A0A090KFT5_HUMAN Loading...

HLA class I antigen

AlphaFold DB , UniProt , Accession A0A090KFT5, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 365 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	34.3	Very low	42.5	Very low	243 Å²	243	147.1 Å²	147.1	100%	1.197	75%	0.752	S	S	*	*				0	99	0	-76.8	163.8	157.6	0	0	108.2
2	R	34.2	Very low	42.7	Very low	252 Å²	252	146.1 Å²	146.1	95%	0.951	75%	0.749	S	S	*	*			trans	-97.3	108.2	171.1	-101.5	179.8	173.6	165.9	-2.2	106.3	M4	R2-M4 PolarHBondContact O-N 3.31Å
3	V	37.4	Very low	42.4	Very low	143 Å²	143	143.5 Å²	143.5	87%	0.867	74%	0.737	S	S	*	*			trans	-73.4	106.7	172.3	179.2	0	0	0	0	106.5	A5	V3-A5 PolarHBondContact O-N 3.19Å
4	M	41.1	Very low	42.4	Very low	179 Å²	179	137.8 Å²	137.8	88%	0.882	72%	0.715	S	S	*	*			trans	-84	97.7	176.4	-159.3	165.6	68.6	0	0	106.8	R2	R2-M4 PolarHBondContact O-N 3.31Å
5	A	44.7	Very low	42.2	Very low	68 Å²	68	131.1 Å²	131.1	56%	0.562	69%	0.694	S	S	*	*			trans	-61.5	135.4	172.5	0	0	0	0	0	109.1	V3 R7	V3-A5 PolarHBondContact O-N 3.19Å; A5-R7 PolarHBondContact O-N 3.25Å
6	P	46.3	Very low	41.8	Very low	82 Å²	82	125.5 Å²	125.5	53%	0.532	68%	0.677	S	S	.	*			trans	-68.5	122.8	-175.8	26.1	-30.5	0	0	0	109.5	A8 L9	P6-A8 PolarHBondContact O-N 2.94Å; P6-L9 HydrophobicContact CG-CB 4.49Å; P6-L9 PolarHBondContact O-N 2.92Å
7	R	49.7	Very low	41.4	Very low	223 Å²	223	125.1 Å²	125.1	84%	0.842	67%	0.674	S	S	*	*	H	α-helix	trans	-51.4	-17.2	175.6	-91.4	177	163.2	167.5	-6.6	114.3	A5	A5-R7 PolarHBondContact O-N 3.25Å
8	A	48.4	Very low	41.2	Very low	67 Å²	67	121.6 Å²	121.6	55%	0.554	67%	0.665	S	S	*	*	H	α-helix	trans	-71.3	-29.8	174.3	0	0	0	0	0	113.7	P6	P6-A8 PolarHBondContact O-N 2.94Å
9	L	43	Very low	40.9	Very low	112 Å²	112	121.2 Å²	121.2	59%	0.586	66%	0.661	S	S	*	*	H	α-helix	trans	-75	-28.5	-179.2	-128	88.8	0	0	0	112.6	P6	P6-L9 HydrophobicContact CG-CB 4.49Å; P6-L9 PolarHBondContact O-N 2.92Å
10	L	41.7	Very low	40.6	Very low	119 Å²	119	120.2 Å²	120.2	62%	0.623	66%	0.659	S	S	*	*	H	α-helix	trans	-73.9	-30.6	179	-94.8	137.7	0	0	0	112.8	S14	L10-S14 PolarHBondContact O-N 2.61Å; L10-S14 PolarHBondContact O-OG 3.18Å
11	L	46.8	Very low	40.4	Very low	130 Å²	130	122.2 Å²	122.2	68%	0.681	66%	0.664	S	S	*	*	H	α-helix	trans	-74.4	-32.9	177.9	-76	165.8	0	0	0	112.8	L13 S14 G15	L11-L13 VanDerWaalsContact C-N 3.34Å; L11-S14 WeakPolarHBondContact CA-OG 3.36Å; L11-S14 PolarHBondContact O-N 2.88Å; L11-S14 PolarHBondContact O-OG 3.44Å; L11-G15 PolarHBondContact O-N 3.08Å
12	L	44.4	Very low	40.7	Very low	135 Å²	135	115.5 Å²	115.5	71%	0.707	64%	0.637	S	S	*	*	H	α-helix	trans	-69.3	-32.4	175.4	-77.2	161.3	0	0	0	112.3	G16	L12-G16 PolarHBondContact O-N 3.29Å
13	L	39	Very low	41.5	Very low	113 Å²	113	108 Å²	108	59%	0.592	61%	0.608	S	S	*	*	H	α-helix	trans	-75.8	-30.4	175.9	-73.9	162.9	0	0	0	112.7	L11 L17	L11-L13 VanDerWaalsContact C-N 3.34Å; L13-L17 WeakPolarHBondContact O-CD1 3.26Å; L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 2.88Å
14	S	42	Very low	42.3	Very low	63 Å²	63	103.7 Å²	103.7	44%	0.441	59%	0.588	S	S	.	*	H	α-helix	trans	-74.4	-30.8	173.7	46.3	0	0	0	0	113.6	L10 L11 A18	L10-S14 PolarHBondContact O-N 2.61Å; L10-S14 PolarHBondContact O-OG 3.18Å; L11-S14 WeakPolarHBondContact CA-OG 3.36Å; L11-S14 PolarHBondContact O-N 2.88Å; L11-S14 PolarHBondContact O-OG 3.44Å; S14-A18 PolarHBondContact O-N 3.25Å
15	G	39.7	Very low	43.8	Very low	38 Å²	38	97.9 Å²	97.9	39%	0.392	56%	0.564	S	S	.	*	H	α-helix	trans	-70.9	-36.8	174.7	0	0	0	0	0	113.1	L11	L11-G15 PolarHBondContact O-N 3.08Å
16	G	36	Very low	46	Very low	41 Å²	41	98.1 Å²	98.1	42%	0.423	56%	0.562	S	S	.	*	H	α-helix	trans	-70.9	-37.2	176.1	0	0	0	0	0	113.7	L12 L19 T20	L12-G16 PolarHBondContact O-N 3.29Å; G16-L19 PolarHBondContact O-N 2.89Å; G16-T20 PolarHBondContact O-N 3.05Å; G16-T20 PolarHBondContact O-OG1 2.96Å
17	L	34.9	Very low	48.4	Very low	119 Å²	119	95.7 Å²	95.7	62%	0.623	54%	0.543	S	S	*	.	H	α-helix	trans	-70.9	-33.3	178.5	-78.8	163.3	0	0	0	112.9	L13 L19 T20 E21	L13-L17 WeakPolarHBondContact O-CD1 3.26Å; L13-L17 WeakPolarHBondContact O-CG 3.36Å; L13-L17 PolarHBondContact O-N 2.88Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 2.86Å; L17-T20 PolarHBondContact O-N 3Å; L17-T20 PolarHBondContact O-OG1 3.11Å; L17-T20 VanDerWaalsContact O-OG1 3.07Å; L17-E21 PolarHBondContact O-N 3.26Å
18	A	37.2	Very low	50.6	Low	62 Å²	62	86.2 Å²	86.2	51%	0.512	51%	0.511	S	S	.	.	H	α-helix	trans	-69.2	-28.1	176.9	0	0	0	0	0	113.2	S14	S14-A18 PolarHBondContact O-N 3.25Å
19	L	36.5	Very low	53	Low	113 Å²	113	83 Å²	83	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-81.6	-23.1	178.6	-92.5	151.4	0	0	0	113.4	G16 L17 T22	G16-L19 PolarHBondContact O-N 2.89Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 2.86Å; L19-T22 PolarHBondContact O-OG1 2.97Å
20	T	34.6	Very low	55.7	Low	101 Å²	101	80 Å²	80	62%	0.62	47%	0.466	S	S	*	.	H	α-helix	trans	-86.6	-20.2	178.8	50.2	0	0	0	0	113.8	G16 L17 T22	G16-T20 PolarHBondContact O-N 3.05Å; G16-T20 PolarHBondContact O-OG1 2.96Å; L17-T20 PolarHBondContact O-N 3Å; L17-T20 PolarHBondContact O-OG1 3.11Å; L17-T20 VanDerWaalsContact O-OG1 3.07Å; T20-T22 VanDerWaalsContact C-N 3.34Å
21	E	35.8	Very low	58.4	Low	163 Å²	163	74.7 Å²	74.7	76%	0.762	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-79.2	-15.1	-177.6	-122.7	176.4	-175	0	0	113.4	L17 W23	L17-E21 PolarHBondContact O-N 3.26Å; E21-W23 PolarHBondContact O-N 3.15Å
22	T	42.3	Very low	60.9	Low	102 Å²	102	72.6 Å²	72.6	63%	0.626	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-86.2	2	-173.7	56.3	0	0	0	0	115.2	L19 T20	L19-T22 PolarHBondContact O-OG1 2.97Å; T20-T22 VanDerWaalsContact C-N 3.34Å
23	W	50.8	Low	63.5	Low	95 Å²	95	66.3 Å²	66.3	36%	0.36	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-124	17.2	-176.2	-58.7	80.3	0	0	0	113.2	E21 C25 H287 E288 L290	E21-W23 PolarHBondContact O-N 3.15Å; W23-C25 PolarHBondContact O-N 2.98Å; W23-C25 VanDerWaalsContact O-N 3.15Å; W23-H287 VanDerWaalsContact CH2-C 3.45Å; W23-H287 WeakPolarHBondContact CH2-O 3.36Å; W23-H287 WeakPolarHBondContact CZ3-O 3.46Å; W23-E288 HydrophobicContact CE3-CB 3.5Å; W23-E288 VanDerWaalsContact CE3-CB 3.5Å; W23-E288 HydrophobicContact CE3-CG 3.97Å; W23-E288 HydrophobicContact CH2-CB 4.38Å; W23-E288 VanDerWaalsContact CZ3-CA 3.47Å; W23-E288 HydrophobicContact CZ3-CB 3.44Å; W23-E288 VanDerWaalsContact CZ3-CB 3.44Å; W23-E288 HydrophobicContact CZ3-CG 4.22Å; W23-E288 WeakPolarHBondContact CZ3-O 3.07Å; W23-L290 WeakPolarHBondContact CH2-O 3.32Å; W23-L290 VanDerWaalsContact CZ3-O 3.31Å; W23-L290 WeakPolarHBondContact CZ3-O 3.34Å
24	A	54.3	Low	66.3	Low	53 Å²	53	62.9 Å²	62.9	44%	0.438	37%	0.374	S	S	.	.	S	Bend	trans	-79.1	99.9	170.8	0	0	0	0	0	106.9	S26 P129	A24-S26 PolarHBondContact O-N 3.02Å; A24-P129 HydrophobicContact CB-CB 3.81Å; A24-P129 HydrophobicContact CB-CG 3.19Å
25	C	72.1	Confident	69	Low	56 Å²	56	60 Å²	60	38%	0.378	35%	0.353	S	S	.	.			trans	-55	107	-173.2	-52.7	0	0	0	0	110.9	W23 E288	W23-C25 PolarHBondContact O-N 2.98Å; W23-C25 VanDerWaalsContact O-N 3.15Å; C25-E288 PolarHBondContact SG-OE1 2.87Å
26	S	91	Very high	71.8	Confident	74 Å²	74	60.6 Å²	60.6	52%	0.517	35%	0.349	S	S	.	.			trans	-86.6	145.3	165.8	57.7	0	0	0	0	109.2	A24 L127	A24-S26 PolarHBondContact O-N 3.02Å; S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.39Å; S26-L127 WeakPolarHBondContact CB-O 3.35Å
27	H	95.5	Very high	74.8	Confident	30 Å²	30	59.5 Å²	59.5	14%	0.139	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	152	176.7	-68	-75.1	0	0	0	110.6	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.26Å; H27-D53 WeakPolarHBondContact CA-OD1 3.25Å; H27-D53 IonicContact CE1-OD2 3.46Å; H27-D53 IonicContact CG-OD2 3.26Å; H27-D53 IonicContact ND1-OD1 3.46Å; H27-D53 IonicContact ND1-OD2 2.72Å; H27-D53 PolarHBondContact ND1-OD2 3.48Å; H27-D126 CarbonylContact O-C 3.59Å; H27-D126 WeakPolarHBondContact O-CA 3.37Å; H27-L127 PolarHBondContact N-O 3Å; H27-L127 VanDerWaalsContact N-O 3.16Å; H27-L127 PolarHBondContact O-N 3.16Å; H27-L192 HydrophobicContact CB-CD1 4.48Å; H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 4Å; H27-L196 HydrophobicContact CB-CG 4.42Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.49Å
28	S	97.6	Very high	77.7	Confident	24 Å²	24	57.3 Å²	57.3	17%	0.168	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149	-178.9	66.4	0	0	0	0	111.5	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.59Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.4Å; S28-D53 PolarHBondContact N-OD1 3.04Å; S28-D53 PolarHBondContact O-N 2.81Å; S28-D53 PolarHBondContact OG-OD1 2.93Å; S28-C125 WeakPolarHBondContact CA-O 3.27Å; S28-D126 WeakPolarHBondContact CB-OD1 3.4Å
29	M	98.6	Very high	80.3	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	122.2	166.9	-174.9	170.3	62.1	0	0	108.1	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.24Å; M29-Y31 HydrophobicContact CG-CE2 4.06Å; M29-Y31 HydrophobicContact SD-CE2 4.08Å; M29-Y51 CarbonylContact C-O 3.6Å; M29-Y51 WeakPolarHBondContact CA-O 3.47Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; M29-F57 HydrophobicContact CG-CE1 4.41Å; M29-F57 HydrophobicContact SD-CZ 4.28Å; M29-G124 CarbonylContact O-C 3.6Å; M29-G124 WeakPolarHBondContact O-CA 3.47Å; M29-C125 PolarHBondContact N-O 3.17Å; M29-C125 PolarHBondContact O-N 2.84Å; M29-C188 HydrophobicContact CE-CB 4.16Å; M29-C188 WeakPolarHBondContact CE-O 3.44Å; M29-C188 WeakPolarHBondContact CE-SG 3.32Å; M29-W191 HydrophobicContact CE-CB 4.03Å; M29-W191 HydrophobicContact SD-CB 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; M29-Y195 HydrophobicContact SD-CD2 3.7Å; M29-Y195 HydrophobicContact SD-CE2 3.57Å; M29-Y195 VanDerWaalsContact SD-CE2 3.57Å
30	R	98.6	Very high	82.9	Confident	49 Å²	49	55.7 Å²	55.7	19%	0.185	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	135.6	-176.1	-57	-62.8	-178.3	75.6	4.2	110.7	F32 G50 Y51 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.47Å; R30-F32 HydrophobicContact CB-CE2 3.64Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; R30-G50 CarbonylContact O-C 3.58Å; R30-G50 WeakPolarHBondContact O-CA 3.46Å; R30-Y51 PolarHBondContact N-O 3.35Å; R30-Y51 PolarHBondContact O-N 2.9Å; R30-D126 IonicContact CZ-OD1 3.42Å; R30-D126 IonicContact NE-OD1 3.26Å; R30-D126 PolarHBondContact NE-OD1 3.18Å; R30-D126 VanDerWaalsContact NH2-CG 3.27Å; R30-D126 IonicContact NH2-OD1 2.72Å; R30-D126 PolarHBondContact NH2-OD1 3.1Å; R30-D126 IonicContact NH2-OD2 2.87Å; R30-D126 PolarHBondContact NH2-OD2 2.79Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.3Å; R30-Y137 PolarHBondContact NH2-OH 3.18Å
31	Y	98.8	Very high	85.6	Confident	7 Å²	7	60.9 Å²	60.9	3%	0.027	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	138.2	169.2	-69.2	-93.1	0	0	0	109.3	M29 V49 F57 V58 M122 Y123	M29-Y31 HydrophobicContact CE-CE2 4.24Å; M29-Y31 HydrophobicContact CG-CE2 4.06Å; M29-Y31 HydrophobicContact SD-CE2 4.08Å; Y31-V49 CarbonylContact C-O 3.56Å; Y31-V49 WeakPolarHBondContact CA-O 3.18Å; Y31-F57 HydrophobicContact CE1-CZ 4.07Å; Y31-F57 AromaticContact CZ-CZ 3.77Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.22Å; Y31-V58 HydrophobicContact CE1-CG2 3.93Å; Y31-M122 VanDerWaalsContact O-CA 3.32Å; Y31-M122 WeakPolarHBondContact O-CA 3.41Å; Y31-Y123 VanDerWaalsContact CB-CE1 3.43Å; Y31-Y123 HydrophobicContact CD2-CD2 4.35Å; Y31-Y123 AromaticContact CD2-CE2 3.68Å; Y31-Y123 HydrophobicContact CD2-CE2 3.68Å; Y31-Y123 AromaticContact CD2-CZ 3.91Å; Y31-Y123 HydrophobicContact CE2-CE2 4.46Å; Y31-Y123 HydrophobicContact CG-CE1 4.26Å; Y31-Y123 AromaticContact CG-CE2 3.96Å; Y31-Y123 HydrophobicContact CG-CE2 3.96Å; Y31-Y123 AromaticContact CG-CZ 3.68Å; Y31-Y123 PolarHBondContact N-O 3.18Å; Y31-Y123 PolarHBondContact O-N 3.24Å; Y31-Y123 VanDerWaalsContact O-N 3.11Å
32	F	98.9	Very high	88.3	Confident	86 Å²	86	55.8 Å²	55.8	38%	0.377	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	112.1	177.2	-57	-94.6	0	0	0	108.8	R30 S48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.47Å; R30-F32 HydrophobicContact CB-CE2 3.64Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; F32-S48 WeakPolarHBondContact O-CA 3.26Å; F32-V49 HydrophobicContact CB-CG2 3.87Å; F32-V49 HydrophobicContact CD2-CG2 4.31Å; F32-V49 PolarHBondContact N-O 3.19Å; F32-V49 PolarHBondContact O-N 2.99Å; F32-Y51 HydrophobicContact CD2-CD2 4.14Å; F32-Y51 HydrophobicContact CE2-CD2 4.14Å; F32-R121 WeakPolarHBondContact CA-O 3.27Å; F32-M122 HydrophobicContact CD1-CB 3.96Å; F32-M122 HydrophobicContact CD1-CG 3.67Å; F32-M122 HydrophobicContact CE1-CB 4.11Å; F32-M122 HydrophobicContact CE1-CG 3.39Å; F32-M122 HydrophobicContact CG-CG 4.49Å; F32-M122 HydrophobicContact CZ-CG 4.02Å
33	D	98.8	Very high	90.8	Very high	3 Å²	3	55.4 Å²	55.4	2%	0.016	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	138.9	175.5	-61.7	-23.5	0	0	0	109.2	F46 I47 S48 Q120 R121	D33-F46 HydrophobicContact CB-CE2 3.83Å; D33-F46 HydrophobicContact CB-CZ 4.03Å; D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.34Å; D33-S48 WeakPolarHBondContact OD1-CB 3.46Å; D33-S48 PolarHBondContact OD1-OG 3.23Å; D33-Q120 CarbonylContact O-C 3.56Å; D33-Q120 VanDerWaalsContact O-CA 3.3Å; D33-Q120 WeakPolarHBondContact O-CA 3.41Å; D33-R121 HydrophobicContact CB-CB 4.28Å; D33-R121 PolarHBondContact N-O 2.95Å; D33-R121 PolarHBondContact O-N 3.47Å
34	T	98.9	Very high	93	Very high	40 Å²	40	52.1 Å²	52.1	25%	0.245	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	119.5	175.8	-61	0	0	0	0	109.8	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 4.02Å; T34-F46 WeakPolarHBondContact O-CA 3.42Å; T34-I47 PolarHBondContact N-O 3.43Å; T34-I47 PolarHBondContact O-N 2.82Å; T34-T118 HydrophobicContact CG2-CG2 4.13Å; T34-L119 WeakPolarHBondContact CA-O 3.49Å; T34-Q120 HydrophobicContact CG2-CG 4.14Å
35	A	98.8	Very high	95.1	Very high	2 Å²	2	53.9 Å²	53.9	2%	0.017	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	124.1	174.5	0	0	0	0	0	110.3	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.55Å; A35-R45 VanDerWaalsContact CA-O 3.28Å; A35-R45 WeakPolarHBondContact CA-O 3.37Å; A35-F46 HydrophobicContact CB-CD2 4.26Å; A35-D98 HydrophobicContact CB-CB 3.66Å; A35-L102 HydrophobicContact CB-CD1 3.89Å; A35-T118 WeakPolarHBondContact O-CA 3.32Å; A35-L119 HydrophobicContact CB-CB 4.47Å; A35-L119 PolarHBondContact N-O 3.35Å; A35-L119 PolarHBondContact O-N 2.86Å
36	V	98.6	Very high	96.3	Very high	51 Å²	51	51.3 Å²	51.3	31%	0.309	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	116.1	-179	-174.3	0	0	0	0	109.6	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 4.02Å; V36-P44 CarbonylContact O-C 3.5Å; V36-P44 WeakPolarHBondContact O-CA 3.38Å; V36-P44 WeakPolarHBondContact O-CB 3.38Å; V36-R45 PolarHBondContact N-O 2.99Å; V36-R45 PolarHBondContact O-N 3.24Å; V36-H117 WeakPolarHBondContact CA-O 3.34Å; V36-T118 HydrophobicContact CG2-CG2 4.21Å
37	S	97.9	Very high	96.7	Very high	18 Å²	18	50.1 Å²	50.1	13%	0.126	27%	0.273	C	S	.	.			trans	-70.8	143.7	174.2	76	0	0	0	0	110.7	S116 H117	S37-S116 WeakPolarHBondContact O-CB 3.33Å; S37-S116 PolarHBondContact O-OG 3.16Å; S37-H117 PolarHBondContact N-O 2.85Å; S37-H117 PolarHBondContact OG-N 3.32Å; S37-H117 PolarHBondContact OG-O 3.29Å
38	R	95.8	Very high	96.9	Very high	73 Å²	73	48.7 Å²	48.7	28%	0.275	27%	0.267	S	S	.	.			trans	-137.8	74.5	-178.4	53.5	174.2	176.5	-160.5	-9.9	111.1	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 3.19Å; R38-R41 HydrophobicContact CB-CB 4.09Å; R38-R41 WeakPolarHBondContact CD-O 3.18Å; R38-R41 HydrophobicContact CG-CB 4.12Å; R38-R41 PolarHBondContact NE-O 3.33Å; R38-R41 PolarHBondContact O-N 3.25Å; R38-E43 VanDerWaalsContact CZ-O 3.3Å; R38-E43 PolarHBondContact NE-O 3.43Å; R38-E43 PolarHBondContact NH2-O 3.37Å; R38-D63 IonicContact CZ-OD1 2.73Å; R38-D63 IonicContact CZ-OD2 3.97Å; R38-D63 IonicContact NH1-OD1 3.15Å; R38-D63 PolarHBondContact NH1-OD1 3.31Å; R38-D63 IonicContact NH1-OD2 3.21Å; R38-D63 PolarHBondContact NH1-OD2 3.31Å; R38-D63 IonicContact NH2-OD1 2.63Å; R38-D63 PolarHBondContact NH2-OD1 2.8Å; R38-D63 IonicContact NH2-OD2 2.73Å
39	P	91.9	Very high	96.9	Very high	51 Å²	51	49 Å²	49	33%	0.331	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	132.7	-178.6	-27.1	35.2	0	0	0	112.1	R41 E113 G115	P39-R41 PolarHBondContact O-N 3.49Å; P39-E113 VanDerWaalsContact CB-O 3.32Å; P39-E113 WeakPolarHBondContact CB-O 3.26Å; P39-E113 WeakPolarHBondContact CG-O 3.41Å; P39-G115 VanDerWaalsContact CG-O 3.22Å; P39-G115 WeakPolarHBondContact CG-O 3.43Å
40	G	90.8	Very high	96.9	Very high	91 Å²	91	49 Å²	49	94%	0.938	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	-0	-177.3	0	0	0	0	0	116.1	R38	R38-G40 PolarHBondContact O-N 3.19Å
41	R	92.5	Very high	96.9	Very high	210 Å²	210	50 Å²	50	79%	0.792	27%	0.271	S	S	*	.	S	Bend	trans	-122.7	22.3	-179.3	-58.6	-174.4	-179.2	-173.6	0.8	113.7	R38 P39	R38-R41 HydrophobicContact CB-CB 4.09Å; R38-R41 WeakPolarHBondContact CD-O 3.18Å; R38-R41 HydrophobicContact CG-CB 4.12Å; R38-R41 PolarHBondContact NE-O 3.33Å; R38-R41 PolarHBondContact O-N 3.25Å; P39-R41 PolarHBondContact O-N 3.49Å
42	G	91.4	Very high	96.9	Very high	56 Å²	56	49.6 Å²	49.6	58%	0.577	27%	0.27	S	S	*	.	S	Bend	trans	95.8	-159.7	178.4	0	0	0	0	0	113.6
43	E	94.5	Very high	96.8	Very high	93 Å²	93	46.9 Å²	46.9	44%	0.435	26%	0.259	S	S	.	.	S	Bend	trans	-70.4	154.4	-177.4	-64.9	-56.1	160.3	0	0	112.7	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.3Å; R38-E43 PolarHBondContact NE-O 3.43Å; R38-E43 PolarHBondContact NH2-O 3.37Å; E43-R45 PolarHBondContact O-N 2.81Å; E43-R99 VanDerWaalsContact CD-NE 3.32Å; E43-R99 IonicContact OE1-CZ 3.89Å; E43-R99 VanDerWaalsContact OE1-CZ 3.23Å; E43-R99 IonicContact OE1-NE 2.74Å; E43-R99 IonicContact OE1-NH2 2.93Å; E43-R99 PolarHBondContact OE1-NH2 2.86Å; E43-R99 WeakPolarHBondContact OE2-CD 3.31Å; E43-R99 IonicContact OE2-CZ 3.72Å; E43-R99 IonicContact OE2-NE 3.69Å; E43-R99 PolarHBondContact OE2-NE 3.28Å; E43-R99 IonicContact OE2-NH2 3.68Å; E43-R99 PolarHBondContact OE2-NH2 3.34Å; E43-R99 VanDerWaalsContact OE2-NH2 3.15Å
44	P	97.3	Very high	96.7	Very high	26 Å²	26	49.8 Å²	49.8	17%	0.169	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-51	133.7	172.8	-25.8	34.8	0	0	0	111.5	V36 R99 L102	V36-P44 CarbonylContact O-C 3.5Å; V36-P44 WeakPolarHBondContact O-CA 3.38Å; V36-P44 WeakPolarHBondContact O-CB 3.38Å; P44-R99 HydrophobicContact CG-CB 4.42Å; P44-R99 HydrophobicContact CG-CG 4.16Å; P44-L102 HydrophobicContact CB-CD1 3.7Å; P44-L102 HydrophobicContact CG-CD1 3.87Å
45	R	98.4	Very high	96.6	Very high	90 Å²	90	49.3 Å²	49.3	34%	0.34	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	130.3	173.5	-177.1	-178.4	-177.1	-176.1	-0.7	108.4	A35 V36 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.55Å; A35-R45 VanDerWaalsContact CA-O 3.28Å; A35-R45 WeakPolarHBondContact CA-O 3.37Å; V36-R45 PolarHBondContact N-O 2.99Å; V36-R45 PolarHBondContact O-N 3.24Å; E43-R45 PolarHBondContact O-N 2.81Å; R45-I47 HydrophobicContact CG-CG1 4.37Å; R45-D61 IonicContact CZ-OD1 3.36Å; R45-D61 IonicContact CZ-OD2 3.06Å; R45-D61 IonicContact NE-OD1 3.65Å; R45-D61 PolarHBondContact NE-OD1 2.77Å; R45-D61 IonicContact NE-OD2 2.75Å; R45-D61 IonicContact NH2-OD1 3.59Å; R45-D61 PolarHBondContact NH2-OD1 2.84Å; R45-D61 IonicContact NH2-OD2 3.48Å; R45-D61 PolarHBondContact NH2-OD2 2.79Å; R45-S62 WeakPolarHBondContact CA-OG 3.44Å; R45-D63 VanDerWaalsContact CD-OD2 3.29Å; R45-D63 WeakPolarHBondContact CD-OD2 3.37Å; R45-D63 HydrophobicContact CG-CB 4.39Å; R45-D63 IonicContact NE-OD2 2.71Å
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	-114.5	127.6	176.9	176.4	-92.6	0	0	0	110	D33 T34 A35 F60 S62 Q94 A95 D98	D33-F46 HydrophobicContact CB-CE2 3.83Å; D33-F46 HydrophobicContact CB-CZ 4.03Å; T34-F46 WeakPolarHBondContact O-CA 3.42Å; A35-F46 HydrophobicContact CB-CD2 4.26Å; F46-F60 AromaticContact CD1-CD1 3.7Å; F46-F60 HydrophobicContact CD1-CD1 3.7Å; F46-F60 AromaticContact CD1-CE1 3.8Å; F46-F60 HydrophobicContact CD1-CE1 3.8Å; F46-F60 AromaticContact CE1-CD1 3.92Å; F46-F60 HydrophobicContact CE1-CD1 3.92Å; F46-F60 HydrophobicContact CE1-CE1 4.3Å; F46-S62 PolarHBondContact N-OG 3.08Å; F46-S62 PolarHBondContact O-N 2.83Å; F46-S62 PolarHBondContact O-OG 2.04Å; F46-Q94 HydrophobicContact CE2-CB 4.26Å; F46-Q94 HydrophobicContact CE2-CG 3.74Å; F46-Q94 HydrophobicContact CZ-CB 3.92Å; F46-Q94 HydrophobicContact CZ-CG 3.72Å; F46-A95 HydrophobicContact CB-CB 3.68Å; F46-A95 HydrophobicContact CD1-CB 3.75Å; F46-A95 HydrophobicContact CD2-CB 4.1Å; F46-A95 HydrophobicContact CE1-CB 4.41Å; F46-A95 HydrophobicContact CG-CB 3.57Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.41Å; F46-D98 VanDerWaalsContact CE2-OD2 3.23Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.17Å
47	I	98.8	Very high	96.5	Very high	49 Å²	49	49.4 Å²	49.4	25%	0.251	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.4	174.5	-57.9	175	0	0	0	107.3	D33 T34 R45 V49 F60	D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.34Å; T34-I47 PolarHBondContact N-O 3.43Å; T34-I47 PolarHBondContact O-N 2.82Å; R45-I47 HydrophobicContact CG-CG1 4.37Å; I47-V49 HydrophobicContact CG2-CG1 4.39Å; I47-F60 WeakPolarHBondContact CA-O 2.96Å
48	S	98.8	Very high	96.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.5	171.3	-176.9	0	0	0	0	109.8	F32 D33 R59 F60 Y91	F32-S48 WeakPolarHBondContact O-CA 3.26Å; D33-S48 WeakPolarHBondContact OD1-CB 3.46Å; D33-S48 PolarHBondContact OD1-OG 3.23Å; S48-R59 CarbonylContact O-C 3.6Å; S48-R59 WeakPolarHBondContact O-CA 3.03Å; S48-F60 PolarHBondContact N-O 2.91Å; S48-F60 PolarHBondContact O-N 2.78Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.48Å
49	V	98.9	Very high	96.7	Very high	30 Å²	30	49 Å²	49	18%	0.182	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139.5	175.2	-63.4	0	0	0	0	109.9	Y31 F32 I47 Y51 Q56 V58 R59	Y31-V49 CarbonylContact C-O 3.56Å; Y31-V49 WeakPolarHBondContact CA-O 3.18Å; F32-V49 HydrophobicContact CB-CG2 3.87Å; F32-V49 HydrophobicContact CD2-CG2 4.31Å; F32-V49 PolarHBondContact N-O 3.19Å; F32-V49 PolarHBondContact O-N 2.99Å; I47-V49 HydrophobicContact CG2-CG1 4.39Å; V49-Y51 HydrophobicContact CB-CE2 4.11Å; V49-Y51 HydrophobicContact CG2-CD2 4.38Å; V49-Y51 HydrophobicContact CG2-CE2 3.83Å; V49-Q56 VanDerWaalsContact CG1-NE2 3.25Å; V49-V58 WeakPolarHBondContact CA-O 3.32Å; V49-R59 HydrophobicContact CG1-CB 4.47Å; V49-R59 HydrophobicContact CG1-CG 4.23Å
50	G	98.7	Very high	97	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.5	177.5	0	0	0	0	0	111	R30 Q56 F57 V58	R30-G50 CarbonylContact O-C 3.58Å; R30-G50 WeakPolarHBondContact O-CA 3.46Å; G50-Q56 WeakPolarHBondContact O-CA 3.4Å; G50-F57 WeakPolarHBondContact O-CD1 3.34Å; G50-F57 PolarHBondContact O-N 3.2Å; G50-V58 PolarHBondContact N-O 3.43Å; G50-V58 PolarHBondContact O-N 3.09Å
51	Y	98.6	Very high	97.4	Very high	70 Å²	70	43.2 Å²	43.2	28%	0.275	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	141.5	178.7	-75.8	-102.7	0	0	0	110.5	M29 R30 F32 V49 T55 Q56	M29-Y51 CarbonylContact C-O 3.6Å; M29-Y51 WeakPolarHBondContact CA-O 3.47Å; R30-Y51 PolarHBondContact N-O 3.35Å; R30-Y51 PolarHBondContact O-N 2.9Å; F32-Y51 HydrophobicContact CD2-CD2 4.14Å; F32-Y51 HydrophobicContact CE2-CD2 4.14Å; V49-Y51 HydrophobicContact CB-CE2 4.11Å; V49-Y51 HydrophobicContact CG2-CD2 4.38Å; V49-Y51 HydrophobicContact CG2-CE2 3.83Å; Y51-T55 WeakPolarHBondContact CA-O 3.49Å; Y51-T55 VanDerWaalsContact CD1-C 3.47Å; Y51-Q56 HydrophobicContact CD1-CB 4.02Å; Y51-Q56 VanDerWaalsContact CD1-N 3.3Å; Y51-Q56 HydrophobicContact CD2-CG 4.37Å; Y51-Q56 HydrophobicContact CE1-CB 3.52Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.08Å; Y51-Q56 HydrophobicContact CE2-CG 3.86Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å
52	V	98.3	Very high	97.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.3	156	177.2	0	0	0	0	105.9	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.59Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.4Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; V52-D54 PolarHBondContact O-N 3.47Å; V52-T55 PolarHBondContact N-O 2.68Å; V52-T55 WeakPolarHBondContact O-CB 3.39Å; V52-T55 PolarHBondContact O-N 2.95Å; V52-F57 HydrophobicContact CG2-CD1 4.03Å; V52-F57 HydrophobicContact CG2-CE1 4.05Å; V52-W75 HydrophobicContact CB-CH2 4.4Å; V52-W75 HydrophobicContact CB-CZ2 4.47Å; V52-W75 HydrophobicContact CG2-CH2 3.87Å; V52-W75 HydrophobicContact CG2-CZ2 4.43Å; V52-L192 HydrophobicContact CG1-CD1 3.59Å; V52-L192 HydrophobicContact CG2-CD1 4.24Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; V52-Y195 HydrophobicContact CG2-CG 4.45Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.13Å; V52-L203 HydrophobicContact CG1-CD1 3.91Å; V52-L203 HydrophobicContact CG1-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CG 4.5Å
53	D	96.1	Very high	97.9	Very high	29 Å²	29	35.6 Å²	35.6	16%	0.155	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	-125.6	-167.1	-54.7	-41.3	0	0	0	110.5	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.26Å; H27-D53 WeakPolarHBondContact CA-OD1 3.25Å; H27-D53 IonicContact CE1-OD2 3.46Å; H27-D53 IonicContact CG-OD2 3.26Å; H27-D53 IonicContact ND1-OD1 3.46Å; H27-D53 IonicContact ND1-OD2 2.72Å; H27-D53 PolarHBondContact ND1-OD2 3.48Å; S28-D53 PolarHBondContact N-OD1 3.04Å; S28-D53 PolarHBondContact O-N 2.81Å; S28-D53 PolarHBondContact OG-OD1 2.93Å; D53-T55 VanDerWaalsContact C-N 3.32Å; D53-T55 PolarHBondContact O-N 2.93Å
54	D	96.1	Very high	98.1	Very high	63 Å²	63	32.8 Å²	32.8	34%	0.337	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	10.7	179.4	-63	-54.2	0	0	0	113.7	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.47Å; D54-Y233 HydrophobicContact CB-CE2 4.07Å; D54-P234 VanDerWaalsContact OD2-CB 3.3Å; D54-P234 WeakPolarHBondContact OD2-CB 3.44Å; D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 VanDerWaalsContact OD2-CB 3.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.41Å; D54-A235 PolarHBondContact OD2-N 3.07Å; D54-F265 HydrophobicContact CB-CE2 3.79Å; D54-F265 HydrophobicContact CB-CZ 3.71Å
55	T	97	Very high	98	Very high	31 Å²	31	37.1 Å²	37.1	19%	0.19	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113.6	-176.4	-60.7	0	0	0	0	112.4	Y51 V52 D53 F57 A73 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.49Å; Y51-T55 VanDerWaalsContact CD1-C 3.47Å; V52-T55 PolarHBondContact N-O 2.68Å; V52-T55 WeakPolarHBondContact O-CB 3.39Å; V52-T55 PolarHBondContact O-N 2.95Å; D53-T55 VanDerWaalsContact C-N 3.32Å; D53-T55 PolarHBondContact O-N 2.93Å; T55-F57 PolarHBondContact O-N 3.47Å; T55-A73 HydrophobicContact CG2-CB 4.49Å; T55-L203 HydrophobicContact CG2-CD2 4.11Å; T55-Y233 PolarHBondContact OG1-OH 3.43Å
56	Q	97.8	Very high	97.9	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	-67.6	129.1	173.6	-166.2	179.7	2.9	0	0	110.3	V49 G50 Y51 V58 R72	V49-Q56 VanDerWaalsContact CG1-NE2 3.25Å; G50-Q56 WeakPolarHBondContact O-CA 3.4Å; Y51-Q56 HydrophobicContact CD1-CB 4.02Å; Y51-Q56 VanDerWaalsContact CD1-N 3.3Å; Y51-Q56 HydrophobicContact CD2-CG 4.37Å; Y51-Q56 HydrophobicContact CE1-CB 3.52Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.08Å; Y51-Q56 HydrophobicContact CE2-CG 3.86Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å; Q56-V58 PolarHBondContact NE2-O 3.46Å; Q56-R72 HydrophobicContact CB-CB 4.48Å; Q56-R72 HydrophobicContact CG-CB 4.1Å; Q56-R72 HydrophobicContact CG-CG 4.32Å; Q56-R72 CarbonylContact O-C 3.51Å
57	F	98.3	Very high	97.8	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	-120.7	-23.5	-179.7	75.8	-82.6	0	0	0	114.1	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.41Å; M29-F57 HydrophobicContact SD-CZ 4.28Å; Y31-F57 HydrophobicContact CE1-CZ 4.07Å; Y31-F57 AromaticContact CZ-CZ 3.77Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.22Å; G50-F57 WeakPolarHBondContact O-CD1 3.34Å; G50-F57 PolarHBondContact O-N 3.2Å; V52-F57 HydrophobicContact CG2-CD1 4.03Å; V52-F57 HydrophobicContact CG2-CE1 4.05Å; T55-F57 PolarHBondContact O-N 3.47Å; F57-R72 PolarHBondContact O-N 3.42Å; F57-A73 HydrophobicContact CB-CB 4.09Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.35Å; F57-W75 HydrophobicContact CB-CZ3 3.9Å; F57-W75 HydrophobicContact CD1-CH2 4.01Å; F57-W75 AromaticContact CD2-CH2 3.74Å; F57-W75 HydrophobicContact CD2-CH2 3.74Å; F57-W75 AromaticContact CD2-CZ3 3.97Å; F57-W75 HydrophobicContact CD2-CZ3 3.97Å; F57-W75 AromaticContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CZ2 4.09Å; F57-W75 HydrophobicContact CG-CZ3 4.08Å; F57-V76 HydrophobicContact CB-CG1 4.38Å; F57-V76 HydrophobicContact CD2-CB 4.36Å; F57-V76 HydrophobicContact CD2-CG1 4.5Å; F57-V76 HydrophobicContact CD2-CG2 4.08Å; F57-V76 VanDerWaalsContact O-CG1 3.24Å; F57-V76 WeakPolarHBondContact O-CG1 3.19Å; F57-Y195 HydrophobicContact CD2-CE2 4.4Å; F57-Y195 HydrophobicContact CE2-CD2 4.22Å; F57-Y195 AromaticContact CE2-CE2 3.57Å; F57-Y195 HydrophobicContact CE2-CE2 3.57Å; 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	98.4	Very high	97.8	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	154.2	176.7	-73	0	0	0	0	112.6	Y31 V49 G50 Q56 E70 W84 Y91	Y31-V58 HydrophobicContact CE1-CG2 3.93Å; V49-V58 WeakPolarHBondContact CA-O 3.32Å; G50-V58 PolarHBondContact N-O 3.43Å; G50-V58 PolarHBondContact O-N 3.09Å; Q56-V58 PolarHBondContact NE2-O 3.46Å; V58-E70 WeakPolarHBondContact CA-O 3.32Å; V58-W84 HydrophobicContact CG1-CH2 3.94Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.34Å
59	R	98.5	Very high	97.7	Very high	82 Å²	82	43.3 Å²	43.3	31%	0.309	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	146.6	170.9	178.5	172.1	169.6	170.8	-2	111.1	S48 V49 D61 E70 R72	S48-R59 CarbonylContact O-C 3.6Å; S48-R59 WeakPolarHBondContact O-CA 3.03Å; V49-R59 HydrophobicContact CG1-CB 4.47Å; V49-R59 HydrophobicContact CG1-CG 4.23Å; R59-D61 IonicContact NH2-OD2 3.61Å; R59-D61 PolarHBondContact NH2-OD2 3.4Å; R59-E70 PolarHBondContact N-O 2.86Å; R59-E70 PolarHBondContact O-N 3.22Å; R59-R72 HydrophobicContact CB-CG 3.92Å
60	F	98.8	Very high	97.7	Very high	3 Å²	3	44.7 Å²	44.7	1%	0.013	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	142.3	165.4	178.2	-86	0	0	0	109.6	F46 I47 S48 P67 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.7Å; F46-F60 HydrophobicContact CD1-CD1 3.7Å; F46-F60 AromaticContact CD1-CE1 3.8Å; F46-F60 HydrophobicContact CD1-CE1 3.8Å; F46-F60 AromaticContact CE1-CD1 3.92Å; F46-F60 HydrophobicContact CE1-CD1 3.92Å; F46-F60 HydrophobicContact CE1-CE1 4.3Å; I47-F60 WeakPolarHBondContact CA-O 2.96Å; S48-F60 PolarHBondContact N-O 2.91Å; S48-F60 PolarHBondContact O-N 2.78Å; F60-P67 HydrophobicContact CE2-CB 3.86Å; F60-P67 HydrophobicContact CZ-CB 3.67Å; F60-Y91 HydrophobicContact CB-CD1 4.2Å; F60-Y91 HydrophobicContact CB-CD2 3.52Å; F60-Y91 HydrophobicContact CB-CE2 3.95Å; F60-Y91 HydrophobicContact CB-CG 3.67Å; F60-Y91 HydrophobicContact CD1-CG 4.33Å; F60-Y91 AromaticContact CD2-CD2 3.61Å; F60-Y91 HydrophobicContact CD2-CD2 3.61Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.73Å; F60-Y91 HydrophobicContact CG-CD2 3.73Å; 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 4.09Å
61	D	98.7	Very high	97.6	Very high	19 Å²	19	47 Å²	47	10%	0.102	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	119.6	175.9	-164.4	-26.8	0	0	0	109.5	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 3.36Å; R45-D61 IonicContact CZ-OD2 3.06Å; R45-D61 IonicContact NE-OD1 3.65Å; R45-D61 PolarHBondContact NE-OD1 2.77Å; R45-D61 IonicContact NE-OD2 2.75Å; R45-D61 IonicContact NH2-OD1 3.59Å; R45-D61 PolarHBondContact NH2-OD1 2.84Å; R45-D61 IonicContact NH2-OD2 3.48Å; R45-D61 PolarHBondContact NH2-OD2 2.79Å; R59-D61 IonicContact NH2-OD2 3.61Å; R59-D61 PolarHBondContact NH2-OD2 3.4Å; D61-D63 PolarHBondContact O-N 2.9Å; D61-D63 PolarHBondContact OD1-N 3.43Å; D61-D63 VanDerWaalsContact OD1-N 3.14Å; D61-A64 HydrophobicContact CB-CB 4.47Å; D61-A64 WeakPolarHBondContact O-CB 3.31Å; D61-A64 PolarHBondContact O-N 2.93Å
62	S	98.3	Very high	97.6	Very high	35 Å²	35	49.1 Å²	49.1	25%	0.245	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-22	-178.7	68.9	0	0	0	0	113.4	R45 F46 P67	R45-S62 WeakPolarHBondContact CA-OG 3.44Å; F46-S62 PolarHBondContact N-OG 3.08Å; F46-S62 PolarHBondContact O-N 2.83Å; F46-S62 PolarHBondContact O-OG 2.04Å; S62-P67 WeakPolarHBondContact O-CG 3.4Å
63	D	97.4	Very high	97.5	Very high	71 Å²	71	49.3 Å²	49.3	38%	0.38	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-2.7	179.9	-79.5	4.7	0	0	0	112.8	R38 R45 D61	R38-D63 IonicContact CZ-OD1 2.73Å; R38-D63 IonicContact CZ-OD2 3.97Å; R38-D63 IonicContact NH1-OD1 3.15Å; R38-D63 PolarHBondContact NH1-OD1 3.31Å; R38-D63 IonicContact NH1-OD2 3.21Å; R38-D63 PolarHBondContact NH1-OD2 3.31Å; R38-D63 IonicContact NH2-OD1 2.63Å; R38-D63 PolarHBondContact NH2-OD1 2.8Å; R38-D63 IonicContact NH2-OD2 2.73Å; R45-D63 VanDerWaalsContact CD-OD2 3.29Å; R45-D63 WeakPolarHBondContact CD-OD2 3.37Å; R45-D63 HydrophobicContact CG-CB 4.39Å; R45-D63 IonicContact NE-OD2 2.71Å; D61-D63 PolarHBondContact O-N 2.9Å; D61-D63 PolarHBondContact OD1-N 3.43Å; D61-D63 VanDerWaalsContact OD1-N 3.14Å
64	A	97.2	Very high	97.5	Very high	33 Å²	33	52.9 Å²	52.9	27%	0.273	30%	0.296	S	S	.	.	S	Bend	trans	-61.7	149.3	173.2	0	0	0	0	0	110.9	D61 S66 P67	D61-A64 HydrophobicContact CB-CB 4.47Å; D61-A64 WeakPolarHBondContact O-CB 3.31Å; D61-A64 PolarHBondContact O-N 2.93Å; A64-S66 PolarHBondContact O-N 2.93Å; A64-S66 VanDerWaalsContact O-N 3.15Å; A64-P67 VanDerWaalsContact O-CD 3.23Å; A64-P67 WeakPolarHBondContact O-CD 3.31Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.39Å
65	A	96.6	Very high	97.5	Very high	117 Å²	117	50.7 Å²	50.7	97%	0.967	28%	0.283	S	S	*	.	S	Bend	trans	-58.6	-31	179.4	0	0	0	0	0	113
66	S	96	Very high	97.5	Very high	79 Å²	79	49.2 Å²	49.2	55%	0.552	27%	0.274	S	S	*	.	S	Bend	trans	-134.6	89.8	171.5	-169.4	0	0	0	0	108.9	A64 R68	A64-S66 PolarHBondContact O-N 2.93Å; A64-S66 VanDerWaalsContact O-N 3.15Å; S66-R68 PolarHBondContact O-N 2.9Å; S66-R68 VanDerWaalsContact O-N 3.1Å
67	P	97	Very high	97.5	Very high	37 Å²	37	52.5 Å²	52.5	24%	0.24	29%	0.289	C	S	.	.			trans	-64.8	112.3	-175.3	-23.9	35.3	0	0	0	111.9	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.86Å; F60-P67 HydrophobicContact CZ-CB 3.67Å; S62-P67 WeakPolarHBondContact O-CG 3.4Å; A64-P67 VanDerWaalsContact O-CD 3.23Å; A64-P67 WeakPolarHBondContact O-CD 3.31Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.39Å; P67-K92 VanDerWaalsContact O-CE 3.24Å; P67-K92 WeakPolarHBondContact O-CE 3.35Å; P67-K92 PolarHBondContact O-NZ 2.81Å
68	R	97.9	Very high	97.3	Very high	150 Å²	150	58.2 Å²	58.2	57%	0.566	32%	0.316	S	S	*	.			trans	-146.6	159.2	177.4	62.3	-174.6	168.8	179.1	-1.9	110.5	S66 E70 T88	S66-R68 PolarHBondContact O-N 2.9Å; S66-R68 VanDerWaalsContact O-N 3.1Å; R68-E70 HydrophobicContact CG-CG 4.41Å; R68-T88 HydrophobicContact CB-CG2 4.21Å
69	G	97.6	Very high	97.2	Very high	6 Å²	6	58.8 Å²	58.8	6%	0.062	32%	0.319	C	S	.	.			trans	-64.2	131.2	168.5	0	0	0	0	0	109.8	T88	G69-T88 PolarHBondContact N-OG1 3.4Å
70	E	97.9	Very high	97.1	Very high	59 Å²	59	56.6 Å²	56.6	28%	0.276	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.1	-179	-64.3	178.2	161.2	0	0	109.9	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.32Å; R59-E70 PolarHBondContact N-O 2.86Å; R59-E70 PolarHBondContact O-N 3.22Å; R68-E70 HydrophobicContact CG-CG 4.41Å; E70-R72 IonicContact OE2-CZ 3.68Å; E70-R72 IonicContact OE2-NH2 3.44Å; E70-R72 PolarHBondContact OE2-NH2 2.8Å
71	P	98.1	Very high	97.1	Very high	49 Å²	49	61.1 Å²	61.1	32%	0.318	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	145.1	172.8	28.9	-33.9	0	0	0	110.8	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.78Å; P71-E77 HydrophobicContact CB-CG 3.7Å; P71-E77 HydrophobicContact CG-CG 3.93Å; P71-W84 HydrophobicContact CB-CH2 3.63Å; P71-W84 HydrophobicContact CB-CZ2 3.84Å; P71-W84 HydrophobicContact CG-CH2 4.24Å; P71-W84 HydrophobicContact CG-CZ2 4.26Å
72	R	97.6	Very high	97	Very high	115 Å²	115	68.2 Å²	68.2	43%	0.434	38%	0.384	S	S	.	.			trans	-127	-2	174.9	-60.5	-64	172.3	-177.3	-0.8	113.1	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CB-CB 4.48Å; Q56-R72 HydrophobicContact CG-CB 4.1Å; Q56-R72 HydrophobicContact CG-CG 4.32Å; Q56-R72 CarbonylContact O-C 3.51Å; F57-R72 PolarHBondContact O-N 3.42Å; R59-R72 HydrophobicContact CB-CG 3.92Å; E70-R72 IonicContact OE2-CZ 3.68Å; E70-R72 IonicContact OE2-NH2 3.44Å; E70-R72 PolarHBondContact OE2-NH2 2.8Å
73	A	96.4	Very high	97	Very high	4 Å²	4	67 Å²	67	3%	0.033	37%	0.374	C	S	.	.	S	Bend	trans	-136.3	143.5	173.1	0	0	0	0	0	110.9	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.49Å; F57-A73 HydrophobicContact CB-CB 4.09Å; A73-W75 VanDerWaalsContact C-N 3.28Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.35Å; A73-W75 HydrophobicContact CB-CZ2 3.99Å; A73-W75 PolarHBondContact O-N 2.96Å; A73-V76 WeakPolarHBondContact O-CG1 3.11Å; A73-V76 PolarHBondContact O-N 2.91Å
74	P	96.4	Very high	97	Very high	103 Å²	103	65.6 Å²	65.6	67%	0.669	36%	0.363	S	S	*	.	H	α-helix	trans	-58.1	-37.1	-177.6	-26.8	35	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 2.91Å; P74-E77 WeakPolarHBondContact O-CB 3.41Å; P74-E77 PolarHBondContact O-N 2.8Å; P74-E77 VanDerWaalsContact O-N 3.1Å
75	W	96.3	Very high	97.1	Very high	18 Å²	18	69.1 Å²	69.1	7%	0.068	38%	0.378	C	S	.	.	H	α-helix	trans	-70.5	-13.5	-175.7	53.2	-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 4.47Å; V52-W75 HydrophobicContact CG2-CH2 3.87Å; V52-W75 HydrophobicContact CG2-CZ2 4.43Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.35Å; F57-W75 HydrophobicContact CB-CZ3 3.9Å; F57-W75 HydrophobicContact CD1-CH2 4.01Å; F57-W75 AromaticContact CD2-CH2 3.74Å; F57-W75 HydrophobicContact CD2-CH2 3.74Å; F57-W75 AromaticContact CD2-CZ3 3.97Å; F57-W75 HydrophobicContact CD2-CZ3 3.97Å; F57-W75 AromaticContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CZ2 4.09Å; F57-W75 HydrophobicContact CG-CZ3 4.08Å; A73-W75 VanDerWaalsContact C-N 3.28Å; A73-W75 HydrophobicContact CB-CD2 4.14Å; A73-W75 HydrophobicContact CB-CG 4.35Å; A73-W75 HydrophobicContact CB-CZ2 3.99Å; A73-W75 PolarHBondContact O-N 2.96Å; W75-Q78 WeakPolarHBondContact O-CG 3.37Å; W75-Q78 PolarHBondContact O-NE2 3.44Å; W75-Y195 HydrophobicContact CE3-CD1 4.23Å; W75-Y195 HydrophobicContact CE3-CG 4.47Å; W75-Y195 HydrophobicContact CH2-CG 4.12Å; W75-Y195 AromaticContact CZ3-CD1 3.57Å; W75-Y195 HydrophobicContact CZ3-CD1 3.57Å; W75-Y195 HydrophobicContact CZ3-CD2 4.29Å; W75-Y195 HydrophobicContact CZ3-CE1 4.29Å; W75-Y195 AromaticContact CZ3-CG 3.57Å; W75-Y195 HydrophobicContact CZ3-CG 3.57Å; W75-N198 HydrophobicContact CB-CB 4.5Å; W75-N198 WeakPolarHBondContact CB-O 3.49Å; W75-T202 VanDerWaalsContact CD1-OG1 3.23Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.37Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.1Å; W75-L203 HydrophobicContact CZ2-CG 4.39Å
76	V	97.4	Very high	97.1	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-94.5	-16.3	172.3	72.5	0	0	0	0	112.1	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.38Å; F57-V76 HydrophobicContact CD2-CB 4.36Å; F57-V76 HydrophobicContact CD2-CG1 4.5Å; F57-V76 HydrophobicContact CD2-CG2 4.08Å; F57-V76 VanDerWaalsContact O-CG1 3.24Å; F57-V76 WeakPolarHBondContact O-CG1 3.19Å; P71-V76 HydrophobicContact CB-CG1 3.78Å; A73-V76 WeakPolarHBondContact O-CG1 3.11Å; A73-V76 PolarHBondContact O-N 2.91Å; P74-V76 PolarHBondContact O-N 2.91Å; V76-Q78 PolarHBondContact O-N 3.38Å; V76-E79 HydrophobicContact CG2-CG 3.87Å; V76-E79 VanDerWaalsContact O-CB 3.31Å; V76-E79 WeakPolarHBondContact O-CB 3.38Å; V76-E79 WeakPolarHBondContact O-CG 3.44Å; V76-E79 PolarHBondContact O-N 3.37Å; V76-Y83 HydrophobicContact CG2-CE1 4.08Å; V76-W84 HydrophobicContact CG1-CH2 4.07Å; V76-W84 HydrophobicContact CG1-CZ2 4.33Å; V76-W84 HydrophobicContact CG2-CH2 3.98Å; V76-W84 HydrophobicContact CG2-CZ2 4.06Å; V76-W84 WeakPolarHBondContact O-CZ2 3.42Å; V76-Y195 HydrophobicContact CG2-CE1 4.37Å
77	E	96	Very high	97.2	Very high	122 Å²	122	66.1 Å²	66.1	57%	0.57	33%	0.33	S	S	*	.	H	α-helix	trans	-63.2	-25.7	-179.9	-65.4	-178	-177.2	0	0	112.9	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.7Å; P71-E77 HydrophobicContact CG-CG 3.93Å; P74-E77 WeakPolarHBondContact O-CB 3.41Å; P74-E77 PolarHBondContact O-N 2.8Å; P74-E77 VanDerWaalsContact O-N 3.1Å; E77-E79 PolarHBondContact O-N 3.39Å
78	Q	95.1	Very high	97.3	Very high	121 Å²	121	65 Å²	65	57%	0.565	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-11.7	175.1	65.8	-176	-20.1	0	0	114	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.37Å; W75-Q78 PolarHBondContact O-NE2 3.44Å; V76-Q78 PolarHBondContact O-N 3.38Å; Q78-N198 PolarHBondContact NE2-ND2 3.41Å
79	E	97.1	Very high	97.3	Very high	11 Å²	11	62.8 Å²	62.8	5%	0.051	32%	0.319	C	S	.	.	S	Bend	trans	-65.3	136.4	175.4	-65.7	-61.6	162.9	0	0	111	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 3.87Å; V76-E79 VanDerWaalsContact O-CB 3.31Å; V76-E79 WeakPolarHBondContact O-CB 3.38Å; V76-E79 WeakPolarHBondContact O-CG 3.44Å; V76-E79 PolarHBondContact O-N 3.37Å; E77-E79 PolarHBondContact O-N 3.39Å; E79-Y83 HydrophobicContact CB-CD1 3.46Å; E79-Y83 VanDerWaalsContact CB-CD1 3.46Å; E79-Y83 HydrophobicContact CB-CE1 4.06Å; E79-Y83 HydrophobicContact CB-CG 3.78Å; E79-Y83 HydrophobicContact CG-CD1 4Å; E79-Y83 HydrophobicContact CG-CE1 4.19Å; E79-Y83 HydrophobicContact CG-CG 4.2Å; E79-W84 PolarHBondContact O-NE1 3.47Å; E79-R194 IonicContact OE1-CZ 2.84Å; E79-R194 IonicContact OE1-NE 2.76Å; E79-R194 PolarHBondContact OE1-NE 3.25Å; E79-R194 IonicContact OE1-NH2 3.22Å; E79-R194 PolarHBondContact OE1-NH2 2.85Å; E79-R194 IonicContact OE2-CZ 3.36Å; E79-R194 IonicContact OE2-NE 3.34Å; E79-R194 IonicContact OE2-NH2 3.6Å; E79-R194 PolarHBondContact OE2-NH2 3.25Å; E79-N198 PolarHBondContact OE1-ND2 3Å
80	G	96.2	Very high	97.3	Very high	36 Å²	36	64.9 Å²	64.9	37%	0.371	33%	0.329	S	S	.	.			trans	-70.5	169.4	-174.3	0	0	0	0	0	114.1	E82 Y83 W84	G80-E82 PolarHBondContact O-N 2.93Å; G80-Y83 WeakPolarHBondContact O-CB 2.98Å; G80-Y83 PolarHBondContact O-N 2.88Å; G80-Y83 VanDerWaalsContact O-N 3.07Å; G80-W84 PolarHBondContact O-N 2.99Å
81	P	97.1	Very high	97.3	Very high	98 Å²	98	62.3 Å²	62.3	64%	0.636	32%	0.317	S	S	*	.	H	α-helix	trans	-58	-34.5	-178.8	23	-33.7	0	0	0	113.2	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.28Å; P81-Y83 PolarHBondContact O-N 3.39Å; P81-W84 PolarHBondContact O-N 3.25Å; P81-D85 WeakPolarHBondContact O-CB 3.22Å; P81-D85 PolarHBondContact O-N 3.13Å
82	E	97.6	Very high	97.3	Very high	168 Å²	168	64 Å²	64	79%	0.785	32%	0.319	S	S	*	.	H	α-helix	trans	-60.6	-36.3	177.9	-63.5	-178.6	177.8	0	0	112.9	G80 R86	G80-E82 PolarHBondContact O-N 2.93Å; E82-R86 VanDerWaalsContact O-CB 3.24Å; E82-R86 WeakPolarHBondContact O-CB 3.47Å; E82-R86 PolarHBondContact O-N 3.01Å
83	Y	97.8	Very high	97.4	Very high	11 Å²	11	66.3 Å²	66.3	4%	0.043	33%	0.328	C	S	.	.	H	α-helix	trans	-64.6	-52.3	174.7	168.2	-95.1	0	0	0	110.1	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.08Å; E79-Y83 HydrophobicContact CB-CD1 3.46Å; E79-Y83 VanDerWaalsContact CB-CD1 3.46Å; E79-Y83 HydrophobicContact CB-CE1 4.06Å; E79-Y83 HydrophobicContact CB-CG 3.78Å; E79-Y83 HydrophobicContact CG-CD1 4Å; E79-Y83 HydrophobicContact CG-CE1 4.19Å; E79-Y83 HydrophobicContact CG-CG 4.2Å; G80-Y83 WeakPolarHBondContact O-CB 2.98Å; G80-Y83 PolarHBondContact O-N 2.88Å; G80-Y83 VanDerWaalsContact O-N 3.07Å; P81-Y83 VanDerWaalsContact C-N 3.28Å; P81-Y83 PolarHBondContact O-N 3.39Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.84Å; Y83-R86 PolarHBondContact O-N 3.36Å; Y83-E87 HydrophobicContact CD1-CG 4.44Å; Y83-E87 HydrophobicContact CD2-CG 4.02Å; Y83-E87 HydrophobicContact CE1-CG 4.09Å; Y83-E87 HydrophobicContact CE2-CG 3.61Å; Y83-E87 HydrophobicContact CG-CG 4.42Å; Y83-E87 WeakPolarHBondContact O-CG 3.39Å; Y83-E87 PolarHBondContact O-N 3.15Å; Y83-W191 AromaticContact CD2-CH2 3.45Å; Y83-W191 HydrophobicContact CD2-CH2 3.45Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.45Å; Y83-W191 HydrophobicContact CD2-CZ2 4.13Å; Y83-W191 AromaticContact CD2-CZ3 3.75Å; Y83-W191 HydrophobicContact CD2-CZ3 3.75Å; Y83-W191 HydrophobicContact CE2-CE3 4.25Å; Y83-W191 AromaticContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CZ2 4.46Å; Y83-W191 AromaticContact CE2-CZ3 3.72Å; Y83-W191 HydrophobicContact CE2-CZ3 3.72Å; Y83-W191 HydrophobicContact CG-CH2 4.49Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.12Å; Y83-Y195 PolarHBondContact OH-OH 3.47Å
84	W	98.1	Very high	97.5	Very high	40 Å²	40	68.4 Å²	68.4	15%	0.152	34%	0.336	C	S	.	.	H	α-helix	trans	-63.5	-38.2	-178.1	-66.6	112.2	0	0	0	113.1	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.94Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å; P71-W84 HydrophobicContact CB-CH2 3.63Å; P71-W84 HydrophobicContact CB-CZ2 3.84Å; P71-W84 HydrophobicContact CG-CH2 4.24Å; P71-W84 HydrophobicContact CG-CZ2 4.26Å; V76-W84 HydrophobicContact CG1-CH2 4.07Å; V76-W84 HydrophobicContact CG1-CZ2 4.33Å; V76-W84 HydrophobicContact CG2-CH2 3.98Å; V76-W84 HydrophobicContact CG2-CZ2 4.06Å; V76-W84 WeakPolarHBondContact O-CZ2 3.42Å; E79-W84 PolarHBondContact O-NE1 3.47Å; G80-W84 PolarHBondContact O-N 2.99Å; P81-W84 PolarHBondContact O-N 3.25Å; W84-T88 WeakPolarHBondContact O-CB 3.44Å; W84-T88 PolarHBondContact O-N 2.84Å; W84-T88 PolarHBondContact O-OG1 3.21Å
85	D	98.1	Very high	97.6	Very high	108 Å²	108	64.3 Å²	64.3	58%	0.578	31%	0.312	S	S	*	.	H	α-helix	trans	-65.1	-46.9	175	-76.1	-21.7	0	0	0	110.8	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.22Å; P81-D85 PolarHBondContact O-N 3.13Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 2.84Å; D85-T88 PolarHBondContact O-N 3.29Å; D85-Q89 WeakPolarHBondContact O-CG 3.33Å; D85-Q89 PolarHBondContact O-N 2.71Å
86	R	97.8	Very high	97.7	Very high	111 Å²	111	68.5 Å²	68.5	42%	0.419	33%	0.332	S	S	.	.	H	α-helix	trans	-62.2	-48.8	178.4	-172.1	-176	69.4	-156.8	-2.9	111.8	E82 Y83 T88 Q89 N90	E82-R86 VanDerWaalsContact O-CB 3.24Å; E82-R86 WeakPolarHBondContact O-CB 3.47Å; E82-R86 PolarHBondContact O-N 3.01Å; Y83-R86 PolarHBondContact O-N 3.36Å; R86-T88 VanDerWaalsContact C-N 3.34Å; R86-T88 PolarHBondContact O-N 2.68Å; R86-Q89 PolarHBondContact O-N 3.47Å; R86-N90 VanDerWaalsContact O-CG 3.23Å; R86-N90 PolarHBondContact O-N 2.83Å; R86-N90 PolarHBondContact O-ND2 3.37Å; R86-N90 PolarHBondContact O-OD1 2.97Å
87	E	97.8	Very high	97.7	Very high	22 Å²	22	70.6 Å²	70.6	10%	0.103	35%	0.349	C	S	.	.	H	α-helix	trans	-64.7	-39.7	179.3	-64.5	-40.1	125.3	0	0	111.5	Y83 Q89 N90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.44Å; Y83-E87 HydrophobicContact CD2-CG 4.02Å; Y83-E87 HydrophobicContact CE1-CG 4.09Å; Y83-E87 HydrophobicContact CE2-CG 3.61Å; Y83-E87 HydrophobicContact CG-CG 4.42Å; Y83-E87 WeakPolarHBondContact O-CG 3.39Å; Y83-E87 PolarHBondContact O-N 3.15Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 2.97Å; E87-N90 WeakPolarHBondContact O-CB 3.39Å; E87-N90 PolarHBondContact O-N 3.11Å; E87-N90 VanDerWaalsContact O-N 3.1Å; E87-N90 PolarHBondContact OE2-ND2 2.93Å; E87-N90 VanDerWaalsContact OE2-ND2 3.1Å; E87-Y91 HydrophobicContact CB-CE2 4.03Å; E87-Y91 WeakPolarHBondContact O-CD2 3.44Å; E87-Y91 PolarHBondContact O-N 2.95Å
88	T	98.5	Very high	97.8	Very high	12 Å²	12	65.1 Å²	65.1	7%	0.074	32%	0.324	C	S	.	.	H	α-helix	trans	-58.4	-42.3	173.1	-64.8	0	0	0	0	112.1	R68 G69 W84 D85 R86 K92	R68-T88 HydrophobicContact CB-CG2 4.21Å; G69-T88 PolarHBondContact N-OG1 3.4Å; W84-T88 WeakPolarHBondContact O-CB 3.44Å; W84-T88 PolarHBondContact O-N 2.84Å; W84-T88 PolarHBondContact O-OG1 3.21Å; D85-T88 PolarHBondContact O-N 3.29Å; R86-T88 VanDerWaalsContact C-N 3.34Å; R86-T88 PolarHBondContact O-N 2.68Å; T88-K92 HydrophobicContact CG2-CD 4.19Å; T88-K92 WeakPolarHBondContact O-CG 3.43Å; T88-K92 PolarHBondContact O-N 3.45Å
89	Q	98.4	Very high	97.9	Very high	105 Å²	105	62.5 Å²	62.5	49%	0.491	31%	0.309	S	S	.	.	H	α-helix	trans	-69	-35.3	175.8	-66.6	-58	-28.7	0	0	112.2	D85 R86 E87 K92 R93	D85-Q89 WeakPolarHBondContact O-CG 3.33Å; D85-Q89 PolarHBondContact O-N 2.71Å; R86-Q89 PolarHBondContact O-N 3.47Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 2.97Å; Q89-K92 PolarHBondContact O-N 2.91Å; Q89-R93 WeakPolarHBondContact O-CB 3.24Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 3.04Å
90	N	97.8	Very high	98	Very high	50 Å²	50	65.3 Å²	65.3	27%	0.267	33%	0.327	S	S	.	.	H	α-helix	trans	-59.5	-50.6	173.3	-66.5	-19.4	0	0	0	110.9	R86 E87 K92 R93 Q94	R86-N90 VanDerWaalsContact O-CG 3.23Å; R86-N90 PolarHBondContact O-N 2.83Å; R86-N90 PolarHBondContact O-ND2 3.37Å; R86-N90 PolarHBondContact O-OD1 2.97Å; E87-N90 WeakPolarHBondContact O-CB 3.39Å; E87-N90 PolarHBondContact O-N 3.11Å; E87-N90 VanDerWaalsContact O-N 3.1Å; E87-N90 PolarHBondContact OE2-ND2 2.93Å; E87-N90 VanDerWaalsContact OE2-ND2 3.1Å; N90-K92 PolarHBondContact O-N 3.44Å; N90-R93 PolarHBondContact O-N 3.41Å; N90-R93 PolarHBondContact OD1-NH2 3.29Å; N90-Q94 PolarHBondContact O-N 3.3Å
91	Y	98.6	Very high	98.1	Very high	5 Å²	5	65.7 Å²	65.7	2%	0.02	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-42.5	177.6	-61	-48.4	0	0	0	112.5	S48 V58 F60 E87 R93 Q94 A95	S48-Y91 WeakPolarHBondContact OG-CE1 3.48Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.34Å; F60-Y91 HydrophobicContact CB-CD1 4.2Å; F60-Y91 HydrophobicContact CB-CD2 3.52Å; F60-Y91 HydrophobicContact CB-CE2 3.95Å; F60-Y91 HydrophobicContact CB-CG 3.67Å; F60-Y91 HydrophobicContact CD1-CG 4.33Å; F60-Y91 AromaticContact CD2-CD2 3.61Å; F60-Y91 HydrophobicContact CD2-CD2 3.61Å; F60-Y91 AromaticContact CD2-CG 3.9Å; F60-Y91 HydrophobicContact CD2-CG 3.9Å; F60-Y91 AromaticContact CG-CD2 3.73Å; F60-Y91 HydrophobicContact CG-CD2 3.73Å; F60-Y91 AromaticContact CG-CG 3.71Å; F60-Y91 HydrophobicContact CG-CG 3.71Å; E87-Y91 HydrophobicContact CB-CE2 4.03Å; E87-Y91 WeakPolarHBondContact O-CD2 3.44Å; E87-Y91 PolarHBondContact O-N 2.95Å; Y91-R93 PolarHBondContact O-N 2.91Å; Y91-Q94 PolarHBondContact O-N 3.47Å; Y91-A95 WeakPolarHBondContact O-CB 3.3Å; Y91-A95 PolarHBondContact O-N 2.84Å
92	K	98.4	Very high	98.1	Very high	84 Å²	84	61.5 Å²	61.5	37%	0.365	30%	0.296	S	S	.	.	H	α-helix	trans	-64	-39.2	177.1	-74.4	175.7	-179.8	174.1	0	112.5	F60 P67 T88 Q89 N90 Q96	F60-K92 HydrophobicContact CE2-CG 4.36Å; F60-K92 HydrophobicContact CZ-CG 4.09Å; P67-K92 VanDerWaalsContact O-CE 3.24Å; P67-K92 WeakPolarHBondContact O-CE 3.35Å; P67-K92 PolarHBondContact O-NZ 2.81Å; T88-K92 HydrophobicContact CG2-CD 4.19Å; T88-K92 WeakPolarHBondContact O-CG 3.43Å; T88-K92 PolarHBondContact O-N 3.45Å; Q89-K92 PolarHBondContact O-N 2.91Å; N90-K92 PolarHBondContact O-N 3.44Å; K92-Q96 WeakPolarHBondContact O-CG 3.49Å; K92-Q96 PolarHBondContact O-N 3.25Å
93	R	98.4	Very high	98.1	Very high	164 Å²	164	59.2 Å²	59.2	62%	0.619	28%	0.28	S	S	*	.	H	α-helix	trans	-65.8	-44.2	174.6	-74.3	-172.2	-65.9	169.2	-0.8	111.3	Q89 N90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.24Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 3.04Å; N90-R93 PolarHBondContact O-N 3.41Å; N90-R93 PolarHBondContact OD1-NH2 3.29Å; Y91-R93 PolarHBondContact O-N 2.91Å; R93-Q96 PolarHBondContact O-N 3.47Å; R93-A97 PolarHBondContact O-N 2.92Å
94	Q	98.4	Very high	98.1	Very high	47 Å²	47	62 Å²	62	22%	0.22	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-44.5	177.1	-170.7	62	50.4	0	0	111.6	F46 N90 Y91 Q96 A97 D98	F46-Q94 HydrophobicContact CE2-CB 4.26Å; F46-Q94 HydrophobicContact CE2-CG 3.74Å; F46-Q94 HydrophobicContact CZ-CB 3.92Å; F46-Q94 HydrophobicContact CZ-CG 3.72Å; N90-Q94 PolarHBondContact O-N 3.3Å; Y91-Q94 PolarHBondContact O-N 3.47Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 3.49Å; Q94-A97 WeakPolarHBondContact O-CA 3.47Å; Q94-A97 WeakPolarHBondContact O-CB 3.31Å; Q94-A97 PolarHBondContact O-N 3.28Å; Q94-D98 PolarHBondContact NE2-OD1 3.46Å; Q94-D98 PolarHBondContact O-N 3.46Å
95	A	98.4	Very high	98.1	Very high	18 Å²	18	60.3 Å²	60.3	15%	0.149	29%	0.289	C	S	.	.	H	α-helix	trans	-57.4	-39.6	176.6	0	0	0	0	0	112.8	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.68Å; F46-A95 HydrophobicContact CD1-CB 3.75Å; F46-A95 HydrophobicContact CD2-CB 4.1Å; F46-A95 HydrophobicContact CE1-CB 4.41Å; F46-A95 HydrophobicContact CG-CB 3.57Å; Y91-A95 WeakPolarHBondContact O-CB 3.3Å; Y91-A95 PolarHBondContact O-N 2.84Å; A95-R99 WeakPolarHBondContact O-CB 3.31Å; A95-R99 PolarHBondContact O-N 3.42Å
96	Q	98.1	Very high	98.1	Very high	106 Å²	106	58.1 Å²	58.1	50%	0.495	27%	0.273	S	S	.	.	H	α-helix	trans	-70.1	-39	174.8	-67.5	-57.9	-35.9	0	0	112.3	K92 R93 Q94 R99 V100	K92-Q96 WeakPolarHBondContact O-CG 3.49Å; K92-Q96 PolarHBondContact O-N 3.25Å; R93-Q96 PolarHBondContact O-N 3.47Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 3.49Å; Q96-R99 PolarHBondContact O-N 2.95Å; Q96-V100 WeakPolarHBondContact O-CG2 2.91Å; Q96-V100 PolarHBondContact O-N 2.89Å
97	A	97.8	Very high	98	Very high	44 Å²	44	54.9 Å²	54.9	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-47.9	174.8	0	0	0	0	0	110.9	R93 Q94 R99 V100 S101	R93-A97 PolarHBondContact O-N 2.92Å; Q94-A97 WeakPolarHBondContact O-CA 3.47Å; Q94-A97 WeakPolarHBondContact O-CB 3.31Å; Q94-A97 PolarHBondContact O-N 3.28Å; A97-R99 VanDerWaalsContact C-N 3.32Å; A97-R99 PolarHBondContact O-N 3.47Å; A97-V100 WeakPolarHBondContact O-CB 3.15Å; A97-V100 PolarHBondContact O-N 3.41Å; A97-S101 PolarHBondContact O-N 2.92Å; A97-S101 PolarHBondContact O-OG 3.15Å; A97-S101 VanDerWaalsContact O-OG 3.14Å
98	D	98.3	Very high	98.1	Very high	6 Å²	6	56.4 Å²	56.4	3%	0.032	28%	0.279	C	S	.	.	H	α-helix	trans	-64.5	-36.2	180	-73.8	1.2	0	0	0	112.4	A35 F46 Q94 V100 S101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.66Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.41Å; F46-D98 VanDerWaalsContact CE2-OD2 3.23Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.17Å; Q94-D98 PolarHBondContact NE2-OD1 3.46Å; Q94-D98 PolarHBondContact O-N 3.46Å; D98-V100 VanDerWaalsContact C-N 3.29Å; D98-V100 PolarHBondContact O-N 2.93Å; D98-S101 PolarHBondContact O-N 2.93Å; D98-L102 WeakPolarHBondContact O-CB 3.11Å; D98-L102 WeakPolarHBondContact O-CG 3.39Å; D98-L102 PolarHBondContact O-N 2.77Å; D98-L119 HydrophobicContact CB-CD2 4.17Å
99	R	97.9	Very high	98	Very high	67 Å²	67	59.1 Å²	59.1	25%	0.253	29%	0.289	S	S	.	.	H	α-helix	trans	-59.4	-39.6	171.8	177.8	-169.8	176	-163.4	5.9	112.3	E43 P44 A95 Q96 A97 R103	E43-R99 VanDerWaalsContact CD-NE 3.32Å; E43-R99 IonicContact OE1-CZ 3.89Å; E43-R99 VanDerWaalsContact OE1-CZ 3.23Å; E43-R99 IonicContact OE1-NE 2.74Å; E43-R99 IonicContact OE1-NH2 2.93Å; E43-R99 PolarHBondContact OE1-NH2 2.86Å; E43-R99 WeakPolarHBondContact OE2-CD 3.31Å; E43-R99 IonicContact OE2-CZ 3.72Å; E43-R99 IonicContact OE2-NE 3.69Å; E43-R99 PolarHBondContact OE2-NE 3.28Å; E43-R99 IonicContact OE2-NH2 3.68Å; E43-R99 PolarHBondContact OE2-NH2 3.34Å; E43-R99 VanDerWaalsContact OE2-NH2 3.15Å; P44-R99 HydrophobicContact CG-CB 4.42Å; P44-R99 HydrophobicContact CG-CG 4.16Å; A95-R99 WeakPolarHBondContact O-CB 3.31Å; A95-R99 PolarHBondContact O-N 3.42Å; Q96-R99 PolarHBondContact O-N 2.95Å; A97-R99 VanDerWaalsContact C-N 3.32Å; A97-R99 PolarHBondContact O-N 3.47Å; R99-R103 VanDerWaalsContact CZ-NH2 3.32Å; R99-R103 PolarHBondContact O-NE 3.48Å
100	V	97.8	Very high	98	Very high	70 Å²	70	61.3 Å²	61.3	42%	0.424	30%	0.304	S	S	.	.	H	α-helix	trans	-72.9	-42.3	175.8	174	0	0	0	0	110.2	Q96 A97 D98 L102 R103 N104	Q96-V100 WeakPolarHBondContact O-CG2 2.91Å; Q96-V100 PolarHBondContact O-N 2.89Å; A97-V100 WeakPolarHBondContact O-CB 3.15Å; A97-V100 PolarHBondContact O-N 3.41Å; D98-V100 VanDerWaalsContact C-N 3.29Å; D98-V100 PolarHBondContact O-N 2.93Å; V100-L102 PolarHBondContact O-N 2.67Å; V100-R103 PolarHBondContact O-N 3.05Å; V100-N104 PolarHBondContact O-N 2.63Å; V100-N104 PolarHBondContact O-ND2 2.9Å
101	S	98.1	Very high	97.9	Very high	44 Å²	44	61.8 Å²	61.8	31%	0.308	30%	0.304	S	S	.	.	H	α-helix	trans	-58.8	-46	176.7	-63.5	0	0	0	0	112.1	A97 D98 R103 N104 L105	A97-S101 PolarHBondContact O-N 2.92Å; A97-S101 PolarHBondContact O-OG 3.15Å; A97-S101 VanDerWaalsContact O-OG 3.14Å; D98-S101 PolarHBondContact O-N 2.93Å; S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 2.98Å; S101-N104 PolarHBondContact O-N 3.46Å; S101-N104 VanDerWaalsContact O-N 3.1Å; S101-L105 WeakPolarHBondContact O-CB 3.45Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.24Å; S101-L105 PolarHBondContact O-N 2.93Å
102	L	98.4	Very high	97.8	Very high	9 Å²	9	65 Å²	65	5%	0.047	33%	0.328	C	S	.	.	H	α-helix	trans	-56.7	-40.3	175.7	-78	168.1	0	0	0	112.3	A35 P44 D98 V100 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.89Å; P44-L102 HydrophobicContact CB-CD1 3.7Å; P44-L102 HydrophobicContact CG-CD1 3.87Å; D98-L102 WeakPolarHBondContact O-CB 3.11Å; D98-L102 WeakPolarHBondContact O-CG 3.39Å; D98-L102 PolarHBondContact O-N 2.77Å; V100-L102 PolarHBondContact O-N 2.67Å; L102-R106 WeakPolarHBondContact O-CB 3.45Å; L102-R106 PolarHBondContact O-N 2.82Å; L102-R106 VanDerWaalsContact O-N 3.1Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; L102-L119 HydrophobicContact CD2-CB 3.69Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L102-Y142 HydrophobicContact CD2-CE2 4Å
103	R	97	Very high	97.4	Very high	121 Å²	121	67 Å²	67	46%	0.457	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-41.8	175.6	-74.6	-175.3	-103.4	167.7	-9.1	112.2	R99 V100 S101 G107	R99-R103 VanDerWaalsContact CZ-NH2 3.32Å; R99-R103 PolarHBondContact O-NE 3.48Å; V100-R103 PolarHBondContact O-N 3.05Å; S101-R103 VanDerWaalsContact C-N 3.28Å; S101-R103 PolarHBondContact O-N 2.98Å; R103-G107 PolarHBondContact O-N 2.86Å
104	N	97.8	Very high	97.1	Very high	69 Å²	69	66 Å²	66	37%	0.369	35%	0.345	S	S	.	.	H	α-helix	trans	-65.5	-46.6	177.9	-68.8	-23.4	0	0	0	111.6	V100 S101 G107 Y108	V100-N104 PolarHBondContact O-N 2.63Å; V100-N104 PolarHBondContact O-ND2 2.9Å; S101-N104 PolarHBondContact O-N 3.46Å; S101-N104 VanDerWaalsContact O-N 3.1Å; N104-G107 CarbonylContact O-C 3.54Å; N104-G107 WeakPolarHBondContact O-CA 3.39Å; N104-G107 PolarHBondContact O-N 3.2Å; N104-G107 VanDerWaalsContact O-N 3.12Å; N104-Y108 HydrophobicContact CB-CE2 4.39Å; N104-Y108 WeakPolarHBondContact O-CD1 3.45Å; N104-Y108 VanDerWaalsContact O-CG 3.29Å; N104-Y108 PolarHBondContact O-N 2.94Å
105	L	98.3	Very high	96.9	Very high	5 Å²	5	64.9 Å²	64.9	3%	0.026	35%	0.346	C	S	.	.	H	α-helix	trans	-60.3	-48.4	179.9	-70.4	164.7	0	0	0	110.9	S101 G107 Y108 Y109 L119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.45Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.24Å; S101-L105 PolarHBondContact O-N 2.93Å; L105-G107 PolarHBondContact O-N 3.41Å; L105-Y108 HydrophobicContact CD2-CD2 4.48Å; L105-Y108 PolarHBondContact O-N 3Å; L105-Y109 HydrophobicContact CD2-CE2 4.21Å; L105-Y109 VanDerWaalsContact O-CD2 3.25Å; L105-Y109 WeakPolarHBondContact O-CD2 3.42Å; L105-Y109 PolarHBondContact O-N 3.19Å; L105-L119 HydrophobicContact CD1-CD1 3.88Å; 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 3.96Å; L105-Y142 HydrophobicContact CB-CE2 3.86Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.93Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.41Å; L105-Y142 HydrophobicContact CG-CE2 4.5Å; L105-Y147 HydrophobicContact CD2-CD1 4.31Å; L105-Y147 HydrophobicContact CD2-CD2 4.06Å; L105-Y147 HydrophobicContact CD2-CE1 3.73Å; L105-Y147 HydrophobicContact CD2-CE2 3.42Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.42Å; L105-Y147 HydrophobicContact CD2-CG 4.47Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.47Å
106	R	97.4	Very high	96.8	Very high	61 Å²	61	67.6 Å²	67.6	23%	0.23	36%	0.364	C	S	.	.	H	α-helix	trans	-52.5	-42.2	173.9	-172.4	-174.2	66.3	174.8	10.5	112.1	L102 N110 Q111 E113	L102-R106 WeakPolarHBondContact O-CB 3.45Å; L102-R106 PolarHBondContact O-N 2.82Å; L102-R106 VanDerWaalsContact O-N 3.1Å; R106-N110 PolarHBondContact O-N 3.38Å; R106-N110 VanDerWaalsContact O-N 3.16Å; R106-Q111 HydrophobicContact CG-CB 3.85Å; R106-Q111 PolarHBondContact O-N 2.98Å; R106-E113 IonicContact CZ-OE1 3.02Å; R106-E113 IonicContact NH1-OE1 3.36Å; R106-E113 IonicContact NH2-OE1 3.18Å; R106-E113 PolarHBondContact NH2-OE1 3.15Å
107	G	97.4	Very high	96.8	Very high	43 Å²	43	63.3 Å²	63.3	44%	0.443	34%	0.344	S	S	.	.	H	α-helix	trans	-66.3	-45.9	175.2	0	0	0	0	0	113.3	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 2.86Å; N104-G107 CarbonylContact O-C 3.54Å; N104-G107 WeakPolarHBondContact O-CA 3.39Å; N104-G107 PolarHBondContact O-N 3.2Å; N104-G107 VanDerWaalsContact O-N 3.12Å; L105-G107 PolarHBondContact O-N 3.41Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 2.75Å; G107-N110 PolarHBondContact O-N 2.88Å; G107-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-OD1 3.47Å
108	Y	98	Very high	96.9	Very high	54 Å²	54	63 Å²	63	21%	0.212	34%	0.338	C	S	.	.	H	α-helix	trans	-61.8	-35.7	179.4	-62.1	-18.6	0	0	0	112.8	N104 L105 I166 K170	N104-Y108 HydrophobicContact CB-CE2 4.39Å; N104-Y108 WeakPolarHBondContact O-CD1 3.45Å; N104-Y108 VanDerWaalsContact O-CG 3.29Å; N104-Y108 PolarHBondContact O-N 2.94Å; L105-Y108 HydrophobicContact CD2-CD2 4.48Å; L105-Y108 PolarHBondContact O-N 3Å; Y108-I166 HydrophobicContact CD1-CD1 4.05Å; Y108-I166 HydrophobicContact CE1-CD1 4.36Å; Y108-I166 HydrophobicContact CE1-CG2 4Å; Y108-I166 HydrophobicContact CE2-CB 4.29Å; Y108-I166 HydrophobicContact CE2-CG2 4.14Å; Y108-I166 HydrophobicContact CG-CD1 4.15Å; Y108-K170 PolarHBondContact OH-NZ 2.91Å
109	Y	97.9	Very high	96.9	Very high	69 Å²	69	63.2 Å²	63.2	27%	0.271	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	3.5	178.5	-69.3	-71.3	0	0	0	113.8	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.21Å; L105-Y109 VanDerWaalsContact O-CD2 3.25Å; L105-Y109 WeakPolarHBondContact O-CD2 3.42Å; L105-Y109 PolarHBondContact O-N 3.19Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 2.75Å; Y109-Q111 PolarHBondContact O-N 3Å; Y109-Y142 AromaticContact CD2-CD1 3.76Å; Y109-Y142 HydrophobicContact CD2-CD1 3.76Å; Y109-Y142 AromaticContact CD2-CE1 3.53Å; Y109-Y142 HydrophobicContact CD2-CE1 3.53Å; Y109-Y142 AromaticContact CE2-CD1 3.53Å; Y109-Y142 HydrophobicContact CE2-CD1 3.53Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.46Å; Y109-Y147 HydrophobicContact CE2-CD2 4.42Å; Y109-Y147 HydrophobicContact CE2-CE2 4.13Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.34Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.32Å; Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.36Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.82Å; Y109-D161 PolarHBondContact OH-OD2 3.07Å; Y109-A163 HydrophobicContact CD1-CB 4.15Å; Y109-A163 HydrophobicContact CD2-CB 4.43Å; Y109-A163 HydrophobicContact CE1-CB 3.6Å; Y109-A163 HydrophobicContact CE2-CB 3.91Å; Y109-A163 VanDerWaalsContact CZ-CB 3.47Å
110	N	97	Very high	96.9	Very high	152 Å²	152	63.8 Å²	63.8	81%	0.813	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	41.1	-177.6	-56.7	-59	0	0	0	113.3	R106 G107	R106-N110 PolarHBondContact O-N 3.38Å; R106-N110 VanDerWaalsContact O-N 3.16Å; G107-N110 PolarHBondContact O-N 2.88Å; G107-N110 VanDerWaalsContact O-N 3.14Å; G107-N110 PolarHBondContact O-OD1 3.47Å
111	Q	97.2	Very high	97	Very high	59 Å²	59	62.3 Å²	62.3	28%	0.276	33%	0.332	S	S	.	.			trans	-88.1	154.3	-176.8	-70.6	165	-35.9	0	0	112	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.85Å; R106-Q111 PolarHBondContact O-N 2.98Å; Y109-Q111 PolarHBondContact O-N 3Å; Q111-H117 PolarHBondContact NE2-CE1 3.33Å; Q111-H117 PolarHBondContact OE1-CE1 3.34Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.29Å; Q111-Y142 PolarHBondContact OE1-OH 2.96Å; Q111-D143 PolarHBondContact NE2-OD2 3.2Å
112	S	94.9	Very high	97	Very high	73 Å²	73	61.3 Å²	61.3	51%	0.51	32%	0.322	S	S	.	.			trans	-64.9	151.1	178.1	178.1	0	0	0	0	112.4	D114 G115	S112-D114 VanDerWaalsContact C-N 3.27Å; S112-D114 PolarHBondContact O-N 3.37Å; S112-D114 PolarHBondContact OG-N 2.9Å; S112-G115 PolarHBondContact O-N 3.35Å
113	E	91.3	Very high	97	Very high	126 Å²	126	62.4 Å²	62.4	59%	0.589	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-22.7	174.3	-57.6	-151.4	125.7	0	0	113.7	P39 R106 G115	P39-E113 VanDerWaalsContact CB-O 3.32Å; P39-E113 WeakPolarHBondContact CB-O 3.26Å; P39-E113 WeakPolarHBondContact CG-O 3.41Å; R106-E113 IonicContact CZ-OE1 3.02Å; R106-E113 IonicContact NH1-OE1 3.36Å; R106-E113 IonicContact NH2-OE1 3.18Å; R106-E113 PolarHBondContact NH2-OE1 3.15Å; E113-G115 VanDerWaalsContact C-N 3.27Å; E113-G115 PolarHBondContact O-N 2.92Å
114	D	91.8	Very high	97.1	Very high	142 Å²	142	56.6 Å²	56.6	76%	0.759	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.6	-178.4	-60	-38.9	0	0	0	112.7	S112	S112-D114 VanDerWaalsContact C-N 3.27Å; S112-D114 PolarHBondContact O-N 3.37Å; S112-D114 PolarHBondContact OG-N 2.9Å
115	G	93.3	Very high	97.1	Very high	24 Å²	24	53.3 Å²	53.3	25%	0.247	29%	0.286	C	S	.	.			trans	-76.1	132.6	178.7	0	0	0	0	0	112.9	P39 S112 E113 H117	P39-G115 VanDerWaalsContact CG-O 3.22Å; P39-G115 WeakPolarHBondContact CG-O 3.43Å; S112-G115 PolarHBondContact O-N 3.35Å; E113-G115 VanDerWaalsContact C-N 3.27Å; E113-G115 PolarHBondContact O-N 2.92Å; G115-H117 PolarHBondContact O-CD2 3.37Å; G115-H117 VanDerWaalsContact O-CD2 3.23Å
116	S	97.3	Very high	97.1	Very high	75 Å²	75	54.1 Å²	54.1	52%	0.524	29%	0.291	S	S	.	.			trans	-81.2	134.8	164.2	-178.3	0	0	0	0	109.1	S37	S37-S116 WeakPolarHBondContact O-CB 3.33Å; S37-S116 PolarHBondContact O-OG 3.16Å
117	H	98.4	Very high	97.1	Very high	16 Å²	16	51.4 Å²	51.4	7%	0.074	28%	0.281	C	S	.	.			trans	-134	150.4	-175.8	-64.6	-73.5	0	0	0	110.4	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 WeakPolarHBondContact CA-O 3.34Å; S37-H117 PolarHBondContact N-O 2.85Å; S37-H117 PolarHBondContact OG-N 3.32Å; S37-H117 PolarHBondContact OG-O 3.29Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; Q111-H117 PolarHBondContact NE2-CE1 3.33Å; Q111-H117 PolarHBondContact OE1-CE1 3.34Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.29Å; G115-H117 PolarHBondContact O-CD2 3.37Å; G115-H117 VanDerWaalsContact O-CD2 3.23Å; H117-Y142 HydrophobicContact CB-CE2 3.8Å; H117-Y142 WeakPolarHBondContact CB-OH 3.2Å; H117-Y142 AromaticContact CG-CZ 3.99Å; H117-Y142 AromaticContact ND1-CZ 3.9Å; H117-Y142 PolarHBondContact ND1-OH 3.48Å; H117-D143 WeakPolarHBondContact CA-OD1 3.34Å; H117-D143 WeakPolarHBondContact CB-OD1 3.4Å; H117-D143 IonicContact CE1-OD2 3.23Å; H117-D143 IonicContact CG-OD1 2.6Å; H117-D143 IonicContact CG-OD2 3.64Å; H117-D143 IonicContact ND1-OD1 2.67Å; H117-D143 IonicContact ND1-OD2 3.04Å; H117-D143 PolarHBondContact ND1-OD2 2.83Å
118	T	98.8	Very high	96.9	Very high	39 Å²	39	49.8 Å²	49.8	24%	0.239	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	127.2	-175.4	-59.4	0	0	0	0	110	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.13Å; A35-T118 WeakPolarHBondContact O-CA 3.32Å; V36-T118 HydrophobicContact CG2-CG2 4.21Å; T118-Q120 HydrophobicContact CG2-CG 3.89Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.3Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.35Å; T118-D143 PolarHBondContact N-OD1 2.98Å; T118-D143 PolarHBondContact O-N 3.32Å
119	L	98.9	Very high	96.4	Very high	9 Å²	9	51.4 Å²	51.4	5%	0.047	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.3	169.6	176.1	62	0	0	0	108.2	T34 A35 D98 L102 L105	T34-L119 WeakPolarHBondContact CA-O 3.49Å; A35-L119 HydrophobicContact CB-CB 4.47Å; A35-L119 PolarHBondContact N-O 3.35Å; A35-L119 PolarHBondContact O-N 2.86Å; D98-L119 HydrophobicContact CB-CD2 4.17Å; L102-L119 HydrophobicContact CD2-CB 3.69Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L105-L119 HydrophobicContact CD1-CD1 3.88Å; L105-L119 HydrophobicContact CD1-CD2 4.25Å
120	Q	98.8	Very high	96	Very high	79 Å²	79	53 Å²	53	37%	0.369	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.2	177.3	-62.7	173.3	-87.3	0	0	109.2	D33 T34 T118 S140 A141	D33-Q120 CarbonylContact O-C 3.56Å; D33-Q120 VanDerWaalsContact O-CA 3.3Å; D33-Q120 WeakPolarHBondContact O-CA 3.41Å; T34-Q120 HydrophobicContact CG2-CG 4.14Å; T118-Q120 HydrophobicContact CG2-CG 3.89Å; Q120-S140 CarbonylContact O-C 3.53Å; Q120-S140 WeakPolarHBondContact O-CA 3.36Å; Q120-S140 WeakPolarHBondContact O-CB 3.27Å; Q120-A141 HydrophobicContact CB-CB 4.46Å; Q120-A141 PolarHBondContact N-O 2.86Å; Q120-A141 PolarHBondContact O-N 2.87Å
121	R	98.7	Very high	95.6	Very high	40 Å²	40	46.7 Å²	46.7	15%	0.151	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	133.5	172.9	-179.4	179	173.1	-131.3	3.8	109.7	F32 D33 Y123 D138 Q139	F32-R121 WeakPolarHBondContact CA-O 3.27Å; D33-R121 HydrophobicContact CB-CB 4.28Å; D33-R121 PolarHBondContact N-O 2.95Å; D33-R121 PolarHBondContact O-N 3.47Å; R121-Y123 HydrophobicContact CG-CD1 4.3Å; R121-D138 IonicContact CZ-OD1 2.7Å; R121-D138 IonicContact NE-OD1 3.79Å; R121-D138 PolarHBondContact NE-OD1 2.71Å; R121-D138 IonicContact NE-OD2 3.52Å; R121-D138 IonicContact NH2-OD1 3.65Å; R121-D138 PolarHBondContact NH2-OD1 2.91Å; R121-Q139 CarbonylContact C-O 3.56Å; R121-Q139 VanDerWaalsContact CA-O 3.28Å; R121-Q139 WeakPolarHBondContact CA-O 3.43Å
122	M	98.8	Very high	95.4	Very high	22 Å²	22	52.1 Å²	52.1	11%	0.108	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	129.4	168.9	-176.1	-78.7	-73.9	0	0	108.4	Y31 F32 Y137 Q139	Y31-M122 VanDerWaalsContact O-CA 3.32Å; Y31-M122 WeakPolarHBondContact O-CA 3.41Å; F32-M122 HydrophobicContact CD1-CB 3.96Å; F32-M122 HydrophobicContact CD1-CG 3.67Å; F32-M122 HydrophobicContact CE1-CB 4.11Å; F32-M122 HydrophobicContact CE1-CG 3.39Å; F32-M122 HydrophobicContact CG-CG 4.49Å; F32-M122 HydrophobicContact CZ-CG 4.02Å; M122-Y137 HydrophobicContact CE-CD1 4.12Å; M122-Y137 HydrophobicContact CE-CG 4.14Å; M122-Y137 HydrophobicContact SD-CG 4.48Å; M122-Q139 HydrophobicContact CB-CG 4.16Å; M122-Q139 HydrophobicContact CE-CG 3.91Å; M122-Q139 PolarHBondContact N-O 2.84Å; M122-Q139 PolarHBondContact O-N 3.37Å
123	Y	98.7	Very high	95.5	Very high	32 Å²	32	51 Å²	51	13%	0.125	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	155.7	174	67.5	-83	0	0	0	110.6	Y31 R121 Y137 Y183	Y31-Y123 VanDerWaalsContact CB-CE1 3.43Å; Y31-Y123 HydrophobicContact CD2-CD2 4.35Å; Y31-Y123 AromaticContact CD2-CE2 3.68Å; Y31-Y123 HydrophobicContact CD2-CE2 3.68Å; Y31-Y123 AromaticContact CD2-CZ 3.91Å; Y31-Y123 HydrophobicContact CE2-CE2 4.46Å; Y31-Y123 HydrophobicContact CG-CE1 4.26Å; Y31-Y123 AromaticContact CG-CE2 3.96Å; Y31-Y123 HydrophobicContact CG-CE2 3.96Å; Y31-Y123 AromaticContact CG-CZ 3.68Å; Y31-Y123 PolarHBondContact N-O 3.18Å; Y31-Y123 PolarHBondContact O-N 3.24Å; Y31-Y123 VanDerWaalsContact O-N 3.11Å; R121-Y123 HydrophobicContact CG-CD1 4.3Å; Y123-Y137 WeakPolarHBondContact CA-O 3.15Å; Y123-Y137 WeakPolarHBondContact CB-O 3.18Å; Y123-Y183 AromaticContact CD2-CE1 3.94Å; Y123-Y183 HydrophobicContact CD2-CE1 3.94Å; Y123-Y183 HydrophobicContact CE2-CE1 4.08Å
124	G	98.5	Very high	95.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.3	-175.2	-176.9	0	0	0	0	0	114.1	M29 G136 Y137 L184	M29-G124 CarbonylContact O-C 3.6Å; M29-G124 WeakPolarHBondContact O-CA 3.47Å; G124-G136 CarbonylContact O-C 3.5Å; G124-G136 WeakPolarHBondContact O-CA 3.35Å; G124-Y137 PolarHBondContact N-O 3.02Å; G124-Y137 VanDerWaalsContact N-O 3.07Å; G124-Y137 PolarHBondContact O-N 2.84Å; G124-L184 WeakPolarHBondContact O-CD2 3.45Å
125	C	98.4	Very high	96	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	148.1	-176.4	54.1	0	0	0	0	111.3	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.27Å; M29-C125 PolarHBondContact N-O 3.17Å; M29-C125 PolarHBondContact O-N 2.84Å; C125-L133 HydrophobicContact CB-CD1 3.56Å; C125-R135 CarbonylContact C-O 3.54Å; C125-R135 WeakPolarHBondContact CA-O 3.49Å; C125-C188 HydrophobicContact CB-CB 3.93Å; C125-C188 WeakPolarHBondContact CB-SG 3.29Å; C125-C188 PolarHBondContact N-SG 3.03Å; C125-C188 WeakPolarHBondContact SG-CB 3.42Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.14Å
126	D	97.9	Very high	96.2	Very high	21 Å²	21	47.6 Å²	47.6	11%	0.112	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.6	171.3	-59.7	-12.2	0	0	0	108.8	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.59Å; H27-D126 WeakPolarHBondContact O-CA 3.37Å; S28-D126 WeakPolarHBondContact CB-OD1 3.4Å; R30-D126 IonicContact CZ-OD1 3.42Å; R30-D126 IonicContact NE-OD1 3.26Å; R30-D126 PolarHBondContact NE-OD1 3.18Å; R30-D126 VanDerWaalsContact NH2-CG 3.27Å; R30-D126 IonicContact NH2-OD1 2.72Å; R30-D126 PolarHBondContact NH2-OD1 3.1Å; R30-D126 IonicContact NH2-OD2 2.87Å; R30-D126 PolarHBondContact NH2-OD2 2.79Å; D126-L134 HydrophobicContact CB-CB 4.37Å; D126-L134 PolarHBondContact O-N 3.06Å; D126-R135 HydrophobicContact CB-CB 4.45Å; D126-R135 PolarHBondContact N-O 2.6Å; D126-R135 PolarHBondContact O-N 3.35Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.15Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.29Å; D126-Y137 PolarHBondContact OD2-OH 2.88Å
127	L	96.7	Very high	96.3	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.9	172.6	-56.7	-176.8	0	0	0	110.2	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.39Å; S26-L127 WeakPolarHBondContact CB-O 3.35Å; H27-L127 PolarHBondContact N-O 3Å; H27-L127 VanDerWaalsContact N-O 3.16Å; H27-L127 PolarHBondContact O-N 3.16Å; L127-R132 CarbonylContact C-O 3.52Å; L127-R132 VanDerWaalsContact CA-O 3.25Å; L127-R132 WeakPolarHBondContact CA-O 3.28Å; L127-V189 HydrophobicContact CD2-CB 4.17Å; L127-V189 HydrophobicContact CD2-CG1 3.77Å; L127-V189 HydrophobicContact CD2-CG2 3.83Å; L127-L192 HydrophobicContact CD1-CB 4.27Å; L127-L192 HydrophobicContact CD1-CD2 3.69Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CD2-CD2 4.5Å; L127-L192 HydrophobicContact CG-CD2 3.57Å; L127-L192 HydrophobicContact CG-CG 4.21Å; L127-R193 HydrophobicContact CD1-CG 3.95Å
128	G	93.3	Very high	96.3	Very high	9 Å²	9	45.5 Å²	45.5	9%	0.093	23%	0.226	C	C	.	.			trans	-69.3	173.7	165.1	0	0	0	0	0	111.7	D130 G131 R132	G128-D130 PolarHBondContact O-N 3.11Å; G128-G131 WeakPolarHBondContact O-CA 3.25Å; G128-G131 PolarHBondContact O-N 2.87Å; G128-R132 PolarHBondContact N-O 2.89Å
129	P	88.9	Confident	96.3	Very high	88 Å²	88	47.4 Å²	47.4	57%	0.571	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.9	178.4	-18.9	29.5	0	0	0	113.6	A24 G131	A24-P129 HydrophobicContact CB-CB 3.81Å; A24-P129 HydrophobicContact CB-CG 3.19Å; P129-G131 PolarHBondContact O-N 2.65Å
130	D	88.6	Confident	96.2	Very high	103 Å²	103	48 Å²	48	55%	0.551	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	3.4	174	70.1	-14.6	0	0	0	113	G128 R132	G128-D130 PolarHBondContact O-N 3.11Å; D130-R132 PolarHBondContact O-N 3.28Å; D130-R132 WeakPolarHBondContact OD1-CB 3.33Å; D130-R132 PolarHBondContact OD1-N 2.83Å; D130-R132 WeakPolarHBondContact OD2-CD 3.46Å; D130-R132 WeakPolarHBondContact OD2-CG 3.32Å; D130-R132 IonicContact OD2-NE 3.08Å; D130-R132 IonicContact OD2-NH1 3.94Å
131	G	88.9	Confident	96.3	Very high	20 Å²	20	45 Å²	45	21%	0.206	23%	0.226	C	C	.	.	S	Bend	trans	72	9.6	-178.6	0	0	0	0	0	113.9	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.25Å; G128-G131 PolarHBondContact O-N 2.87Å; P129-G131 PolarHBondContact O-N 2.65Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.83Å; G131-R193 PolarHBondContact O-NH2 3.12Å
132	R	93.6	Very high	96.3	Very high	172 Å²	172	43.6 Å²	43.6	65%	0.649	22%	0.22	S	C	*	.	S	Bend	trans	-89.1	155.2	178.2	-61.7	-173.7	-176.6	163.4	-3.1	111.2	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.52Å; L127-R132 VanDerWaalsContact CA-O 3.25Å; L127-R132 WeakPolarHBondContact CA-O 3.28Å; G128-R132 PolarHBondContact N-O 2.89Å; D130-R132 PolarHBondContact O-N 3.28Å; D130-R132 WeakPolarHBondContact OD1-CB 3.33Å; D130-R132 PolarHBondContact OD1-N 2.83Å; D130-R132 WeakPolarHBondContact OD2-CD 3.46Å; D130-R132 WeakPolarHBondContact OD2-CG 3.32Å; D130-R132 IonicContact OD2-NE 3.08Å; D130-R132 IonicContact OD2-NH1 3.94Å; R132-L134 PolarHBondContact O-N 2.82Å; R132-L134 VanDerWaalsContact O-N 3.1Å
133	L	96.6	Very high	96.2	Very high	50 Å²	50	45.5 Å²	45.5	26%	0.262	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	118.2	174.4	-176.8	72.8	0	0	0	109.6	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.56Å; L133-R135 WeakPolarHBondContact CD1-O 3.47Å; L133-L154 HydrophobicContact CD2-CD1 4.2Å; L133-E185 HydrophobicContact CD2-CB 4.37Å; L133-E185 HydrophobicContact CD2-CG 3.64Å; L133-V189 HydrophobicContact CB-CG2 4.03Å; L133-V189 HydrophobicContact CD1-CG2 4.06Å
134	L	96.2	Very high	96.2	Very high	122 Å²	122	46.8 Å²	46.8	64%	0.639	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	-46	170.3	-179.2	63.5	0	0	0	110	D126 R132	D126-L134 HydrophobicContact CB-CB 4.37Å; D126-L134 PolarHBondContact O-N 3.06Å; R132-L134 PolarHBondContact O-N 2.82Å; R132-L134 VanDerWaalsContact O-N 3.1Å
135	R	96.7	Very high	96.2	Very high	95 Å²	95	54.4 Å²	54.4	36%	0.358	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	143.9	-176.7	-172.7	161.9	170.2	146.2	10.3	111.9	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.54Å; C125-R135 WeakPolarHBondContact CA-O 3.49Å; D126-R135 HydrophobicContact CB-CB 4.45Å; D126-R135 PolarHBondContact N-O 2.6Å; D126-R135 PolarHBondContact O-N 3.35Å; L133-R135 WeakPolarHBondContact CD1-O 3.47Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.46Å; R135-Y137 VanDerWaalsContact CD-OH 3.22Å; R135-Y137 WeakPolarHBondContact CD-OH 3.22Å; R135-Y137 HydrophobicContact CG-CD2 4.44Å; R135-Y137 HydrophobicContact CG-CE1 4.02Å; R135-Y137 HydrophobicContact CG-CE2 3.75Å; R135-E152 VanDerWaalsContact CZ-CD 3.44Å; R135-E152 VanDerWaalsContact CZ-CG 3.5Å; R135-E152 IonicContact CZ-OE1 3.71Å; R135-E152 IonicContact NH1-OE1 3.14Å; R135-E152 PolarHBondContact NH1-OE1 3.49Å; R135-E152 IonicContact NH1-OE2 3.94Å; R135-E152 VanDerWaalsContact NH2-CG 3.28Å; R135-E152 IonicContact NH2-OE1 2.64Å; R135-E152 PolarHBondContact NH2-OE1 3.03Å
136	G	98	Very high	96.2	Very high	4 Å²	4	60.4 Å²	60.4	4%	0.041	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.9	170.9	0	0	0	0	0	111.2	G124	G124-G136 CarbonylContact O-C 3.5Å; G124-G136 WeakPolarHBondContact O-CA 3.35Å
137	Y	98.2	Very high	96.3	Very high	37 Å²	37	59.9 Å²	59.9	15%	0.145	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.2	-178.2	-53.5	-96.8	0	0	0	110.6	R30 M122 Y123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.3Å; R30-Y137 PolarHBondContact NH2-OH 3.18Å; M122-Y137 HydrophobicContact CE-CD1 4.12Å; M122-Y137 HydrophobicContact CE-CG 4.14Å; M122-Y137 HydrophobicContact SD-CG 4.48Å; Y123-Y137 WeakPolarHBondContact CA-O 3.15Å; Y123-Y137 WeakPolarHBondContact CB-O 3.18Å; G124-Y137 PolarHBondContact N-O 3.02Å; G124-Y137 VanDerWaalsContact N-O 3.07Å; G124-Y137 PolarHBondContact O-N 2.84Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.15Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.29Å; D126-Y137 PolarHBondContact OD2-OH 2.88Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.46Å; R135-Y137 VanDerWaalsContact CD-OH 3.22Å; R135-Y137 WeakPolarHBondContact CD-OH 3.22Å; R135-Y137 HydrophobicContact CG-CD2 4.44Å; R135-Y137 HydrophobicContact CG-CE1 4.02Å; R135-Y137 HydrophobicContact CG-CE2 3.75Å
138	D	98.5	Very high	96.3	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.053	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	108.8	160.6	-174	83.9	0	0	0	107.5	R121 L150 L180	R121-D138 IonicContact CZ-OD1 2.7Å; R121-D138 IonicContact NE-OD1 3.79Å; R121-D138 PolarHBondContact NE-OD1 2.71Å; R121-D138 IonicContact NE-OD2 3.52Å; R121-D138 IonicContact NH2-OD1 3.65Å; R121-D138 PolarHBondContact NH2-OD1 2.91Å; D138-L150 HydrophobicContact CB-CB 3.96Å; D138-L150 HydrophobicContact CB-CD2 4.16Å; D138-L150 WeakPolarHBondContact O-CB 3.42Å; D138-L150 PolarHBondContact O-N 3.33Å; D138-L180 HydrophobicContact CB-CD1 4.24Å
139	Q	98.6	Very high	96.6	Very high	78 Å²	78	61.1 Å²	61.1	36%	0.364	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	144.7	-177.1	62.1	-171.4	53.2	0	0	110.8	R121 M122 I148 A149	R121-Q139 CarbonylContact C-O 3.56Å; R121-Q139 VanDerWaalsContact CA-O 3.28Å; R121-Q139 WeakPolarHBondContact CA-O 3.43Å; M122-Q139 HydrophobicContact CB-CG 4.16Å; M122-Q139 HydrophobicContact CE-CG 3.91Å; M122-Q139 PolarHBondContact N-O 2.84Å; M122-Q139 PolarHBondContact O-N 3.37Å; Q139-I148 WeakPolarHBondContact CA-O 3.47Å; Q139-A149 HydrophobicContact CB-CB 3.87Å
140	S	98.8	Very high	97.1	Very high	22 Å²	22	57.6 Å²	57.6	15%	0.154	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	146.1	178.5	-59.2	0	0	0	0	111.6	Q120 Y147 I148	Q120-S140 CarbonylContact O-C 3.53Å; Q120-S140 WeakPolarHBondContact O-CA 3.36Å; Q120-S140 WeakPolarHBondContact O-CB 3.27Å; S140-Y147 WeakPolarHBondContact O-CB 3.31Å; S140-Y147 PolarHBondContact O-N 2.96Å; S140-I148 PolarHBondContact N-O 2.82Å; S140-I148 PolarHBondContact O-N 2.8Å
141	A	98.9	Very high	97.6	Very high	16 Å²	16	54.8 Å²	54.8	13%	0.132	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.6	175.4	0	0	0	0	0	110.1	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.46Å; Q120-A141 PolarHBondContact N-O 2.86Å; Q120-A141 PolarHBondContact O-N 2.87Å; A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.38Å; A141-K145 VanDerWaalsContact CB-O 3.26Å; A141-K145 WeakPolarHBondContact CB-O 3.38Å
142	Y	98.8	Very high	98	Very high	11 Å²	11	60.2 Å²	60.2	4%	0.043	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.7	177.4	-175.2	-121	0	0	0	110.1	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4Å; L105-Y142 HydrophobicContact CB-CD1 4.33Å; L105-Y142 HydrophobicContact CB-CD2 4.21Å; L105-Y142 HydrophobicContact CB-CE1 3.96Å; L105-Y142 HydrophobicContact CB-CE2 3.86Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.93Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.41Å; L105-Y142 HydrophobicContact CG-CE2 4.5Å; Y109-Y142 AromaticContact CD2-CD1 3.76Å; Y109-Y142 HydrophobicContact CD2-CD1 3.76Å; Y109-Y142 AromaticContact CD2-CE1 3.53Å; Y109-Y142 HydrophobicContact CD2-CE1 3.53Å; Y109-Y142 AromaticContact CE2-CD1 3.53Å; Y109-Y142 HydrophobicContact CE2-CD1 3.53Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.46Å; Q111-Y142 PolarHBondContact OE1-OH 2.96Å; H117-Y142 HydrophobicContact CB-CE2 3.8Å; H117-Y142 WeakPolarHBondContact CB-OH 3.2Å; H117-Y142 AromaticContact CG-CZ 3.99Å; H117-Y142 AromaticContact ND1-CZ 3.9Å; H117-Y142 PolarHBondContact ND1-OH 3.48Å; T118-Y142 CarbonylContact O-C 3.59Å; T118-Y142 WeakPolarHBondContact O-CA 3.3Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.35Å; Y142-G144 PolarHBondContact O-N 2.8Å; Y142-K145 PolarHBondContact N-O 3.15Å; Y142-K145 PolarHBondContact O-N 3.18Å
143	D	98.4	Very high	98.2	Very high	62 Å²	62	55.8 Å²	55.8	33%	0.332	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	40.3	-174.3	-65.7	-21.6	0	0	0	113.2	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 3.2Å; H117-D143 WeakPolarHBondContact CA-OD1 3.34Å; H117-D143 WeakPolarHBondContact CB-OD1 3.4Å; H117-D143 IonicContact CE1-OD2 3.23Å; H117-D143 IonicContact CG-OD1 2.6Å; H117-D143 IonicContact CG-OD2 3.64Å; H117-D143 IonicContact ND1-OD1 2.67Å; H117-D143 IonicContact ND1-OD2 3.04Å; H117-D143 PolarHBondContact ND1-OD2 2.83Å; T118-D143 PolarHBondContact N-OD1 2.98Å; T118-D143 PolarHBondContact O-N 3.32Å; D143-K145 VanDerWaalsContact C-N 3.32Å; D143-K145 PolarHBondContact O-N 3.09Å
144	G	97.7	Very high	98.2	Very high	58 Å²	58	53.8 Å²	53.8	60%	0.598	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	8.8	177.6	0	0	0	0	0	115.3	Y142	Y142-G144 PolarHBondContact O-N 2.8Å
145	K	98.6	Very high	98.3	Very high	160 Å²	160	55.9 Å²	55.9	70%	0.696	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.4	176.6	-62.8	179.3	-177.4	176.9	0	110.7	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.38Å; A141-K145 VanDerWaalsContact CB-O 3.26Å; A141-K145 WeakPolarHBondContact CB-O 3.38Å; Y142-K145 PolarHBondContact N-O 3.15Å; Y142-K145 PolarHBondContact O-N 3.18Å; D143-K145 VanDerWaalsContact C-N 3.32Å; D143-K145 PolarHBondContact O-N 3.09Å; K145-Y147 PolarHBondContact O-N 3.48Å
146	D	98.8	Very high	98.3	Very high	127 Å²	127	53.3 Å²	53.3	68%	0.679	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.1	135.1	174.3	-66.7	-31.6	0	0	0	110.7	A160	D146-A160 HydrophobicContact CB-CB 4.45Å; D146-A160 WeakPolarHBondContact O-CB 3.47Å
147	Y	98.8	Very high	98.4	Very high	9 Å²	9	53.8 Å²	53.8	4%	0.035	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	-61.1	-179.4	178.7	-109.9	0	0	0	110.5	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.31Å; L105-Y147 HydrophobicContact CD2-CD2 4.06Å; L105-Y147 HydrophobicContact CD2-CE1 3.73Å; L105-Y147 HydrophobicContact CD2-CE2 3.42Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.42Å; L105-Y147 HydrophobicContact CD2-CG 4.47Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.47Å; Y109-Y147 HydrophobicContact CE2-CD2 4.42Å; Y109-Y147 HydrophobicContact CE2-CE2 4.13Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.34Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.32Å; S140-Y147 WeakPolarHBondContact O-CB 3.31Å; S140-Y147 PolarHBondContact O-N 2.96Å; K145-Y147 PolarHBondContact O-N 3.48Å; Y147-A160 WeakPolarHBondContact O-CB 3.36Å; Y147-A160 PolarHBondContact O-N 3.15Å; Y147-A163 PolarHBondContact OH-O 3.23Å; Y147-A164 HydrophobicContact CD2-CB 3.82Å; Y147-A164 VanDerWaalsContact CE2-CA 3.45Å; Y147-A164 HydrophobicContact CE2-CB 3.64Å; Y147-A164 HydrophobicContact CG-CB 4.33Å; Y147-A164 WeakPolarHBondContact O-CB 3.44Å; Y147-T167 HydrophobicContact CE1-CG2 4.16Å; Y147-T167 WeakPolarHBondContact OH-CB 3.41Å; Y147-T167 PolarHBondContact OH-OG1 3.42Å
148	I	98.8	Very high	98.4	Very high	10 Å²	10	55.8 Å²	55.8	5%	0.051	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	141.8	-179.9	-162.2	166.9	0	0	0	110.8	Q139 S140 W157 T158 T167 Q168 L171	Q139-I148 WeakPolarHBondContact CA-O 3.47Å; S140-I148 PolarHBondContact N-O 2.82Å; S140-I148 PolarHBondContact O-N 2.8Å; I148-W157 HydrophobicContact CD1-CB 4.46Å; I148-W157 HydrophobicContact CD1-CE3 4.22Å; I148-W157 HydrophobicContact CG1-CB 4.47Å; I148-W157 HydrophobicContact CG1-CE3 4Å; I148-T158 WeakPolarHBondContact CA-O 3.23Å; I148-T167 HydrophobicContact CD1-CG2 4.09Å; I148-Q168 HydrophobicContact CD1-CB 4.01Å; I148-L171 HydrophobicContact CD1-CD1 3.73Å
149	A	98.8	Very high	98.4	Very high	29 Å²	29	56.4 Å²	56.4	24%	0.24	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	139.4	178.2	0	0	0	0	0	111.6	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.87Å; A149-W157 CarbonylContact O-C 3.42Å; A149-W157 WeakPolarHBondContact O-CA 3.42Å; A149-T158 PolarHBondContact N-O 3.44Å; A149-T158 PolarHBondContact O-N 2.94Å
150	L	98.8	Very high	98.4	Very high	14 Å²	14	55.6 Å²	55.6	7%	0.073	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	128.3	167.2	-176	67.9	0	0	0	108.6	D138 L154 W157 A177 L180 L184	D138-L150 HydrophobicContact CB-CB 3.96Å; D138-L150 HydrophobicContact CB-CD2 4.16Å; D138-L150 WeakPolarHBondContact O-CB 3.42Å; D138-L150 PolarHBondContact O-N 3.33Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.31Å; L150-W157 HydrophobicContact CB-CE3 4.12Å; L150-W157 HydrophobicContact CB-CH2 4.29Å; L150-W157 HydrophobicContact CB-CZ3 3.86Å; L150-W157 HydrophobicContact CD1-CD2 4.24Å; L150-W157 HydrophobicContact CD1-CE3 4.39Å; L150-W157 HydrophobicContact CD1-CH2 4.22Å; L150-W157 HydrophobicContact CD1-CZ2 4.02Å; L150-W157 HydrophobicContact CD1-CZ3 4.38Å; L150-A177 HydrophobicContact CD1-CB 3.97Å; L150-L180 HydrophobicContact CD2-CB 4.27Å; L150-L184 HydrophobicContact CD2-CD1 3.94Å
151	N	98.6	Very high	98.4	Very high	44 Å²	44	57.1 Å²	57.1	24%	0.235	32%	0.316	C	S	.	.			trans	-72.6	163.1	-179.7	-67.9	-28.1	0	0	0	111.3	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 3.46Å; N151-L154 WeakPolarHBondContact O-CA 3.39Å; N151-L154 PolarHBondContact O-N 2.83Å; N151-S156 WeakPolarHBondContact CB-O 3.39Å; N151-S156 WeakPolarHBondContact CB-OG 3.39Å; N151-S156 PolarHBondContact N-O 3.21Å; N151-S156 PolarHBondContact ND2-OG 2.92Å; N151-T158 PolarHBondContact ND2-OG1 2.9Å; N151-T158 WeakPolarHBondContact OD1-CB 3Å; N151-T158 PolarHBondContact OD1-OG1 2.6Å
152	E	97.4	Very high	98.4	Very high	135 Å²	135	61.6 Å²	61.6	63%	0.631	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.6	-180	-66.7	178.7	-164	0	0	113.7	R135 L154	R135-E152 VanDerWaalsContact CZ-CD 3.44Å; R135-E152 VanDerWaalsContact CZ-CG 3.5Å; R135-E152 IonicContact CZ-OE1 3.71Å; R135-E152 IonicContact NH1-OE1 3.14Å; R135-E152 PolarHBondContact NH1-OE1 3.49Å; R135-E152 IonicContact NH1-OE2 3.94Å; R135-E152 VanDerWaalsContact NH2-CG 3.28Å; R135-E152 IonicContact NH2-OE1 2.64Å; R135-E152 PolarHBondContact NH2-OE1 3.03Å; E152-L154 PolarHBondContact O-N 3.4Å
153	D	97.5	Very high	98.3	Very high	78 Å²	78	61.2 Å²	61.2	42%	0.417	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-7.9	174.6	70.3	4.5	0	0	0	113.9	N151 R155 S156	N151-D153 PolarHBondContact O-N 3.46Å; D153-R155 VanDerWaalsContact O-CG 3.32Å; D153-R155 WeakPolarHBondContact O-CG 3.05Å; D153-R155 PolarHBondContact O-N 3.27Å; D153-R155 PolarHBondContact OD1-N 2.88Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 2.94Å; D153-S156 PolarHBondContact OD1-OG 3.38Å; D153-S156 VanDerWaalsContact OD1-OG 3.11Å; D153-S156 WeakPolarHBondContact OD2-CB 3.47Å; D153-S156 PolarHBondContact OD2-OG 3Å
154	L	97.9	Very high	98.3	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.047	33%	0.326	C	S	.	.	S	Bend	trans	53.4	28.6	-175.4	-53.8	-178.9	0	0	0	113.7	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.2Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.31Å; N151-L154 WeakPolarHBondContact O-CA 3.39Å; N151-L154 PolarHBondContact O-N 2.83Å; E152-L154 PolarHBondContact O-N 3.4Å; L154-R181 HydrophobicContact CB-CB 4.1Å; L154-R181 HydrophobicContact CB-CG 3.86Å; L154-R181 HydrophobicContact CD1-CG 4.15Å; L154-L184 HydrophobicContact CD2-CD1 3.96Å; L154-E185 HydrophobicContact CD1-CG 4.24Å
155	R	97.6	Very high	98.4	Very high	166 Å²	166	59.1 Å²	59.1	63%	0.626	31%	0.314	S	S	*	.	S	Bend	trans	-135.6	-33.6	-173.7	-71.2	169	-176.3	-95.5	13.9	112.8	D153	D153-R155 VanDerWaalsContact O-CG 3.32Å; D153-R155 WeakPolarHBondContact O-CG 3.05Å; D153-R155 PolarHBondContact O-N 3.27Å; D153-R155 PolarHBondContact OD1-N 2.88Å
156	S	98	Very high	98.4	Very high	41 Å²	41	54.3 Å²	54.3	29%	0.287	30%	0.295	S	S	.	.			trans	-114.2	164	-177.2	63.7	0	0	0	0	111.7	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.39Å; N151-S156 WeakPolarHBondContact CB-OG 3.39Å; N151-S156 PolarHBondContact N-O 3.21Å; N151-S156 PolarHBondContact ND2-OG 2.92Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 2.94Å; D153-S156 PolarHBondContact OD1-OG 3.38Å; D153-S156 VanDerWaalsContact OD1-OG 3.11Å; D153-S156 WeakPolarHBondContact OD2-CB 3.47Å; D153-S156 PolarHBondContact OD2-OG 3Å
157	W	98.7	Very high	98.3	Very high	14 Å²	14	49.7 Å²	49.7	5%	0.053	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145	-176.4	-61.1	90.7	0	0	0	110.7	I148 A149 L150 Q168 L171 A176 A177 L180	I148-W157 HydrophobicContact CD1-CB 4.46Å; I148-W157 HydrophobicContact CD1-CE3 4.22Å; I148-W157 HydrophobicContact CG1-CB 4.47Å; I148-W157 HydrophobicContact CG1-CE3 4Å; A149-W157 CarbonylContact O-C 3.42Å; A149-W157 WeakPolarHBondContact O-CA 3.42Å; L150-W157 HydrophobicContact CB-CE3 4.12Å; L150-W157 HydrophobicContact CB-CH2 4.29Å; L150-W157 HydrophobicContact CB-CZ3 3.86Å; L150-W157 HydrophobicContact CD1-CD2 4.24Å; L150-W157 HydrophobicContact CD1-CE3 4.39Å; L150-W157 HydrophobicContact CD1-CH2 4.22Å; L150-W157 HydrophobicContact CD1-CZ2 4.02Å; L150-W157 HydrophobicContact CD1-CZ3 4.38Å; W157-Q168 HydrophobicContact CB-CG 4.11Å; W157-Q168 PolarHBondContact O-NE2 3.47Å; W157-L171 HydrophobicContact CD2-CD1 3.97Å; W157-L171 HydrophobicContact CE3-CD1 4Å; W157-L171 HydrophobicContact CH2-CD1 3.82Å; W157-L171 HydrophobicContact CZ2-CB 4.2Å; W157-L171 HydrophobicContact CZ2-CD1 3.81Å; W157-L171 HydrophobicContact CZ2-CG 4.43Å; W157-L171 HydrophobicContact CZ3-CD1 3.93Å; W157-A176 HydrophobicContact CZ2-CB 4.29Å; W157-A177 HydrophobicContact CZ2-CB 4.35Å; W157-L180 HydrophobicContact CH2-CD1 3.37Å; W157-L180 HydrophobicContact CZ2-CD1 3.79Å; W157-L180 HydrophobicContact CZ3-CD1 4.5Å
158	T	98.7	Very high	98.3	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	-107.5	119.4	166.4	-66.8	0	0	0	0	109	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.23Å; A149-T158 PolarHBondContact N-O 3.44Å; A149-T158 PolarHBondContact O-N 2.94Å; N151-T158 PolarHBondContact ND2-OG1 2.9Å; N151-T158 WeakPolarHBondContact OD1-CB 3Å; N151-T158 PolarHBondContact OD1-OG1 2.6Å
159	A	98.7	Very high	98.3	Very high	23 Å²	23	57.6 Å²	57.6	19%	0.19	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.4	175.9	0	0	0	0	0	110.1	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.71Å; A159-Q165 HydrophobicContact CB-CG 4.02Å; A159-Q168 HydrophobicContact CB-CB 4.39Å
160	A	98.5	Very high	98.3	Very high	61 Å²	61	61.6 Å²	61.6	50%	0.504	31%	0.314	S	S	.	.	S	Bend	trans	-74.1	-31.6	-176.3	0	0	0	0	0	113.4	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.45Å; D146-A160 WeakPolarHBondContact O-CB 3.47Å; Y147-A160 WeakPolarHBondContact O-CB 3.36Å; Y147-A160 PolarHBondContact O-N 3.15Å
161	D	98.4	Very high	98.3	Very high	54 Å²	54	62.9 Å²	62.9	29%	0.289	32%	0.321	S	S	.	.	S	Bend	trans	-150.4	-175.1	-178.2	68.3	27.7	0	0	0	113.4	Y109 A163 A164 Q165	Y109-D161 VanDerWaalsContact CE1-OD2 3.23Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.36Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.82Å; Y109-D161 PolarHBondContact OH-OD2 3.07Å; D161-A163 VanDerWaalsContact C-N 3.32Å; D161-A163 PolarHBondContact O-N 3.46Å; D161-A163 WeakPolarHBondContact OD1-CA 3.15Å; D161-A163 WeakPolarHBondContact OD1-CB 3.35Å; D161-A163 PolarHBondContact OD1-N 3.2Å; D161-A164 PolarHBondContact O-N 3.36Å; D161-A164 PolarHBondContact OD1-N 2.84Å; D161-Q165 WeakPolarHBondContact O-CG 3.24Å; D161-Q165 PolarHBondContact O-N 2.69Å
162	T	98.2	Very high	98.2	Very high	110 Å²	110	65.3 Å²	65.3	68%	0.675	33%	0.331	S	S	*	.	H	α-helix	trans	-65.8	-29.3	-178.8	58.1	0	0	0	0	113.9
163	A	98.1	Very high	98.3	Very high	4 Å²	4	63.1 Å²	63.1	3%	0.033	34%	0.336	C	S	.	.	H	α-helix	trans	-74	-38.8	174.9	0	0	0	0	0	110.6	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.15Å; Y109-A163 HydrophobicContact CD2-CB 4.43Å; Y109-A163 HydrophobicContact CE1-CB 3.6Å; Y109-A163 HydrophobicContact CE2-CB 3.91Å; Y109-A163 VanDerWaalsContact CZ-CB 3.47Å; Y147-A163 PolarHBondContact OH-O 3.23Å; D161-A163 VanDerWaalsContact C-N 3.32Å; D161-A163 PolarHBondContact O-N 3.46Å; D161-A163 WeakPolarHBondContact OD1-CA 3.15Å; D161-A163 WeakPolarHBondContact OD1-CB 3.35Å; D161-A163 PolarHBondContact OD1-N 3.2Å; A163-Q165 VanDerWaalsContact C-N 3.31Å; A163-Q165 PolarHBondContact O-N 3.35Å; A163-I166 WeakPolarHBondContact O-CB 3.4Å; A163-I166 PolarHBondContact O-N 2.85Å
164	A	98.5	Very high	98.3	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-63.1	-34.9	172.8	0	0	0	0	0	112.9	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.82Å; Y147-A164 VanDerWaalsContact CE2-CA 3.45Å; Y147-A164 HydrophobicContact CE2-CB 3.64Å; Y147-A164 HydrophobicContact CG-CB 4.33Å; Y147-A164 WeakPolarHBondContact O-CB 3.44Å; A159-A164 HydrophobicContact CB-CB 3.71Å; D161-A164 PolarHBondContact O-N 3.36Å; D161-A164 PolarHBondContact OD1-N 2.84Å; A164-I166 PolarHBondContact O-N 3.34Å; A164-T167 PolarHBondContact O-N 2.76Å; A164-Q168 PolarHBondContact O-N 3.32Å
165	Q	98.7	Very high	98.3	Very high	76 Å²	76	70 Å²	70	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-60.1	-28.3	174.1	-72.1	174	8.9	0	0	113.1	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 4.02Å; D161-Q165 WeakPolarHBondContact O-CG 3.24Å; D161-Q165 PolarHBondContact O-N 2.69Å; A163-Q165 VanDerWaalsContact C-N 3.31Å; A163-Q165 PolarHBondContact O-N 3.35Å; Q165-R169 WeakPolarHBondContact O-CG 3.16Å; Q165-R169 PolarHBondContact O-N 3.06Å; Q165-R169 VanDerWaalsContact O-N 3.15Å
166	I	98.4	Very high	98.3	Very high	59 Å²	59	62.8 Å²	62.8	30%	0.303	35%	0.346	S	S	.	.	H	α-helix	trans	-65	-44.7	174.1	-57.5	171.7	0	0	0	109.8	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.05Å; Y108-I166 HydrophobicContact CE1-CD1 4.36Å; Y108-I166 HydrophobicContact CE1-CG2 4Å; Y108-I166 HydrophobicContact CE2-CB 4.29Å; Y108-I166 HydrophobicContact CE2-CG2 4.14Å; Y108-I166 HydrophobicContact CG-CD1 4.15Å; A163-I166 WeakPolarHBondContact O-CB 3.4Å; A163-I166 PolarHBondContact O-N 2.85Å; A164-I166 PolarHBondContact O-N 3.34Å; I166-K170 WeakPolarHBondContact O-CG 3.48Å; I166-K170 PolarHBondContact O-N 2.83Å
167	T	98.3	Very high	98.3	Very high	30 Å²	30	61.2 Å²	61.2	18%	0.184	34%	0.336	C	S	.	.	H	α-helix	trans	-68.2	-42.7	177.2	-65.5	0	0	0	0	111.4	Y147 I148 A164 R169 K170 L171	Y147-T167 HydrophobicContact CE1-CG2 4.16Å; Y147-T167 WeakPolarHBondContact OH-CB 3.41Å; Y147-T167 PolarHBondContact OH-OG1 3.42Å; I148-T167 HydrophobicContact CD1-CG2 4.09Å; A164-T167 PolarHBondContact O-N 2.76Å; T167-R169 PolarHBondContact O-N 2.85Å; T167-K170 WeakPolarHBondContact O-CB 3.37Å; T167-K170 PolarHBondContact O-N 2.75Å; T167-L171 HydrophobicContact CG2-CD1 3.91Å; T167-L171 HydrophobicContact CG2-CG 4.13Å; T167-L171 WeakPolarHBondContact O-CG 3.47Å; T167-L171 PolarHBondContact O-N 3.34Å
168	Q	98.6	Very high	98.2	Very high	40 Å²	40	66.1 Å²	66.1	19%	0.187	36%	0.359	C	S	.	.	H	α-helix	trans	-51	-52.4	174.5	175.6	175.7	13.7	0	0	111.8	I148 W157 A159 A164 K170 L171 E172	I148-Q168 HydrophobicContact CD1-CB 4.01Å; W157-Q168 HydrophobicContact CB-CG 4.11Å; W157-Q168 PolarHBondContact O-NE2 3.47Å; A159-Q168 HydrophobicContact CB-CB 4.39Å; A164-Q168 PolarHBondContact O-N 3.32Å; Q168-K170 VanDerWaalsContact C-N 3.25Å; Q168-K170 PolarHBondContact O-N 3.02Å; Q168-L171 PolarHBondContact O-N 3.47Å; Q168-L171 VanDerWaalsContact O-N 3.12Å; Q168-E172 HydrophobicContact CG-CG 4.34Å; Q168-E172 VanDerWaalsContact CG-OE1 3.27Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.26Å; Q168-E172 PolarHBondContact NE2-OE1 2.74Å; Q168-E172 WeakPolarHBondContact O-CG 3.47Å; Q168-E172 PolarHBondContact O-N 3.02Å
169	R	98.6	Very high	98.1	Very high	145 Å²	145	69.3 Å²	69.3	55%	0.547	37%	0.369	S	S	.	.	H	α-helix	trans	-59	-36.5	179	-68.4	173.1	-165.4	124.8	6.8	112.5	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.16Å; Q165-R169 PolarHBondContact O-N 3.06Å; Q165-R169 VanDerWaalsContact O-N 3.15Å; T167-R169 PolarHBondContact O-N 2.85Å; R169-A173 VanDerWaalsContact O-CB 3.25Å; R169-A173 WeakPolarHBondContact O-CB 3.04Å; R169-A173 PolarHBondContact O-N 3.14Å
170	K	98.1	Very high	98.1	Very high	112 Å²	112	69.7 Å²	69.7	49%	0.487	37%	0.367	S	S	.	.	H	α-helix	trans	-68.3	-43.4	176.4	-70.9	178.2	175.5	-174.7	0	111.7	Y108 I166 T167 Q168 A173 A174	Y108-K170 PolarHBondContact OH-NZ 2.91Å; I166-K170 WeakPolarHBondContact O-CG 3.48Å; I166-K170 PolarHBondContact O-N 2.83Å; T167-K170 WeakPolarHBondContact O-CB 3.37Å; T167-K170 PolarHBondContact O-N 2.75Å; Q168-K170 VanDerWaalsContact C-N 3.25Å; Q168-K170 PolarHBondContact O-N 3.02Å; K170-A173 PolarHBondContact O-N 3Å; K170-A174 VanDerWaalsContact O-CB 3.3Å; K170-A174 WeakPolarHBondContact O-CB 3.26Å; K170-A174 PolarHBondContact O-N 3.49Å
171	L	98.1	Very high	98.1	Very high	42 Å²	42	70 Å²	70	22%	0.22	36%	0.356	C	S	.	.	H	α-helix	trans	-65.5	-41.8	178	-67	174.8	0	0	0	111.7	I148 W157 T167 Q168 A174 R175 A176	I148-L171 HydrophobicContact CD1-CD1 3.73Å; W157-L171 HydrophobicContact CD2-CD1 3.97Å; W157-L171 HydrophobicContact CE3-CD1 4Å; W157-L171 HydrophobicContact CH2-CD1 3.82Å; W157-L171 HydrophobicContact CZ2-CB 4.2Å; W157-L171 HydrophobicContact CZ2-CD1 3.81Å; W157-L171 HydrophobicContact CZ2-CG 4.43Å; W157-L171 HydrophobicContact CZ3-CD1 3.93Å; T167-L171 HydrophobicContact CG2-CD1 3.91Å; T167-L171 HydrophobicContact CG2-CG 4.13Å; T167-L171 WeakPolarHBondContact O-CG 3.47Å; T167-L171 PolarHBondContact O-N 3.34Å; Q168-L171 PolarHBondContact O-N 3.47Å; Q168-L171 VanDerWaalsContact O-N 3.12Å; L171-A174 CarbonylContact O-C 3.58Å; L171-A174 PolarHBondContact O-N 2.88Å; L171-R175 PolarHBondContact O-N 3.12Å; L171-A176 HydrophobicContact CB-CB 4.08Å; L171-A176 HydrophobicContact CD2-CB 3.67Å; L171-A176 HydrophobicContact CG-CB 4.46Å; L171-A176 PolarHBondContact O-N 3.49Å
172	E	98.4	Very high	98	Very high	95 Å²	95	70.6 Å²	70.6	44%	0.444	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-47.2	175.5	-72.3	170.5	176.2	0	0	111.4	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.34Å; Q168-E172 VanDerWaalsContact CG-OE1 3.27Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.26Å; Q168-E172 PolarHBondContact NE2-OE1 2.74Å; Q168-E172 WeakPolarHBondContact O-CG 3.47Å; Q168-E172 PolarHBondContact O-N 3.02Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 2.72Å; E172-R175 PolarHBondContact O-N 3.35Å
173	A	98.3	Very high	98	Very high	88 Å²	88	68.2 Å²	68.2	73%	0.727	35%	0.347	S	S	*	.	H	α-helix	trans	-61	-35.1	176.7	0	0	0	0	0	112.6	R169 K170 R175	R169-A173 VanDerWaalsContact O-CB 3.25Å; R169-A173 WeakPolarHBondContact O-CB 3.04Å; R169-A173 PolarHBondContact O-N 3.14Å; K170-A173 PolarHBondContact O-N 3Å; A173-R175 VanDerWaalsContact C-N 3.33Å
174	A	97.6	Very high	98.1	Very high	69 Å²	69	68.1 Å²	68.1	57%	0.57	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.1	176.3	0	0	0	0	0	114	K170 L171 E172 A176	K170-A174 VanDerWaalsContact O-CB 3.3Å; K170-A174 WeakPolarHBondContact O-CB 3.26Å; K170-A174 PolarHBondContact O-N 3.49Å; L171-A174 CarbonylContact O-C 3.58Å; L171-A174 PolarHBondContact O-N 2.88Å; E172-A174 VanDerWaalsContact C-N 3.25Å; E172-A174 PolarHBondContact O-N 2.72Å; A174-A176 PolarHBondContact O-N 2.88Å
175	R	97.6	Very high	98	Very high	162 Å²	162	72.3 Å²	72.3	61%	0.611	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	37.2	-172.9	-56.8	-177	177.7	-160.2	1.6	113.6	L171 E172 A173 A177 E178	L171-R175 PolarHBondContact O-N 3.12Å; E172-R175 PolarHBondContact O-N 3.35Å; A173-R175 VanDerWaalsContact C-N 3.33Å; R175-A177 PolarHBondContact O-N 3.25Å; R175-A177 VanDerWaalsContact O-N 3.14Å; R175-E178 HydrophobicContact CB-CG 4.3Å; R175-E178 IonicContact NH1-OE1 3.96Å; R175-E178 WeakPolarHBondContact O-CB 3.25Å; R175-E178 PolarHBondContact O-N 3.07Å
176	A	97.5	Very high	98	Very high	15 Å²	15	69.7 Å²	69.7	12%	0.124	36%	0.359	C	S	.	.	H	α-helix	trans	-58.7	-31.5	-174.8	0	0	0	0	0	113.2	W157 L171 A174 E178 Q179 L180	W157-A176 HydrophobicContact CZ2-CB 4.29Å; L171-A176 HydrophobicContact CB-CB 4.08Å; L171-A176 HydrophobicContact CD2-CB 3.67Å; L171-A176 HydrophobicContact CG-CB 4.46Å; L171-A176 PolarHBondContact O-N 3.49Å; A174-A176 PolarHBondContact O-N 2.88Å; A176-E178 VanDerWaalsContact C-N 3.27Å; A176-E178 PolarHBondContact O-N 2.93Å; A176-Q179 PolarHBondContact O-N 3.04Å; A176-L180 PolarHBondContact O-N 3.35Å; A176-L180 VanDerWaalsContact O-N 3.1Å
177	A	98.1	Very high	97.9	Very high	8 Å²	8	69.6 Å²	69.6	7%	0.066	36%	0.361	C	S	.	.	H	α-helix	trans	-60.8	-33.8	177.5	0	0	0	0	0	112.7	L150 W157 R175 Q179 L180 R181	L150-A177 HydrophobicContact CD1-CB 3.97Å; W157-A177 HydrophobicContact CZ2-CB 4.35Å; R175-A177 PolarHBondContact O-N 3.25Å; R175-A177 VanDerWaalsContact O-N 3.14Å; A177-Q179 PolarHBondContact O-N 3.28Å; A177-L180 PolarHBondContact O-N 3.16Å; A177-R181 WeakPolarHBondContact O-CB 3.42Å; A177-R181 PolarHBondContact O-N 2.73Å
178	E	97.8	Very high	98	Very high	117 Å²	117	68.2 Å²	68.2	55%	0.547	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-40.6	178.5	-64.4	178.3	-177.8	0	0	111.4	R175 A176 A182	R175-E178 HydrophobicContact CB-CG 4.3Å; R175-E178 IonicContact NH1-OE1 3.96Å; R175-E178 WeakPolarHBondContact O-CB 3.25Å; R175-E178 PolarHBondContact O-N 3.07Å; A176-E178 VanDerWaalsContact C-N 3.27Å; A176-E178 PolarHBondContact O-N 2.93Å; E178-A182 WeakPolarHBondContact O-CB 3.38Å; E178-A182 PolarHBondContact O-N 3.35Å
179	Q	96.4	Very high	97.9	Very high	146 Å²	146	66.6 Å²	66.6	68%	0.682	35%	0.345	S	S	*	.	H	α-helix	trans	-69.9	-44.6	178	-65.2	-179.3	-10.4	0	0	111.8	A176 A177 R181 A182 Y183	A176-Q179 PolarHBondContact O-N 3.04Å; A177-Q179 PolarHBondContact O-N 3.28Å; Q179-R181 VanDerWaalsContact C-N 3.34Å; Q179-A182 PolarHBondContact O-N 3.21Å; Q179-Y183 PolarHBondContact O-N 3.02Å; Q179-Y183 VanDerWaalsContact O-N 3.08Å
180	L	97.4	Very high	97.9	Very high	30 Å²	30	65.7 Å²	65.7	16%	0.157	35%	0.347	C	S	.	.	H	α-helix	trans	-63.2	-43.3	177.1	-72.9	169.2	0	0	0	111.2	D138 L150 W157 A176 A177 A182 Y183 L184	D138-L180 HydrophobicContact CB-CD1 4.24Å; L150-L180 HydrophobicContact CD2-CB 4.27Å; W157-L180 HydrophobicContact CH2-CD1 3.37Å; W157-L180 HydrophobicContact CZ2-CD1 3.79Å; W157-L180 HydrophobicContact CZ3-CD1 4.5Å; A176-L180 PolarHBondContact O-N 3.35Å; A176-L180 VanDerWaalsContact O-N 3.1Å; A177-L180 PolarHBondContact O-N 3.16Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 3.18Å; L180-Y183 WeakPolarHBondContact O-CB 3.2Å; L180-Y183 PolarHBondContact O-N 3.19Å; L180-L184 WeakPolarHBondContact O-CB 3.36Å; L180-L184 VanDerWaalsContact O-CG 3.24Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 2.86Å
181	R	98.1	Very high	97.9	Very high	69 Å²	69	62.5 Å²	62.5	26%	0.26	33%	0.332	S	S	.	.	H	α-helix	trans	-59.3	-44.7	175.3	-175.8	173.8	-179.8	-137.9	-12.1	112.1	L154 A177 Q179 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.1Å; L154-R181 HydrophobicContact CB-CG 3.86Å; L154-R181 HydrophobicContact CD1-CG 4.15Å; A177-R181 WeakPolarHBondContact O-CB 3.42Å; A177-R181 PolarHBondContact O-N 2.73Å; Q179-R181 VanDerWaalsContact C-N 3.34Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.83Å; R181-L184 PolarHBondContact O-N 2.86Å; R181-E185 HydrophobicContact CG-CG 4.09Å; R181-E185 IonicContact CZ-OE1 2.77Å; R181-E185 VanDerWaalsContact CZ-OE1 3.22Å; R181-E185 IonicContact CZ-OE2 3.02Å; R181-E185 VanDerWaalsContact NE-CD 3.3Å; R181-E185 IonicContact NE-OE1 3.65Å; R181-E185 PolarHBondContact NE-OE1 2.86Å; R181-E185 IonicContact NE-OE2 3.58Å; R181-E185 PolarHBondContact NE-OE2 2.85Å; R181-E185 IonicContact NH2-OE1 3.85Å; R181-E185 PolarHBondContact NH2-OE1 3.11Å; R181-E185 IonicContact NH2-OE2 3.97Å; R181-E185 PolarHBondContact NH2-OE2 2.99Å; R181-E185 WeakPolarHBondContact O-CB 3.42Å; R181-E185 PolarHBondContact O-N 2.87Å
182	A	98.2	Very high	97.9	Very high	65 Å²	65	60.5 Å²	60.5	54%	0.537	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-39.5	176.8	0	0	0	0	0	112.4	E178 Q179 L180 G186	E178-A182 WeakPolarHBondContact O-CB 3.38Å; E178-A182 PolarHBondContact O-N 3.35Å; Q179-A182 PolarHBondContact O-N 3.21Å; L180-A182 VanDerWaalsContact C-N 3.35Å; L180-A182 PolarHBondContact O-N 3.18Å; A182-G186 PolarHBondContact O-N 2.67Å; A182-G186 VanDerWaalsContact O-N 3.12Å
183	Y	98	Very high	97.8	Very high	60 Å²	60	61.7 Å²	61.7	24%	0.235	32%	0.322	C	S	.	.	I	π-helix	trans	-65.6	-48.3	173.1	169.3	-95.8	0	0	0	112	Y123 Q179 L180 R181 G186 T187 C188	Y123-Y183 AromaticContact CD2-CE1 3.94Å; Y123-Y183 HydrophobicContact CD2-CE1 3.94Å; Y123-Y183 HydrophobicContact CE2-CE1 4.08Å; Q179-Y183 PolarHBondContact O-N 3.02Å; Q179-Y183 VanDerWaalsContact O-N 3.08Å; L180-Y183 WeakPolarHBondContact O-CB 3.2Å; L180-Y183 PolarHBondContact O-N 3.19Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.83Å; Y183-G186 CarbonylContact O-C 3.59Å; Y183-G186 PolarHBondContact O-N 2.62Å; Y183-T187 HydrophobicContact CD2-CG2 3.9Å; Y183-T187 HydrophobicContact CE2-CG2 3.81Å; Y183-T187 PolarHBondContact O-N 2.97Å; Y183-C188 HydrophobicContact CD1-CB 4.38Å; Y183-C188 HydrophobicContact CE1-CB 3.93Å; Y183-C188 WeakPolarHBondContact O-CB 3.39Å; Y183-C188 PolarHBondContact O-N 2.83Å
184	L	98.4	Very high	97.8	Very high	2 Å²	2	63.3 Å²	63.3	1%	0.01	31%	0.309	C	S	.	.	I	π-helix	trans	-68.7	-39.3	-174.9	-70	172	0	0	0	112.8	G124 L150 L154 L180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.45Å; L150-L184 HydrophobicContact CD2-CD1 3.94Å; L154-L184 HydrophobicContact CD2-CD1 3.96Å; L180-L184 WeakPolarHBondContact O-CB 3.36Å; L180-L184 VanDerWaalsContact O-CG 3.24Å; L180-L184 WeakPolarHBondContact O-CG 3.3Å; L180-L184 PolarHBondContact O-N 2.86Å; R181-L184 PolarHBondContact O-N 2.86Å; L184-V189 WeakPolarHBondContact O-CG2 3.05Å
185	E	97.8	Very high	97.8	Very high	88 Å²	88	60 Å²	60	41%	0.411	28%	0.282	S	S	.	.	I	π-helix	trans	-80.3	-23.8	177.8	-69.6	-178.7	166.8	0	0	113.2	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.37Å; L133-E185 HydrophobicContact CD2-CG 3.64Å; L154-E185 HydrophobicContact CD1-CG 4.24Å; R181-E185 HydrophobicContact CG-CG 4.09Å; R181-E185 IonicContact CZ-OE1 2.77Å; R181-E185 VanDerWaalsContact CZ-OE1 3.22Å; R181-E185 IonicContact CZ-OE2 3.02Å; R181-E185 VanDerWaalsContact NE-CD 3.3Å; R181-E185 IonicContact NE-OE1 3.65Å; R181-E185 PolarHBondContact NE-OE1 2.86Å; R181-E185 IonicContact NE-OE2 3.58Å; R181-E185 PolarHBondContact NE-OE2 2.85Å; R181-E185 IonicContact NH2-OE1 3.85Å; R181-E185 PolarHBondContact NH2-OE1 3.11Å; R181-E185 IonicContact NH2-OE2 3.97Å; R181-E185 PolarHBondContact NH2-OE2 2.99Å; R181-E185 WeakPolarHBondContact O-CB 3.42Å; R181-E185 PolarHBondContact O-N 2.87Å
186	G	97.8	Very high	97.7	Very high	22 Å²	22	53 Å²	53	23%	0.227	26%	0.257	C	S	.	.	I	π-helix	trans	-110	-89.2	-177.7	0	0	0	0	0	112.3	A182 Y183 C188 V189 E190	A182-G186 PolarHBondContact O-N 2.67Å; A182-G186 VanDerWaalsContact O-N 3.12Å; Y183-G186 CarbonylContact O-C 3.59Å; Y183-G186 PolarHBondContact O-N 2.62Å; G186-C188 VanDerWaalsContact C-N 3.34Å; G186-C188 PolarHBondContact O-N 2.87Å; G186-V189 PolarHBondContact O-N 3.04Å; G186-V189 VanDerWaalsContact O-N 3.11Å; G186-E190 WeakPolarHBondContact O-CG 3.48Å; G186-E190 PolarHBondContact O-N 3.2Å
187	T	97.8	Very high	97.7	Very high	57 Å²	57	58.3 Å²	58.3	35%	0.35	28%	0.279	S	S	.	.	I	π-helix	trans	-53.5	-45.4	-171	-55.9	0	0	0	0	113.2	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.9Å; Y183-T187 HydrophobicContact CE2-CG2 3.81Å; Y183-T187 PolarHBondContact O-N 2.97Å; T187-V189 PolarHBondContact O-N 3.35Å; T187-E190 PolarHBondContact O-N 2.94Å; T187-W191 VanDerWaalsContact CG2-CD1 3.48Å; T187-W191 WeakPolarHBondContact O-CB 3.41Å; T187-W191 PolarHBondContact O-N 2.82Å
188	C	98.3	Very high	97.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-47.7	179.6	-171.9	0	0	0	0	111.5	M29 C125 Y183 G186 E190 W191 L192	M29-C188 HydrophobicContact CE-CB 4.16Å; M29-C188 WeakPolarHBondContact CE-O 3.44Å; M29-C188 WeakPolarHBondContact CE-SG 3.32Å; C125-C188 HydrophobicContact CB-CB 3.93Å; C125-C188 WeakPolarHBondContact CB-SG 3.29Å; C125-C188 PolarHBondContact N-SG 3.03Å; C125-C188 WeakPolarHBondContact SG-CB 3.42Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.14Å; Y183-C188 HydrophobicContact CD1-CB 4.38Å; Y183-C188 HydrophobicContact CE1-CB 3.93Å; Y183-C188 WeakPolarHBondContact O-CB 3.39Å; Y183-C188 PolarHBondContact O-N 2.83Å; G186-C188 VanDerWaalsContact C-N 3.34Å; G186-C188 PolarHBondContact O-N 2.87Å; C188-E190 PolarHBondContact O-N 3.16Å; C188-W191 PolarHBondContact O-N 3.46Å; C188-L192 WeakPolarHBondContact O-CB 3.28Å; C188-L192 PolarHBondContact O-N 3.48Å
189	V	98.2	Very high	97.5	Very high	6 Å²	6	55.1 Å²	55.1	4%	0.036	27%	0.266	C	S	.	.	H	α-helix	trans	-62.3	-44.6	178.3	175.4	0	0	0	0	111.3	L127 L133 L184 G186 T187 R193	L127-V189 HydrophobicContact CD2-CB 4.17Å; L127-V189 HydrophobicContact CD2-CG1 3.77Å; L127-V189 HydrophobicContact CD2-CG2 3.83Å; L133-V189 HydrophobicContact CB-CG2 4.03Å; L133-V189 HydrophobicContact CD1-CG2 4.06Å; L184-V189 WeakPolarHBondContact O-CG2 3.05Å; G186-V189 PolarHBondContact O-N 3.04Å; G186-V189 VanDerWaalsContact O-N 3.11Å; T187-V189 PolarHBondContact O-N 3.35Å; V189-R193 VanDerWaalsContact CG1-CZ 3.44Å; V189-R193 WeakPolarHBondContact O-CG 3.39Å; V189-R193 PolarHBondContact O-N 3.29Å
190	E	98	Very high	97.4	Very high	127 Å²	127	53.4 Å²	53.4	59%	0.593	26%	0.256	S	S	*	.	H	α-helix	trans	-62.2	-46.2	179.5	-71.8	174.9	175.1	0	0	112.1	G186 T187 C188 R194	G186-E190 WeakPolarHBondContact O-CG 3.48Å; G186-E190 PolarHBondContact O-N 3.2Å; T187-E190 PolarHBondContact O-N 2.94Å; C188-E190 PolarHBondContact O-N 3.16Å; E190-R194 PolarHBondContact O-N 3.44Å
191	W	98.1	Very high	97.1	Very high	44 Å²	44	60.6 Å²	60.6	17%	0.167	29%	0.289	C	S	.	.	H	α-helix	trans	-68.2	-42.4	178.6	-82.2	102	0	0	0	112.3	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.03Å; M29-W191 HydrophobicContact SD-CB 4.42Å; Y83-W191 AromaticContact CD2-CH2 3.45Å; Y83-W191 HydrophobicContact CD2-CH2 3.45Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.45Å; Y83-W191 HydrophobicContact CD2-CZ2 4.13Å; Y83-W191 AromaticContact CD2-CZ3 3.75Å; Y83-W191 HydrophobicContact CD2-CZ3 3.75Å; Y83-W191 HydrophobicContact CE2-CE3 4.25Å; Y83-W191 AromaticContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CH2 3.85Å; Y83-W191 HydrophobicContact CE2-CZ2 4.46Å; Y83-W191 AromaticContact CE2-CZ3 3.72Å; Y83-W191 HydrophobicContact CE2-CZ3 3.72Å; Y83-W191 HydrophobicContact CG-CH2 4.49Å; T187-W191 VanDerWaalsContact CG2-CD1 3.48Å; T187-W191 WeakPolarHBondContact O-CB 3.41Å; T187-W191 PolarHBondContact O-N 2.82Å; C188-W191 PolarHBondContact O-N 3.46Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 2.82Å; W191-R194 WeakPolarHBondContact O-CB 3.46Å; W191-R194 PolarHBondContact O-N 3.31Å; W191-R194 VanDerWaalsContact O-N 3.16Å; W191-Y195 HydrophobicContact CB-CE2 4.03Å; W191-Y195 HydrophobicContact CE3-CD1 4.39Å; W191-Y195 AromaticContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE1 3.5Å; W191-Y195 VanDerWaalsContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE2 4.17Å; W191-Y195 AromaticContact CE3-CZ 3.35Å; W191-Y195 AromaticContact CZ3-CE1 3.85Å; W191-Y195 HydrophobicContact CZ3-CE1 3.85Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.26Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 2.96Å
192	L	98.3	Very high	96.8	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60	-44.7	176.4	175.2	50.4	0	0	0	111.3	H27 M29 V52 L127 C188 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.48Å; 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 4.24Å; L127-L192 HydrophobicContact CD1-CB 4.27Å; L127-L192 HydrophobicContact CD1-CD2 3.69Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CD2-CD2 4.5Å; L127-L192 HydrophobicContact CG-CD2 3.57Å; L127-L192 HydrophobicContact CG-CG 4.21Å; C188-L192 WeakPolarHBondContact O-CB 3.28Å; C188-L192 PolarHBondContact O-N 3.48Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.29Å; L192-Y195 PolarHBondContact O-N 3.4Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.38Å; L192-L196 HydrophobicContact CD1-CG 3.83Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.35Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.42Å; L192-L196 PolarHBondContact O-N 3.25Å
193	R	97	Very high	96.6	Very high	120 Å²	120	56.5 Å²	56.5	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-59.9	-43.1	174.3	-72.2	176.2	-174.1	156	-0.8	112.5	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.95Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.83Å; G131-R193 PolarHBondContact O-NH2 3.12Å; V189-R193 VanDerWaalsContact CG1-CZ 3.44Å; V189-R193 WeakPolarHBondContact O-CG 3.39Å; V189-R193 PolarHBondContact O-N 3.29Å; W191-R193 VanDerWaalsContact C-N 3.35Å; W191-R193 PolarHBondContact O-N 2.82Å; R193-L196 PolarHBondContact O-N 2.83Å; R193-E197 PolarHBondContact O-N 3.06Å
194	R	97.3	Very high	96.2	Very high	122 Å²	122	58 Å²	58	46%	0.46	27%	0.274	S	S	.	.	H	α-helix	trans	-61	-44.7	176.4	178.1	-180	175.4	119	-4.5	111.3	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 2.84Å; E79-R194 IonicContact OE1-NE 2.76Å; E79-R194 PolarHBondContact OE1-NE 3.25Å; E79-R194 IonicContact OE1-NH2 3.22Å; E79-R194 PolarHBondContact OE1-NH2 2.85Å; E79-R194 IonicContact OE2-CZ 3.36Å; E79-R194 IonicContact OE2-NE 3.34Å; E79-R194 IonicContact OE2-NH2 3.6Å; E79-R194 PolarHBondContact OE2-NH2 3.25Å; E190-R194 PolarHBondContact O-N 3.44Å; W191-R194 WeakPolarHBondContact O-CB 3.46Å; W191-R194 PolarHBondContact O-N 3.31Å; W191-R194 VanDerWaalsContact O-N 3.16Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.29Å; R194-E197 PolarHBondContact O-N 3.5Å; R194-N198 VanDerWaalsContact O-CB 3.25Å; R194-N198 WeakPolarHBondContact O-CB 3.36Å; R194-N198 PolarHBondContact O-N 3.04Å; R194-N198 PolarHBondContact O-OD1 3.4Å
195	Y	97.7	Very high	95.9	Very high	1 Å²	1	62 Å²	62	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-67.3	-39.6	178.7	-62.3	-31.6	0	0	0	112.5	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.7Å; M29-Y195 HydrophobicContact SD-CE2 3.57Å; M29-Y195 VanDerWaalsContact SD-CE2 3.57Å; V52-Y195 HydrophobicContact CG2-CD2 3.96Å; V52-Y195 HydrophobicContact CG2-CG 4.45Å; F57-Y195 HydrophobicContact CD2-CE2 4.4Å; F57-Y195 HydrophobicContact CE2-CD2 4.22Å; F57-Y195 AromaticContact CE2-CE2 3.57Å; F57-Y195 HydrophobicContact CE2-CE2 3.57Å; 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 4.23Å; W75-Y195 HydrophobicContact CE3-CG 4.47Å; W75-Y195 HydrophobicContact CH2-CG 4.12Å; W75-Y195 AromaticContact CZ3-CD1 3.57Å; W75-Y195 HydrophobicContact CZ3-CD1 3.57Å; W75-Y195 HydrophobicContact CZ3-CD2 4.29Å; W75-Y195 HydrophobicContact CZ3-CE1 4.29Å; W75-Y195 AromaticContact CZ3-CG 3.57Å; W75-Y195 HydrophobicContact CZ3-CG 3.57Å; V76-Y195 HydrophobicContact CG2-CE1 4.37Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.12Å; Y83-Y195 PolarHBondContact OH-OH 3.47Å; W191-Y195 HydrophobicContact CB-CE2 4.03Å; W191-Y195 HydrophobicContact CE3-CD1 4.39Å; W191-Y195 AromaticContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE1 3.5Å; W191-Y195 VanDerWaalsContact CE3-CE1 3.5Å; W191-Y195 HydrophobicContact CE3-CE2 4.17Å; W191-Y195 AromaticContact CE3-CZ 3.35Å; W191-Y195 AromaticContact CZ3-CE1 3.85Å; W191-Y195 HydrophobicContact CZ3-CE1 3.85Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.26Å; W191-Y195 VanDerWaalsContact O-CG 3.25Å; W191-Y195 PolarHBondContact O-N 2.96Å; L192-Y195 PolarHBondContact O-N 3.4Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 3.03Å; Y195-N198 PolarHBondContact O-N 3.43Å; Y195-G199 WeakPolarHBondContact O-CA 3.36Å; Y195-G199 PolarHBondContact O-N 3.11Å; Y195-L203 WeakPolarHBondContact O-CD1 3.43Å
196	L	96.3	Very high	95.8	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.073	29%	0.285	C	S	.	.	H	α-helix	trans	-62.7	-36	174.7	-71.6	169.5	0	0	0	112.4	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 4Å; H27-L196 HydrophobicContact CB-CG 4.42Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.49Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.38Å; L192-L196 HydrophobicContact CD1-CG 3.83Å; L192-L196 HydrophobicContact CG-CD1 4.02Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.35Å; L192-L196 VanDerWaalsContact O-CG 3.27Å; L192-L196 WeakPolarHBondContact O-CG 3.42Å; L192-L196 PolarHBondContact O-N 3.25Å; R193-L196 PolarHBondContact O-N 2.83Å; L196-K200 WeakPolarHBondContact O-CA 3.44Å; L196-K200 WeakPolarHBondContact O-CB 3.14Å; L196-K200 PolarHBondContact O-N 3.35Å; 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 4.49Å; L196-Q204 PolarHBondContact O-NE2 3.25Å
197	E	96.1	Very high	95.6	Very high	127 Å²	127	61.7 Å²	61.7	59%	0.593	29%	0.288	S	S	*	.	H	α-helix	trans	-72.2	-48.1	174.5	-171.6	60	-151.8	0	0	111.2	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.06Å; R194-E197 PolarHBondContact O-N 3.5Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 3.03Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 3.47Å; E197-K200 WeakPolarHBondContact O-CB 3.41Å; E197-K200 PolarHBondContact O-N 3.42Å
198	N	96.9	Very high	95.6	Very high	55 Å²	55	62.3 Å²	62.3	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-60.5	-39	179.1	-78	-1.3	0	0	0	113	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.5Å; W75-N198 WeakPolarHBondContact CB-O 3.49Å; Q78-N198 PolarHBondContact NE2-ND2 3.41Å; E79-N198 PolarHBondContact OE1-ND2 3Å; R194-N198 VanDerWaalsContact O-CB 3.25Å; R194-N198 WeakPolarHBondContact O-CB 3.36Å; R194-N198 PolarHBondContact O-N 3.04Å; R194-N198 PolarHBondContact O-OD1 3.4Å; Y195-N198 PolarHBondContact O-N 3.43Å
199	G	95.9	Very high	95.6	Very high	3 Å²	3	62.8 Å²	62.8	3%	0.031	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	19	-176.2	0	0	0	0	0	113.5	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.36Å; Y195-G199 PolarHBondContact O-N 3.11Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 3.47Å; G199-E201 VanDerWaalsContact C-N 3.3Å; G199-E201 PolarHBondContact O-N 2.88Å; G199-T202 CarbonylContact O-C 3.57Å; G199-T202 WeakPolarHBondContact O-CA 3.28Å; G199-T202 PolarHBondContact O-N 2.98Å; G199-T202 PolarHBondContact O-OG1 3.24Å; G199-L203 PolarHBondContact O-N 3.42Å
200	K	93.9	Very high	95.6	Very high	109 Å²	109	69.9 Å²	69.9	47%	0.474	33%	0.326	S	S	.	.	H	α-helix	trans	-49.2	-46	-170.9	-176.9	173.1	-174.1	171.7	0	114.2	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.44Å; L196-K200 WeakPolarHBondContact O-CB 3.14Å; L196-K200 PolarHBondContact O-N 3.35Å; L196-K200 VanDerWaalsContact O-N 3.11Å; E197-K200 WeakPolarHBondContact O-CB 3.41Å; E197-K200 PolarHBondContact O-N 3.42Å; K200-T202 PolarHBondContact O-N 3.35Å; K200-Q204 WeakPolarHBondContact O-CB 3.2Å; K200-Q204 PolarHBondContact O-N 3.11Å; K200-Q204 VanDerWaalsContact O-N 3.14Å
201	E	91.9	Very high	95.5	Very high	182 Å²	182	65.8 Å²	65.8	85%	0.85	31%	0.31	S	S	*	.	H	α-helix	trans	-63.3	-24.2	179.4	-62.6	-175.1	166.1	0	0	113.3	G199 R205	G199-E201 VanDerWaalsContact C-N 3.3Å; G199-E201 PolarHBondContact O-N 2.88Å; E201-R205 WeakPolarHBondContact O-CD 3.25Å
202	T	91.6	Very high	95.4	Very high	43 Å²	43	67.6 Å²	67.6	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-104	-37.1	-177.3	54.2	0	0	0	0	114.4	W75 G199 K200 R205	W75-T202 VanDerWaalsContact CD1-OG1 3.23Å; G199-T202 CarbonylContact O-C 3.57Å; G199-T202 WeakPolarHBondContact O-CA 3.28Å; G199-T202 PolarHBondContact O-N 2.98Å; G199-T202 PolarHBondContact O-OG1 3.24Å; K200-T202 PolarHBondContact O-N 3.35Å; T202-R205 WeakPolarHBondContact O-CG 3.48Å
203	L	92.8	Very high	95.4	Very high	4 Å²	4	68.8 Å²	68.8	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-94	-26.6	-172.2	-63.1	171.1	0	0	0	112.6	V52 T55 W75 Y195 L196 G199	V52-L203 HydrophobicContact CB-CD1 4.28Å; V52-L203 HydrophobicContact CB-CD2 4.13Å; V52-L203 HydrophobicContact CG1-CD1 3.91Å; V52-L203 HydrophobicContact CG1-CD2 4.08Å; V52-L203 HydrophobicContact CG1-CG 4.5Å; T55-L203 HydrophobicContact CG2-CD2 4.11Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.37Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.1Å; W75-L203 HydrophobicContact CZ2-CG 4.39Å; 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 3.42Å
204	Q	90.9	Very high	95.4	Very high	93 Å²	93	64.7 Å²	64.7	44%	0.435	32%	0.316	S	S	.	.	S	Bend	trans	-104.3	22.3	178.5	-58.2	178.8	35.9	0	0	111.6	L196 K200	L196-Q204 HydrophobicContact CD2-CG 4.49Å; L196-Q204 PolarHBondContact O-NE2 3.25Å; K200-Q204 WeakPolarHBondContact O-CB 3.2Å; K200-Q204 PolarHBondContact O-N 3.11Å; K200-Q204 VanDerWaalsContact O-N 3.14Å
205	R	92.1	Very high	95.3	Very high	86 Å²	86	61.5 Å²	61.5	33%	0.325	31%	0.306	S	S	.	.			trans	-97.2	146.3	172.8	81	-174.4	-171.4	-126	-1.7	109.3	E201 T202 E207 Y233	E201-R205 WeakPolarHBondContact O-CD 3.25Å; T202-R205 WeakPolarHBondContact O-CG 3.48Å; R205-E207 IonicContact CZ-OE1 3.65Å; R205-E207 IonicContact NE-OE1 2.8Å; R205-E207 PolarHBondContact NE-OE1 3.04Å; R205-E207 IonicContact NH2-OE1 2.66Å; R205-E207 PolarHBondContact NH2-OE1 3.14Å; R205-Y233 HydrophobicContact CG-CD1 4.2Å; R205-Y233 VanDerWaalsContact O-CD1 3.26Å; R205-Y233 WeakPolarHBondContact O-CD1 3.48Å; R205-Y233 WeakPolarHBondContact O-CE1 3.49Å
206	A	93.9	Very high	95.2	Very high	40 Å²	40	65.2 Å²	65.2	33%	0.331	32%	0.323	S	S	.	.			trans	-119.6	119.9	166.7	0	0	0	0	0	108.4	Y233 E288	A206-Y233 CarbonylContact C-O 3.57Å; A206-Y233 WeakPolarHBondContact CA-O 3.44Å; A206-E288 HydrophobicContact CB-CG 4.13Å
207	E	95.6	Very high	95.1	Very high	63 Å²	63	69.3 Å²	69.3	29%	0.294	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-99.7	114.1	176.5	-68.6	-175.9	-119	0	0	108.6	R205 F232 Y233 H287	R205-E207 IonicContact CZ-OE1 3.65Å; R205-E207 IonicContact NE-OE1 2.8Å; R205-E207 PolarHBondContact NE-OE1 3.04Å; R205-E207 IonicContact NH2-OE1 2.66Å; R205-E207 PolarHBondContact NH2-OE1 3.14Å; E207-F232 WeakPolarHBondContact O-CA 3.41Å; E207-F232 WeakPolarHBondContact O-CB 3.34Å; E207-Y233 PolarHBondContact N-O 2.92Å; E207-Y233 PolarHBondContact O-N 2.92Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; E207-H287 PolarHBondContact O-CE1 2.87Å
208	P	97	Very high	94.9	Very high	69 Å²	69	68.1 Å²	68.1	45%	0.448	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-67.8	147.7	-179.6	25.5	-32.6	0	0	0	111.7	L290	P208-L290 HydrophobicContact CB-CD2 3.89Å
209	P	97.9	Very high	94.7	Very high	11 Å²	11	68.2 Å²	68.2	7%	0.071	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-65.8	137.7	178.6	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 3.87Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.91Å; P209-F232 HydrophobicContact CB-CG 4.18Å; P209-I237 HydrophobicContact CB-CD1 4.23Å; P209-I237 HydrophobicContact CG-CD1 4.13Å; P209-M285 HydrophobicContact CB-SD 3.9Å; P209-M285 HydrophobicContact CG-SD 3.4Å; P209-M285 WeakPolarHBondContact CG-SD 3.37Å; P209-H287 HydrophobicContact CG-CB 4.3Å; P209-L290 HydrophobicContact CG-CD1 4.14Å; P209-L290 HydrophobicContact CG-CD2 4.44Å; P209-L290 HydrophobicContact CG-CG 4.39Å
210	K	97.8	Very high	94.4	Very high	154 Å²	154	75.1 Å²	75.1	67%	0.67	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	117.4	161.6	-64.9	172.1	-172.6	164.8	0	108	L230	K210-L230 HydrophobicContact CB-CB 4.48Å; K210-L230 PolarHBondContact N-O 2.98Å; K210-L230 PolarHBondContact O-N 2.64Å
211	T	97.2	Very high	94.3	Very high	42 Å²	42	77 Å²	77	26%	0.258	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	144.6	-170	62.8	0	0	0	0	113.2	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 3.27Å; T211-M285 HydrophobicContact CG2-CE 3.49Å; T211-M285 VanDerWaalsContact CG2-CE 3.49Å; T211-M285 HydrophobicContact CG2-SD 3.39Å; T211-M285 WeakPolarHBondContact CG2-SD 3.41Å; T211-L294 HydrophobicContact CG2-CD1 4.22Å; T211-L296 VanDerWaalsContact CB-CD1 3.48Å; T211-L296 HydrophobicContact CG2-CD1 4.07Å
212	H	96.1	Very high	94.5	Very high	81 Å²	81	72.8 Å²	72.8	38%	0.375	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	158.3	168.5	61.9	-72.1	0	0	0	110.5	W228	H212-W228 AromaticContact CD2-CD1 3.92Å; H212-W228 VanDerWaalsContact CE1-CB 3.41Å; H212-W228 WeakPolarHBondContact CE1-CB 3.33Å; H212-W228 AromaticContact CE1-CD1 3.82Å; H212-W228 AromaticContact CE1-CG 3.6Å; H212-W228 PolarHBondContact N-O 3.1Å; H212-W228 AromaticContact NE2-CD1 3.43Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 AromaticContact NE2-NE1 4Å; H212-W228 PolarHBondContact O-N 3.37Å
213	V	97.8	Very high	94.7	Very high	25 Å²	25	70.8 Å²	70.8	15%	0.152	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.9	174.7	-177.9	0	0	0	0	109.1	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.45Å; V213-R226 WeakPolarHBondContact CA-O 3.46Å; V213-C227 HydrophobicContact CG2-CB 4.48Å; V213-W241 HydrophobicContact CG1-CH2 3.92Å; V213-W241 HydrophobicContact CG1-CZ2 4.38Å; V213-W241 HydrophobicContact CG2-CH2 4.46Å; V213-L296 HydrophobicContact CG2-CB 3.9Å; V213-W298 HydrophobicContact CB-CB 4.5Å; V213-W298 HydrophobicContact CG1-CB 3.83Å
214	T	96.6	Very high	94.9	Very high	34 Å²	34	71.4 Å²	71.4	21%	0.209	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	146	176.2	53.1	0	0	0	0	110.3	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3.24Å; T214-H216 VanDerWaalsContact OG1-CE1 3.29Å; T214-L225 WeakPolarHBondContact O-CA 3.48Å; T214-R226 PolarHBondContact N-O 2.84Å; T214-R226 PolarHBondContact O-N 3.21Å; T214-R226 WeakPolarHBondContact OG1-CB 3.06Å; T214-R226 PolarHBondContact OG1-O 3.18Å; T214-R226 VanDerWaalsContact OG1-O 3.13Å; T214-W228 PolarHBondContact OG1-NE1 2.91Å
215	H	95.9	Very high	95.3	Very high	56 Å²	56	67 Å²	67	26%	0.259	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125	179.5	169.5	-90.1	0	0	0	109.7	A223 T224 L225 E278 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.19Å; H215-T224 WeakPolarHBondContact CA-O 3.43Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; H215-E278 IonicContact NE2-OE1 3.55Å; H215-W298 HydrophobicContact CB-CD2 4.14Å; H215-W298 HydrophobicContact CB-CG 4.19Å; H215-W298 HydrophobicContact CB-CZ2 4Å; H215-W298 VanDerWaalsContact CB-NE1 3.25Å; H215-W298 AromaticContact CG-CE2 3.81Å; H215-W298 AromaticContact CG-CZ2 3.82Å
216	H	94.6	Very high	95.6	Very high	79 Å²	79	65.5 Å²	65.5	37%	0.366	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	106.2	-179.5	-58.5	84.1	0	0	0	109.2	T214 L218 A223 T224 R226	T214-H216 PolarHBondContact OG1-CE1 3.24Å; T214-H216 VanDerWaalsContact OG1-CE1 3.29Å; H216-L218 PolarHBondContact O-N 3.32Å; H216-A223 CarbonylContact O-C 3.54Å; H216-A223 WeakPolarHBondContact O-CA 3.45Å; H216-T224 PolarHBondContact N-O 2.8Å; H216-T224 PolarHBondContact O-N 2.93Å; H216-R226 PolarHBondContact CE1-NH1 2.83Å
217	P	93.9	Very high	95.8	Very high	99 Å²	99	63.6 Å²	63.6	64%	0.643	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.3	130.7	174.2	-19.2	29.6	0	0	0	110.8
218	L	91.8	Very high	95.9	Very high	103 Å²	103	62.8 Å²	62.8	54%	0.539	32%	0.323	S	S	.	.			trans	-100.4	-40.9	173.1	-64.5	178.6	0	0	0	110.9	H216 E222 T224 V272	H216-L218 PolarHBondContact O-N 3.32Å; L218-E222 PolarHBondContact N-O 2.83Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.5Å; L218-V272 HydrophobicContact CD1-CG1 4.2Å; L218-V272 HydrophobicContact CD1-CG2 4.22Å
219	S	92.8	Very high	96	Very high	56 Å²	56	59.5 Å²	59.5	39%	0.392	30%	0.302	S	S	.	.	S	Bend	trans	-151.2	-177.9	176.7	71.6	0	0	0	0	110.3	H221 E222	S219-H221 PolarHBondContact O-N 3.2Å; S219-H221 PolarHBondContact OG-N 3.08Å; S219-H221 VanDerWaalsContact OG-N 3.16Å; S219-E222 PolarHBondContact N-O 2.04Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 2.84Å
220	D	89.7	Confident	96	Very high	149 Å²	149	61.4 Å²	61.4	80%	0.797	31%	0.312	S	S	*	.	S	Bend	trans	-63.2	-19.3	172.4	-65.8	-21.6	0	0	0	112.6	S275	D220-S275 WeakPolarHBondContact O-CB 3.42Å; D220-S275 PolarHBondContact O-OG 2.86Å
221	H	93.4	Very high	96	Very high	147 Å²	147	55 Å²	55	68%	0.681	29%	0.29	S	S	*	.	S	Bend	trans	-106.3	-17.2	-174	-56.2	-47.3	0	0	0	114.1	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.2Å; S219-H221 PolarHBondContact OG-N 3.08Å; S219-H221 VanDerWaalsContact OG-N 3.16Å; H221-P274 CarbonylContact O-C 3.59Å; H221-P274 WeakPolarHBondContact O-CA 3.43Å; H221-S275 PolarHBondContact O-N 3.39Å; H221-S275 PolarHBondContact O-OG 2.86Å
222	E	95.5	Very high	96	Very high	95 Å²	95	53 Å²	53	44%	0.444	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	146.8	-171.3	-66.5	180	169.2	0	0	112.4	L218 S219 V272 V273 S275	L218-E222 PolarHBondContact N-O 2.83Å; S219-E222 PolarHBondContact N-O 2.04Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 2.84Å; E222-V272 HydrophobicContact CB-CG1 4.15Å; E222-V272 HydrophobicContact CG-CG1 4.37Å; E222-V273 WeakPolarHBondContact CA-O 3.14Å; E222-S275 PolarHBondContact N-OG 2.78Å
223	A	96	Very high	96	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	158	172	0	0	0	0	0	110.8	H215 H216 V272 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.19Å; H216-A223 CarbonylContact O-C 3.54Å; H216-A223 WeakPolarHBondContact O-CA 3.45Å; A223-V272 WeakPolarHBondContact O-CA 3.43Å; A223-V273 PolarHBondContact N-O 3.46Å; A223-V273 PolarHBondContact O-N 3.36Å
224	T	97.4	Very high	95.9	Very high	17 Å²	17	49 Å²	49	10%	0.104	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.1	170	-54.5	0	0	0	0	109.8	H215 H216 L218 A270 V271	H215-T224 WeakPolarHBondContact CA-O 3.43Å; H216-T224 PolarHBondContact N-O 2.8Å; H216-T224 PolarHBondContact O-N 2.93Å; L218-T224 WeakPolarHBondContact CD1-OG1 3.5Å; T224-A270 HydrophobicContact CG2-CB 3.9Å; T224-V271 WeakPolarHBondContact CA-O 3.48Å
225	L	97.9	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.9	163.6	-62.8	-175.7	0	0	0	108.9	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.45Å; T214-L225 WeakPolarHBondContact O-CA 3.48Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; L225-W241 HydrophobicContact CB-CH2 3.7Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 4.09Å; L225-W241 HydrophobicContact CD1-CZ3 4.25Å; L225-A270 CarbonylContact O-C 3.55Å; L225-A270 WeakPolarHBondContact O-CA 3.27Å; L225-V271 HydrophobicContact CB-CG1 4.27Å; L225-V271 PolarHBondContact N-O 2.9Å; L225-V271 PolarHBondContact O-N 3.16Å; L225-V273 HydrophobicContact CD1-CG1 4.01Å; L225-V273 HydrophobicContact CD1-CG2 4.09Å; L225-V273 HydrophobicContact CG-CG1 4.14Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; L225-E278 HydrophobicContact CD1-CB 4.09Å; L225-E278 HydrophobicContact CD2-CB 4.47Å; L225-E278 HydrophobicContact CD2-CG 4.32Å; L225-W298 HydrophobicContact CD1-CB 4.3Å; L225-W298 HydrophobicContact CD2-CB 3.78Å; L225-W298 HydrophobicContact CD2-CD2 4.36Å; L225-W298 HydrophobicContact CD2-CG 3.9Å
226	R	98.1	Very high	95.9	Very high	54 Å²	54	52.1 Å²	52.1	20%	0.204	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	118.4	176	-179.4	-175.4	-61.4	120.7	2.7	110.3	V213 T214 H216 W228 W268 A269 A270	V213-R226 WeakPolarHBondContact CA-O 3.46Å; T214-R226 PolarHBondContact N-O 2.84Å; T214-R226 PolarHBondContact O-N 3.21Å; T214-R226 WeakPolarHBondContact OG1-CB 3.06Å; T214-R226 PolarHBondContact OG1-O 3.18Å; T214-R226 VanDerWaalsContact OG1-O 3.13Å; H216-R226 PolarHBondContact CE1-NH1 2.83Å; R226-W228 HydrophobicContact CG-CZ2 4.4Å; R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.09Å; R226-W268 HydrophobicContact CG-CE3 3.86Å; R226-W268 HydrophobicContact CG-CG 4.2Å; R226-A269 WeakPolarHBondContact CA-O 3.2Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.12Å
227	C	98.1	Very high	96	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.6	177	-176.7	0	0	0	0	109.4	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.48Å; C227-W241 HydrophobicContact CB-CH2 4.41Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; C227-W268 CarbonylContact O-C 3.57Å; C227-W268 WeakPolarHBondContact O-CA 3.46Å; C227-W268 WeakPolarHBondContact O-CB 3.21Å; C227-A269 PolarHBondContact N-O 2.96Å; C227-A269 PolarHBondContact O-N 2.99Å; C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.33Å; C227-C283 WeakPolarHBondContact SG-CB 3.23Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 3.38Å
228	W	98.3	Very high	96.1	Very high	46 Å²	46	47.1 Å²	47.1	17%	0.174	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	139.3	-177.8	-69.3	90	0	0	0	111.2	T211 H212 T214 R226 L230 W268	T211-W228 VanDerWaalsContact CA-O 3.24Å; T211-W228 WeakPolarHBondContact CA-O 3.27Å; H212-W228 AromaticContact CD2-CD1 3.92Å; H212-W228 VanDerWaalsContact CE1-CB 3.41Å; H212-W228 WeakPolarHBondContact CE1-CB 3.33Å; H212-W228 AromaticContact CE1-CD1 3.82Å; H212-W228 AromaticContact CE1-CG 3.6Å; H212-W228 PolarHBondContact N-O 3.1Å; H212-W228 AromaticContact NE2-CD1 3.43Å; H212-W228 AromaticContact NE2-CG 3.68Å; H212-W228 AromaticContact NE2-NE1 4Å; H212-W228 PolarHBondContact O-N 3.37Å; T214-W228 PolarHBondContact OG1-NE1 2.91Å; R226-W228 HydrophobicContact CG-CZ2 4.4Å; W228-L230 HydrophobicContact CE3-CD2 3.91Å; W228-L230 HydrophobicContact CZ3-CD2 4.45Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.83Å; W228-W268 HydrophobicContact CE3-CG 4.15Å; W228-W268 HydrophobicContact CG-CB 4.4Å; W228-W268 AromaticContact CH2-CD1 3.69Å; W228-W268 HydrophobicContact CH2-CG 4.32Å; W228-W268 HydrophobicContact CZ3-CB 4.32Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.09Å
229	A	98.4	Very high	96.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121.8	163.1	0	0	0	0	0	107.9	P209 F232 I237 L239 Q266 K267 M285	P209-A229 HydrophobicContact CB-CB 3.87Å; A229-F232 HydrophobicContact CB-CD1 3.93Å; A229-F232 HydrophobicContact CB-CE1 3.65Å; A229-F232 WeakPolarHBondContact O-CE1 3.34Å; A229-I237 HydrophobicContact CB-CD1 3.7Å; A229-L239 HydrophobicContact CB-CD1 4.13Å; A229-L239 HydrophobicContact CB-CD2 4.26Å; A229-Q266 CarbonylContact O-C 3.57Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.4Å; A229-K267 PolarHBondContact N-O 3.45Å; A229-K267 PolarHBondContact O-N 3.5Å; A229-K267 VanDerWaalsContact O-O 3.09Å; A229-M285 HydrophobicContact CB-CE 3.69Å; A229-M285 HydrophobicContact CB-SD 3.9Å
230	L	98.3	Very high	96.5	Very high	52 Å²	52	41.9 Å²	41.9	27%	0.272	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.8	-176.3	-59.3	177.3	0	0	0	111.1	K210 W228 F232 Q266	K210-L230 HydrophobicContact CB-CB 4.48Å; K210-L230 PolarHBondContact N-O 2.98Å; K210-L230 PolarHBondContact O-N 2.64Å; W228-L230 HydrophobicContact CE3-CD2 3.91Å; W228-L230 HydrophobicContact CZ3-CD2 4.45Å; L230-F232 PolarHBondContact O-N 2.87Å; L230-Q266 HydrophobicContact CD2-CB 3.59Å
231	G	97.6	Very high	96.9	Very high	20 Å²	20	34.9 Å²	34.9	21%	0.206	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	69.3	33.2	168.4	0	0	0	0	0	113.9	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.44Å; G231-F265 PolarHBondContact N-O 3.38Å
232	F	97.6	Very high	97.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	156.4	179.8	60	-90.1	0	0	0	112.4	E207 P209 A229 L230 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.41Å; E207-F232 WeakPolarHBondContact O-CB 3.34Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.91Å; P209-F232 HydrophobicContact CB-CG 4.18Å; A229-F232 HydrophobicContact CB-CD1 3.93Å; A229-F232 HydrophobicContact CB-CE1 3.65Å; A229-F232 WeakPolarHBondContact O-CE1 3.34Å; L230-F232 PolarHBondContact O-N 2.87Å; F232-P234 WeakPolarHBondContact CD2-O 3.37Å; F232-I237 HydrophobicContact CD1-CD1 4Å; F232-I237 HydrophobicContact CD2-CB 4.33Å; F232-I237 HydrophobicContact CD2-CD1 4.03Å; F232-I237 HydrophobicContact CE1-CD1 3.89Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.77Å; F232-I237 HydrophobicContact CE2-CD1 3.95Å; F232-I237 HydrophobicContact CE2-CG1 4.44Å; F232-I237 HydrophobicContact CE2-CG2 3.6Å; F232-I237 HydrophobicContact CG-CD1 4.08Å; F232-I237 HydrophobicContact CZ-CB 4.15Å; F232-I237 HydrophobicContact CZ-CD1 3.9Å; F232-I237 HydrophobicContact CZ-CG2 3.55Å; F232-T257 HydrophobicContact CE2-CG2 4.11Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; F232-T264 CarbonylContact O-C 3.53Å; F232-T264 WeakPolarHBondContact O-CA 3.45Å; F232-F265 WeakPolarHBondContact CD1-O 3.3Å; F232-F265 HydrophobicContact CD2-CB 3.96Å; F232-F265 HydrophobicContact CE1-CB 4.27Å; F232-F265 WeakPolarHBondContact CE1-O 3.35Å; F232-F265 HydrophobicContact CE2-CB 3.51Å; F232-F265 HydrophobicContact CG-CB 4.5Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 2.86Å; F232-F265 PolarHBondContact O-N 3.23Å; F232-K267 HydrophobicContact CE1-CB 4.36Å; F232-K267 HydrophobicContact CZ-CB 4.11Å; F232-H287 AromaticContact CD2-CD2 3.8Å; F232-H287 AromaticContact CD2-NE2 3.62Å
233	Y	96.4	Very high	97.2	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.016	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-151.5	137.1	173.6	177.5	-84.5	0	0	0	109	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.07Å; T55-Y233 PolarHBondContact OG1-OH 3.43Å; R205-Y233 HydrophobicContact CG-CD1 4.2Å; R205-Y233 VanDerWaalsContact O-CD1 3.26Å; R205-Y233 WeakPolarHBondContact O-CD1 3.48Å; R205-Y233 WeakPolarHBondContact O-CE1 3.49Å; A206-Y233 CarbonylContact C-O 3.57Å; A206-Y233 WeakPolarHBondContact CA-O 3.44Å; E207-Y233 PolarHBondContact N-O 2.92Å; E207-Y233 PolarHBondContact O-N 2.92Å; E207-Y233 VanDerWaalsContact O-N 3.09Å; Y233-G263 WeakPolarHBondContact CD2-O 3.49Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 HydrophobicContact CD2-CE2 4.01Å; Y233-F265 HydrophobicContact CE2-CE2 4.5Å; Y233-H287 PolarHBondContact O-CE1 3Å
234	P	95.5	Very high	97.1	Very high	17 Å²	17	33.2 Å²	33.2	11%	0.11	17%	0.17	C	C	.	.	S	Bend	cis	-72.4	179.9	2.2	30.6	-36.3	0	0	0	113.2	D54 F232 E236 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.3Å; D54-P234 WeakPolarHBondContact OD2-CB 3.44Å; F232-P234 WeakPolarHBondContact CD2-O 3.37Å; P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 2.92Å; P234-H287 PolarHBondContact O-NE2 3.26Å; P234-E288 WeakPolarHBondContact CG-OE2 3.41Å
235	A	96.6	Very high	96.9	Very high	14 Å²	14	34.8 Å²	34.8	12%	0.116	19%	0.19	C	C	.	.	S	Bend	trans	-70.7	-25.6	-175.4	0	0	0	0	0	113.8	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 VanDerWaalsContact OD2-CB 3.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.41Å; D54-A235 PolarHBondContact OD2-N 3.07Å; A235-I237 PolarHBondContact O-N 2.83Å; A235-T257 HydrophobicContact CB-CG2 4.3Å; A235-F265 HydrophobicContact CB-CD1 3.72Å; A235-F265 HydrophobicContact CB-CD2 3.7Å; A235-F265 HydrophobicContact CB-CE1 3.69Å; A235-F265 HydrophobicContact CB-CE2 3.68Å; A235-F265 HydrophobicContact CB-CG 3.75Å; A235-F265 HydrophobicContact CB-CZ 3.69Å
236	E	95.8	Very high	96.7	Very high	142 Å²	142	41.7 Å²	41.7	66%	0.664	22%	0.222	S	C	*	.			trans	-64.5	116.5	179.7	-171.9	58.7	-144.7	0	0	110.1	P234 H287	P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 2.92Å; E236-H287 PolarHBondContact O-CD2 2.89Å
237	I	96	Very high	96.6	Very high	11 Å²	11	43.6 Å²	43.6	6%	0.056	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	138.9	-178.8	-163.7	171.8	0	0	0	109.6	P209 A229 F232 A235 L239 K267 M285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.23Å; P209-I237 HydrophobicContact CG-CD1 4.13Å; A229-I237 HydrophobicContact CB-CD1 3.7Å; F232-I237 HydrophobicContact CD1-CD1 4Å; F232-I237 HydrophobicContact CD2-CB 4.33Å; F232-I237 HydrophobicContact CD2-CD1 4.03Å; F232-I237 HydrophobicContact CE1-CD1 3.89Å; F232-I237 HydrophobicContact CE1-CG2 4.47Å; F232-I237 HydrophobicContact CE2-CB 3.77Å; F232-I237 HydrophobicContact CE2-CD1 3.95Å; F232-I237 HydrophobicContact CE2-CG1 4.44Å; F232-I237 HydrophobicContact CE2-CG2 3.6Å; F232-I237 HydrophobicContact CG-CD1 4.08Å; F232-I237 HydrophobicContact CZ-CB 4.15Å; F232-I237 HydrophobicContact CZ-CD1 3.9Å; F232-I237 HydrophobicContact CZ-CG2 3.55Å; A235-I237 PolarHBondContact O-N 2.83Å; I237-L239 HydrophobicContact CB-CD1 4.39Å; I237-L239 HydrophobicContact CD1-CD1 3.61Å; I237-L239 HydrophobicContact CG1-CD1 3.61Å; I237-L239 HydrophobicContact CG2-CD1 3.98Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.58Å; I237-M285 HydrophobicContact CD1-CG 4.14Å; I237-M285 HydrophobicContact CD1-SD 4.02Å; I237-M285 HydrophobicContact CG1-CG 4.37Å; I237-Q286 WeakPolarHBondContact CG1-O 3.49Å; I237-H287 HydrophobicContact CD1-CB 4.17Å; I237-H287 HydrophobicContact CG1-CB 3.96Å
238	T	96.7	Very high	96.4	Very high	61 Å²	61	44.9 Å²	44.9	37%	0.374	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124.4	175	-63.2	0	0	0	0	110.1	T240 M285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.17Å; T238-M285 VanDerWaalsContact O-CA 3.31Å; T238-M285 WeakPolarHBondContact O-CA 3.45Å; T238-Q286 PolarHBondContact N-O 2.88Å; T238-Q286 PolarHBondContact O-N 3.43Å
239	L	97	Very high	96	Very high	7 Å²	7	47.7 Å²	47.7	4%	0.037	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124.3	175.3	-89.5	73.9	0	0	0	108.8	A229 I237 L254 K267 A269 M285	A229-L239 HydrophobicContact CB-CD1 4.13Å; A229-L239 HydrophobicContact CB-CD2 4.26Å; I237-L239 HydrophobicContact CB-CD1 4.39Å; I237-L239 HydrophobicContact CD1-CD1 3.61Å; I237-L239 HydrophobicContact CG1-CD1 3.61Å; I237-L239 HydrophobicContact CG2-CD1 3.98Å; L239-L254 HydrophobicContact CB-CD1 4.11Å; L239-K267 HydrophobicContact CD1-CD 4.2Å; L239-A269 HydrophobicContact CB-CB 4.17Å; L239-A269 HydrophobicContact CD2-CB 4.31Å; L239-M285 HydrophobicContact CD1-CE 4.08Å; L239-M285 HydrophobicContact CD1-CG 4Å; L239-M285 HydrophobicContact CD1-SD 4.38Å; L239-M285 HydrophobicContact CD2-CE 4.1Å; L239-M285 HydrophobicContact CG-CE 3.96Å; L239-M285 HydrophobicContact CG-CG 4.42Å
240	T	97.1	Very high	95.6	Very high	42 Å²	42	56.8 Å²	56.8	26%	0.258	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.5	179.7	50.5	0	0	0	0	110.6	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.17Å; T240-C283 CarbonylContact O-C 3.55Å; T240-C283 WeakPolarHBondContact O-CA 3.5Å; T240-H284 PolarHBondContact N-O 2.84Å; T240-H284 PolarHBondContact O-N 3.27Å; T240-H284 WeakPolarHBondContact OG1-CB 3.3Å; T240-H284 PolarHBondContact OG1-O 2.81Å
241	W	98	Very high	95.1	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.008	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	136	168.7	-83.1	105.3	0	0	0	109.6	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.92Å; V213-W241 HydrophobicContact CG1-CZ2 4.38Å; V213-W241 HydrophobicContact CG2-CH2 4.46Å; L225-W241 HydrophobicContact CB-CH2 3.7Å; L225-W241 HydrophobicContact CB-CZ2 3.8Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 4.09Å; L225-W241 HydrophobicContact CD1-CZ3 4.25Å; C227-W241 HydrophobicContact CB-CH2 4.41Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; W241-Q248 HydrophobicContact CB-CB 4.28Å; W241-Q248 PolarHBondContact O-N 3.1Å; W241-A269 VanDerWaalsContact NE1-C 3.34Å; W241-A269 PolarHBondContact NE1-O 3.45Å; W241-V271 HydrophobicContact CB-CB 4.5Å; W241-V271 HydrophobicContact CB-CG1 4.35Å; W241-V271 HydrophobicContact CD2-CB 4.47Å; W241-V271 HydrophobicContact CD2-CG1 3.6Å; W241-V271 HydrophobicContact CE3-CG1 4.02Å; W241-V271 HydrophobicContact CG-CB 4.13Å; W241-V271 HydrophobicContact CG-CG1 3.75Å; W241-V271 HydrophobicContact CZ2-CG1 4.35Å; W241-T282 VanDerWaalsContact CE3-C 3.42Å; W241-C283 HydrophobicContact CD2-CB 4.17Å; W241-C283 HydrophobicContact CE3-CB 4.08Å; W241-C283 HydrophobicContact CH2-CB 4.02Å; W241-C283 HydrophobicContact CZ2-CB 4.11Å; W241-C283 HydrophobicContact CZ3-CB 3.99Å
242	Q	97.6	Very high	95	Very high	40 Å²	40	59.9 Å²	59.9	19%	0.187	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.5	171.8	-69.3	-172.9	-3.4	0	0	110.2	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.26Å; Q242-E246 WeakPolarHBondContact CA-O 3.35Å; Q242-D247 VanDerWaalsContact CG-OD1 3.22Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.46Å; Q242-D247 PolarHBondContact NE2-OD1 2.98Å; Q242-Y281 CarbonylContact O-C 3.58Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.46Å; Q242-T282 PolarHBondContact N-O 2.82Å; Q242-T282 PolarHBondContact O-N 2.89Å; Q242-H284 PolarHBondContact OE1-CE1 2.83Å; Q242-H284 PolarHBondContact OE1-NE2 3.19Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.08Å
243	R	97.1	Very high	95	Very high	71 Å²	71	65.5 Å²	65.5	27%	0.268	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	116.7	169.3	-177	-170.8	-179.1	174.1	3.2	108.4	G245 E246 Q248 R280 Y281	R243-G245 PolarHBondContact O-N 2.88Å; R243-E246 PolarHBondContact N-O 2.8Å; R243-E246 PolarHBondContact O-N 2.94Å; R243-Q248 HydrophobicContact CB-CG 3.93Å; R243-R280 WeakPolarHBondContact CA-O 3.47Å; R243-R280 HydrophobicContact CG-CB 4.48Å; R243-Y281 HydrophobicContact CB-CD1 4.11Å; R243-Y281 HydrophobicContact CB-CE1 3.92Å; R243-Y281 HydrophobicContact CG-CD1 4.45Å; R243-Y281 HydrophobicContact CG-CE1 4.09Å; R243-Y281 HydrophobicContact CG-CE2 4.15Å
244	D	94.6	Very high	95	Very high	97 Å²	97	69.5 Å²	69.5	52%	0.519	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	31	-175.1	-48.1	-63.6	0	0	0	113.8	R280	D244-R280 PolarHBondContact N-O 2.83Å; D244-R280 IonicContact OD1-CZ 3.1Å; D244-R280 IonicContact OD1-NE 2.88Å; D244-R280 PolarHBondContact OD1-NE 3.49Å; D244-R280 VanDerWaalsContact OD1-NE 3.08Å; D244-R280 IonicContact OD1-NH2 3.95Å; D244-R280 IonicContact OD2-CZ 2.82Å; D244-R280 IonicContact OD2-NE 3.86Å; D244-R280 PolarHBondContact OD2-NE 3.14Å; D244-R280 IonicContact OD2-NH2 2.61Å; D244-R280 PolarHBondContact OD2-NH2 2.84Å
245	G	91.2	Very high	95.1	Very high	50 Å²	50	70.3 Å²	70.3	52%	0.515	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	-0.5	-177.4	0	0	0	0	0	116	R243	R243-G245 PolarHBondContact O-N 2.88Å
246	E	95.4	Very high	95.1	Very high	145 Å²	145	77.8 Å²	77.8	68%	0.678	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.1	176.2	-64.1	-174.5	170.8	0	0	111.9	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.53Å; Q242-E246 VanDerWaalsContact CA-O 3.26Å; Q242-E246 WeakPolarHBondContact CA-O 3.35Å; R243-E246 PolarHBondContact N-O 2.8Å; R243-E246 PolarHBondContact O-N 2.94Å; E246-Q248 PolarHBondContact O-NE2 3.12Å
247	D	95.2	Very high	95.2	Very high	95 Å²	95	73.2 Å²	73.2	51%	0.508	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	133.9	179.9	-69.1	-21.2	0	0	0	112.5	Q242	Q242-D247 VanDerWaalsContact CG-OD1 3.22Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.46Å; Q242-D247 PolarHBondContact NE2-OD1 2.98Å
248	Q	95.1	Very high	95.3	Very high	26 Å²	26	77.4 Å²	77.4	12%	0.121	40%	0.402	C	S	.	.			trans	-105	37.3	-177.7	-57.6	-60.4	-69.4	0	0	112.2	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.28Å; W241-Q248 PolarHBondContact O-N 3.1Å; R243-Q248 HydrophobicContact CB-CG 3.93Å; E246-Q248 PolarHBondContact O-NE2 3.12Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.01Å; Q248-D251 PolarHBondContact O-N 3.1Å; Q248-T252 WeakPolarHBondContact O-CB 3.23Å; Q248-T252 PolarHBondContact O-N 3.24Å; Q248-T252 VanDerWaalsContact O-N 3.09Å; Q248-T252 PolarHBondContact O-OG1 2.82Å; Q248-Y281 HydrophobicContact CG-CE1 4.37Å
249	T	89.8	Confident	95.3	Very high	105 Å²	105	79.1 Å²	79.1	64%	0.644	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-36.6	-169.1	-45.7	0	0	0	0	114.1
250	Q	89.9	Confident	95.3	Very high	192 Å²	192	81.1 Å²	81.1	90%	0.897	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-31.5	-178.2	-66.4	-174.8	7.8	0	0	113.2	Q248	Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.01Å
251	D	87.9	Confident	95.1	Very high	114 Å²	114	82.8 Å²	82.8	61%	0.61	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	0.8	-177.5	-58.5	-48.7	0	0	0	112.3	Q248	Q248-D251 PolarHBondContact O-N 3.1Å
252	T	94.9	Very high	94.9	Very high	23 Å²	23	88.1 Å²	88.1	14%	0.141	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121.7	-179.7	-63.8	0	0	0	0	110.8	Q248 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.23Å; Q248-T252 PolarHBondContact O-N 3.24Å; Q248-T252 VanDerWaalsContact O-N 3.09Å; Q248-T252 PolarHBondContact O-OG1 2.82Å; T252-L254 HydrophobicContact CG2-CB 4.41Å; T252-L254 PolarHBondContact O-N 2.8Å; T252-A269 HydrophobicContact CG2-CB 3.95Å; T252-A270 CarbonylContact C-O 3.56Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å
253	E	96.8	Very high	94.6	Very high	117 Å²	117	88.2 Å²	88.2	55%	0.547	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	105.7	163.2	-174.1	-174.8	-170.6	0	0	108.8	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.23Å; E253-W268 HydrophobicContact CG-CH2 3.89Å; E253-W268 HydrophobicContact CG-CZ3 3.83Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; E253-A269 CarbonylContact O-C 3.52Å; E253-A269 WeakPolarHBondContact O-CA 3.25Å; E253-A270 HydrophobicContact CB-CB 4.4Å; E253-A270 PolarHBondContact N-O 3.07Å; E253-A270 PolarHBondContact O-N 3.45Å
254	L	96.8	Very high	94.6	Very high	88 Å²	88	85.2 Å²	85.2	46%	0.461	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.1	177.4	-174.3	68.2	0	0	0	109.8	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.11Å; T252-L254 HydrophobicContact CG2-CB 4.41Å; T252-L254 PolarHBondContact O-N 2.8Å; L254-K267 HydrophobicContact CD1-CD 4.48Å; L254-A269 HydrophobicContact CD1-CB 3.66Å
255	V	96.9	Very high	94.8	Very high	34 Å²	34	81.9 Å²	81.9	21%	0.206	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-84.4	153.1	174.7	-64.7	0	0	0	0	112.2	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.43Å; V255-K267 VanDerWaalsContact O-CE 3.31Å; V255-K267 WeakPolarHBondContact O-CE 3.22Å; V255-K267 WeakPolarHBondContact O-CG 3.42Å; V255-K267 PolarHBondContact O-NZ 3.48Å; V255-W268 HydrophobicContact CB-CD2 4.48Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.24Å; V255-W268 HydrophobicContact CG1-CH2 3.54Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.04Å; V255-W268 HydrophobicContact CG2-CD2 3.73Å; V255-W268 HydrophobicContact CG2-CE3 4.44Å; V255-W268 HydrophobicContact CG2-CG 3.72Å; V255-W268 HydrophobicContact CG2-CZ2 4.38Å; V255-W268 WeakPolarHBondContact CG2-O 3.49Å; V255-W268 PolarHBondContact N-O 3.06Å
256	E	97	Very high	95.1	Very high	172 Å²	172	81.6 Å²	81.6	80%	0.804	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-57.6	148	167.5	-68	-176.9	175.6	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.48Å
257	T	97.9	Very high	95.2	Very high	46 Å²	46	75.7 Å²	75.7	28%	0.282	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-68.3	130	174.2	-55.6	0	0	0	0	108.4	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.11Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; A235-T257 HydrophobicContact CB-CG2 4.3Å; T257-F265 HydrophobicContact CG2-CB 3.78Å; T257-F265 HydrophobicContact CG2-CD1 3.92Å; T257-F265 HydrophobicContact CG2-CG 4.12Å; T257-K267 WeakPolarHBondContact OG1-CD 3.33Å; T257-K267 PolarHBondContact OG1-NZ 3.25Å; T257-K267 VanDerWaalsContact OG1-NZ 3.15Å
258	R	97.4	Very high	95.4	Very high	99 Å²	99	72.4 Å²	72.4	37%	0.374	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.9	-174.7	68	-168.7	-179.2	-172.8	3.3	111.3	E256 F265 Q266	E256-R258 PolarHBondContact O-N 3.48Å; R258-F265 WeakPolarHBondContact O-CA 3.48Å; R258-Q266 HydrophobicContact CG-CG 3.57Å; R258-Q266 PolarHBondContact N-O 2.83Å; R258-Q266 WeakPolarHBondContact O-CG 3.35Å; R258-Q266 PolarHBondContact O-N 2.83Å
259	P	97.4	Very high	95.5	Very high	96 Å²	96	71.2 Å²	71.2	62%	0.623	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	144.2	178.1	28.4	-34.5	0	0	0	111.1	F265	P259-F265 HydrophobicContact CB-CE1 4.31Å
260	A	96.6	Very high	95.9	Very high	50 Å²	50	66.3 Å²	66.3	41%	0.413	37%	0.37	S	S	.	.			trans	-87.3	-18.2	173.1	0	0	0	0	0	112.9	T264	A260-T264 WeakPolarHBondContact CB-O 3.42Å; A260-T264 PolarHBondContact N-O 2.81Å
261	G	93.4	Very high	96.3	Very high	77 Å²	77	57.3 Å²	57.3	79%	0.794	33%	0.328	S	S	*	.	S	Bend	trans	97.4	-7.4	178.4	0	0	0	0	0	114.9
262	D	93.1	Very high	96.8	Very high	114 Å²	114	55.2 Å²	55.2	61%	0.61	32%	0.319	S	S	*	.	S	Bend	trans	-104.5	11.5	176.1	60.3	1.2	0	0	0	113	T264	D262-T264 WeakPolarHBondContact OD1-CB 3.42Å; D262-T264 PolarHBondContact OD1-N 3.3Å; D262-T264 PolarHBondContact OD1-OG1 2.85Å
263	G	92.1	Very high	96.8	Very high	41 Å²	41	54.1 Å²	54.1	42%	0.423	31%	0.313	S	S	.	.	S	Bend	trans	91.7	-4.2	-174	0	0	0	0	0	114.2	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.49Å
264	T	96.8	Very high	96.8	Very high	9 Å²	9	50.6 Å²	50.6	6%	0.055	30%	0.3	C	S	.	.			trans	-102.8	173.4	175.1	73.4	0	0	0	0	112.5	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.44Å; F232-T264 CarbonylContact O-C 3.53Å; F232-T264 WeakPolarHBondContact O-CA 3.45Å; A260-T264 WeakPolarHBondContact CB-O 3.42Å; A260-T264 PolarHBondContact N-O 2.81Å; D262-T264 WeakPolarHBondContact OD1-CB 3.42Å; D262-T264 PolarHBondContact OD1-N 3.3Å; D262-T264 PolarHBondContact OD1-OG1 2.85Å
265	F	98.3	Very high	96.6	Very high	26 Å²	26	48.9 Å²	48.9	11%	0.114	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	163.4	-177.3	-63.9	-86.5	0	0	0	112.5	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.79Å; D54-F265 HydrophobicContact CB-CZ 3.71Å; G231-F265 PolarHBondContact N-O 3.38Å; F232-F265 WeakPolarHBondContact CD1-O 3.3Å; F232-F265 HydrophobicContact CD2-CB 3.96Å; F232-F265 HydrophobicContact CE1-CB 4.27Å; F232-F265 WeakPolarHBondContact CE1-O 3.35Å; F232-F265 HydrophobicContact CE2-CB 3.51Å; F232-F265 HydrophobicContact CG-CB 4.5Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 2.86Å; F232-F265 PolarHBondContact O-N 3.23Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 HydrophobicContact CD2-CE2 4.01Å; Y233-F265 HydrophobicContact CE2-CE2 4.5Å; A235-F265 HydrophobicContact CB-CD1 3.72Å; A235-F265 HydrophobicContact CB-CD2 3.7Å; A235-F265 HydrophobicContact CB-CE1 3.69Å; A235-F265 HydrophobicContact CB-CE2 3.68Å; A235-F265 HydrophobicContact CB-CG 3.75Å; A235-F265 HydrophobicContact CB-CZ 3.69Å; T257-F265 HydrophobicContact CG2-CB 3.78Å; T257-F265 HydrophobicContact CG2-CD1 3.92Å; T257-F265 HydrophobicContact CG2-CG 4.12Å; R258-F265 WeakPolarHBondContact O-CA 3.48Å; P259-F265 HydrophobicContact CB-CE1 4.31Å
266	Q	98.3	Very high	96.3	Very high	45 Å²	45	50.5 Å²	50.5	21%	0.21	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	146.1	173.8	44.1	168	-22.6	0	0	110.1	A229 L230 R258	A229-Q266 CarbonylContact O-C 3.57Å; A229-Q266 VanDerWaalsContact O-CA 3.26Å; A229-Q266 WeakPolarHBondContact O-CA 3.4Å; L230-Q266 HydrophobicContact CD2-CB 3.59Å; R258-Q266 HydrophobicContact CG-CG 3.57Å; R258-Q266 PolarHBondContact N-O 2.83Å; R258-Q266 WeakPolarHBondContact O-CG 3.35Å; R258-Q266 PolarHBondContact O-N 2.83Å
267	K	98.5	Very high	96.2	Very high	21 Å²	21	45 Å²	45	9%	0.091	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	154.8	177.2	-162.5	-176.3	-171.4	69.4	0	108.9	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 3.45Å; A229-K267 PolarHBondContact O-N 3.5Å; A229-K267 VanDerWaalsContact O-O 3.09Å; F232-K267 HydrophobicContact CE1-CB 4.36Å; F232-K267 HydrophobicContact CZ-CB 4.11Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.58Å; L239-K267 HydrophobicContact CD1-CD 4.2Å; L254-K267 HydrophobicContact CD1-CD 4.48Å; V255-K267 HydrophobicContact CG2-CG 4.43Å; V255-K267 VanDerWaalsContact O-CE 3.31Å; V255-K267 WeakPolarHBondContact O-CE 3.22Å; V255-K267 WeakPolarHBondContact O-CG 3.42Å; V255-K267 PolarHBondContact O-NZ 3.48Å; T257-K267 WeakPolarHBondContact OG1-CD 3.33Å; T257-K267 PolarHBondContact OG1-NZ 3.25Å; T257-K267 VanDerWaalsContact OG1-NZ 3.15Å
268	W	98.3	Very high	96.1	Very high	26 Å²	26	43.8 Å²	43.8	10%	0.098	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	157	169.2	58.6	-98.9	0	0	0	111.5	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.09Å; R226-W268 HydrophobicContact CG-CE3 3.86Å; R226-W268 HydrophobicContact CG-CG 4.2Å; C227-W268 CarbonylContact O-C 3.57Å; C227-W268 WeakPolarHBondContact O-CA 3.46Å; C227-W268 WeakPolarHBondContact O-CB 3.21Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.83Å; W228-W268 HydrophobicContact CE3-CG 4.15Å; W228-W268 HydrophobicContact CG-CB 4.4Å; W228-W268 AromaticContact CH2-CD1 3.69Å; W228-W268 HydrophobicContact CH2-CG 4.32Å; W228-W268 HydrophobicContact CZ3-CB 4.32Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.09Å; E253-W268 HydrophobicContact CB-CZ3 4.23Å; E253-W268 HydrophobicContact CG-CH2 3.89Å; E253-W268 HydrophobicContact CG-CZ3 3.83Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; V255-W268 HydrophobicContact CB-CD2 4.48Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.95Å; V255-W268 HydrophobicContact CG1-CE3 4.24Å; V255-W268 HydrophobicContact CG1-CH2 3.54Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.04Å; V255-W268 HydrophobicContact CG2-CD2 3.73Å; V255-W268 HydrophobicContact CG2-CE3 4.44Å; V255-W268 HydrophobicContact CG2-CG 3.72Å; V255-W268 HydrophobicContact CG2-CZ2 4.38Å; V255-W268 WeakPolarHBondContact CG2-O 3.49Å; V255-W268 PolarHBondContact N-O 3.06Å; W268-A270 HydrophobicContact CE3-CB 3.93Å; W268-A270 HydrophobicContact CZ3-CB 3.62Å
269	A	98.2	Very high	95.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	133	173	0	0	0	0	0	108.5	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.2Å; C227-A269 PolarHBondContact N-O 2.96Å; C227-A269 PolarHBondContact O-N 2.99Å; L239-A269 HydrophobicContact CB-CB 4.17Å; L239-A269 HydrophobicContact CD2-CB 4.31Å; W241-A269 VanDerWaalsContact NE1-C 3.34Å; W241-A269 PolarHBondContact NE1-O 3.45Å; T252-A269 HydrophobicContact CG2-CB 3.95Å; E253-A269 CarbonylContact O-C 3.52Å; E253-A269 WeakPolarHBondContact O-CA 3.25Å; L254-A269 HydrophobicContact CD1-CB 3.66Å
270	A	97.8	Very high	95.9	Very high	2 Å²	2	44.7 Å²	44.7	2%	0.017	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	145.6	179.2	0	0	0	0	0	112	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.9Å; L225-A270 CarbonylContact O-C 3.55Å; L225-A270 WeakPolarHBondContact O-CA 3.27Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.12Å; T252-A270 CarbonylContact C-O 3.56Å; T252-A270 WeakPolarHBondContact CA-O 3.47Å; E253-A270 HydrophobicContact CB-CB 4.4Å; E253-A270 PolarHBondContact N-O 3.07Å; E253-A270 PolarHBondContact O-N 3.45Å; W268-A270 HydrophobicContact CE3-CB 3.93Å; W268-A270 HydrophobicContact CZ3-CB 3.62Å
271	V	97.8	Very high	95.9	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.018	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142.1	176.5	63.3	0	0	0	0	109.1	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.48Å; L225-V271 HydrophobicContact CB-CG1 4.27Å; L225-V271 PolarHBondContact N-O 2.9Å; L225-V271 PolarHBondContact O-N 3.16Å; W241-V271 HydrophobicContact CB-CB 4.5Å; W241-V271 HydrophobicContact CB-CG1 4.35Å; W241-V271 HydrophobicContact CD2-CB 4.47Å; W241-V271 HydrophobicContact CD2-CG1 3.6Å; W241-V271 HydrophobicContact CE3-CG1 4.02Å; W241-V271 HydrophobicContact CG-CB 4.13Å; W241-V271 HydrophobicContact CG-CG1 3.75Å; W241-V271 HydrophobicContact CZ2-CG1 4.35Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.46Å; V271-Y281 HydrophobicContact CG1-CD1 4.03Å; V271-Y281 HydrophobicContact CG1-CE1 4.47Å; V271-Y281 HydrophobicContact CG2-CD1 4.39Å; V271-Y281 HydrophobicContact CG2-CE1 4.07Å
272	V	97.5	Very high	96.1	Very high	70 Å²	70	40.5 Å²	40.5	42%	0.424	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.7	171.7	-179.6	0	0	0	0	108.2	L218 E222 A223	L218-V272 HydrophobicContact CD1-CG1 4.2Å; L218-V272 HydrophobicContact CD1-CG2 4.22Å; E222-V272 HydrophobicContact CB-CG1 4.15Å; E222-V272 HydrophobicContact CG-CG1 4.37Å; A223-V272 WeakPolarHBondContact O-CA 3.43Å
273	V	96.7	Very high	96.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.3	-175.9	-52.5	0	0	0	0	110.5	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.14Å; A223-V273 PolarHBondContact N-O 3.46Å; A223-V273 PolarHBondContact O-N 3.36Å; L225-V273 HydrophobicContact CD1-CG1 4.01Å; L225-V273 HydrophobicContact CD1-CG2 4.09Å; L225-V273 HydrophobicContact CG-CG1 4.14Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.46Å; V273-E278 HydrophobicContact CG2-CG 3.94Å; V273-Y281 HydrophobicContact CB-CD2 4.01Å; V273-Y281 HydrophobicContact CB-CE2 3.73Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.58Å; V273-Y281 HydrophobicContact CG1-CE1 3.68Å; V273-Y281 HydrophobicContact CG1-CE2 3.58Å; V273-Y281 HydrophobicContact CG1-CG 3.64Å
274	P	96.4	Very high	96.6	Very high	42 Å²	42	35.1 Å²	35.1	27%	0.273	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	139.1	170.4	-19.5	32	0	0	0	111.3	H221 G276 Q277	H221-P274 CarbonylContact O-C 3.59Å; H221-P274 WeakPolarHBondContact O-CA 3.43Å; P274-G276 PolarHBondContact O-N 3.37Å; P274-Q277 HydrophobicContact CB-CB 4.42Å; P274-Q277 HydrophobicContact CB-CG 4.22Å; P274-Q277 WeakPolarHBondContact O-CB 3.36Å; P274-Q277 PolarHBondContact O-N 2.53Å
275	S	92.5	Very high	96.6	Very high	53 Å²	53	34.7 Å²	34.7	37%	0.371	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	130.6	175.4	-62	0	0	0	0	111.1	D220 H221 E222 Q277 E278	D220-S275 WeakPolarHBondContact O-CB 3.42Å; D220-S275 PolarHBondContact O-OG 2.86Å; H221-S275 PolarHBondContact O-N 3.39Å; H221-S275 PolarHBondContact O-OG 2.86Å; E222-S275 PolarHBondContact N-OG 2.78Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; S275-E278 WeakPolarHBondContact CA-OE1 3.12Å
276	G	91.2	Very high	96.5	Very high	68 Å²	68	38.4 Å²	38.4	70%	0.701	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	84	-1.1	-178.6	0	0	0	0	0	115	P274 E278	P274-G276 PolarHBondContact O-N 3.37Å; G276-E278 WeakPolarHBondContact CA-OE2 3.45Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.78Å; G276-E278 PolarHBondContact N-OE2 2.99Å
277	Q	94.9	Very high	96.3	Very high	57 Å²	57	36.5 Å²	36.5	27%	0.266	20%	0.199	S	C	.	.			trans	-106.5	6.6	174.5	-61	-169.1	42.6	0	0	113.2	P274 S275 Q279 R280 Y281	P274-Q277 HydrophobicContact CB-CB 4.42Å; P274-Q277 HydrophobicContact CB-CG 4.22Å; P274-Q277 WeakPolarHBondContact O-CB 3.36Å; P274-Q277 PolarHBondContact O-N 2.53Å; S275-Q277 VanDerWaalsContact C-N 3.32Å; Q277-Q279 PolarHBondContact O-N 3.07Å; Q277-Q279 VanDerWaalsContact O-N 3.15Å; Q277-R280 WeakPolarHBondContact O-CB 3.38Å; Q277-R280 PolarHBondContact O-N 3.28Å; Q277-Y281 HydrophobicContact CB-CE2 4.44Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.48Å
278	E	94.6	Very high	96	Very high	20 Å²	20	39.1 Å²	39.1	9%	0.093	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-57.1	-36	-173.1	-57.7	80	-176.4	0	0	112.3	H215 L225 V273 S275 G276 R280 Y281 W298	H215-E278 IonicContact NE2-OE1 3.55Å; L225-E278 HydrophobicContact CD1-CB 4.09Å; L225-E278 HydrophobicContact CD2-CB 4.47Å; L225-E278 HydrophobicContact CD2-CG 4.32Å; V273-E278 HydrophobicContact CG2-CG 3.94Å; S275-E278 WeakPolarHBondContact CA-OE1 3.12Å; G276-E278 WeakPolarHBondContact CA-OE2 3.45Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 2.78Å; G276-E278 PolarHBondContact N-OE2 2.99Å; E278-R280 PolarHBondContact O-N 2.77Å; E278-Y281 PolarHBondContact O-N 3.25Å; E278-Y281 VanDerWaalsContact O-N 3.11Å; E278-W298 HydrophobicContact CB-CD2 4.37Å; E278-W298 HydrophobicContact CB-CE3 3.39Å; E278-W298 HydrophobicContact CB-CZ3 3.82Å; E278-W298 HydrophobicContact CG-CE3 3.72Å; E278-W298 HydrophobicContact CG-CZ3 3.77Å
279	Q	94.2	Very high	95.8	Very high	107 Å²	107	39 Å²	39	50%	0.5	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-69.3	-15.2	180	-63	-57.3	-43.1	0	0	114.1	Q277 Y281 W298	Q277-Q279 PolarHBondContact O-N 3.07Å; Q277-Q279 VanDerWaalsContact O-N 3.15Å; Q279-Y281 VanDerWaalsContact C-N 3.25Å; Q279-W298 PolarHBondContact NE2-O 2.8Å
280	R	96.1	Very high	95.6	Very high	107 Å²	107	40 Å²	40	40%	0.404	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-79.7	-12.6	174	-63.9	175.3	67.3	-179.9	6	112.4	R243 D244 Q277 E278	R243-R280 WeakPolarHBondContact CA-O 3.47Å; R243-R280 HydrophobicContact CG-CB 4.48Å; D244-R280 PolarHBondContact N-O 2.83Å; D244-R280 IonicContact OD1-CZ 3.1Å; D244-R280 IonicContact OD1-NE 2.88Å; D244-R280 PolarHBondContact OD1-NE 3.49Å; D244-R280 VanDerWaalsContact OD1-NE 3.08Å; D244-R280 IonicContact OD1-NH2 3.95Å; D244-R280 IonicContact OD2-CZ 2.82Å; D244-R280 IonicContact OD2-NE 3.86Å; D244-R280 PolarHBondContact OD2-NE 3.14Å; D244-R280 IonicContact OD2-NH2 2.61Å; D244-R280 PolarHBondContact OD2-NH2 2.84Å; Q277-R280 WeakPolarHBondContact O-CB 3.38Å; Q277-R280 PolarHBondContact O-N 3.28Å; E278-R280 PolarHBondContact O-N 2.77Å
281	Y	97.3	Very high	95.3	Very high	7 Å²	7	49.3 Å²	49.3	3%	0.027	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.7	-177.8	-69.2	-100.1	0	0	0	110.6	Q242 R243 Q248 V271 V273 Q277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.58Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.46Å; R243-Y281 HydrophobicContact CB-CD1 4.11Å; R243-Y281 HydrophobicContact CB-CE1 3.92Å; R243-Y281 HydrophobicContact CG-CD1 4.45Å; R243-Y281 HydrophobicContact CG-CE1 4.09Å; R243-Y281 HydrophobicContact CG-CE2 4.15Å; Q248-Y281 HydrophobicContact CG-CE1 4.37Å; V271-Y281 HydrophobicContact CG1-CD1 4.03Å; V271-Y281 HydrophobicContact CG1-CE1 4.47Å; V271-Y281 HydrophobicContact CG2-CD1 4.39Å; V271-Y281 HydrophobicContact CG2-CE1 4.07Å; V273-Y281 HydrophobicContact CB-CD2 4.01Å; V273-Y281 HydrophobicContact CB-CE2 3.73Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.58Å; V273-Y281 HydrophobicContact CG1-CE1 3.68Å; V273-Y281 HydrophobicContact CG1-CE2 3.58Å; V273-Y281 HydrophobicContact CG1-CG 3.64Å; Q277-Y281 HydrophobicContact CB-CE2 4.44Å; Q277-Y281 WeakPolarHBondContact O-CD2 3.48Å; E278-Y281 PolarHBondContact O-N 3.25Å; E278-Y281 VanDerWaalsContact O-N 3.11Å; Q279-Y281 VanDerWaalsContact C-N 3.25Å
282	T	97.7	Very high	95	Very high	32 Å²	32	56.5 Å²	56.5	20%	0.196	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.6	177.1	50.9	0	0	0	0	110.3	W241 Q242 H284 T295 L296	W241-T282 VanDerWaalsContact CE3-C 3.42Å; Q242-T282 PolarHBondContact N-O 2.82Å; Q242-T282 PolarHBondContact O-N 2.89Å; T282-H284 PolarHBondContact OG1-NE2 3.4Å; T282-T295 HydrophobicContact CG2-CG2 4.03Å; T282-L296 CarbonylContact C-O 3.59Å; T282-L296 WeakPolarHBondContact CA-O 3.42Å
283	C	97.8	Very high	94.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	120.6	171.9	175	0	0	0	0	109.1	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.33Å; C227-C283 WeakPolarHBondContact SG-CB 3.23Å; C227-C283 CovalentContact SG-SG 2.04Å; C227-C283 PolarHBondContact SG-SG 3.38Å; T240-C283 CarbonylContact O-C 3.55Å; T240-C283 WeakPolarHBondContact O-CA 3.5Å; W241-C283 HydrophobicContact CD2-CB 4.17Å; W241-C283 HydrophobicContact CE3-CB 4.08Å; W241-C283 HydrophobicContact CH2-CB 4.02Å; W241-C283 HydrophobicContact CZ2-CB 4.11Å; W241-C283 HydrophobicContact CZ3-CB 3.99Å; C283-T295 CarbonylContact O-C 3.56Å; C283-T295 WeakPolarHBondContact O-CA 3.48Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.26Å; C283-L296 PolarHBondContact O-N 3.04Å
284	H	97.2	Very high	94.8	Very high	41 Å²	41	58.9 Å²	58.9	19%	0.19	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.3	176.3	-67.9	-101.5	0	0	0	109.9	T240 Q242 T282 L294 T295	T240-H284 PolarHBondContact N-O 2.84Å; T240-H284 PolarHBondContact O-N 3.27Å; T240-H284 WeakPolarHBondContact OG1-CB 3.3Å; T240-H284 PolarHBondContact OG1-O 2.81Å; Q242-H284 PolarHBondContact OE1-CE1 2.83Å; Q242-H284 PolarHBondContact OE1-NE2 3.19Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.08Å; T282-H284 PolarHBondContact OG1-NE2 3.4Å; H284-L294 CarbonylContact C-O 3.57Å; H284-L294 WeakPolarHBondContact CA-O 3.15Å; H284-T295 PolarHBondContact CE1-OG1 3.02Å; H284-T295 PolarHBondContact ND1-OG1 3.05Å
285	M	96.6	Very high	94.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131.6	-174.3	-172.1	177.3	-57.1	0	0	111.7	P209 T211 A229 I237 T238 L239 L290 P293 L294 L296	P209-M285 HydrophobicContact CB-SD 3.9Å; P209-M285 HydrophobicContact CG-SD 3.4Å; P209-M285 WeakPolarHBondContact CG-SD 3.37Å; T211-M285 HydrophobicContact CG2-CE 3.49Å; T211-M285 VanDerWaalsContact CG2-CE 3.49Å; T211-M285 HydrophobicContact CG2-SD 3.39Å; T211-M285 WeakPolarHBondContact CG2-SD 3.41Å; A229-M285 HydrophobicContact CB-CE 3.69Å; A229-M285 HydrophobicContact CB-SD 3.9Å; I237-M285 HydrophobicContact CD1-CG 4.14Å; I237-M285 HydrophobicContact CD1-SD 4.02Å; I237-M285 HydrophobicContact CG1-CG 4.37Å; T238-M285 VanDerWaalsContact O-CA 3.31Å; T238-M285 WeakPolarHBondContact O-CA 3.45Å; L239-M285 HydrophobicContact CD1-CE 4.08Å; L239-M285 HydrophobicContact CD1-CG 4Å; L239-M285 HydrophobicContact CD1-SD 4.38Å; L239-M285 HydrophobicContact CD2-CE 4.1Å; L239-M285 HydrophobicContact CG-CE 3.96Å; L239-M285 HydrophobicContact CG-CG 4.42Å; M285-L290 HydrophobicContact CG-CD1 4.39Å; M285-P293 CarbonylContact O-C 3.5Å; M285-P293 WeakPolarHBondContact O-CA 3.5Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.72Å; M285-L294 PolarHBondContact O-N 3.33Å; M285-L296 HydrophobicContact CE-CD1 4.29Å
286	Q	96.6	Very high	95	Very high	104 Å²	104	60 Å²	60	49%	0.486	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132.7	175.7	-57.8	179.3	11.3	0	0	109.5	I237 T238 P293	I237-Q286 WeakPolarHBondContact CG1-O 3.49Å; T238-Q286 PolarHBondContact N-O 2.88Å; T238-Q286 PolarHBondContact O-N 3.43Å; Q286-P293 HydrophobicContact CG-CB 4.04Å; Q286-P293 HydrophobicContact CG-CG 4.17Å
287	H	95.4	Very high	95.2	Very high	5 Å²	5	59.5 Å²	59.5	2%	0.023	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	140.2	-176.4	-177.1	-99.7	0	0	0	112.3	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 VanDerWaalsContact CH2-C 3.45Å; W23-H287 WeakPolarHBondContact CH2-O 3.36Å; W23-H287 WeakPolarHBondContact CZ3-O 3.46Å; E207-H287 PolarHBondContact O-CE1 2.87Å; P209-H287 HydrophobicContact CG-CB 4.3Å; F232-H287 AromaticContact CD2-CD2 3.8Å; F232-H287 AromaticContact CD2-NE2 3.62Å; Y233-H287 PolarHBondContact O-CE1 3Å; P234-H287 PolarHBondContact O-NE2 3.26Å; E236-H287 PolarHBondContact O-CD2 2.89Å; I237-H287 HydrophobicContact CD1-CB 4.17Å; I237-H287 HydrophobicContact CG1-CB 3.96Å; H287-G289 PolarHBondContact CE1-N 2.95Å; H287-G289 PolarHBondContact ND1-N 2.64Å; H287-G289 PolarHBondContact O-N 2.72Å; H287-L290 HydrophobicContact CB-CD1 3.91Å; H287-L290 HydrophobicContact CB-CG 4.12Å; H287-L290 WeakPolarHBondContact O-CB 3.28Å; H287-L290 PolarHBondContact O-N 3.35Å
288	E	92.4	Very high	95.1	Very high	77 Å²	77	59 Å²	59	36%	0.36	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-15.2	-52.8	161.7	173.8	-122.7	-165.6	0	0	118.5	W23 C25 A206 P234	W23-E288 HydrophobicContact CE3-CB 3.5Å; W23-E288 VanDerWaalsContact CE3-CB 3.5Å; W23-E288 HydrophobicContact CE3-CG 3.97Å; W23-E288 HydrophobicContact CH2-CB 4.38Å; W23-E288 VanDerWaalsContact CZ3-CA 3.47Å; W23-E288 HydrophobicContact CZ3-CB 3.44Å; W23-E288 VanDerWaalsContact CZ3-CB 3.44Å; W23-E288 HydrophobicContact CZ3-CG 4.22Å; W23-E288 WeakPolarHBondContact CZ3-O 3.07Å; C25-E288 PolarHBondContact SG-OE1 2.87Å; A206-E288 HydrophobicContact CB-CG 4.13Å; P234-E288 WeakPolarHBondContact CG-OE2 3.41Å
289	G	92.7	Very high	94.8	Very high	23 Å²	23	66.1 Å²	66.1	24%	0.237	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-7.7	-172.1	0	0	0	0	0	114.3	H287	H287-G289 PolarHBondContact CE1-N 2.95Å; H287-G289 PolarHBondContact ND1-N 2.64Å; H287-G289 PolarHBondContact O-N 2.72Å
290	L	94.4	Very high	94.1	Very high	20 Å²	20	64.4 Å²	64.4	11%	0.105	33%	0.329	C	S	.	.			trans	-94	130.2	-175.4	-63.6	173.8	0	0	0	111	W23 P208 P209 M285 H287 E292 L294	W23-L290 WeakPolarHBondContact CH2-O 3.32Å; W23-L290 VanDerWaalsContact CZ3-O 3.31Å; W23-L290 WeakPolarHBondContact CZ3-O 3.34Å; P208-L290 HydrophobicContact CB-CD2 3.89Å; P209-L290 HydrophobicContact CG-CD1 4.14Å; P209-L290 HydrophobicContact CG-CD2 4.44Å; P209-L290 HydrophobicContact CG-CG 4.39Å; M285-L290 HydrophobicContact CG-CD1 4.39Å; H287-L290 HydrophobicContact CB-CD1 3.91Å; H287-L290 HydrophobicContact CB-CG 4.12Å; H287-L290 WeakPolarHBondContact O-CB 3.28Å; H287-L290 PolarHBondContact O-N 3.35Å; L290-E292 VanDerWaalsContact C-N 3.3Å; L290-E292 PolarHBondContact O-N 3.23Å; L290-L294 HydrophobicContact CD1-CB 4.47Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 3.89Å; L290-L294 HydrophobicContact CD2-CD1 3.55Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.39Å; L290-L294 HydrophobicContact CG-CG 4.5Å
291	Q	91.4	Very high	92.6	Very high	198 Å²	198	64 Å²	64	93%	0.925	34%	0.343	S	S	*	.	S	Bend	trans	-65.6	-36.3	174.7	-67.1	-177.8	-3.3	0	0	112.2
292	E	92.6	Very high	90.3	Very high	155 Å²	155	69 Å²	69	72%	0.724	38%	0.379	S	S	*	.	S	Bend	trans	-139.8	151.3	176.6	-65.9	-176.9	178.7	0	0	109.2	L290 L294	L290-E292 VanDerWaalsContact C-N 3.3Å; L290-E292 PolarHBondContact O-N 3.23Å; E292-L294 PolarHBondContact O-N 2.91Å
293	P	94.4	Very high	87.7	Confident	63 Å²	63	75.1 Å²	75.1	41%	0.409	41%	0.405	S	S	.	.			trans	-52.9	134.5	173	-26.9	35.7	0	0	0	112.1	M285 Q286	M285-P293 CarbonylContact O-C 3.5Å; M285-P293 WeakPolarHBondContact O-CA 3.5Å; Q286-P293 HydrophobicContact CG-CB 4.04Å; Q286-P293 HydrophobicContact CG-CG 4.17Å
294	L	95.3	Very high	85.2	Confident	58 Å²	58	79.8 Å²	79.8	30%	0.304	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.6	177.4	-68.2	177.2	0	0	0	110.7	T211 H284 M285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.22Å; H284-L294 CarbonylContact C-O 3.57Å; H284-L294 WeakPolarHBondContact CA-O 3.15Å; M285-L294 HydrophobicContact CB-CB 4.35Å; M285-L294 PolarHBondContact N-O 2.72Å; M285-L294 PolarHBondContact O-N 3.33Å; L290-L294 HydrophobicContact CD1-CB 4.47Å; L290-L294 HydrophobicContact CD1-CD1 3.91Å; L290-L294 HydrophobicContact CD1-CG 3.89Å; L290-L294 HydrophobicContact CD2-CD1 3.55Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.39Å; L290-L294 HydrophobicContact CG-CG 4.5Å; E292-L294 PolarHBondContact O-N 2.91Å
295	T	96.7	Very high	82.9	Confident	82 Å²	82	84.2 Å²	84.2	50%	0.503	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.5	170.6	-56.2	0	0	0	0	108.5	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 4.03Å; C283-T295 CarbonylContact O-C 3.56Å; C283-T295 WeakPolarHBondContact O-CA 3.48Å; H284-T295 PolarHBondContact CE1-OG1 3.02Å; H284-T295 PolarHBondContact ND1-OG1 3.05Å
296	L	96	Very high	80.9	Confident	35 Å²	35	88.8 Å²	88.8	18%	0.183	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.2	-174	-59.5	162.3	0	0	0	109.9	T211 V213 T282 C283 M285	T211-L296 VanDerWaalsContact CB-CD1 3.48Å; T211-L296 HydrophobicContact CG2-CD1 4.07Å; V213-L296 HydrophobicContact CG2-CB 3.9Å; T282-L296 CarbonylContact C-O 3.59Å; T282-L296 WeakPolarHBondContact CA-O 3.42Å; C283-L296 HydrophobicContact CB-CB 4.3Å; C283-L296 PolarHBondContact N-O 3.26Å; C283-L296 PolarHBondContact O-N 3.04Å; M285-L296 HydrophobicContact CE-CD1 4.29Å
297	S	94.1	Very high	79	Confident	59 Å²	59	87.9 Å²	87.9	41%	0.413	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	161.8	166.9	56	0	0	0	0	110.1	E299	S297-E299 PolarHBondContact O-N 3.3Å
298	W	94.6	Very high	77.4	Confident	47 Å²	47	93.3 Å²	93.3	18%	0.178	52%	0.52	C	S	.	.			trans	-71.6	125.5	169.8	169.8	61.1	0	0	0	109.9	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.5Å; V213-W298 HydrophobicContact CG1-CB 3.83Å; H215-W298 HydrophobicContact CB-CD2 4.14Å; H215-W298 HydrophobicContact CB-CG 4.19Å; H215-W298 HydrophobicContact CB-CZ2 4Å; H215-W298 VanDerWaalsContact CB-NE1 3.25Å; H215-W298 AromaticContact CG-CE2 3.81Å; H215-W298 AromaticContact CG-CZ2 3.82Å; L225-W298 HydrophobicContact CD1-CB 4.3Å; L225-W298 HydrophobicContact CD2-CB 3.78Å; L225-W298 HydrophobicContact CD2-CD2 4.36Å; L225-W298 HydrophobicContact CD2-CG 3.9Å; E278-W298 HydrophobicContact CB-CD2 4.37Å; E278-W298 HydrophobicContact CB-CE3 3.39Å; E278-W298 HydrophobicContact CB-CZ3 3.82Å; E278-W298 HydrophobicContact CG-CE3 3.72Å; E278-W298 HydrophobicContact CG-CZ3 3.77Å; Q279-W298 PolarHBondContact NE2-O 2.8Å; W298-P300 HydrophobicContact CE3-CG 4.39Å; W298-P300 HydrophobicContact CH2-CB 4.22Å; W298-P300 HydrophobicContact CH2-CG 3.92Å; W298-P300 HydrophobicContact CZ2-CB 4.13Å; W298-P300 HydrophobicContact CZ2-CG 4.17Å; W298-P300 HydrophobicContact CZ3-CG 4.02Å
299	E	87.4	Confident	75.6	Confident	168 Å²	168	97.5 Å²	97.5	79%	0.785	54%	0.542	S	S	*	.			trans	-106.2	120.7	174.3	-157.1	159.9	-158.8	0	0	109.3	S297 S301	S297-E299 PolarHBondContact O-N 3.3Å; E299-S301 PolarHBondContact O-N 2.89Å
300	P	79.9	Confident	74.3	Confident	71 Å²	71	98.6 Å²	98.6	46%	0.461	55%	0.553	S	S	.	*			trans	-58.8	125.9	175.3	-20.2	30.4	0	0	0	109.1	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.39Å; W298-P300 HydrophobicContact CH2-CB 4.22Å; W298-P300 HydrophobicContact CH2-CG 3.92Å; W298-P300 HydrophobicContact CZ2-CB 4.13Å; W298-P300 HydrophobicContact CZ2-CG 4.17Å; W298-P300 HydrophobicContact CZ3-CG 4.02Å; P300-S302 PolarHBondContact O-N 3.29Å
301	S	63.7	Low	73.3	Confident	99 Å²	99	102.2 Å²	102.2	69%	0.692	57%	0.571	S	S	*	*			trans	-50	103.2	176.2	141.6	0	0	0	0	110	E299 Q303	E299-S301 PolarHBondContact O-N 2.89Å; S301-Q303 PolarHBondContact O-N 2.71Å
302	S	48.8	Very low	72.5	Confident	112 Å²	112	97.1 Å²	97.1	78%	0.783	55%	0.553	S	S	*	*			trans	-77.7	70.6	164.8	63.3	0	0	0	0	107.8	P300 P304	P300-S302 PolarHBondContact O-N 3.29Å; S302-P304 WeakPolarHBondContact O-CD 3.29Å
303	Q	43.8	Very low	71.7	Confident	161 Å²	161	92.3 Å²	92.3	75%	0.752	54%	0.54	S	S	*	.			trans	-72.6	105.5	151	-83.3	-169.8	-17.2	0	0	104.9	S301 T305	S301-Q303 PolarHBondContact O-N 2.71Å; Q303-T305 PolarHBondContact O-N 3.48Å
304	P	44.5	Very low	71	Confident	98 Å²	98	91 Å²	91	64%	0.636	54%	0.538	S	S	*	.			trans	-59.5	114.1	162.9	27.2	-31.4	0	0	0	104.6	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.29Å; P304-I306 HydrophobicContact CB-CG1 3.92Å; P304-I306 HydrophobicContact CG-CD1 4.4Å; P304-I306 HydrophobicContact CG-CG1 4.05Å; P304-I306 PolarHBondContact O-N 3.42Å
305	T	49.5	Very low	70.5	Confident	133 Å²	133	93 Å²	93	82%	0.816	55%	0.548	S	S	*	.			trans	-65.9	74.6	156.4	-41.3	0	0	0	0	105	Q303 P307	Q303-T305 PolarHBondContact O-N 3.48Å; T305-P307 VanDerWaalsContact O-CD 3.25Å; T305-P307 WeakPolarHBondContact O-CD 3.12Å
306	I	55.2	Low	69.8	Low	97 Å²	97	91.7 Å²	91.7	50%	0.497	55%	0.546	S	S	.	.			trans	-54.7	118.8	165.6	-60.8	178.3	0	0	0	102.5	P304 I308 I311	P304-I306 HydrophobicContact CB-CG1 3.92Å; P304-I306 HydrophobicContact CG-CD1 4.4Å; P304-I306 HydrophobicContact CG-CG1 4.05Å; P304-I306 PolarHBondContact O-N 3.42Å; I306-I308 HydrophobicContact CB-CG1 4.28Å; I306-I308 HydrophobicContact CG2-CG1 4.05Å; I306-I308 PolarHBondContact O-N 3.1Å; I306-I311 HydrophobicContact CG2-CD1 4.24Å
307	P	56	Low	69.3	Low	84 Å²	84	94.1 Å²	94.1	55%	0.545	56%	0.562	S	S	.	*			trans	-74.6	73.5	-178.9	31.4	-32.8	0	0	0	106.7	T305 M309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.25Å; T305-P307 WeakPolarHBondContact O-CD 3.12Å; P307-M309 PolarHBondContact O-N 3.25Å; P307-M309 VanDerWaalsContact O-N 3.15Å; P307-G310 WeakPolarHBondContact O-CA 3.34Å; P307-G310 PolarHBondContact O-N 3.32Å; P307-I311 PolarHBondContact O-N 3.1Å; P307-I311 VanDerWaalsContact O-N 3.11Å
308	I	61.1	Low	68.8	Low	119 Å²	119	96.7 Å²	96.7	61%	0.61	57%	0.571	S	S	*	*	H	α-helix	trans	-54.2	-35	176.2	-66.2	168.1	0	0	0	108.2	I306 G310 I311 V312	I306-I308 HydrophobicContact CB-CG1 4.28Å; I306-I308 HydrophobicContact CG2-CG1 4.05Å; I306-I308 PolarHBondContact O-N 3.1Å; I308-G310 PolarHBondContact O-N 2.9Å; I308-I311 PolarHBondContact O-N 3.24Å; I308-V312 HydrophobicContact CG2-CG2 4.36Å; I308-V312 WeakPolarHBondContact O-CB 3.32Å; I308-V312 WeakPolarHBondContact O-CG2 3.37Å; I308-V312 PolarHBondContact O-N 3.22Å
309	M	55.5	Low	68.3	Low	166 Å²	166	98.9 Å²	98.9	82%	0.818	59%	0.589	S	S	*	*	H	α-helix	trans	-64.3	-35.9	173.7	-164.1	131.4	63.6	0	0	113.7	P307 A313	P307-M309 PolarHBondContact O-N 3.25Å; P307-M309 VanDerWaalsContact O-N 3.15Å; M309-A313 VanDerWaalsContact O-CB 3.24Å; M309-A313 WeakPolarHBondContact O-CB 3.31Å; M309-A313 PolarHBondContact O-N 3.47Å
310	G	65.8	Low	68.2	Low	45 Å²	45	94.9 Å²	94.9	46%	0.464	58%	0.576	S	S	.	*	H	α-helix	trans	-71.5	-37.7	176.7	0	0	0	0	0	112.8	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.34Å; P307-G310 PolarHBondContact O-N 3.32Å; I308-G310 PolarHBondContact O-N 2.9Å; G310-G314 PolarHBondContact O-N 3.2Å
311	I	73.9	Confident	68.4	Low	96 Å²	96	96.5 Å²	96.5	49%	0.492	58%	0.58	S	S	.	*	H	α-helix	trans	-69.7	-43	176.2	-61.7	172.8	0	0	0	110.5	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 4.24Å; P307-I311 PolarHBondContact O-N 3.1Å; P307-I311 VanDerWaalsContact O-N 3.11Å; I308-I311 PolarHBondContact O-N 3.24Å; I311-G314 PolarHBondContact O-N 3.4Å; I311-L315 HydrophobicContact CG2-CD1 3.97Å; I311-L315 WeakPolarHBondContact O-CB 3.38Å; I311-L315 WeakPolarHBondContact O-CG 3.39Å; I311-L315 PolarHBondContact O-N 3.29Å
312	V	74.5	Confident	69.3	Low	91 Å²	91	94.9 Å²	94.9	55%	0.552	57%	0.572	S	S	*	*	H	α-helix	trans	-65.6	-43	177.2	172.8	0	0	0	0	111.3	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.36Å; I308-V312 WeakPolarHBondContact O-CB 3.32Å; I308-V312 WeakPolarHBondContact O-CG2 3.37Å; I308-V312 PolarHBondContact O-N 3.22Å; V312-L315 PolarHBondContact O-N 3Å; V312-A316 WeakPolarHBondContact O-CB 3.4Å; V312-A316 PolarHBondContact O-N 2.95Å
313	A	75.1	Confident	70.9	Confident	54 Å²	54	93.6 Å²	93.6	45%	0.446	56%	0.56	S	S	.	*	H	α-helix	trans	-63.1	-43.1	174.7	0	0	0	0	0	111.8	M309 A316 V317	M309-A313 VanDerWaalsContact O-CB 3.24Å; M309-A313 WeakPolarHBondContact O-CB 3.31Å; M309-A313 PolarHBondContact O-N 3.47Å; A313-A316 PolarHBondContact O-N 3.35Å; A313-V317 WeakPolarHBondContact O-CG2 3.46Å; A313-V317 PolarHBondContact O-N 2.83Å
314	G	80.4	Confident	72.7	Confident	35 Å²	35	90.8 Å²	90.8	36%	0.361	55%	0.549	S	S	.	.	H	α-helix	trans	-62	-43.8	176.6	0	0	0	0	0	113.1	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 3.2Å; I311-G314 PolarHBondContact O-N 3.4Å; G314-V317 PolarHBondContact O-N 3.06Å; G314-L318 PolarHBondContact O-N 3.42Å
315	L	83.9	Confident	74.4	Confident	101 Å²	101	87.7 Å²	87.7	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-65.6	-41.4	176.3	-79	166.6	0	0	0	112.2	I311 V312 V317 L318 V319	I311-L315 HydrophobicContact CG2-CD1 3.97Å; I311-L315 WeakPolarHBondContact O-CB 3.38Å; I311-L315 WeakPolarHBondContact O-CG 3.39Å; I311-L315 PolarHBondContact O-N 3.29Å; V312-L315 PolarHBondContact O-N 3Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 2.92Å; L315-L318 PolarHBondContact O-N 3.23Å; L315-V319 WeakPolarHBondContact O-CG2 3.42Å; L315-V319 PolarHBondContact O-N 3.1Å
316	A	82.1	Confident	75.8	Confident	54 Å²	54	84.2 Å²	84.2	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-61.4	-43	176.8	0	0	0	0	0	111.7	V312 A313 V319 V320	V312-A316 WeakPolarHBondContact O-CB 3.4Å; V312-A316 PolarHBondContact O-N 2.95Å; A313-A316 PolarHBondContact O-N 3.35Å; A316-V319 PolarHBondContact O-N 2.87Å; A316-V320 VanDerWaalsContact O-CG2 3.3Å; A316-V320 WeakPolarHBondContact O-CG2 3.21Å; A316-V320 PolarHBondContact O-N 2.6Å
317	V	85	Confident	76.9	Confident	86 Å²	86	83.2 Å²	83.2	52%	0.521	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-42.8	176.4	172.8	0	0	0	0	111.3	A313 G314 L315 V319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.46Å; A313-V317 PolarHBondContact O-N 2.83Å; G314-V317 PolarHBondContact O-N 3.06Å; L315-V317 VanDerWaalsContact C-N 3.34Å; L315-V317 PolarHBondContact O-N 2.92Å; V317-V319 PolarHBondContact O-N 3.2Å; V317-V320 PolarHBondContact O-N 3.46Å; V317-L321 HydrophobicContact CG1-CD1 3.95Å; V317-L321 HydrophobicContact CG1-CG 4.37Å; V317-L321 WeakPolarHBondContact O-CB 3.24Å; V317-L321 WeakPolarHBondContact O-CG 3.36Å; V317-L321 PolarHBondContact O-N 2.88Å
318	L	84.4	Confident	77.9	Confident	114 Å²	114	83 Å²	83	60%	0.597	52%	0.516	S	S	*	.	H	α-helix	trans	-61.1	-42.4	176.4	-88.3	162.8	0	0	0	112.5	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.42Å; L315-L318 PolarHBondContact O-N 3.23Å; L318-L321 PolarHBondContact O-N 3.14Å; L318-A322 WeakPolarHBondContact O-CB 3.03Å; L318-A322 PolarHBondContact O-N 3.05Å
319	V	84.1	Confident	78.5	Confident	92 Å²	92	81.3 Å²	81.3	56%	0.558	51%	0.511	S	S	*	.	H	α-helix	trans	-64.3	-44.2	176.4	172.4	0	0	0	0	110.8	L315 A316 V317 L321 A322 V323	L315-V319 WeakPolarHBondContact O-CG2 3.42Å; L315-V319 PolarHBondContact O-N 3.1Å; A316-V319 PolarHBondContact O-N 2.87Å; V317-V319 PolarHBondContact O-N 3.2Å; V319-L321 PolarHBondContact O-N 3.26Å; V319-A322 PolarHBondContact O-N 3.06Å; V319-V323 HydrophobicContact CG1-CG2 4.5Å; V319-V323 WeakPolarHBondContact O-CG2 3.49Å; V319-V323 PolarHBondContact O-N 2.66Å
320	V	84.3	Confident	79.3	Confident	84 Å²	84	76 Å²	76	51%	0.509	49%	0.493	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 3.3Å; A316-V320 WeakPolarHBondContact O-CG2 3.21Å; A316-V320 PolarHBondContact O-N 2.6Å; V317-V320 PolarHBondContact O-N 3.46Å; V320-A322 PolarHBondContact O-N 3.21Å; V320-V323 PolarHBondContact O-N 2.74Å; V320-L324 HydrophobicContact CG1-CD1 3.92Å; V320-L324 HydrophobicContact CG1-CG 4.42Å; V320-L324 WeakPolarHBondContact O-CB 3.48Å; V320-L324 VanDerWaalsContact O-CG 3.31Å; V320-L324 WeakPolarHBondContact O-CG 3.33Å; V320-L324 PolarHBondContact O-N 3.41Å
321	L	84.4	Confident	79.5	Confident	105 Å²	105	79.9 Å²	79.9	55%	0.55	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-39.5	176.9	-72.6	172.6	0	0	0	112.3	V317 L318 V319 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.95Å; V317-L321 HydrophobicContact CG1-CG 4.37Å; V317-L321 WeakPolarHBondContact O-CB 3.24Å; V317-L321 WeakPolarHBondContact O-CG 3.36Å; V317-L321 PolarHBondContact O-N 2.88Å; L318-L321 PolarHBondContact O-N 3.14Å; V319-L321 PolarHBondContact O-N 3.26Å; L321-L324 PolarHBondContact O-N 2.7Å; L321-G325 PolarHBondContact O-N 3.44Å
322	A	82.6	Confident	79.3	Confident	65 Å²	65	81.7 Å²	81.7	54%	0.537	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-41.8	176.3	0	0	0	0	0	112	L318 V319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.03Å; L318-A322 PolarHBondContact O-N 3.05Å; V319-A322 PolarHBondContact O-N 3.06Å; V320-A322 PolarHBondContact O-N 3.21Å; A322-G325 PolarHBondContact O-N 2.75Å; A322-A326 WeakPolarHBondContact O-CB 3.4Å; A322-A326 PolarHBondContact O-N 3.05Å
323	V	82.8	Confident	78.6	Confident	86 Å²	86	81.1 Å²	81.1	52%	0.521	51%	0.508	S	S	.	.	H	α-helix	trans	-65.4	-45.4	176.2	173.1	0	0	0	0	110.8	V319 V320 G325 A326 V327	V319-V323 HydrophobicContact CG1-CG2 4.5Å; V319-V323 WeakPolarHBondContact O-CG2 3.49Å; V319-V323 PolarHBondContact O-N 2.66Å; V320-V323 PolarHBondContact O-N 2.74Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 3.36Å; V323-A326 PolarHBondContact O-N 3.03Å; V323-V327 HydrophobicContact CG1-CG2 4.47Å; V323-V327 VanDerWaalsContact O-CG2 3.29Å; V323-V327 WeakPolarHBondContact O-CG2 3.4Å; V323-V327 PolarHBondContact O-N 3.44Å
324	L	81.8	Confident	77.9	Confident	101 Å²	101	88.3 Å²	88.3	53%	0.529	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-42.5	176	-71.5	172.1	0	0	0	111.5	V320 L321 V327 V328	V320-L324 HydrophobicContact CG1-CD1 3.92Å; V320-L324 HydrophobicContact CG1-CG 4.42Å; V320-L324 WeakPolarHBondContact O-CB 3.48Å; V320-L324 VanDerWaalsContact O-CG 3.31Å; V320-L324 WeakPolarHBondContact O-CG 3.33Å; V320-L324 PolarHBondContact O-N 3.41Å; L321-L324 PolarHBondContact O-N 2.7Å; L324-V327 PolarHBondContact O-N 3.04Å; L324-V328 VanDerWaalsContact O-CG2 3.31Å; L324-V328 WeakPolarHBondContact O-CG2 3.33Å; L324-V328 PolarHBondContact O-N 3.32Å
325	G	79.9	Confident	76.7	Confident	34 Å²	34	97 Å²	97	35%	0.351	55%	0.545	S	S	.	.	H	α-helix	trans	-57.2	-49.8	173.5	0	0	0	0	0	111.9	L321 A322 V323 V327 V328 T329	L321-G325 PolarHBondContact O-N 3.44Å; A322-G325 PolarHBondContact O-N 2.75Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 3.36Å; G325-V327 PolarHBondContact O-N 2.73Å; G325-V328 PolarHBondContact O-N 3.2Å; G325-T329 PolarHBondContact O-N 3.33Å; G325-T329 PolarHBondContact O-OG1 3.07Å
326	A	78.3	Confident	75.1	Confident	60 Å²	60	100.9 Å²	100.9	50%	0.496	56%	0.558	S	S	.	*	H	α-helix	trans	-61.7	-39.7	178	0	0	0	0	0	112.8	A322 V323 T329 A330	A322-A326 WeakPolarHBondContact O-CB 3.4Å; A322-A326 PolarHBondContact O-N 3.05Å; V323-A326 PolarHBondContact O-N 3.03Å; A326-T329 PolarHBondContact O-N 2.91Å; A326-A330 VanDerWaalsContact O-CB 3.27Å; A326-A330 WeakPolarHBondContact O-CB 3.36Å; A326-A330 PolarHBondContact O-N 3.2Å
327	V	79.1	Confident	73.6	Confident	76 Å²	76	102.8 Å²	102.8	46%	0.461	57%	0.568	S	S	.	*	H	α-helix	trans	-65.6	-43.4	176.1	171.2	0	0	0	0	111	V323 L324 G325 A330 M331	V323-V327 HydrophobicContact CG1-CG2 4.47Å; V323-V327 VanDerWaalsContact O-CG2 3.29Å; V323-V327 WeakPolarHBondContact O-CG2 3.4Å; V323-V327 PolarHBondContact O-N 3.44Å; L324-V327 PolarHBondContact O-N 3.04Å; G325-V327 PolarHBondContact O-N 2.73Å; V327-A330 PolarHBondContact O-N 3.22Å; V327-M331 HydrophobicContact CG1-CG 4.4Å; V327-M331 WeakPolarHBondContact O-CB 3.33Å; V327-M331 VanDerWaalsContact O-CG 3.27Å; V327-M331 WeakPolarHBondContact O-CG 3.35Å; V327-M331 PolarHBondContact O-N 3.39Å
328	V	77.8	Confident	71.9	Confident	80 Å²	80	103.8 Å²	103.8	49%	0.485	58%	0.579	S	S	.	*	H	α-helix	trans	-63.6	-45.3	176.2	172.2	0	0	0	0	110.6	L324 G325 A330 M331 M332	L324-V328 VanDerWaalsContact O-CG2 3.31Å; L324-V328 WeakPolarHBondContact O-CG2 3.33Å; L324-V328 PolarHBondContact O-N 3.32Å; G325-V328 PolarHBondContact O-N 3.2Å; V328-A330 PolarHBondContact O-N 3.01Å; V328-M331 PolarHBondContact O-N 3.19Å; V328-M332 HydrophobicContact CG1-CG 4.44Å; V328-M332 HydrophobicContact CG1-SD 4.15Å; V328-M332 WeakPolarHBondContact O-CB 3.24Å; V328-M332 WeakPolarHBondContact O-CG 3.4Å; V328-M332 PolarHBondContact O-N 3.19Å
329	T	72.4	Confident	70	Confident	83 Å²	83	101.5 Å²	101.5	51%	0.509	58%	0.583	S	S	.	*	H	α-helix	trans	-61.2	-44.3	175.7	-51.7	0	0	0	0	111.5	G325 A326 M331 M332 C333	G325-T329 PolarHBondContact O-N 3.33Å; G325-T329 PolarHBondContact O-OG1 3.07Å; A326-T329 PolarHBondContact O-N 2.91Å; T329-M331 PolarHBondContact O-N 3.47Å; T329-M332 PolarHBondContact O-N 2.99Å; T329-C333 WeakPolarHBondContact O-CB 3.16Å; T329-C333 PolarHBondContact O-N 3.41Å; T329-C333 PolarHBondContact O-SG 2.86Å; T329-C333 VanDerWaalsContact O-SG 3.34Å
330	A	72.1	Confident	67.8	Low	53 Å²	53	101 Å²	101	44%	0.438	60%	0.597	S	S	.	*	H	α-helix	trans	-64.6	-38.7	176.8	0	0	0	0	0	112.5	A326 V327 V328 C333 R334	A326-A330 VanDerWaalsContact O-CB 3.27Å; A326-A330 WeakPolarHBondContact O-CB 3.36Å; A326-A330 PolarHBondContact O-N 3.2Å; V327-A330 PolarHBondContact O-N 3.22Å; V328-A330 PolarHBondContact O-N 3.01Å; A330-C333 PolarHBondContact O-N 2.92Å; A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 2.93Å
331	M	70	Confident	65.5	Low	128 Å²	128	107.6 Å²	107.6	63%	0.631	62%	0.619	S	S	*	*	H	α-helix	trans	-68.2	-39.4	175.1	-74.4	-129.7	-69.7	0	0	112	V327 V328 T329 R334 R335	V327-M331 HydrophobicContact CG1-CG 4.4Å; V327-M331 WeakPolarHBondContact O-CB 3.33Å; V327-M331 VanDerWaalsContact O-CG 3.27Å; V327-M331 WeakPolarHBondContact O-CG 3.35Å; V327-M331 PolarHBondContact O-N 3.39Å; V328-M331 PolarHBondContact O-N 3.19Å; T329-M331 PolarHBondContact O-N 3.47Å; M331-R334 PolarHBondContact O-N 3.1Å; M331-R335 WeakPolarHBondContact O-CB 3.23Å; M331-R335 PolarHBondContact O-N 3.3Å
332	M	70.8	Confident	63.1	Low	133 Å²	133	106.4 Å²	106.4	66%	0.655	63%	0.631	S	S	*	*	H	α-helix	trans	-67.3	-39.1	174.1	-70.8	-175.7	78.7	0	0	111.9	V328 T329 R335 K336	V328-M332 HydrophobicContact CG1-CG 4.44Å; V328-M332 HydrophobicContact CG1-SD 4.15Å; V328-M332 WeakPolarHBondContact O-CB 3.24Å; V328-M332 WeakPolarHBondContact O-CG 3.4Å; V328-M332 PolarHBondContact O-N 3.19Å; T329-M332 PolarHBondContact O-N 2.99Å; M332-R335 PolarHBondContact O-N 2.87Å; M332-K336 WeakPolarHBondContact O-CB 3.24Å; M332-K336 PolarHBondContact O-N 2.7Å
333	C	60.3	Low	60.7	Low	80 Å²	80	107.2 Å²	107.2	54%	0.541	65%	0.646	S	S	.	*	H	α-helix	trans	-63.4	-41.9	171.8	-74.1	0	0	0	0	111.6	T329 A330 K336 S337	T329-C333 WeakPolarHBondContact O-CB 3.16Å; T329-C333 PolarHBondContact O-N 3.41Å; T329-C333 PolarHBondContact O-SG 2.86Å; T329-C333 VanDerWaalsContact O-SG 3.34Å; A330-C333 PolarHBondContact O-N 2.92Å; C333-K336 PolarHBondContact O-N 2.63Å; C333-S337 WeakPolarHBondContact O-CB 3.29Å; C333-S337 PolarHBondContact O-N 3.15Å; C333-S337 PolarHBondContact O-OG 3.2Å
334	R	59.2	Low	58.5	Low	204 Å²	204	108.9 Å²	108.9	77%	0.77	66%	0.661	S	S	*	*	H	α-helix	trans	-67	-33.9	174.7	-84.3	-171.3	163.3	-175.7	-3	113.4	A330 M331 K336 S337	A330-R334 WeakPolarHBondContact O-CB 3.42Å; A330-R334 PolarHBondContact O-N 2.93Å; M331-R334 PolarHBondContact O-N 3.1Å; R334-K336 VanDerWaalsContact C-N 3.33Å; R334-S337 WeakPolarHBondContact CA-OG 3.43Å; R334-S337 PolarHBondContact O-OG 3.15Å
335	R	55.9	Low	56.2	Low	218 Å²	218	109.3 Å²	109.3	82%	0.823	67%	0.672	S	S	*	*	H	α-helix	trans	-72.7	-27.7	174.1	-130.4	177.6	-176.1	178.1	0.9	112.2	M331 M332	M331-R335 WeakPolarHBondContact O-CB 3.23Å; M331-R335 PolarHBondContact O-N 3.3Å; M332-R335 PolarHBondContact O-N 2.87Å
336	K	49.8	Very low	54	Low	183 Å²	183	113 Å²	113	80%	0.796	69%	0.692	S	S	*	*	H	α-helix	trans	-86.3	-19.2	177.1	-162	163	-178.3	176.2	0	113.3	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.24Å; M332-K336 PolarHBondContact O-N 2.7Å; C333-K336 PolarHBondContact O-N 2.63Å; R334-K336 VanDerWaalsContact C-N 3.33Å
337	S	49.9	Very low	51.9	Low	93 Å²	93	118.9 Å²	118.9	65%	0.65	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	3.6	176.2	63.5	0	0	0	0	114.9	C333 R334 G339	C333-S337 WeakPolarHBondContact O-CB 3.29Å; C333-S337 PolarHBondContact O-N 3.15Å; C333-S337 PolarHBondContact O-OG 3.2Å; R334-S337 WeakPolarHBondContact CA-OG 3.43Å; R334-S337 PolarHBondContact O-OG 3.15Å; S337-G339 VanDerWaalsContact C-N 3.32Å
338	S	49.3	Very low	49.8	Very low	107 Å²	107	119.7 Å²	119.7	75%	0.748	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	16.6	174.1	82.3	0	0	0	0	114.1
339	G	45.7	Very low	47.5	Very low	66 Å²	66	120.6 Å²	120.6	68%	0.68	74%	0.74	S	S	*	*	S	Bend	trans	-158	105.5	172.9	0	0	0	0	0	111.9	S337	S337-G339 VanDerWaalsContact C-N 3.32Å
340	G	37.7	Very low	45.8	Very low	83 Å²	83	123 Å²	123	86%	0.856	76%	0.758	S	S	*	*			trans	128.8	113.5	163	0	0	0	0	0	115.4
341	K	35.7	Very low	43.9	Very low	222 Å²	222	126 Å²	126	97%	0.965	78%	0.777	S	S	*	*			trans	-80.6	145.6	-176.3	-167.1	163.9	-179.9	171.5	0	112.2
342	G	34.8	Very low	42.4	Very low	79 Å²	79	127.6 Å²	127.6	81%	0.814	79%	0.788	S	S	*	*			trans	138	115.8	147.7	0	0	0	0	0	118.6
343	G	32.1	Very low	40.9	Very low	82 Å²	82	127.4 Å²	127.4	85%	0.845	80%	0.8	S	S	*	*			trans	116	90.2	135.5	0	0	0	0	0	121.1
344	S	35.9	Very low	39.9	Very low	121 Å²	121	128.1 Å²	128.1	85%	0.846	81%	0.811	S	S	*	*			trans	20.8	120	140.1	-149.8	0	0	0	0	121.8
345	C	33	Very low	38.8	Very low	111 Å²	111	128.3 Å²	128.3	75%	0.75	82%	0.821	S	S	*	*				80.7	133.9	102.9	-144.6	0	0	0	0	113.9
346	S	33.6	Very low	37.6	Very low	112 Å²	112	121.7 Å²	121.7	78%	0.783	82%	0.82	S	S	*	*				-165.2	144.1	53.4	15.3	0	0	0	0	115.6
347	Q	34.8	Very low	37.1	Very low	182 Å²	182	118.1 Å²	118.1	85%	0.85	82%	0.818	S	S	*	*			trans	8.2	121.8	140.9	-154.2	160.7	1.5	0	0	123.3
348	A	34.6	Very low	36.5	Very low	94 Å²	94	121.2 Å²	121.2	78%	0.777	83%	0.827	S	S	*	*			trans	36.7	133.8	132.5	0	0	0	0	0	123.4
349	A	30	Very low	35.7	Very low	98 Å²	98	124.5 Å²	124.5	81%	0.81	83%	0.831	S	S	*	*				-162.1	119.6	127.7	0	0	0	0	0	111.5
350	C	36.2	Very low	35.2	Very low	133 Å²	133	126.1 Å²	126.1	90%	0.899	83%	0.832	S	S	*	*			trans	-95.8	142.8	156.1	-77	0	0	0	0	108.1
351	S	32.8	Very low	35.3	Very low	118 Å²	118	130.1 Å²	130.1	83%	0.825	83%	0.833	S	S	*	*			trans	-157.4	131.6	155.1	26.7	0	0	0	0	112.7
352	N	39.2	Very low	35.3	Very low	161 Å²	161	127.1 Å²	127.1	86%	0.861	83%	0.826	S	S	*	*			trans	-68.9	160.8	170.7	-74.5	-33	0	0	0	112.4
353	S	38.7	Very low	35.3	Very low	129 Å²	129	129 Å²	129	90%	0.902	82%	0.822	S	S	*	*			trans	-150.2	128.1	145.1	-41.1	0	0	0	0	110.2
354	A	39.2	Very low	35.3	Very low	94 Å²	94	131.1 Å²	131.1	78%	0.777	82%	0.822	S	S	*	*			trans	-123.4	133.8	167.5	0	0	0	0	0	107.6
355	Q	36.3	Very low	35.4	Very low	209 Å²	209	138.4 Å²	138.4	98%	0.977	84%	0.838	S	S	*	*			trans	175.7	143.5	145.2	-113.3	169.3	-10.5	0	0	111.8
356	G	29.7	Very low	35.5	Very low	79 Å²	79	139.8 Å²	139.8	81%	0.814	84%	0.843	S	S	*	*			trans	139	88.4	156.7	0	0	0	0	0	114.6
357	S	40	Very low	35.6	Very low	107 Å²	107	141.3 Å²	141.3	75%	0.748	85%	0.846	S	S	*	*			trans	-80	154.9	168.4	32	0	0	0	0	113
358	D	36.7	Very low	35.7	Very low	158 Å²	158	139 Å²	139	85%	0.845	85%	0.846	S	S	*	*			trans	124.8	145.8	139.3	-82	-25.3	0	0	0	119.3
359	E	33.2	Very low	35.7	Very low	176 Å²	176	141.6 Å²	141.6	82%	0.822	85%	0.85	S	S	*	*			trans	96.7	103.6	157.9	-85.7	-170.4	129.9	0	0	122.1
360	S	35.5	Very low	36.1	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	85%	0.852	S	S	*	*				96.7	117.5	117.4	75.8	0	0	0	0	119.8
361	L	39.1	Very low	36.1	Very low	167 Å²	167	145.1 Å²	145.1	87%	0.874	85%	0.849	S	S	*	*			trans	-48.3	130.3	158	-78.2	148.2	0	0	0	112.6
362	I	36.1	Very low	36.3	Very low	160 Å²	160	147.1 Å²	147.1	82%	0.821	85%	0.851	S	S	*	*			trans	-139	114.7	148.5	-64.1	-176	0	0	0	109.6
363	T	35	Very low	36.1	Very low	119 Å²	119	146 Å²	146	73%	0.73	85%	0.85	S	S	*	*			trans	-68.5	146.1	157.7	37.3	0	0	0	0	112.4
364	C	32	Very low	35.9	Very low	125 Å²	125	147.4 Å²	147.4	85%	0.845	85%	0.846	S	S	*	*			trans	147.3	134.9	146.3	-78.7	0	0	0	0	107.7
365	K	37.6	Very low	35.6	Very low	275 Å²	275	152.3 Å²	152.3	100%	1.196	85%	0.852	S	S	*	*			cis	-159.3	0	29	-152.9	177.9	-167.5	173.4	0	109.3

Retrieved 365 of 365 residues in 61.4 ms (Link to these results)

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