromaticContact CG-CE2 3.83Å; H215-W298 AromaticContact CG-CZ2 3.86Å; L225-W298 HydrophobicContact CD1-CB 4.34Å; L225-W298 HydrophobicContact CD2-CB 3.82Å; L225-W298 HydrophobicContact CD2-CD2 4.38Å; L225-W298 HydrophobicContact CD2-CG 3.93Å; E278-W298 HydrophobicContact CB-CD2 4.34Å; E278-W298 HydrophobicContact CB-CE3 3.37Å; E278-W298 HydrophobicContact CB-CZ3 3.78Å; E278-W298 HydrophobicContact CG-CE3 3.72Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å; Q279-W298 PolarHBondContact NE2-O 2.94Å; W298-P300 HydrophobicContact CE3-CG 4.34Å; W298-P300 HydrophobicContact CH2-CB 4.2Å; W298-P300 HydrophobicContact CH2-CG 3.88Å; W298-P300 HydrophobicContact CZ2-CB 4.08Å; W298-P300 HydrophobicContact CZ2-CG 4.11Å; W298-P300 HydrophobicContact CZ3-CG 3.99Å
299	E	86.8	Confident	74.8	Confident	169 Å²	169	98.4 Å²	98.4	79%	0.79	55%	0.547	S	S	*	.			trans	-104.2	119.7	172.6	-163.4	153.8	-156.1	0	0	109.5	S297 S301	S297-E299 PolarHBondContact O-N 3.32Å; E299-S301 PolarHBondContact O-N 3.18Å
300	P	79.6	Confident	73.4	Confident	66 Å²	66	99.4 Å²	99.4	43%	0.429	56%	0.558	S	S	.	*			trans	-58.1	128.5	174.3	-19.8	30	0	0	0	109.2	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.34Å; W298-P300 HydrophobicContact CH2-CB 4.2Å; W298-P300 HydrophobicContact CH2-CG 3.88Å; W298-P300 HydrophobicContact CZ2-CB 4.08Å; W298-P300 HydrophobicContact CZ2-CG 4.11Å; W298-P300 HydrophobicContact CZ3-CG 3.99Å; P300-S302 PolarHBondContact O-N 3.38Å
301	S	62.6	Low	72.3	Confident	99 Å²	99	103 Å²	103	69%	0.692	58%	0.576	S	S	*	*			trans	-52.7	106.4	177.2	175.8	0	0	0	0	110.2	E299 Q303	E299-S301 PolarHBondContact O-N 3.18Å; S301-Q303 PolarHBondContact O-N 3.46Å
302	S	48.5	Very low	71.4	Confident	108 Å²	108	97.7 Å²	97.7	76%	0.755	56%	0.557	S	S	*	*			trans	-79.8	65.2	165.1	63.8	0	0	0	0	108.1	P300 P304	P300-S302 PolarHBondContact O-N 3.38Å; S302-P304 WeakPolarHBondContact O-CD 3.38Å
303	Q	42.8	Very low	70.4	Confident	161 Å²	161	92.9 Å²	92.9	75%	0.752	54%	0.544	S	S	*	.			trans	-75.7	103.6	152.9	-84.2	-170.5	-14.4	0	0	105.8	S301 T305	S301-Q303 PolarHBondContact O-N 3.46Å; Q303-T305 PolarHBondContact O-N 2.99Å
304	P	44.5	Very low	69.6	Low	98 Å²	98	90.8 Å²	90.8	64%	0.636	54%	0.536	S	S	*	.			trans	-57.6	116.4	161.5	25.1	-30.8	0	0	0	104.9	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.38Å; P304-I306 HydrophobicContact CB-CG1 4.11Å; P304-I306 HydrophobicContact CG-CG1 4.14Å; P304-I306 PolarHBondContact O-N 2.83Å
305	T	49	Very low	69	Low	132 Å²	132	92.8 Å²	92.8	81%	0.81	55%	0.547	S	S	*	.			trans	-65.1	78.7	158.1	-45.7	0	0	0	0	105	Q303 P307	Q303-T305 PolarHBondContact O-N 2.99Å; T305-P307 VanDerWaalsContact O-CD 3.22Å; T305-P307 WeakPolarHBondContact O-CD 3.46Å
306	I	52.9	Low	68.2	Low	100 Å²	100	91.6 Å²	91.6	51%	0.513	55%	0.545	S	S	.	.			trans	-54.9	117.6	168.3	-62.3	175.7	0	0	0	102.9	P304 I308 I311	P304-I306 HydrophobicContact CB-CG1 4.11Å; P304-I306 HydrophobicContact CG-CG1 4.14Å; P304-I306 PolarHBondContact O-N 2.83Å; I306-I308 HydrophobicContact CB-CG1 4.32Å; I306-I308 HydrophobicContact CG2-CG1 4.02Å; I306-I308 PolarHBondContact O-N 3.36Å; I306-I311 HydrophobicContact CG2-CD1 4.29Å
307	P	52.7	Low	67.6	Low	86 Å²	86	94 Å²	94	56%	0.558	56%	0.561	S	S	*	*			trans	-75	74.2	-178.4	31.3	-32.7	0	0	0	106.8	T305 M309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.22Å; T305-P307 WeakPolarHBondContact O-CD 3.46Å; P307-M309 PolarHBondContact O-N 2.77Å; P307-M309 VanDerWaalsContact O-N 3.12Å; P307-G310 WeakPolarHBondContact O-CA 3.49Å; P307-G310 PolarHBondContact O-N 3.09Å; P307-I311 PolarHBondContact O-N 3.21Å
308	I	60.2	Low	67.1	Low	117 Å²	117	96.8 Å²	96.8	60%	0.6	57%	0.571	S	S	*	*	H	α-helix	trans	-54.2	-33.8	177.5	-65.4	170.9	0	0	0	108.5	I306 G310 I311 V312	I306-I308 HydrophobicContact CB-CG1 4.32Å; I306-I308 HydrophobicContact CG2-CG1 4.02Å; I306-I308 PolarHBondContact O-N 3.36Å; I308-G310 PolarHBondContact O-N 3.43Å; I308-I311 PolarHBondContact O-N 3.41Å; I308-V312 HydrophobicContact CG2-CG2 4.36Å; I308-V312 WeakPolarHBondContact O-CB 3.42Å; I308-V312 VanDerWaalsContact O-CG2 3.23Å; I308-V312 WeakPolarHBondContact O-CG2 3.37Å; I308-V312 PolarHBondContact O-N 2.68Å
309	M	55	Low	66.6	Low	165 Å²	165	98.8 Å²	98.8	81%	0.813	59%	0.588	S	S	*	*	H	α-helix	trans	-65.2	-34.8	174.7	-163.1	133.7	62.1	0	0	113.8	P307 A313	P307-M309 PolarHBondContact O-N 2.77Å; P307-M309 VanDerWaalsContact O-N 3.12Å; M309-A313 VanDerWaalsContact O-CB 3.28Å; M309-A313 WeakPolarHBondContact O-CB 3.5Å; M309-A313 PolarHBondContact O-N 3.45Å
310	G	61.9	Low	66.4	Low	46 Å²	46	94.8 Å²	94.8	47%	0.474	58%	0.575	S	S	.	*	H	α-helix	trans	-72.3	-37.2	177	0	0	0	0	0	112.9	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.49Å; P307-G310 PolarHBondContact O-N 3.09Å; I308-G310 PolarHBondContact O-N 3.43Å; G310-G314 PolarHBondContact O-N 3.02Å
311	I	71	Confident	66.6	Low	98 Å²	98	96.6 Å²	96.6	50%	0.503	58%	0.581	S	S	.	*	H	α-helix	trans	-70	-42.5	176.7	-61.6	173.3	0	0	0	110.6	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 4.29Å; P307-I311 PolarHBondContact O-N 3.21Å; I308-I311 PolarHBondContact O-N 3.41Å; I311-G314 PolarHBondContact O-N 2.88Å; I311-L315 HydrophobicContact CG2-CD1 3.97Å; I311-L315 WeakPolarHBondContact O-CB 3.5Å; I311-L315 WeakPolarHBondContact O-CG 3.4Å; I311-L315 PolarHBondContact O-N 2.89Å
312	V	72.1	Confident	67.4	Low	90 Å²	90	95 Å²	95	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-65.8	-42.6	177.3	173.4	0	0	0	0	111.3	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.36Å; I308-V312 WeakPolarHBondContact O-CB 3.42Å; I308-V312 VanDerWaalsContact O-CG2 3.23Å; I308-V312 WeakPolarHBondContact O-CG2 3.37Å; I308-V312 PolarHBondContact O-N 2.68Å; V312-L315 PolarHBondContact O-N 2.71Å; V312-A316 WeakPolarHBondContact O-CB 3.31Å; V312-A316 PolarHBondContact O-N 3.09Å
313	A	71.1	Confident	69	Low	53 Å²	53	94 Å²	94	44%	0.438	56%	0.563	S	S	.	*	H	α-helix	trans	-63.3	-43.1	174.8	0	0	0	0	0	111.9	M309 A316 V317	M309-A313 VanDerWaalsContact O-CB 3.28Å; M309-A313 WeakPolarHBondContact O-CB 3.5Å; M309-A313 PolarHBondContact O-N 3.45Å; A313-A316 PolarHBondContact O-N 2.86Å; A313-V317 WeakPolarHBondContact O-CG2 3.22Å; A313-V317 PolarHBondContact O-N 3.35Å
314	G	77.3	Confident	70.8	Confident	36 Å²	36	91.1 Å²	91.1	37%	0.371	55%	0.552	S	S	.	*	H	α-helix	trans	-62.3	-43.5	176.8	0	0	0	0	0	113.1	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 3.02Å; I311-G314 PolarHBondContact O-N 2.88Å; G314-V317 PolarHBondContact O-N 2.75Å; G314-L318 PolarHBondContact O-N 3.38Å
315	L	82.2	Confident	72.4	Confident	103 Å²	103	88.1 Å²	88.1	54%	0.539	54%	0.539	S	S	.	.	H	α-helix	trans	-65.6	-41.4	176.1	-81.4	164.5	0	0	0	112.2	I311 V312 V317 L318 V319	I311-L315 HydrophobicContact CG2-CD1 3.97Å; I311-L315 WeakPolarHBondContact O-CB 3.5Å; I311-L315 WeakPolarHBondContact O-CG 3.4Å; I311-L315 PolarHBondContact O-N 2.89Å; V312-L315 PolarHBondContact O-N 2.71Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 3.42Å; L315-L318 PolarHBondContact O-N 3.04Å; L315-V319 WeakPolarHBondContact O-CG2 3.4Å; L315-V319 PolarHBondContact O-N 3.2Å
316	A	79.3	Confident	73.8	Confident	56 Å²	56	84.6 Å²	84.6	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-61.4	-42.6	176.8	0	0	0	0	0	111.7	V312 A313 V319 V320	V312-A316 WeakPolarHBondContact O-CB 3.31Å; V312-A316 PolarHBondContact O-N 3.09Å; A313-A316 PolarHBondContact O-N 2.86Å; A316-V319 PolarHBondContact O-N 2.91Å; A316-V320 VanDerWaalsContact O-CG2 3.29Å; A316-V320 WeakPolarHBondContact O-CG2 3.5Å; A316-V320 PolarHBondContact O-N 3.34Å
317	V	83.3	Confident	74.9	Confident	85 Å²	85	83.4 Å²	83.4	52%	0.515	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-42.9	176.4	172.7	0	0	0	0	111.4	A313 G314 L315 V319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.22Å; A313-V317 PolarHBondContact O-N 3.35Å; G314-V317 PolarHBondContact O-N 2.75Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 3.42Å; V317-V319 PolarHBondContact O-N 3.05Å; V317-V320 PolarHBondContact O-N 3.17Å; V317-L321 HydrophobicContact CG1-CD1 3.94Å; V317-L321 HydrophobicContact CG1-CG 4.38Å; V317-L321 WeakPolarHBondContact O-CB 3.27Å; V317-L321 WeakPolarHBondContact O-CG 3.37Å; V317-L321 PolarHBondContact O-N 2.73Å
318	L	82.7	Confident	76.1	Confident	117 Å²	117	83.1 Å²	83.1	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-61	-42.5	176.4	-90.4	161.1	0	0	0	112.5	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.38Å; L315-L318 PolarHBondContact O-N 3.04Å; L318-L321 PolarHBondContact O-N 2.75Å; L318-A322 WeakPolarHBondContact O-CB 3.47Å; L318-A322 PolarHBondContact O-N 3.01Å
319	V	82.6	Confident	76.6	Confident	90 Å²	90	81.7 Å²	81.7	55%	0.545	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-44.2	176.4	172.6	0	0	0	0	110.9	L315 A316 V317 L321 A322 V323	L315-V319 WeakPolarHBondContact O-CG2 3.4Å; L315-V319 PolarHBondContact O-N 3.2Å; A316-V319 PolarHBondContact O-N 2.91Å; V317-V319 PolarHBondContact O-N 3.05Å; V319-L321 PolarHBondContact O-N 3.17Å; V319-A322 PolarHBondContact O-N 3.35Å; V319-V323 HydrophobicContact CG1-CG2 4.48Å; V319-V323 WeakPolarHBondContact O-CG2 3.36Å; V319-V323 PolarHBondContact O-N 3.07Å
320	V	83	Confident	77.4	Confident	84 Å²	84	76.4 Å²	76.4	51%	0.509	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-44.3	177.2	171.5	0	0	0	0	111.1	A316 V317 A322 V323 L324	A316-V320 VanDerWaalsContact O-CG2 3.29Å; A316-V320 WeakPolarHBondContact O-CG2 3.5Å; A316-V320 PolarHBondContact O-N 3.34Å; V317-V320 PolarHBondContact O-N 3.17Å; V320-A322 PolarHBondContact O-N 3.09Å; V320-V323 PolarHBondContact O-N 2.99Å; V320-L324 HydrophobicContact CG1-CD1 3.92Å; V320-L324 HydrophobicContact CG1-CG 4.42Å; V320-L324 WeakPolarHBondContact O-CB 3.32Å; V320-L324 VanDerWaalsContact O-CG 3.3Å; V320-L324 WeakPolarHBondContact O-CG 3.34Å; V320-L324 PolarHBondContact O-N 2.73Å
321	L	83.3	Confident	77.8	Confident	105 Å²	105	80.2 Å²	80.2	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-63.9	-39.7	176.9	-72.3	172.1	0	0	0	112.3	V317 L318 V319 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.94Å; V317-L321 HydrophobicContact CG1-CG 4.38Å; V317-L321 WeakPolarHBondContact O-CB 3.27Å; V317-L321 WeakPolarHBondContact O-CG 3.37Å; V317-L321 PolarHBondContact O-N 2.73Å; L318-L321 PolarHBondContact O-N 2.75Å; V319-L321 PolarHBondContact O-N 3.17Å; L321-L324 PolarHBondContact O-N 2.78Å; L321-G325 PolarHBondContact O-N 3.31Å
322	A	80.4	Confident	77.7	Confident	66 Å²	66	81.9 Å²	81.9	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-42.3	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 3.01Å; V319-A322 PolarHBondContact O-N 3.35Å; V320-A322 PolarHBondContact O-N 3.09Å; A322-G325 PolarHBondContact O-N 3.31Å; A322-A326 WeakPolarHBondContact O-CB 3.39Å; A322-A326 PolarHBondContact O-N 2.9Å
323	V	81.8	Confident	77.2	Confident	86 Å²	86	81.3 Å²	81.3	52%	0.521	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-45.2	176.1	173.1	0	0	0	0	110.8	V319 V320 G325 A326 V327	V319-V323 HydrophobicContact CG1-CG2 4.48Å; V319-V323 WeakPolarHBondContact O-CG2 3.36Å; V319-V323 PolarHBondContact O-N 3.07Å; V320-V323 PolarHBondContact O-N 2.99Å; V323-G325 VanDerWaalsContact C-N 3.35Å; V323-G325 PolarHBondContact O-N 2.96Å; V323-A326 PolarHBondContact O-N 3.4Å; V323-V327 HydrophobicContact CG1-CG2 4.42Å; V323-V327 VanDerWaalsContact O-CG2 3.29Å; V323-V327 WeakPolarHBondContact O-CG2 3.44Å; V323-V327 PolarHBondContact O-N 2.71Å
324	L	80	Confident	76.6	Confident	100 Å²	100	88.5 Å²	88.5	52%	0.524	53%	0.526	S	S	.	.	H	α-helix	trans	-62.1	-42.8	176.3	-71.2	172	0	0	0	111.5	V320 L321 A326 V327 V328	V320-L324 HydrophobicContact CG1-CD1 3.92Å; V320-L324 HydrophobicContact CG1-CG 4.42Å; V320-L324 WeakPolarHBondContact O-CB 3.32Å; V320-L324 VanDerWaalsContact O-CG 3.3Å; V320-L324 WeakPolarHBondContact O-CG 3.34Å; V320-L324 PolarHBondContact O-N 2.73Å; L321-L324 PolarHBondContact O-N 2.78Å; L324-A326 PolarHBondContact O-N 2.87Å; L324-V327 PolarHBondContact O-N 3.16Å; L324-V328 VanDerWaalsContact O-CG2 3.31Å; L324-V328 WeakPolarHBondContact O-CG2 3.06Å; L324-V328 PolarHBondContact O-N 3.32Å
325	G	78.9	Confident	75.6	Confident	35 Å²	35	97.5 Å²	97.5	36%	0.361	55%	0.548	S	S	.	.	H	α-helix	trans	-60.1	-43	174.5	0	0	0	0	0	112.7	L321 A322 V323 V328 T329	L321-G325 PolarHBondContact O-N 3.31Å; A322-G325 PolarHBondContact O-N 3.31Å; V323-G325 VanDerWaalsContact C-N 3.35Å; V323-G325 PolarHBondContact O-N 2.96Å; G325-V328 PolarHBondContact O-N 2.94Å; G325-T329 WeakPolarHBondContact O-CB 3.4Å; G325-T329 PolarHBondContact O-N 3.19Å; G325-T329 PolarHBondContact O-OG1 2.93Å
326	A	77.1	Confident	74.1	Confident	59 Å²	59	101.4 Å²	101.4	49%	0.488	56%	0.561	S	S	.	*	H	α-helix	trans	-65.4	-41.4	176	0	0	0	0	0	112.2	A322 V323 L324 T329 A330	A322-A326 WeakPolarHBondContact O-CB 3.39Å; A322-A326 PolarHBondContact O-N 2.9Å; V323-A326 PolarHBondContact O-N 3.4Å; L324-A326 PolarHBondContact O-N 2.87Å; A326-T329 PolarHBondContact O-N 3.18Å; A326-A330 VanDerWaalsContact O-CB 3.29Å; A326-A330 WeakPolarHBondContact O-CB 3.17Å; A326-A330 PolarHBondContact O-N 3.47Å
327	V	77.8	Confident	72.7	Confident	74 Å²	74	103.2 Å²	103.2	45%	0.448	57%	0.57	S	S	.	*	H	α-helix	trans	-65.2	-44.2	177.2	171.4	0	0	0	0	111.1	V323 L324 A330 M331	V323-V327 HydrophobicContact CG1-CG2 4.42Å; V323-V327 VanDerWaalsContact O-CG2 3.29Å; V323-V327 WeakPolarHBondContact O-CG2 3.44Å; V323-V327 PolarHBondContact O-N 2.71Å; L324-V327 PolarHBondContact O-N 3.16Å; V327-A330 PolarHBondContact O-N 3.09Å; V327-M331 HydrophobicContact CG1-CG 4.4Å; V327-M331 WeakPolarHBondContact O-CB 3.38Å; V327-M331 VanDerWaalsContact O-CG 3.29Å; V327-M331 WeakPolarHBondContact O-CG 3.29Å; V327-M331 PolarHBondContact O-N 3.27Å
328	V	76.6	Confident	71	Confident	81 Å²	81	104.3 Å²	104.3	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-62.5	-44.3	176.1	172.1	0	0	0	0	110.6	L324 G325 A330 M331 M332	L324-V328 VanDerWaalsContact O-CG2 3.31Å; L324-V328 WeakPolarHBondContact O-CG2 3.06Å; L324-V328 PolarHBondContact O-N 3.32Å; G325-V328 PolarHBondContact O-N 2.94Å; V328-A330 PolarHBondContact O-N 3.22Å; V328-M331 PolarHBondContact O-N 3.22Å; V328-M332 HydrophobicContact CG1-CG 4.47Å; V328-M332 HydrophobicContact CG1-SD 4.22Å; V328-M332 WeakPolarHBondContact O-CB 3.37Å; V328-M332 WeakPolarHBondContact O-CG 3.47Å; V328-M332 PolarHBondContact O-N 3.41Å
329	T	72	Confident	69.2	Low	86 Å²	86	101.9 Å²	101.9	53%	0.528	59%	0.585	S	S	.	*	H	α-helix	trans	-62.4	-44.4	177.2	-53.5	0	0	0	0	111.2	G325 A326 M331 M332 C333	G325-T329 WeakPolarHBondContact O-CB 3.4Å; G325-T329 PolarHBondContact O-N 3.19Å; G325-T329 PolarHBondContact O-OG1 2.93Å; A326-T329 PolarHBondContact O-N 3.18Å; T329-M331 PolarHBondContact O-N 3.02Å; T329-M332 PolarHBondContact O-N 3.42Å; T329-C333 WeakPolarHBondContact O-CB 3.25Å; T329-C333 PolarHBondContact O-N 3.02Å; T329-C333 PolarHBondContact O-SG 3.06Å; T329-C333 VanDerWaalsContact O-SG 3.34Å
330	A	71.3	Confident	67	Low	55 Å²	55	101.6 Å²	101.6	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-65.2	-38.3	176.5	0	0	0	0	0	112.5	A326 V327 V328 C333 R334	A326-A330 VanDerWaalsContact O-CB 3.29Å; A326-A330 WeakPolarHBondContact O-CB 3.17Å; A326-A330 PolarHBondContact O-N 3.47Å; V327-A330 PolarHBondContact O-N 3.09Å; V328-A330 PolarHBondContact O-N 3.22Å; A330-C333 PolarHBondContact O-N 3.15Å; A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 3.2Å
331	M	70.4	Confident	64.7	Low	126 Å²	126	108.1 Å²	108.1	62%	0.621	62%	0.622	S	S	*	*	H	α-helix	trans	-68.3	-39.4	174.9	-74	-133.4	-68.3	0	0	112	V327 V328 T329 R334 R335	V327-M331 HydrophobicContact CG1-CG 4.4Å; V327-M331 WeakPolarHBondContact O-CB 3.38Å; V327-M331 VanDerWaalsContact O-CG 3.29Å; V327-M331 WeakPolarHBondContact O-CG 3.29Å; V327-M331 PolarHBondContact O-N 3.27Å; V328-M331 PolarHBondContact O-N 3.22Å; T329-M331 PolarHBondContact O-N 3.02Å; M331-R334 PolarHBondContact O-N 3.45Å; M331-R335 WeakPolarHBondContact O-CB 3.42Å; M331-R335 PolarHBondContact O-N 2.97Å
332	M	69.5	Low	62.4	Low	132 Å²	132	106.9 Å²	106.9	65%	0.65	64%	0.635	S	S	*	*	H	α-helix	trans	-67.1	-39.4	174.2	-71.5	-174.8	80.5	0	0	111.8	V328 T329 R335 K336	V328-M332 HydrophobicContact CG1-CG 4.47Å; V328-M332 HydrophobicContact CG1-SD 4.22Å; V328-M332 WeakPolarHBondContact O-CB 3.37Å; V328-M332 WeakPolarHBondContact O-CG 3.47Å; V328-M332 PolarHBondContact O-N 3.41Å; T329-M332 PolarHBondContact O-N 3.42Å; M332-R335 PolarHBondContact O-N 2.63Å; M332-K336 WeakPolarHBondContact O-CB 3.31Å; M332-K336 PolarHBondContact O-N 3.22Å
333	C	60	Low	60.1	Low	79 Å²	79	107.9 Å²	107.9	53%	0.534	65%	0.652	S	S	.	*	H	α-helix	trans	-62.5	-42.7	171.7	-73.5	0	0	0	0	111.7	T329 A330 K336 S337	T329-C333 WeakPolarHBondContact O-CB 3.25Å; T329-C333 PolarHBondContact O-N 3.02Å; T329-C333 PolarHBondContact O-SG 3.06Å; T329-C333 VanDerWaalsContact O-SG 3.34Å; A330-C333 PolarHBondContact O-N 3.15Å; C333-K336 PolarHBondContact O-N 3.29Å; C333-S337 WeakPolarHBondContact O-CB 3.22Å; C333-S337 PolarHBondContact O-N 2.88Å; C333-S337 PolarHBondContact O-OG 3.05Å; C333-S337 VanDerWaalsContact O-OG 3.11Å
334	R	59.7	Low	57.8	Low	204 Å²	204	109.5 Å²	109.5	77%	0.77	67%	0.667	S	S	*	*	H	α-helix	trans	-67.3	-33.3	175.4	-83.9	-170.8	163.4	-176.1	-3.1	113.5	A330 M331 K336 S337	A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 3.2Å; M331-R334 PolarHBondContact O-N 3.45Å; R334-K336 VanDerWaalsContact C-N 3.32Å; R334-S337 PolarHBondContact O-OG 3.04Å
335	R	55.7	Low	55.5	Low	225 Å²	225	109.8 Å²	109.8	85%	0.849	68%	0.676	S	S	*	*	H	α-helix	trans	-72.9	-26.7	174.2	-128.9	178	-177	175.4	0.9	112.3	M331 M332	M331-R335 WeakPolarHBondContact O-CB 3.42Å; M331-R335 PolarHBondContact O-N 2.97Å; M332-R335 PolarHBondContact O-N 2.63Å
336	K	50.5	Low	53.3	Low	184 Å²	184	113.2 Å²	113.2	80%	0.8	69%	0.694	S	S	*	*	H	α-helix	trans	-90.4	-17.7	178.7	-160.9	163.9	-179.3	176.1	0	113.5	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.31Å; M332-K336 PolarHBondContact O-N 3.22Å; C333-K336 PolarHBondContact O-N 3.29Å; R334-K336 VanDerWaalsContact C-N 3.32Å
337	S	50	Low	51.3	Low	94 Å²	94	119.5 Å²	119.5	66%	0.657	71%	0.713	S	S	*	*	S	Bend	trans	-93.3	4.9	177.2	65.6	0	0	0	0	115	C333 R334 G339	C333-S337 WeakPolarHBondContact O-CB 3.22Å; C333-S337 PolarHBondContact O-N 2.88Å; C333-S337 PolarHBondContact O-OG 3.05Å; C333-S337 VanDerWaalsContact O-OG 3.11Å; R334-S337 PolarHBondContact O-OG 3.04Å; S337-G339 VanDerWaalsContact C-N 3.27Å; S337-G339 PolarHBondContact O-N 3.39Å
338	S	48.2	Very low	49.2	Very low	109 Å²	109	120.2 Å²	120.2	76%	0.762	73%	0.727	S	S	*	*	S	Bend	trans	-90.6	25.8	172	82.8	0	0	0	0	113.7
339	G	43.5	Very low	47	Very low	66 Å²	66	121.4 Å²	121.4	68%	0.68	75%	0.745	S	S	*	*	S	Bend	trans	-167.9	105.3	171.4	0	0	0	0	0	111.2	S337	S337-G339 VanDerWaalsContact C-N 3.27Å; S337-G339 PolarHBondContact O-N 3.39Å
340	G	36.6	Very low	45.1	Very low	84 Å²	84	123.3 Å²	123.3	87%	0.866	76%	0.761	S	S	*	*			trans	136.9	104.9	165.1	0	0	0	0	0	115.1
341	K	36.1	Very low	43.2	Very low	220 Å²	220	126.4 Å²	126.4	96%	0.957	78%	0.779	S	S	*	*			trans	-77.3	144.8	177.4	-171.5	164.7	178.8	172.1	0	111.4
342	G	33.9	Very low	41.6	Very low	80 Å²	80	127.9 Å²	127.9	83%	0.825	79%	0.79	S	S	*	*			trans	128.1	133.6	148.2	0	0	0	0	0	117.6
343	G	31.5	Very low	40.1	Very low	87 Å²	87	126.9 Å²	126.9	90%	0.897	80%	0.795	S	S	*	*			trans	127.8	131.1	153.3	0	0	0	0	0	115.3
344	S	35.3	Very low	39	Very low	120 Å²	120	127.6 Å²	127.6	84%	0.839	81%	0.807	S	S	*	*			trans	-118	149.4	-161.9	-177.1	0	0	0	0	113.3
345	C	30.8	Very low	37.9	Very low	106 Å²	106	127.8 Å²	127.8	72%	0.716	82%	0.817	S	S	*	*			trans	59.1	126.8	141.4	-154.1	0	0	0	0	122.8
346	S	33.5	Very low	36.6	Very low	107 Å²	107	120.8 Å²	120.8	75%	0.748	82%	0.815	S	S	*	*				168.7	119	111.6	34.7	0	0	0	0	108.5
347	Q	34.1	Very low	36.1	Very low	190 Å²	190	117.2 Å²	117.2	89%	0.888	81%	0.813	S	S	*	*				101.6	135.1	72	-166.3	166.3	0.3	0	0	111.9
348	A	33.7	Very low	35.5	Very low	89 Å²	89	119.9 Å²	119.9	74%	0.736	82%	0.82	S	S	*	*			trans	-67.9	162	-163.7	0	0	0	0	0	117.2
349	A	29.9	Very low	34.8	Very low	106 Å²	106	123 Å²	123	88%	0.876	82%	0.822	S	S	*	*			trans	-150.3	108.2	135.1	0	0	0	0	0	110.3
350	C	32.5	Very low	34.3	Very low	127 Å²	127	124.7 Å²	124.7	86%	0.858	82%	0.824	S	S	*	*			trans	-90.6	151.2	162.2	-74.2	0	0	0	0	109
351	S	32.8	Very low	34.3	Very low	119 Å²	119	127.6 Å²	127.6	83%	0.832	82%	0.819	S	S	*	*			trans	-130.1	114.3	162.6	32	0	0	0	0	110.5
352	N	36	Very low	34.3	Very low	158 Å²	158	123.9 Å²	123.9	85%	0.845	81%	0.808	S	S	*	*			trans	-103.6	162.8	152	-75.8	-23.5	0	0	0	105.1
353	S	38	Very low	34.2	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	81%	0.81	S	S	*	*			cis	-179.2	142.4	35.8	-0.5	0	0	0	0	107.1
354	A	36.2	Very low	34.4	Very low	95 Å²	95	128.5 Å²	128.5	79%	0.785	81%	0.807	S	S	*	*				66.4	130.9	111.2	0	0	0	0	0	121
355	Q	36.7	Very low	34.3	Very low	207 Å²	207	132.8 Å²	132.8	97%	0.967	81%	0.81	S	S	*	*				115.5	128.8	127.2	-146.9	160.9	26	0	0	119.4
356	G	28.3	Very low	34.7	Very low	78 Å²	78	136 Å²	136	80%	0.804	84%	0.844	S	S	*	*			trans	157.2	103.1	160.8	0	0	0	0	0	114.7
357	S	40.7	Very low	34.7	Very low	110 Å²	110	137.4 Å²	137.4	77%	0.769	85%	0.849	S	S	*	*			trans	-103.9	143.7	169.5	-48.1	0	0	0	0	110.2
358	D	38.4	Very low	34.8	Very low	149 Å²	149	134.6 Å²	134.6	80%	0.797	85%	0.847	S	S	*	*				157.3	140.2	119.9	-87	-15.1	0	0	0	115.8
359	E	32.5	Very low	34.8	Very low	174 Å²	174	137.2 Å²	137.2	81%	0.813	85%	0.853	S	S	*	*			trans	47.7	121.9	147.9	-80.3	-170.3	121	0	0	123.8
360	S	32.8	Very low	35.1	Very low	102 Å²	102	139 Å²	139	71%	0.713	85%	0.852	S	S	*	*				158	149.2	93.8	60.5	0	0	0	0	114.9
361	L	37.7	Very low	35.3	Very low	146 Å²	146	139.8 Å²	139.8	76%	0.764	85%	0.851	S	S	*	*			trans	84.7	97.4	153.7	-66.3	166.7	0	0	0	122.6
362	I	35.2	Very low	35.5	Very low	141 Å²	141	141.1 Å²	141.1	72%	0.723	85%	0.853	S	S	*	*				41.8	116.2	114.5	-54.3	173.9	0	0	0	118.5
363	T	32.7	Very low	35.4	Very low	142 Å²	142	139.9 Å²	139.9	87%	0.871	85%	0.853	S	S	*	*				-172.7	135.8	113.5	21.6	0	0	0	0	111.2
364	C	33.7	Very low	35.2	Very low	122 Å²	122	142.2 Å²	142.2	82%	0.824	86%	0.86	S	S	*	*			trans	-106.8	161.1	180	-78.1	0	0	0	0	111.8
365	K	33.7	Very low	35.1	Very low	210 Å²	210	146.2 Å²	146.2	91%	0.913	87%	0.866	S	S	*	*			trans	77.5	142.6	157.8	-75.5	177	173.6	179	0	116.6
366	A	39.2	Very low	35	Very low	173 Å²	173	140.6 Å²	140.6	100%	1.43	86%	0.857	S	S	*	*			cis	-131.5	0	19.4	0	0	0	0	0	112.7

Retrieved 366 of 366 residues in 1352.5 ms (Link to these results)

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