A0A060VCV3_HUMAN Loading...

MHC class I antigen

Involved in the presentation of foreign antigens to the immune system.

AlphaFold DB , UniProt , Accession A0A060VCV3, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 366 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.8	Very low	44.5	Very low	240 Å²	240	143.8 Å²	143.8	100%	1.182	72%	0.72	S	S	*	*				0	105.1	0	-71.7	160.7	89.3	0	0	107.7	V3	M1-V3 PolarHBondContact O-N 3.3Å
2	R	35.9	Very low	44.6	Very low	253 Å²	253	142.7 Å²	142.7	96%	0.955	72%	0.717	S	S	*	*			trans	-80.9	108.6	171.8	-97.2	-179.7	172.9	164.6	-2.4	106.9	M4	R2-M4 PolarHBondContact O-N 3.31Å; R2-M4 VanDerWaalsContact O-N 3.12Å
3	V	39.5	Very low	44.2	Very low	140 Å²	140	139.5 Å²	139.5	85%	0.848	70%	0.703	S	S	*	*			trans	-71.2	104.4	171.3	179.3	0	0	0	0	106.6	M1 A5	M1-V3 PolarHBondContact O-N 3.3Å; V3-A5 PolarHBondContact O-N 3.4Å
4	M	42.7	Very low	44.1	Very low	175 Å²	175	133.9 Å²	133.9	86%	0.862	68%	0.683	S	S	*	*			trans	-80.9	100.2	175.5	-162.6	168.3	62.8	0	0	106.6	R2	R2-M4 PolarHBondContact O-N 3.31Å; R2-M4 VanDerWaalsContact O-N 3.12Å
5	A	46.2	Very low	44.1	Very low	58 Å²	58	127.3 Å²	127.3	48%	0.479	66%	0.662	S	S	.	*			trans	-58.9	138.4	173.2	0	0	0	0	0	109.2	V3 R7	V3-A5 PolarHBondContact O-N 3.4Å; A5-R7 PolarHBondContact O-N 2.93Å
6	P	44.5	Very low	43.9	Very low	74 Å²	74	122.7 Å²	122.7	48%	0.481	65%	0.648	S	S	.	*			trans	-62.1	125.2	-177.9	-15.2	27.8	0	0	0	109.7	T8 L9	P6-T8 PolarHBondContact O-N 2.89Å; P6-L9 WeakPolarHBondContact O-CB 3.29Å; P6-L9 PolarHBondContact O-N 3.38Å
7	R	51.2	Low	43.4	Very low	220 Å²	220	122.1 Å²	122.1	83%	0.83	65%	0.645	S	S	*	*	H	α-helix	trans	-53	-24.5	176.9	-84.8	177.4	162.9	147.2	-6.1	113.4	A5 L11	A5-R7 PolarHBondContact O-N 2.93Å; R7-L11 PolarHBondContact O-N 3.38Å
8	T	49.8	Very low	43	Very low	98 Å²	98	118.6 Å²	118.6	60%	0.601	64%	0.636	S	S	*	*	H	α-helix	trans	-67.7	-33.1	173.9	27.9	0	0	0	0	113.7	P6 L12	P6-T8 PolarHBondContact O-N 2.89Å; T8-L12 PolarHBondContact O-N 2.88Å
9	L	43.4	Very low	42.7	Very low	103 Å²	103	117.7 Å²	117.7	54%	0.539	63%	0.63	S	S	.	*	H	α-helix	trans	-73	-34.4	178.9	-133.4	105.7	0	0	0	111.7	P6 L13	P6-L9 WeakPolarHBondContact O-CB 3.29Å; P6-L9 PolarHBondContact O-N 3.38Å; L9-L13 HydrophobicContact CD2-CD1 4.47Å; L9-L13 WeakPolarHBondContact O-CD1 3.47Å; L9-L13 WeakPolarHBondContact O-CG 3.49Å; L9-L13 PolarHBondContact O-N 2.87Å; L9-L13 VanDerWaalsContact O-N 3.13Å
10	I	49.6	Very low	42.4	Very low	97 Å²	97	116.5 Å²	116.5	50%	0.497	63%	0.628	S	S	.	*	H	α-helix	trans	-70.3	-38.6	178.3	-63.1	172.5	0	0	0	110.6	L13 S14	I10-L13 PolarHBondContact O-N 3.34Å; I10-S14 WeakPolarHBondContact O-CB 3.42Å; I10-S14 PolarHBondContact O-N 3.45Å; I10-S14 PolarHBondContact O-OG 3.23Å
11	L	51.5	Low	42.1	Very low	124 Å²	124	118.9 Å²	118.9	65%	0.649	64%	0.635	S	S	*	*	H	α-helix	trans	-68.1	-38.6	176.2	-74.3	165.9	0	0	0	112.7	R7 S14 G15	R7-L11 PolarHBondContact O-N 3.38Å; L11-S14 PolarHBondContact O-N 2.9Å; L11-G15 PolarHBondContact O-N 3.28Å
12	L	46.2	Very low	42.5	Very low	130 Å²	130	112.4 Å²	112.4	68%	0.681	61%	0.609	S	S	*	*	H	α-helix	trans	-65.5	-39.4	174.8	-77.4	164.2	0	0	0	112.4	T8 S14 G15 A16	T8-L12 PolarHBondContact O-N 2.88Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-G15 PolarHBondContact O-N 3.47Å; L12-A16 WeakPolarHBondContact O-CB 3.37Å; L12-A16 PolarHBondContact O-N 3.4Å
13	L	39.8	Very low	43.2	Very low	101 Å²	101	105.3 Å²	105.3	53%	0.529	58%	0.582	S	S	.	*	H	α-helix	trans	-67.9	-32.1	173.5	-78.6	159.5	0	0	0	112.4	L9 I10 L17	L9-L13 HydrophobicContact CD2-CD1 4.47Å; L9-L13 WeakPolarHBondContact O-CD1 3.47Å; L9-L13 WeakPolarHBondContact O-CG 3.49Å; L9-L13 PolarHBondContact O-N 2.87Å; L9-L13 VanDerWaalsContact O-N 3.13Å; I10-L13 PolarHBondContact O-N 3.34Å; L13-L17 WeakPolarHBondContact O-CB 3.3Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 WeakPolarHBondContact O-CG 3.3Å; L13-L17 PolarHBondContact O-N 3.46Å
14	S	43.1	Very low	43.9	Very low	62 Å²	62	101.1 Å²	101.1	43%	0.434	56%	0.562	S	S	.	*	H	α-helix	trans	-70.7	-39.9	176.1	-49.8	0	0	0	0	111.9	I10 L11 L12 A18	I10-S14 WeakPolarHBondContact O-CB 3.42Å; I10-S14 PolarHBondContact O-N 3.45Å; I10-S14 PolarHBondContact O-OG 3.23Å; L11-S14 PolarHBondContact O-N 2.9Å; L12-S14 VanDerWaalsContact C-N 3.33Å; S14-A18 WeakPolarHBondContact O-CB 3.38Å; S14-A18 PolarHBondContact O-N 2.93Å
15	G	43	Very low	45.3	Very low	35 Å²	35	95.3 Å²	95.3	36%	0.361	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-40.7	174.5	0	0	0	0	0	112.6	L11 L12 L19	L11-G15 PolarHBondContact O-N 3.28Å; L12-G15 PolarHBondContact O-N 3.47Å; G15-L19 WeakPolarHBondContact O-CB 3.38Å; G15-L19 WeakPolarHBondContact O-CD1 3.32Å; G15-L19 PolarHBondContact O-N 2.73Å
16	A	40.8	Very low	47.4	Very low	53 Å²	53	96.1 Å²	96.1	44%	0.438	54%	0.54	S	S	.	.	H	α-helix	trans	-67.2	-39.4	175.8	0	0	0	0	0	112.7	L12 L19 T20	L12-A16 WeakPolarHBondContact O-CB 3.37Å; L12-A16 PolarHBondContact O-N 3.4Å; A16-L19 PolarHBondContact O-N 3.02Å; A16-T20 WeakPolarHBondContact O-CG2 3.47Å; A16-T20 PolarHBondContact O-N 3.02Å; A16-T20 PolarHBondContact O-OG1 3.29Å
17	L	35.2	Very low	49.8	Very low	113 Å²	113	94 Å²	94	59%	0.592	52%	0.524	S	S	*	.	H	α-helix	trans	-68	-39.2	176.1	-79.2	162.7	0	0	0	112.3	L13 L19 T20 E21	L13-L17 WeakPolarHBondContact O-CB 3.3Å; L13-L17 WeakPolarHBondContact O-CD1 3.47Å; L13-L17 WeakPolarHBondContact O-CG 3.3Å; L13-L17 PolarHBondContact O-N 3.46Å; L17-L19 VanDerWaalsContact C-N 3.32Å; L17-L19 PolarHBondContact O-N 2.87Å; L17-T20 WeakPolarHBondContact CA-OG1 3.45Å; L17-T20 PolarHBondContact O-N 3.42Å; L17-T20 PolarHBondContact O-OG1 2.95Å; L17-E21 PolarHBondContact O-N 3.32Å; L17-E21 VanDerWaalsContact O-N 3.13Å
18	A	37.8	Very low	52	Low	59 Å²	59	84.6 Å²	84.6	49%	0.488	49%	0.492	S	S	.	.	H	α-helix	trans	-66	-33.6	173.9	0	0	0	0	0	112.6	S14	S14-A18 WeakPolarHBondContact O-CB 3.38Å; S14-A18 PolarHBondContact O-N 2.93Å
19	L	37.3	Very low	54.4	Low	101 Å²	101	80 Å²	80	53%	0.529	46%	0.463	S	S	.	.	H	α-helix	trans	-73.6	-26.8	174.8	-93.1	150.6	0	0	0	113.3	G15 A16 L17 T22 W23	G15-L19 WeakPolarHBondContact O-CB 3.38Å; G15-L19 WeakPolarHBondContact O-CD1 3.32Å; G15-L19 PolarHBondContact O-N 2.73Å; A16-L19 PolarHBondContact O-N 3.02Å; L17-L19 VanDerWaalsContact C-N 3.32Å; L17-L19 PolarHBondContact O-N 2.87Å; L19-T22 PolarHBondContact O-OG1 3.48Å; L19-W23 VanDerWaalsContact O-CD1 3.26Å
20	T	35.8	Very low	57	Low	94 Å²	94	77.3 Å²	77.3	58%	0.577	45%	0.446	S	S	*	.	H	α-helix	trans	-84.9	-26.2	176.8	49.6	0	0	0	0	113.8	A16 L17 T22	A16-T20 WeakPolarHBondContact O-CG2 3.47Å; A16-T20 PolarHBondContact O-N 3.02Å; A16-T20 PolarHBondContact O-OG1 3.29Å; L17-T20 WeakPolarHBondContact CA-OG1 3.45Å; L17-T20 PolarHBondContact O-N 3.42Å; L17-T20 PolarHBondContact O-OG1 2.95Å; T20-T22 VanDerWaalsContact C-N 3.3Å; T20-T22 PolarHBondContact O-N 3.38Å
21	E	37.1	Very low	59.3	Low	166 Å²	166	73.6 Å²	73.6	78%	0.776	43%	0.426	S	S	*	.	H	α-helix	trans	-71.7	-22.7	177.6	-101.9	-177	166.9	0	0	113.1	L17 W23	L17-E21 PolarHBondContact O-N 3.32Å; L17-E21 VanDerWaalsContact O-N 3.13Å; E21-W23 PolarHBondContact O-N 3.33Å
22	T	42.3	Very low	61.6	Low	105 Å²	105	71.6 Å²	71.6	64%	0.644	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	2.3	-179.7	53.1	0	0	0	0	114.5	L19 T20	L19-T22 PolarHBondContact O-OG1 3.48Å; T20-T22 VanDerWaalsContact C-N 3.3Å; T20-T22 PolarHBondContact O-N 3.38Å
23	W	49.9	Very low	64.1	Low	104 Å²	104	65.7 Å²	65.7	39%	0.394	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.3	11.2	-173.7	-78.3	79.3	0	0	0	113.9	L19 E21 C25 H287 E288 L290	L19-W23 VanDerWaalsContact O-CD1 3.26Å; E21-W23 PolarHBondContact O-N 3.33Å; W23-C25 PolarHBondContact O-N 3.46Å; W23-H287 WeakPolarHBondContact CH2-O 3.06Å; W23-H287 WeakPolarHBondContact CZ2-O 3.36Å; W23-E288 HydrophobicContact CE3-CG 4.29Å; W23-E288 VanDerWaalsContact CH2-O 3.24Å; W23-E288 WeakPolarHBondContact CH2-O 3.34Å; W23-E288 VanDerWaalsContact CZ3-C 3.42Å; W23-E288 HydrophobicContact CZ3-CG 4.25Å; W23-E288 WeakPolarHBondContact CZ3-O 3.43Å; W23-L290 WeakPolarHBondContact CH2-O 3.34Å; W23-L290 VanDerWaalsContact CZ2-O 3.29Å; W23-L290 WeakPolarHBondContact CZ2-O 3.44Å
24	A	54	Low	66.9	Low	51 Å²	51	62.9 Å²	62.9	42%	0.421	37%	0.368	S	S	.	.	S	Bend	trans	-85.4	102.1	174.8	0	0	0	0	0	107.8	S26 P129	A24-S26 PolarHBondContact O-N 3.38Å; A24-P129 HydrophobicContact CB-CB 4.03Å; A24-P129 HydrophobicContact CB-CG 3.21Å
25	C	72.4	Confident	69.5	Low	54 Å²	54	60 Å²	60	37%	0.365	35%	0.348	S	S	.	.			trans	-52	106.4	-176.1	-58.2	0	0	0	0	111	W23 E288	W23-C25 PolarHBondContact O-N 3.46Å; C25-E288 PolarHBondContact SG-OE1 3.35Å
26	S	90.9	Very high	72.2	Confident	74 Å²	74	60.7 Å²	60.7	52%	0.517	35%	0.345	S	S	.	.			trans	-89.6	147	165.2	57.5	0	0	0	0	109	A24 L127	A24-S26 PolarHBondContact O-N 3.38Å; S26-L127 VanDerWaalsContact CA-O 3.25Å; S26-L127 WeakPolarHBondContact CA-O 3.39Å; S26-L127 WeakPolarHBondContact CB-O 3.33Å
27	H	95.5	Very high	74.9	Confident	29 Å²	29	58.9 Å²	58.9	13%	0.134	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	152.2	176.5	-67.4	-75.3	0	0	0	110.6	D53 D126 L127 L192 L196	H27-D53 WeakPolarHBondContact CA-OD1 3.32Å; H27-D53 IonicContact CE1-OD2 2.74Å; H27-D53 IonicContact CG-OD2 3.38Å; H27-D53 IonicContact ND1-OD1 3.68Å; H27-D53 IonicContact ND1-OD2 2.71Å; H27-D53 PolarHBondContact ND1-OD2 3.12Å; H27-D126 CarbonylContact O-C 3.54Å; H27-D126 WeakPolarHBondContact O-CA 3.46Å; H27-L127 PolarHBondContact N-O 2.6Å; H27-L127 PolarHBondContact O-N 3.28Å; H27-L192 HydrophobicContact CB-CD1 4.47Å; H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 3.98Å; H27-L196 HydrophobicContact CB-CG 4.41Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.46Å
28	S	97.5	Very high	77.8	Confident	23 Å²	23	57 Å²	57	16%	0.161	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	150.6	179.2	66.6	0	0	0	0	111.7	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.6Å; S28-V52 VanDerWaalsContact O-CA 3.29Å; S28-V52 WeakPolarHBondContact O-CA 3.1Å; S28-D53 PolarHBondContact N-OD1 2.92Å; S28-D53 PolarHBondContact O-N 2.68Å; S28-C125 WeakPolarHBondContact CA-O 3.25Å; S28-D126 WeakPolarHBondContact CB-OD1 3.41Å
29	M	98.6	Very high	80.4	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	124.1	166.8	-177.4	172.5	60.6	0	0	107.9	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.26Å; M29-Y31 HydrophobicContact CG-CE2 4.08Å; M29-Y31 HydrophobicContact SD-CE2 4.01Å; M29-Y51 CarbonylContact C-O 3.59Å; M29-Y51 WeakPolarHBondContact CA-O 3.18Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; M29-F57 HydrophobicContact CG-CE1 4.44Å; M29-F57 HydrophobicContact SD-CZ 4.35Å; M29-G124 CarbonylContact O-C 3.58Å; M29-G124 WeakPolarHBondContact O-CA 3.24Å; M29-C125 PolarHBondContact N-O 3.17Å; M29-C125 PolarHBondContact O-N 3.02Å; M29-C188 HydrophobicContact CE-CB 4.17Å; M29-C188 WeakPolarHBondContact CE-O 3.23Å; M29-C188 WeakPolarHBondContact CE-SG 3.38Å; M29-W191 HydrophobicContact CE-CB 4.08Å; M29-W191 HydrophobicContact SD-CB 4.43Å; M29-L192 HydrophobicContact CB-CB 4.03Å; M29-L192 HydrophobicContact CB-CD1 4.02Å; M29-L192 HydrophobicContact CB-CD2 3.95Å; M29-L192 HydrophobicContact CB-CG 4.21Å; M29-L192 HydrophobicContact CE-CB 4.28Å; M29-L192 HydrophobicContact SD-CB 4.46Å; M29-Y195 HydrophobicContact SD-CD2 3.73Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å
30	R	98.6	Very high	83	Confident	48 Å²	48	56.3 Å²	56.3	18%	0.181	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.4	-177.5	-56.7	-62.7	-179.7	77.3	4.8	110.8	F32 G50 Y51 C123 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.37Å; R30-F32 HydrophobicContact CB-CE2 3.55Å; R30-F32 HydrophobicContact CB-CZ 3.82Å; R30-F32 HydrophobicContact CG-CZ 4.44Å; R30-G50 CarbonylContact O-C 3.53Å; R30-G50 WeakPolarHBondContact O-CA 3.39Å; R30-Y51 PolarHBondContact N-O 3.4Å; R30-Y51 PolarHBondContact O-N 2.94Å; R30-C123 CarbonylContact C-O 3.59Å; R30-C123 WeakPolarHBondContact CA-O 3.34Å; R30-D126 IonicContact CZ-OD1 3.69Å; R30-D126 IonicContact NE-OD1 2.76Å; R30-D126 PolarHBondContact NE-OD1 3.35Å; R30-D126 VanDerWaalsContact NH2-CG 3.32Å; R30-D126 IonicContact NH2-OD1 3.89Å; R30-D126 PolarHBondContact NH2-OD1 3.28Å; R30-D126 IonicContact NH2-OD2 3.52Å; R30-D126 PolarHBondContact NH2-OD2 2.92Å; R30-D126 VanDerWaalsContact NH2-OD2 3.1Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.26Å; R30-Y137 PolarHBondContact NH2-OH 3.27Å
31	Y	98.7	Very high	85.7	Confident	18 Å²	18	61.7 Å²	61.7	7%	0.071	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.7	166.9	-67.9	-93.8	0	0	0	109	M29 V49 F57 V58 M122 C123	M29-Y31 HydrophobicContact CE-CE2 4.26Å; M29-Y31 HydrophobicContact CG-CE2 4.08Å; M29-Y31 HydrophobicContact SD-CE2 4.01Å; Y31-V49 CarbonylContact C-O 3.51Å; Y31-V49 WeakPolarHBondContact CA-O 3.49Å; Y31-F57 HydrophobicContact CE1-CZ 4.03Å; Y31-F57 AromaticContact CZ-CZ 3.75Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.32Å; Y31-V58 HydrophobicContact CE1-CG2 3.93Å; Y31-M122 VanDerWaalsContact O-CA 3.31Å; Y31-M122 WeakPolarHBondContact O-CA 3.44Å; Y31-C123 PolarHBondContact N-O 3.24Å; Y31-C123 PolarHBondContact O-N 2.94Å; Y31-C123 VanDerWaalsContact O-N 3.13Å
32	F	98.8	Very high	88.4	Confident	83 Å²	83	56.5 Å²	56.5	36%	0.364	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	118.5	177	-56.7	-93.9	0	0	0	108.9	R30 S48 V49 Y51 W121 M122	R30-F32 HydrophobicContact CB-CD2 4.37Å; R30-F32 HydrophobicContact CB-CE2 3.55Å; R30-F32 HydrophobicContact CB-CZ 3.82Å; R30-F32 HydrophobicContact CG-CZ 4.44Å; F32-S48 WeakPolarHBondContact O-CA 3.36Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.31Å; F32-V49 PolarHBondContact N-O 3.16Å; F32-V49 PolarHBondContact O-N 2.92Å; F32-Y51 HydrophobicContact CD2-CD2 4.16Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; F32-W121 WeakPolarHBondContact CA-O 3.37Å; F32-M122 HydrophobicContact CD1-CB 4.04Å; F32-M122 HydrophobicContact CD1-CG 3.6Å; F32-M122 HydrophobicContact CE1-CB 4.25Å; F32-M122 HydrophobicContact CE1-CG 3.4Å; F32-M122 HydrophobicContact CG-CG 4.44Å; F32-M122 HydrophobicContact CZ-CG 4.1Å
33	D	98.7	Very high	90.9	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.027	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	141.7	177.3	-67	-0.6	0	0	0	109.4	F46 I47 S48 Q94 Q120 W121	D33-F46 HydrophobicContact CB-CE2 3.78Å; D33-F46 HydrophobicContact CB-CZ 3.99Å; D33-F46 WeakPolarHBondContact OD2-CZ 3.34Å; D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.39Å; D33-S48 WeakPolarHBondContact OD1-CB 3.3Å; D33-S48 PolarHBondContact OD1-OG 2.96Å; D33-Q94 VanDerWaalsContact OD2-CG 3.31Å; D33-Q94 WeakPolarHBondContact OD2-CG 3.48Å; D33-Q120 VanDerWaalsContact O-CA 3.32Å; D33-Q120 WeakPolarHBondContact O-CA 3.42Å; D33-W121 HydrophobicContact CB-CB 4.34Å; D33-W121 HydrophobicContact CB-CE3 3.91Å; D33-W121 PolarHBondContact N-O 3.44Å; D33-W121 PolarHBondContact O-N 2.68Å; D33-W121 WeakPolarHBondContact OD2-CZ3 3.03Å
34	T	98.9	Very high	93.1	Very high	42 Å²	42	52.3 Å²	52.3	26%	0.258	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	118.7	177.2	-60.1	0	0	0	0	109.3	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 3.99Å; T34-F46 WeakPolarHBondContact O-CA 3.43Å; T34-I47 PolarHBondContact N-O 2.93Å; T34-I47 PolarHBondContact O-N 3.39Å; T34-T118 HydrophobicContact CG2-CG2 4.05Å; T34-L119 WeakPolarHBondContact CA-O 3.24Å; T34-Q120 HydrophobicContact CG2-CG 4.17Å
35	A	98.7	Very high	95.2	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.5	174.6	0	0	0	0	0	110.1	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.59Å; A35-R45 VanDerWaalsContact CA-O 3.3Å; A35-R45 WeakPolarHBondContact CA-O 3.41Å; A35-F46 HydrophobicContact CB-CD2 4.26Å; A35-D98 HydrophobicContact CB-CB 3.67Å; A35-L102 HydrophobicContact CB-CD1 3.91Å; A35-T118 WeakPolarHBondContact O-CA 3.18Å; A35-L119 HydrophobicContact CB-CB 4.45Å; A35-L119 PolarHBondContact N-O 2.98Å; A35-L119 PolarHBondContact O-N 2.71Å
36	V	98.6	Very high	96.5	Very high	50 Å²	50	51.8 Å²	51.8	30%	0.303	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.5	-179.3	-172.9	0	0	0	0	109.4	T34 P44 R45 T118	T34-V36 HydrophobicContact CG2-CG2 3.99Å; V36-P44 CarbonylContact O-C 3.56Å; V36-P44 WeakPolarHBondContact O-CA 3.41Å; V36-P44 WeakPolarHBondContact O-CB 3.44Å; V36-R45 PolarHBondContact N-O 3.46Å; V36-R45 PolarHBondContact O-N 3.37Å; V36-T118 HydrophobicContact CG2-CG2 4.22Å
37	S	97.9	Very high	96.9	Very high	16 Å²	16	50.5 Å²	50.5	11%	0.112	28%	0.275	C	S	.	.			trans	-68.9	143.5	173.5	68	0	0	0	0	110.5	S116 H117	S37-S116 PolarHBondContact O-OG 3.07Å; S37-H117 PolarHBondContact N-O 2.76Å; S37-H117 PolarHBondContact OG-N 3.48Å; S37-H117 PolarHBondContact OG-O 3.23Å
38	R	96.1	Very high	97	Very high	74 Å²	74	49.1 Å²	49.1	28%	0.279	27%	0.268	S	S	.	.			trans	-136.1	76	-179.2	52.4	176.5	175.7	-161.6	-8.5	111.1	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 2.91Å; R38-R41 HydrophobicContact CB-CB 4.1Å; R38-R41 WeakPolarHBondContact CD-O 3.21Å; R38-R41 HydrophobicContact CG-CB 4.14Å; R38-R41 PolarHBondContact NE-O 2.9Å; R38-R41 PolarHBondContact O-N 3.33Å; R38-E43 VanDerWaalsContact CZ-O 3.29Å; R38-E43 PolarHBondContact NE-O 3.35Å; R38-E43 PolarHBondContact NH2-O 3.45Å; R38-D63 IonicContact CZ-OD1 3.7Å; R38-D63 IonicContact CZ-OD2 2.73Å; R38-D63 IonicContact NH1-OD1 3.82Å; R38-D63 PolarHBondContact NH1-OD1 3.33Å; R38-D63 IonicContact NH1-OD2 3.1Å; R38-D63 PolarHBondContact NH1-OD2 3.01Å; R38-D63 IonicContact NH2-OD1 2.76Å; R38-D63 PolarHBondContact NH2-OD1 2.92Å; R38-D63 IonicContact NH2-OD2 3.27Å
39	P	92.6	Very high	97.1	Very high	53 Å²	53	49.5 Å²	49.5	34%	0.344	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	132.3	-177.9	-27	34.9	0	0	0	112.3	R41 E113 G115	P39-R41 PolarHBondContact O-N 3.02Å; P39-E113 WeakPolarHBondContact CB-O 3.47Å; P39-E113 WeakPolarHBondContact CG-O 3.46Å; P39-G115 VanDerWaalsContact CG-O 3.24Å; P39-G115 WeakPolarHBondContact CG-O 3.35Å
40	G	91.6	Very high	97.1	Very high	91 Å²	91	49.4 Å²	49.4	94%	0.938	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	0.5	-177.3	0	0	0	0	0	116.1	R38	R38-G40 PolarHBondContact O-N 2.91Å
41	R	93.3	Very high	97.1	Very high	208 Å²	208	50.5 Å²	50.5	79%	0.785	27%	0.274	S	S	*	.	S	Bend	trans	-123.9	23.1	-179	-58.2	-174.9	-179.3	-170.9	0.7	113.7	R38 P39	R38-R41 HydrophobicContact CB-CB 4.1Å; R38-R41 WeakPolarHBondContact CD-O 3.21Å; R38-R41 HydrophobicContact CG-CB 4.14Å; R38-R41 PolarHBondContact NE-O 2.9Å; R38-R41 PolarHBondContact O-N 3.33Å; P39-R41 PolarHBondContact O-N 3.02Å
42	G	91.9	Very high	97	Very high	57 Å²	57	49.7 Å²	49.7	59%	0.588	27%	0.27	S	S	*	.	S	Bend	trans	97.2	-161.5	178.1	0	0	0	0	0	113.8
43	E	94.8	Very high	96.9	Very high	92 Å²	92	47 Å²	47	43%	0.43	26%	0.26	S	S	.	.	S	Bend	trans	-69.3	155	-178.9	-64.6	-58.2	162.6	0	0	112.4	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.29Å; R38-E43 PolarHBondContact NE-O 3.35Å; R38-E43 PolarHBondContact NH2-O 3.45Å; E43-R45 PolarHBondContact O-N 2.94Å; E43-R99 IonicContact OE1-CZ 3.75Å; E43-R99 IonicContact OE1-NE 3.77Å; E43-R99 IonicContact OE1-NH1 3.19Å; E43-R99 PolarHBondContact OE1-NH1 2.96Å; E43-R99 IonicContact OE1-NH2 3.23Å; E43-R99 PolarHBondContact OE1-NH2 2.93Å; E43-R99 VanDerWaalsContact OE2-CD 3.24Å; E43-R99 WeakPolarHBondContact OE2-CD 3.32Å; E43-R99 IonicContact OE2-CZ 3.67Å; E43-R99 IonicContact OE2-NE 3.66Å; E43-R99 PolarHBondContact OE2-NE 3.46Å; E43-R99 IonicContact OE2-NH1 2.89Å; E43-R99 IonicContact OE2-NH2 3.56Å; E43-R99 PolarHBondContact OE2-NH2 3Å; E43-R99 VanDerWaalsContact OE2-NH2 3.11Å
44	P	97.3	Very high	96.8	Very high	28 Å²	28	49.8 Å²	49.8	18%	0.182	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-51.5	133.6	172.6	-25.4	34.6	0	0	0	111.7	V36 R99 L102	V36-P44 CarbonylContact O-C 3.56Å; V36-P44 WeakPolarHBondContact O-CA 3.41Å; V36-P44 WeakPolarHBondContact O-CB 3.44Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.16Å; P44-L102 HydrophobicContact CB-CD1 3.69Å; P44-L102 HydrophobicContact CG-CD1 3.85Å
45	R	98.4	Very high	96.7	Very high	91 Å²	91	49.2 Å²	49.2	34%	0.343	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	126	173	-176.3	-177.3	-177	-177.6	-1.5	108.3	A35 V36 E43 I47 D61 D63	A35-R45 CarbonylContact C-O 3.59Å; A35-R45 VanDerWaalsContact CA-O 3.3Å; A35-R45 WeakPolarHBondContact CA-O 3.41Å; V36-R45 PolarHBondContact N-O 3.46Å; V36-R45 PolarHBondContact O-N 3.37Å; E43-R45 PolarHBondContact O-N 2.94Å; R45-I47 HydrophobicContact CG-CG1 4.4Å; R45-D61 IonicContact CZ-OD1 3.41Å; R45-D61 IonicContact CZ-OD2 2.81Å; R45-D61 IonicContact NE-OD1 3.89Å; R45-D61 PolarHBondContact NE-OD1 3.34Å; R45-D61 VanDerWaalsContact NE-OD1 3.14Å; R45-D61 IonicContact NE-OD2 3.75Å; R45-D61 IonicContact NH2-OD1 3.84Å; R45-D61 IonicContact NH2-OD2 2.81Å; R45-D61 PolarHBondContact NH2-OD2 3.46Å; R45-D63 VanDerWaalsContact CD-OD2 3.24Å; R45-D63 WeakPolarHBondContact CD-OD2 3.35Å; R45-D63 HydrophobicContact CG-CB 4.43Å; R45-D63 IonicContact NE-OD2 2.88Å
46	F	98.8	Very high	96.6	Very high	3 Å²	3	51.7 Å²	51.7	1%	0.013	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.2	174.2	177.3	-92.7	0	0	0	110.5	D33 T34 A35 F60 S62 Q94 A95 D98	D33-F46 HydrophobicContact CB-CE2 3.78Å; D33-F46 HydrophobicContact CB-CZ 3.99Å; D33-F46 WeakPolarHBondContact OD2-CZ 3.34Å; T34-F46 WeakPolarHBondContact O-CA 3.43Å; A35-F46 HydrophobicContact CB-CD2 4.26Å; F46-F60 AromaticContact CD1-CD1 3.68Å; F46-F60 HydrophobicContact CD1-CD1 3.68Å; F46-F60 AromaticContact CD1-CE1 3.78Å; F46-F60 HydrophobicContact CD1-CE1 3.78Å; F46-F60 AromaticContact CE1-CD1 3.86Å; F46-F60 HydrophobicContact CE1-CD1 3.86Å; F46-F60 HydrophobicContact CE1-CE1 4.23Å; F46-S62 PolarHBondContact N-OG 3.41Å; F46-S62 WeakPolarHBondContact O-CB 3.43Å; F46-S62 PolarHBondContact O-N 2.91Å; F46-S62 PolarHBondContact O-OG 2.8Å; F46-S62 VanDerWaalsContact O-OG 3.06Å; F46-Q94 HydrophobicContact CE2-CB 4.27Å; F46-Q94 HydrophobicContact CE2-CG 3.79Å; F46-Q94 HydrophobicContact CZ-CB 3.94Å; F46-Q94 HydrophobicContact CZ-CG 3.78Å; F46-A95 HydrophobicContact CB-CB 3.69Å; F46-A95 HydrophobicContact CD1-CB 3.74Å; F46-A95 HydrophobicContact CD2-CB 4.1Å; F46-A95 HydrophobicContact CE1-CB 4.37Å; F46-A95 HydrophobicContact CG-CB 3.57Å; F46-D98 VanDerWaalsContact CE2-OD2 3.28Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.3Å
47	I	98.8	Very high	96.6	Very high	48 Å²	48	49.3 Å²	49.3	25%	0.246	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.8	173.4	-60.1	171.2	0	0	0	107.4	D33 T34 R45 V49 F60	D33-I47 CarbonylContact C-O 3.54Å; D33-I47 WeakPolarHBondContact CA-O 3.39Å; T34-I47 PolarHBondContact N-O 2.93Å; T34-I47 PolarHBondContact O-N 3.39Å; R45-I47 HydrophobicContact CG-CG1 4.4Å; I47-V49 HydrophobicContact CG2-CG1 4.39Å; I47-F60 WeakPolarHBondContact CA-O 3.47Å
48	S	98.8	Very high	96.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	138.5	170.4	-179.4	0	0	0	0	109.6	F32 D33 R59 F60 Y91	F32-S48 WeakPolarHBondContact O-CA 3.36Å; D33-S48 WeakPolarHBondContact OD1-CB 3.3Å; D33-S48 PolarHBondContact OD1-OG 2.96Å; S48-R59 CarbonylContact O-C 3.57Å; S48-R59 WeakPolarHBondContact O-CA 3.33Å; S48-F60 PolarHBondContact N-O 3.03Å; S48-F60 PolarHBondContact O-N 2.71Å; S48-Y91 VanDerWaalsContact OG-CE1 3.23Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.48Å
49	V	98.8	Very high	96.7	Very high	30 Å²	30	49 Å²	49	18%	0.182	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.4	173.6	-63.4	0	0	0	0	109.6	Y31 F32 I47 Y51 V58 R59	Y31-V49 CarbonylContact C-O 3.51Å; Y31-V49 WeakPolarHBondContact CA-O 3.49Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.31Å; F32-V49 PolarHBondContact N-O 3.16Å; F32-V49 PolarHBondContact O-N 2.92Å; I47-V49 HydrophobicContact CG2-CG1 4.39Å; V49-Y51 HydrophobicContact CB-CE2 4.12Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; V49-V58 WeakPolarHBondContact CA-O 3.35Å; V49-R59 HydrophobicContact CG1-CG 4.28Å
50	G	98.6	Very high	97	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	138.7	176.9	0	0	0	0	0	110.9	R30 Q56 F57 V58	R30-G50 CarbonylContact O-C 3.53Å; R30-G50 WeakPolarHBondContact O-CA 3.39Å; G50-Q56 WeakPolarHBondContact O-CA 3.35Å; G50-F57 WeakPolarHBondContact O-CD1 3.41Å; G50-F57 PolarHBondContact O-N 3.22Å; G50-V58 PolarHBondContact N-O 2.88Å; G50-V58 PolarHBondContact O-N 3.17Å
51	Y	98.6	Very high	97.3	Very high	71 Å²	71	43.1 Å²	43.1	28%	0.278	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.4	178.8	-76.5	-102.2	0	0	0	110.7	M29 R30 F32 V49 T55 Q56	M29-Y51 CarbonylContact C-O 3.59Å; M29-Y51 WeakPolarHBondContact CA-O 3.18Å; R30-Y51 PolarHBondContact N-O 3.4Å; R30-Y51 PolarHBondContact O-N 2.94Å; F32-Y51 HydrophobicContact CD2-CD2 4.16Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; V49-Y51 HydrophobicContact CB-CE2 4.12Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.84Å; Y51-T55 WeakPolarHBondContact CA-O 3.42Å; Y51-T55 VanDerWaalsContact CD1-C 3.49Å; Y51-Q56 HydrophobicContact CD1-CB 4.03Å; Y51-Q56 VanDerWaalsContact CD1-N 3.31Å; Y51-Q56 HydrophobicContact CD2-CG 4.36Å; Y51-Q56 HydrophobicContact CE1-CB 3.53Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.06Å; Y51-Q56 HydrophobicContact CE2-CG 3.85Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å
52	V	98.2	Very high	97.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.4	156.5	176.8	0	0	0	0	106	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.6Å; S28-V52 VanDerWaalsContact O-CA 3.29Å; S28-V52 WeakPolarHBondContact O-CA 3.1Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; V52-D54 PolarHBondContact O-N 2.96Å; V52-T55 PolarHBondContact N-O 3.48Å; V52-T55 WeakPolarHBondContact O-CB 3.04Å; V52-T55 PolarHBondContact O-N 2.85Å; V52-F57 HydrophobicContact CG2-CD1 3.99Å; V52-F57 HydrophobicContact CG2-CE1 4.02Å; V52-W75 HydrophobicContact CB-CH2 4.36Å; V52-W75 HydrophobicContact CB-CZ2 4.45Å; V52-W75 HydrophobicContact CG2-CH2 3.86Å; V52-W75 HydrophobicContact CG2-CZ2 4.43Å; V52-L192 HydrophobicContact CG1-CD1 3.6Å; V52-L192 HydrophobicContact CG2-CD1 4.26Å; V52-Y195 HydrophobicContact CG2-CD2 3.94Å; V52-Y195 HydrophobicContact CG2-CG 4.44Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CB-CD1 4.27Å; V52-L203 HydrophobicContact CB-CD2 4.14Å; V52-L203 HydrophobicContact CG1-CD1 3.87Å; V52-L203 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CG1-CG 4.49Å
53	D	95.9	Very high	97.8	Very high	28 Å²	28	35.5 Å²	35.5	15%	0.15	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	-124.9	-166.4	-52.8	-39.1	0	0	0	110.4	H27 S28 T55	H27-D53 WeakPolarHBondContact CA-OD1 3.32Å; H27-D53 IonicContact CE1-OD2 2.74Å; H27-D53 IonicContact CG-OD2 3.38Å; H27-D53 IonicContact ND1-OD1 3.68Å; H27-D53 IonicContact ND1-OD2 2.71Å; H27-D53 PolarHBondContact ND1-OD2 3.12Å; S28-D53 PolarHBondContact N-OD1 2.92Å; S28-D53 PolarHBondContact O-N 2.68Å; D53-T55 VanDerWaalsContact C-N 3.34Å
54	D	95.7	Very high	98	Very high	63 Å²	63	32.7 Å²	32.7	34%	0.337	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	8.2	178.9	-61.1	-56.4	0	0	0	113.6	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 2.96Å; D54-Y233 HydrophobicContact CB-CE2 4.02Å; D54-P234 VanDerWaalsContact OD2-CB 3.29Å; D54-P234 WeakPolarHBondContact OD2-CB 3.42Å; D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.41Å; D54-A235 PolarHBondContact OD2-N 3.24Å; D54-F265 HydrophobicContact CB-CE2 3.76Å; D54-F265 HydrophobicContact CB-CZ 3.68Å
55	T	96.6	Very high	97.9	Very high	29 Å²	29	37 Å²	37	18%	0.178	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.8	-176.6	-61.1	0	0	0	0	111.9	Y51 V52 D53 F57 A73 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.42Å; Y51-T55 VanDerWaalsContact CD1-C 3.49Å; V52-T55 PolarHBondContact N-O 3.48Å; V52-T55 WeakPolarHBondContact O-CB 3.04Å; V52-T55 PolarHBondContact O-N 2.85Å; D53-T55 VanDerWaalsContact C-N 3.34Å; T55-F57 PolarHBondContact O-N 3.18Å; T55-A73 HydrophobicContact CG2-CB 4.43Å; T55-L203 HydrophobicContact CG2-CD2 4.11Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.37Å; T55-Y233 PolarHBondContact OG1-OH 2.92Å
56	Q	97.6	Very high	97.8	Very high	53 Å²	53	36.6 Å²	36.6	25%	0.248	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	129.4	172.9	-166.4	-179.7	4.8	0	0	110.4	G50 Y51 V58 R72	G50-Q56 WeakPolarHBondContact O-CA 3.35Å; Y51-Q56 HydrophobicContact CD1-CB 4.03Å; Y51-Q56 VanDerWaalsContact CD1-N 3.31Å; Y51-Q56 HydrophobicContact CD2-CG 4.36Å; Y51-Q56 HydrophobicContact CE1-CB 3.53Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.06Å; Y51-Q56 HydrophobicContact CE2-CG 3.85Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å; Q56-V58 PolarHBondContact NE2-O 3.19Å; Q56-R72 HydrophobicContact CB-CB 4.49Å; Q56-R72 HydrophobicContact CG-CB 4.12Å; Q56-R72 HydrophobicContact CG-CG 4.34Å; Q56-R72 CarbonylContact O-C 3.55Å
57	F	98.1	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	-121.1	-22.9	-179.6	75.7	-83	0	0	0	114.4	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.44Å; M29-F57 HydrophobicContact SD-CZ 4.35Å; Y31-F57 HydrophobicContact CE1-CZ 4.03Å; Y31-F57 AromaticContact CZ-CZ 3.75Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.32Å; G50-F57 WeakPolarHBondContact O-CD1 3.41Å; G50-F57 PolarHBondContact O-N 3.22Å; V52-F57 HydrophobicContact CG2-CD1 3.99Å; V52-F57 HydrophobicContact CG2-CE1 4.02Å; T55-F57 PolarHBondContact O-N 3.18Å; F57-R72 PolarHBondContact O-N 2.7Å; F57-A73 HydrophobicContact CB-CB 4.08Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.34Å; F57-W75 HydrophobicContact CB-CZ3 3.88Å; F57-W75 AromaticContact CD1-CH2 3.97Å; F57-W75 HydrophobicContact CD1-CH2 3.97Å; F57-W75 AromaticContact CD2-CH2 3.76Å; F57-W75 HydrophobicContact CD2-CH2 3.76Å; F57-W75 AromaticContact CD2-CZ3 3.98Å; F57-W75 HydrophobicContact CD2-CZ3 3.98Å; F57-W75 AromaticContact CG-CH2 3.36Å; F57-W75 HydrophobicContact CG-CH2 3.36Å; F57-W75 HydrophobicContact CG-CZ2 4.08Å; F57-W75 HydrophobicContact CG-CZ3 4.05Å; F57-V76 HydrophobicContact CB-CG1 4.38Å; F57-V76 HydrophobicContact CD2-CB 4.36Å; F57-V76 HydrophobicContact CD2-CG1 4.49Å; F57-V76 HydrophobicContact CD2-CG2 4.1Å; F57-V76 VanDerWaalsContact O-CG1 3.25Å; F57-V76 WeakPolarHBondContact O-CG1 3.45Å; F57-Y195 HydrophobicContact CD2-CE2 4.44Å; F57-Y195 HydrophobicContact CE2-CD2 4.29Å; F57-Y195 AromaticContact CE2-CE2 3.63Å; F57-Y195 HydrophobicContact CE2-CE2 3.63Å; F57-Y195 AromaticContact CE2-CZ 3.8Å; F57-Y195 HydrophobicContact CZ-CD2 4.33Å; F57-Y195 AromaticContact CZ-CE2 3.76Å; F57-Y195 HydrophobicContact CZ-CE2 3.76Å
58	V	98.4	Very high	97.7	Very high	1 Å²	1	43 Å²	43	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	153.6	176.5	-73.3	0	0	0	0	112.4	Y31 V49 G50 Q56 E70 W84 Y91	Y31-V58 HydrophobicContact CE1-CG2 3.93Å; V49-V58 WeakPolarHBondContact CA-O 3.35Å; G50-V58 PolarHBondContact N-O 2.88Å; G50-V58 PolarHBondContact O-N 3.17Å; Q56-V58 PolarHBondContact NE2-O 3.19Å; V58-E70 WeakPolarHBondContact CA-O 3.25Å; V58-W84 HydrophobicContact CG1-CH2 3.93Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.45Å
59	R	98.4	Very high	97.6	Very high	83 Å²	83	43.3 Å²	43.3	31%	0.313	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	146.7	171.3	178.6	173.9	169.7	174.3	-2.5	110.9	S48 V49 D61 E70 R72	S48-R59 CarbonylContact O-C 3.57Å; S48-R59 WeakPolarHBondContact O-CA 3.33Å; V49-R59 HydrophobicContact CG1-CG 4.28Å; R59-D61 IonicContact NH2-OD2 3.76Å; R59-D61 PolarHBondContact NH2-OD2 3.06Å; R59-E70 PolarHBondContact N-O 3.49Å; R59-E70 PolarHBondContact O-N 3.04Å; R59-R72 HydrophobicContact CB-CG 3.91Å
60	F	98.8	Very high	97.6	Very high	3 Å²	3	44.8 Å²	44.8	1%	0.013	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	140.7	165	177.5	-85.3	0	0	0	109.6	F46 I47 S48 P67 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.68Å; F46-F60 HydrophobicContact CD1-CD1 3.68Å; F46-F60 AromaticContact CD1-CE1 3.78Å; F46-F60 HydrophobicContact CD1-CE1 3.78Å; F46-F60 AromaticContact CE1-CD1 3.86Å; F46-F60 HydrophobicContact CE1-CD1 3.86Å; F46-F60 HydrophobicContact CE1-CE1 4.23Å; I47-F60 WeakPolarHBondContact CA-O 3.47Å; S48-F60 PolarHBondContact N-O 3.03Å; S48-F60 PolarHBondContact O-N 2.71Å; F60-P67 HydrophobicContact CE2-CB 3.84Å; F60-P67 HydrophobicContact CZ-CB 3.65Å; F60-Y91 HydrophobicContact CB-CD1 4.24Å; F60-Y91 HydrophobicContact CB-CD2 3.57Å; F60-Y91 HydrophobicContact CB-CE2 4.02Å; F60-Y91 HydrophobicContact CB-CG 3.7Å; F60-Y91 HydrophobicContact CD1-CG 4.37Å; F60-Y91 AromaticContact CD2-CD2 3.68Å; F60-Y91 HydrophobicContact CD2-CD2 3.68Å; F60-Y91 AromaticContact CD2-CG 3.93Å; F60-Y91 HydrophobicContact CD2-CG 3.93Å; F60-Y91 AromaticContact CG-CD2 3.8Å; F60-Y91 HydrophobicContact CG-CD2 3.8Å; F60-Y91 AromaticContact CG-CG 3.75Å; F60-Y91 HydrophobicContact CG-CG 3.75Å; F60-K92 HydrophobicContact CE2-CG 4.3Å; F60-K92 HydrophobicContact CZ-CG 4.07Å
61	D	98.6	Very high	97.6	Very high	17 Å²	17	47 Å²	47	9%	0.091	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	118.5	175.1	-164.9	-23.4	0	0	0	109.7	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 3.41Å; R45-D61 IonicContact CZ-OD2 2.81Å; R45-D61 IonicContact NE-OD1 3.89Å; R45-D61 PolarHBondContact NE-OD1 3.34Å; R45-D61 VanDerWaalsContact NE-OD1 3.14Å; R45-D61 IonicContact NE-OD2 3.75Å; R45-D61 IonicContact NH2-OD1 3.84Å; R45-D61 IonicContact NH2-OD2 2.81Å; R45-D61 PolarHBondContact NH2-OD2 3.46Å; R59-D61 IonicContact NH2-OD2 3.76Å; R59-D61 PolarHBondContact NH2-OD2 3.06Å; D61-D63 PolarHBondContact O-N 2.94Å; D61-D63 PolarHBondContact OD1-N 3.37Å; D61-D63 VanDerWaalsContact OD1-N 3.11Å; D61-A64 HydrophobicContact CB-CB 4.45Å; D61-A64 VanDerWaalsContact O-CB 3.31Å; D61-A64 WeakPolarHBondContact O-CB 3.17Å; D61-A64 PolarHBondContact O-N 2.91Å; D61-A64 VanDerWaalsContact O-N 3.17Å
62	S	98.3	Very high	97.5	Very high	34 Å²	34	49 Å²	49	24%	0.238	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.9	179.9	61.6	0	0	0	0	114	F46 A64 P67	F46-S62 PolarHBondContact N-OG 3.41Å; F46-S62 WeakPolarHBondContact O-CB 3.43Å; F46-S62 PolarHBondContact O-N 2.91Å; F46-S62 PolarHBondContact O-OG 2.8Å; F46-S62 VanDerWaalsContact O-OG 3.06Å; S62-A64 VanDerWaalsContact C-N 3.34Å; S62-P67 WeakPolarHBondContact O-CG 3.48Å
63	D	97.6	Very high	97.4	Very high	71 Å²	71	49.2 Å²	49.2	38%	0.38	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-3.4	178.4	-82	-3	0	0	0	112.6	R38 R45 D61	R38-D63 IonicContact CZ-OD1 3.7Å; R38-D63 IonicContact CZ-OD2 2.73Å; R38-D63 IonicContact NH1-OD1 3.82Å; R38-D63 PolarHBondContact NH1-OD1 3.33Å; R38-D63 IonicContact NH1-OD2 3.1Å; R38-D63 PolarHBondContact NH1-OD2 3.01Å; R38-D63 IonicContact NH2-OD1 2.76Å; R38-D63 PolarHBondContact NH2-OD1 2.92Å; R38-D63 IonicContact NH2-OD2 3.27Å; R45-D63 VanDerWaalsContact CD-OD2 3.24Å; R45-D63 WeakPolarHBondContact CD-OD2 3.35Å; R45-D63 HydrophobicContact CG-CB 4.43Å; R45-D63 IonicContact NE-OD2 2.88Å; D61-D63 PolarHBondContact O-N 2.94Å; D61-D63 PolarHBondContact OD1-N 3.37Å; D61-D63 VanDerWaalsContact OD1-N 3.11Å
64	A	97.3	Very high	97.4	Very high	33 Å²	33	52.8 Å²	52.8	27%	0.273	30%	0.296	S	S	.	.	S	Bend	trans	-62.4	149.5	174.4	0	0	0	0	0	111	D61 S62 S66 P67	D61-A64 HydrophobicContact CB-CB 4.45Å; D61-A64 VanDerWaalsContact O-CB 3.31Å; D61-A64 WeakPolarHBondContact O-CB 3.17Å; D61-A64 PolarHBondContact O-N 2.91Å; D61-A64 VanDerWaalsContact O-N 3.17Å; S62-A64 VanDerWaalsContact C-N 3.34Å; A64-S66 PolarHBondContact O-N 2.94Å; A64-S66 VanDerWaalsContact O-N 3.15Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.42Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.48Å
65	A	96.8	Very high	97.4	Very high	119 Å²	119	50.5 Å²	50.5	98%	0.983	28%	0.283	S	S	*	.	S	Bend	trans	-58.6	-30.8	179.8	0	0	0	0	0	113.2
66	S	96.1	Very high	97.5	Very high	82 Å²	82	49.1 Å²	49.1	57%	0.573	27%	0.274	S	S	*	.	S	Bend	trans	-135.4	89.5	171.4	-173.4	0	0	0	0	109.1	A64 R68	A64-S66 PolarHBondContact O-N 2.94Å; A64-S66 VanDerWaalsContact O-N 3.15Å; S66-R68 PolarHBondContact O-N 2.9Å; S66-R68 VanDerWaalsContact O-N 3.1Å
67	P	97.1	Very high	97.4	Very high	37 Å²	37	52.4 Å²	52.4	24%	0.24	29%	0.29	C	S	.	.			trans	-64.6	112.5	-174.9	-24	35.3	0	0	0	112	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.84Å; F60-P67 HydrophobicContact CZ-CB 3.65Å; S62-P67 WeakPolarHBondContact O-CG 3.48Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.42Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.48Å; P67-K92 WeakPolarHBondContact O-CE 3.4Å; P67-K92 PolarHBondContact O-NZ 2.84Å
68	R	97.8	Very high	97.2	Very high	150 Å²	150	58.2 Å²	58.2	57%	0.566	32%	0.317	S	S	*	.			trans	-147.2	160.1	176.9	63.7	-176.9	174.8	175.5	0.3	110.6	S66 E70 T88	S66-R68 PolarHBondContact O-N 2.9Å; S66-R68 VanDerWaalsContact O-N 3.1Å; R68-E70 HydrophobicContact CG-CG 4.39Å; R68-E70 PolarHBondContact O-N 2.67Å; R68-T88 HydrophobicContact CB-CG2 4.16Å
69	G	97.6	Very high	97.1	Very high	6 Å²	6	58.7 Å²	58.7	6%	0.062	32%	0.319	C	S	.	.			trans	-64.5	130.9	168.9	0	0	0	0	0	109.7	T88	G69-T88 PolarHBondContact N-OG1 3.21Å
70	E	97.8	Very high	97	Very high	60 Å²	60	56.5 Å²	56.5	28%	0.28	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.6	-179	-64.3	178.7	160.6	0	0	110	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.25Å; R59-E70 PolarHBondContact N-O 3.49Å; R59-E70 PolarHBondContact O-N 3.04Å; R68-E70 HydrophobicContact CG-CG 4.39Å; R68-E70 PolarHBondContact O-N 2.67Å; E70-R72 IonicContact OE2-CZ 3.09Å; E70-R72 IonicContact OE2-NH2 2.64Å; E70-R72 PolarHBondContact OE2-NH2 2.62Å
71	P	97.9	Very high	96.9	Very high	48 Å²	48	61 Å²	61	31%	0.312	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	145	172.9	28.6	-33.9	0	0	0	110.7	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.76Å; P71-E77 HydrophobicContact CB-CG 3.73Å; P71-E77 HydrophobicContact CG-CG 3.95Å; P71-W84 HydrophobicContact CB-CH2 3.62Å; P71-W84 HydrophobicContact CB-CZ2 3.82Å; P71-W84 HydrophobicContact CG-CH2 4.23Å; P71-W84 HydrophobicContact CG-CZ2 4.24Å
72	R	97.4	Very high	96.8	Very high	113 Å²	113	68.1 Å²	68.1	43%	0.426	38%	0.384	S	S	.	.			trans	-126.9	-1.8	175.1	-60.7	-64.1	171.4	179.9	-2.1	113.2	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CB-CB 4.49Å; Q56-R72 HydrophobicContact CG-CB 4.12Å; Q56-R72 HydrophobicContact CG-CG 4.34Å; Q56-R72 CarbonylContact O-C 3.55Å; F57-R72 PolarHBondContact O-N 2.7Å; R59-R72 HydrophobicContact CB-CG 3.91Å; E70-R72 IonicContact OE2-CZ 3.09Å; E70-R72 IonicContact OE2-NH2 2.64Å; E70-R72 PolarHBondContact OE2-NH2 2.62Å
73	A	96	Very high	96.8	Very high	3 Å²	3	66.8 Å²	66.8	3%	0.025	37%	0.374	C	S	.	.	S	Bend	trans	-136.5	143.3	172.7	0	0	0	0	0	110.9	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.43Å; F57-A73 HydrophobicContact CB-CB 4.08Å; A73-W75 VanDerWaalsContact C-N 3.27Å; A73-W75 HydrophobicContact CB-CD2 4.13Å; A73-W75 HydrophobicContact CB-CG 4.34Å; A73-W75 HydrophobicContact CB-CZ2 3.97Å; A73-W75 PolarHBondContact O-N 2.81Å; A73-V76 WeakPolarHBondContact O-CG1 3.49Å; A73-V76 PolarHBondContact O-N 3.41Å
74	P	96.1	Very high	96.8	Very high	103 Å²	103	65.3 Å²	65.3	67%	0.669	36%	0.363	S	S	*	.	H	α-helix	trans	-57.7	-36.7	-177.4	-26.9	35.1	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 2.95Å; P74-E77 WeakPolarHBondContact O-CB 3.32Å; P74-E77 PolarHBondContact O-N 3.05Å; P74-E77 VanDerWaalsContact O-N 3.11Å
75	W	95.8	Very high	96.8	Very high	16 Å²	16	68.8 Å²	68.8	6%	0.061	38%	0.377	C	S	.	.	H	α-helix	trans	-70.5	-13.9	-175.7	53	-106.5	0	0	0	114.5	V52 F57 A73 Q78 Y195 N198 T202 L203	V52-W75 HydrophobicContact CB-CH2 4.36Å; V52-W75 HydrophobicContact CB-CZ2 4.45Å; V52-W75 HydrophobicContact CG2-CH2 3.86Å; V52-W75 HydrophobicContact CG2-CZ2 4.43Å; F57-W75 HydrophobicContact CB-CH2 3.1Å; F57-W75 HydrophobicContact CB-CZ2 3.34Å; F57-W75 HydrophobicContact CB-CZ3 3.88Å; F57-W75 AromaticContact CD1-CH2 3.97Å; F57-W75 HydrophobicContact CD1-CH2 3.97Å; F57-W75 AromaticContact CD2-CH2 3.76Å; F57-W75 HydrophobicContact CD2-CH2 3.76Å; F57-W75 AromaticContact CD2-CZ3 3.98Å; F57-W75 HydrophobicContact CD2-CZ3 3.98Å; F57-W75 AromaticContact CG-CH2 3.36Å; F57-W75 HydrophobicContact CG-CH2 3.36Å; F57-W75 HydrophobicContact CG-CZ2 4.08Å; F57-W75 HydrophobicContact CG-CZ3 4.05Å; A73-W75 VanDerWaalsContact C-N 3.27Å; A73-W75 HydrophobicContact CB-CD2 4.13Å; A73-W75 HydrophobicContact CB-CG 4.34Å; A73-W75 HydrophobicContact CB-CZ2 3.97Å; A73-W75 PolarHBondContact O-N 2.81Å; W75-Q78 WeakPolarHBondContact O-CG 3.24Å; W75-Q78 PolarHBondContact O-NE2 2.8Å; W75-Y195 HydrophobicContact CE3-CD1 4.29Å; W75-Y195 HydrophobicContact CH2-CG 4.16Å; W75-Y195 AromaticContact CZ3-CD1 3.63Å; W75-Y195 HydrophobicContact CZ3-CD1 3.63Å; W75-Y195 HydrophobicContact CZ3-CD2 4.32Å; W75-Y195 HydrophobicContact CZ3-CE1 4.36Å; W75-Y195 AromaticContact CZ3-CG 3.61Å; W75-Y195 HydrophobicContact CZ3-CG 3.61Å; W75-N198 WeakPolarHBondContact CB-O 3.43Å; W75-T202 VanDerWaalsContact CD1-OG1 3.24Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.36Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.12Å; W75-L203 HydrophobicContact CZ2-CG 4.38Å
76	V	97.2	Very high	96.9	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-94	-16.5	172.4	71.9	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 4.49Å; F57-V76 HydrophobicContact CD2-CG2 4.1Å; F57-V76 VanDerWaalsContact O-CG1 3.25Å; F57-V76 WeakPolarHBondContact O-CG1 3.45Å; P71-V76 HydrophobicContact CB-CG1 3.76Å; A73-V76 WeakPolarHBondContact O-CG1 3.49Å; A73-V76 PolarHBondContact O-N 3.41Å; P74-V76 PolarHBondContact O-N 2.95Å; V76-Q78 PolarHBondContact O-N 3.34Å; V76-E79 HydrophobicContact CG2-CG 3.95Å; V76-E79 VanDerWaalsContact O-CB 3.32Å; V76-E79 WeakPolarHBondContact O-CB 3.47Å; V76-E79 WeakPolarHBondContact O-CG 3.4Å; V76-E79 PolarHBondContact O-N 3.36Å; V76-Y83 HydrophobicContact CG2-CE1 4.17Å; V76-W84 HydrophobicContact CG1-CH2 4.06Å; V76-W84 HydrophobicContact CG1-CZ2 4.32Å; V76-W84 HydrophobicContact CG2-CH2 3.95Å; V76-W84 HydrophobicContact CG2-CZ2 4.03Å; V76-W84 WeakPolarHBondContact O-CZ2 3.36Å; V76-Y195 HydrophobicContact CG2-CE1 4.42Å
77	E	95.5	Very high	96.9	Very high	122 Å²	122	64.7 Å²	64.7	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-62.9	-26	-179.8	-64.7	-177.7	-179.8	0	0	112.9	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.73Å; P71-E77 HydrophobicContact CG-CG 3.95Å; P74-E77 WeakPolarHBondContact O-CB 3.32Å; P74-E77 PolarHBondContact O-N 3.05Å; P74-E77 VanDerWaalsContact O-N 3.11Å; E77-E79 PolarHBondContact O-N 2.94Å
78	Q	94.6	Very high	97	Very high	121 Å²	121	63.5 Å²	63.5	57%	0.565	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.2	175.3	67.4	-175	-27.3	0	0	114	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.24Å; W75-Q78 PolarHBondContact O-NE2 2.8Å; V76-Q78 PolarHBondContact O-N 3.34Å; Q78-N198 PolarHBondContact NE2-ND2 3.43Å
79	E	96.7	Very high	97	Very high	12 Å²	12	61.3 Å²	61.3	6%	0.056	31%	0.312	C	S	.	.	S	Bend	trans	-65.2	135.5	174.8	-67.3	-61.3	150.3	0	0	110.9	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 3.95Å; V76-E79 VanDerWaalsContact O-CB 3.32Å; V76-E79 WeakPolarHBondContact O-CB 3.47Å; V76-E79 WeakPolarHBondContact O-CG 3.4Å; V76-E79 PolarHBondContact O-N 3.36Å; E77-E79 PolarHBondContact O-N 2.94Å; E79-Y83 HydrophobicContact CB-CD1 3.59Å; E79-Y83 HydrophobicContact CB-CD2 4.37Å; E79-Y83 HydrophobicContact CB-CE1 4.17Å; E79-Y83 HydrophobicContact CB-CG 3.72Å; E79-Y83 HydrophobicContact CG-CD1 4.13Å; E79-Y83 HydrophobicContact CG-CD2 4.3Å; E79-Y83 HydrophobicContact CG-CE1 4.31Å; E79-Y83 HydrophobicContact CG-CE2 4.45Å; E79-Y83 HydrophobicContact CG-CG 4.14Å; E79-W84 PolarHBondContact O-NE1 3.03Å; E79-R194 IonicContact OE1-CZ 3.73Å; E79-R194 VanDerWaalsContact OE1-CZ 3.22Å; E79-R194 IonicContact OE1-NE 3.29Å; E79-R194 PolarHBondContact OE1-NE 2.88Å; E79-R194 IonicContact OE1-NH2 3.45Å; E79-R194 PolarHBondContact OE1-NH2 3.35Å; E79-R194 IonicContact OE2-CZ 3.47Å; E79-R194 IonicContact OE2-NE 3.93Å; E79-R194 IonicContact OE2-NH2 2.78Å; E79-R194 PolarHBondContact OE2-NH2 3.31Å; E79-N198 PolarHBondContact OE1-ND2 2.87Å
80	G	95.9	Very high	97	Very high	36 Å²	36	64.3 Å²	64.3	37%	0.371	32%	0.324	S	S	.	.			trans	-70.4	170.1	-174.4	0	0	0	0	0	114.2	E82 Y83 W84	G80-E82 PolarHBondContact O-N 3.19Å; G80-Y83 WeakPolarHBondContact O-CB 3.03Å; G80-Y83 PolarHBondContact O-N 3.3Å; G80-W84 PolarHBondContact O-N 2.96Å
81	P	96.8	Very high	97	Very high	98 Å²	98	62 Å²	62	64%	0.636	31%	0.312	S	S	*	.	H	α-helix	trans	-58	-34.7	-178.5	23.1	-33.6	0	0	0	113.3	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 2.89Å; P81-W84 PolarHBondContact O-N 2.89Å; P81-D85 WeakPolarHBondContact O-CB 3.33Å; P81-D85 PolarHBondContact O-N 2.8Å
82	E	97.4	Very high	97.1	Very high	166 Å²	166	63.7 Å²	63.7	78%	0.776	32%	0.315	S	S	*	.	H	α-helix	trans	-60.6	-35.1	177.6	-63.1	178.5	179.9	0	0	112.9	G80 R86	G80-E82 PolarHBondContact O-N 3.19Å; E82-R86 VanDerWaalsContact O-CB 3.22Å; E82-R86 WeakPolarHBondContact O-CB 3.39Å; E82-R86 PolarHBondContact O-N 2.88Å
83	Y	97.4	Very high	97.1	Very high	7 Å²	7	66.3 Å²	66.3	3%	0.027	33%	0.325	C	S	.	.	H	α-helix	trans	-64.5	-53.5	174.1	170.3	-89.2	0	0	0	110	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.17Å; E79-Y83 HydrophobicContact CB-CD1 3.59Å; E79-Y83 HydrophobicContact CB-CD2 4.37Å; E79-Y83 HydrophobicContact CB-CE1 4.17Å; E79-Y83 HydrophobicContact CB-CG 3.72Å; E79-Y83 HydrophobicContact CG-CD1 4.13Å; E79-Y83 HydrophobicContact CG-CD2 4.3Å; E79-Y83 HydrophobicContact CG-CE1 4.31Å; E79-Y83 HydrophobicContact CG-CE2 4.45Å; E79-Y83 HydrophobicContact CG-CG 4.14Å; G80-Y83 WeakPolarHBondContact O-CB 3.03Å; G80-Y83 PolarHBondContact O-N 3.3Å; P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 2.89Å; Y83-D85 VanDerWaalsContact C-N 3.33Å; Y83-D85 PolarHBondContact O-N 3.06Å; Y83-R86 PolarHBondContact O-N 3.19Å; Y83-E87 HydrophobicContact CD1-CG 4.25Å; Y83-E87 HydrophobicContact CD2-CG 4.22Å; Y83-E87 HydrophobicContact CE1-CG 3.88Å; Y83-E87 HydrophobicContact CE2-CG 3.88Å; Y83-E87 HydrophobicContact CG-CG 4.4Å; Y83-E87 WeakPolarHBondContact O-CG 3.11Å; Y83-E87 PolarHBondContact O-N 2.82Å; Y83-W191 AromaticContact CD2-CH2 3.52Å; Y83-W191 HydrophobicContact CD2-CH2 3.52Å; Y83-W191 HydrophobicContact CD2-CZ2 4.28Å; Y83-W191 AromaticContact CD2-CZ3 3.74Å; Y83-W191 HydrophobicContact CD2-CZ3 3.74Å; Y83-W191 HydrophobicContact CE2-CE3 4.16Å; Y83-W191 AromaticContact CE2-CH2 3.81Å; Y83-W191 HydrophobicContact CE2-CH2 3.81Å; Y83-W191 HydrophobicContact CE2-CZ2 4.49Å; Y83-W191 AromaticContact CE2-CZ3 3.6Å; Y83-W191 HydrophobicContact CE2-CZ3 3.6Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.25Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.46Å; Y83-Y195 PolarHBondContact OH-OH 3.2Å
84	W	98	Very high	97.2	Very high	39 Å²	39	68.6 Å²	68.6	15%	0.148	34%	0.335	C	S	.	.	H	α-helix	trans	-63.5	-38.3	-176.9	-66.9	111.6	0	0	0	112.9	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.93Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å; P71-W84 HydrophobicContact CB-CH2 3.62Å; P71-W84 HydrophobicContact CB-CZ2 3.82Å; P71-W84 HydrophobicContact CG-CH2 4.23Å; P71-W84 HydrophobicContact CG-CZ2 4.24Å; V76-W84 HydrophobicContact CG1-CH2 4.06Å; V76-W84 HydrophobicContact CG1-CZ2 4.32Å; V76-W84 HydrophobicContact CG2-CH2 3.95Å; V76-W84 HydrophobicContact CG2-CZ2 4.03Å; V76-W84 WeakPolarHBondContact O-CZ2 3.36Å; E79-W84 PolarHBondContact O-NE1 3.03Å; G80-W84 PolarHBondContact O-N 2.96Å; P81-W84 PolarHBondContact O-N 2.89Å; W84-T88 WeakPolarHBondContact O-CB 2.94Å; W84-T88 PolarHBondContact O-N 2.83Å; W84-T88 PolarHBondContact O-OG1 2.84Å
85	D	97.9	Very high	97.3	Very high	107 Å²	107	64.6 Å²	64.6	57%	0.572	31%	0.31	S	S	*	.	H	α-helix	trans	-64.4	-46.7	174.4	-75.5	-21.5	0	0	0	110.8	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.33Å; P81-D85 PolarHBondContact O-N 2.8Å; Y83-D85 VanDerWaalsContact C-N 3.33Å; Y83-D85 PolarHBondContact O-N 3.06Å; D85-T88 PolarHBondContact O-N 3.12Å; D85-Q89 VanDerWaalsContact O-CG 3.29Å; D85-Q89 WeakPolarHBondContact O-CG 3.16Å; D85-Q89 PolarHBondContact O-N 2.88Å
86	R	97.4	Very high	97.4	Very high	106 Å²	106	69 Å²	69	40%	0.4	33%	0.332	S	S	.	.	H	α-helix	trans	-62.9	-47.3	178.6	-175.7	-178.2	66	-145.2	-6	112.1	E82 Y83 Q89 K90	E82-R86 VanDerWaalsContact O-CB 3.22Å; E82-R86 WeakPolarHBondContact O-CB 3.39Å; E82-R86 PolarHBondContact O-N 2.88Å; Y83-R86 PolarHBondContact O-N 3.19Å; R86-Q89 PolarHBondContact O-N 3.05Å; R86-K90 WeakPolarHBondContact O-CG 3.23Å; R86-K90 PolarHBondContact O-N 3.31Å
87	E	97.5	Very high	97.4	Very high	8 Å²	8	70.9 Å²	70.9	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-65.4	-42	178.8	-63.3	-42.4	119.1	0	0	110.9	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.25Å; Y83-E87 HydrophobicContact CD2-CG 4.22Å; Y83-E87 HydrophobicContact CE1-CG 3.88Å; Y83-E87 HydrophobicContact CE2-CG 3.88Å; Y83-E87 HydrophobicContact CG-CG 4.4Å; Y83-E87 WeakPolarHBondContact O-CG 3.11Å; Y83-E87 PolarHBondContact O-N 2.82Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 2.92Å; E87-K90 WeakPolarHBondContact O-CB 3.2Å; E87-K90 PolarHBondContact O-N 2.91Å; E87-K90 VanDerWaalsContact O-N 3.08Å; E87-K90 IonicContact OE1-NZ 3.53Å; E87-K90 PolarHBondContact OE1-NZ 3.03Å; E87-K90 VanDerWaalsContact OE2-CD 3.32Å; E87-K90 WeakPolarHBondContact OE2-CD 3.47Å; E87-K90 IonicContact OE2-NZ 2.71Å; E87-K90 PolarHBondContact OE2-NZ 3.19Å; E87-Y91 HydrophobicContact CB-CE2 4Å; E87-Y91 WeakPolarHBondContact O-CD2 3.3Å; E87-Y91 PolarHBondContact O-N 3.27Å
88	T	98.4	Very high	97.6	Very high	12 Å²	12	65.3 Å²	65.3	7%	0.074	32%	0.321	C	S	.	.	H	α-helix	trans	-56.6	-43.3	173.3	-64.3	0	0	0	0	112.3	R68 G69 W84 D85 Y91 K92	R68-T88 HydrophobicContact CB-CG2 4.16Å; G69-T88 PolarHBondContact N-OG1 3.21Å; W84-T88 WeakPolarHBondContact O-CB 2.94Å; W84-T88 PolarHBondContact O-N 2.83Å; W84-T88 PolarHBondContact O-OG1 2.84Å; D85-T88 PolarHBondContact O-N 3.12Å; T88-Y91 PolarHBondContact O-N 2.83Å; T88-K92 HydrophobicContact CG2-CD 4.17Å; T88-K92 WeakPolarHBondContact O-CG 3.43Å; T88-K92 PolarHBondContact O-N 2.79Å
89	Q	98.3	Very high	97.7	Very high	104 Å²	104	63.1 Å²	63.1	49%	0.486	31%	0.308	S	S	.	.	H	α-helix	trans	-69.4	-32.5	177.3	-68.5	-59.6	-25	0	0	112.8	D85 R86 E87 R93	D85-Q89 VanDerWaalsContact O-CG 3.29Å; D85-Q89 WeakPolarHBondContact O-CG 3.16Å; D85-Q89 PolarHBondContact O-N 2.88Å; R86-Q89 PolarHBondContact O-N 3.05Å; E87-Q89 VanDerWaalsContact C-N 3.3Å; E87-Q89 PolarHBondContact O-N 2.92Å; Q89-R93 WeakPolarHBondContact O-CB 3.39Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 2.89Å; Q89-R93 PolarHBondContact O-NE 2.97Å
90	K	97.4	Very high	97.8	Very high	70 Å²	70	65.1 Å²	65.1	30%	0.304	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-50.3	171.7	-72.8	171.2	178.3	173.1	0	110.8	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.23Å; R86-K90 PolarHBondContact O-N 3.31Å; E87-K90 WeakPolarHBondContact O-CB 3.2Å; E87-K90 PolarHBondContact O-N 2.91Å; E87-K90 VanDerWaalsContact O-N 3.08Å; E87-K90 IonicContact OE1-NZ 3.53Å; E87-K90 PolarHBondContact OE1-NZ 3.03Å; E87-K90 VanDerWaalsContact OE2-CD 3.32Å; E87-K90 WeakPolarHBondContact OE2-CD 3.47Å; E87-K90 IonicContact OE2-NZ 2.71Å; E87-K90 PolarHBondContact OE2-NZ 3.19Å; K90-K92 VanDerWaalsContact C-N 3.32Å; K90-K92 PolarHBondContact O-N 2.67Å; K90-R93 PolarHBondContact O-N 2.84Å; K90-R93 VanDerWaalsContact O-N 3.12Å; K90-Q94 PolarHBondContact O-N 2.86Å
91	Y	98.4	Very high	97.8	Very high	11 Å²	11	66 Å²	66	4%	0.043	32%	0.317	C	S	.	.	H	α-helix	trans	-58.5	-42.8	177.8	-60.8	-48.4	0	0	0	112.4	S48 V58 F60 E87 T88 R93 Q94 A95	S48-Y91 VanDerWaalsContact OG-CE1 3.23Å; S48-Y91 WeakPolarHBondContact OG-CE1 3.48Å; V58-Y91 WeakPolarHBondContact CG2-OH 3.45Å; F60-Y91 HydrophobicContact CB-CD1 4.24Å; F60-Y91 HydrophobicContact CB-CD2 3.57Å; F60-Y91 HydrophobicContact CB-CE2 4.02Å; F60-Y91 HydrophobicContact CB-CG 3.7Å; F60-Y91 HydrophobicContact CD1-CG 4.37Å; F60-Y91 AromaticContact CD2-CD2 3.68Å; F60-Y91 HydrophobicContact CD2-CD2 3.68Å; F60-Y91 AromaticContact CD2-CG 3.93Å; F60-Y91 HydrophobicContact CD2-CG 3.93Å; F60-Y91 AromaticContact CG-CD2 3.8Å; F60-Y91 HydrophobicContact CG-CD2 3.8Å; F60-Y91 AromaticContact CG-CG 3.75Å; F60-Y91 HydrophobicContact CG-CG 3.75Å; E87-Y91 HydrophobicContact CB-CE2 4Å; E87-Y91 WeakPolarHBondContact O-CD2 3.3Å; E87-Y91 PolarHBondContact O-N 3.27Å; T88-Y91 PolarHBondContact O-N 2.83Å; Y91-R93 PolarHBondContact O-N 2.79Å; Y91-Q94 PolarHBondContact O-N 2.03Å; Y91-A95 WeakPolarHBondContact O-CB 3.49Å; Y91-A95 PolarHBondContact O-N 3.26Å
92	K	98.3	Very high	97.9	Very high	84 Å²	84	61.7 Å²	61.7	37%	0.365	29%	0.289	S	S	.	.	H	α-helix	trans	-63.4	-39.9	176.6	-74.3	177.8	179.4	175.6	0	112.6	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.3Å; F60-K92 HydrophobicContact CZ-CG 4.07Å; P67-K92 WeakPolarHBondContact O-CE 3.4Å; P67-K92 PolarHBondContact O-NZ 2.84Å; T88-K92 HydrophobicContact CG2-CD 4.17Å; T88-K92 WeakPolarHBondContact O-CG 3.43Å; T88-K92 PolarHBondContact O-N 2.79Å; K90-K92 VanDerWaalsContact C-N 3.32Å; K90-K92 PolarHBondContact O-N 2.67Å; K92-Q96 WeakPolarHBondContact O-CG 3.41Å; K92-Q96 PolarHBondContact O-N 3.05Å
93	R	98.3	Very high	97.9	Very high	167 Å²	167	59.8 Å²	59.8	63%	0.63	27%	0.274	S	S	*	.	H	α-helix	trans	-66.2	-43	175	-76.3	-174.7	-68.7	167.4	-0.9	111.5	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.39Å; Q89-R93 WeakPolarHBondContact O-CG 3.32Å; Q89-R93 PolarHBondContact O-N 2.89Å; Q89-R93 PolarHBondContact O-NE 2.97Å; K90-R93 PolarHBondContact O-N 2.84Å; K90-R93 VanDerWaalsContact O-N 3.12Å; Y91-R93 PolarHBondContact O-N 2.79Å; R93-Q96 PolarHBondContact O-N 3.33Å; R93-A97 PolarHBondContact O-N 2.74Å
94	Q	98.3	Very high	97.9	Very high	52 Å²	52	64.3 Å²	64.3	24%	0.243	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-44.7	177.9	-169.8	56.8	41.5	0	0	111.7	D33 F46 K90 Y91 Q96 A97 D98	D33-Q94 VanDerWaalsContact OD2-CG 3.31Å; D33-Q94 WeakPolarHBondContact OD2-CG 3.48Å; F46-Q94 HydrophobicContact CE2-CB 4.27Å; F46-Q94 HydrophobicContact CE2-CG 3.79Å; F46-Q94 HydrophobicContact CZ-CB 3.94Å; F46-Q94 HydrophobicContact CZ-CG 3.78Å; K90-Q94 PolarHBondContact O-N 2.86Å; Y91-Q94 PolarHBondContact O-N 2.03Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 2.8Å; Q94-A97 WeakPolarHBondContact O-CA 3.39Å; Q94-A97 WeakPolarHBondContact O-CB 3.46Å; Q94-A97 PolarHBondContact O-N 3.19Å; Q94-D98 PolarHBondContact NE2-OD1 2.9Å; Q94-D98 PolarHBondContact NE2-OD2 3.44Å; Q94-D98 PolarHBondContact O-N 2.98Å
95	A	98.3	Very high	97.9	Very high	18 Å²	18	62.8 Å²	62.8	15%	0.149	29%	0.289	C	S	.	.	H	α-helix	trans	-56.4	-39.9	174.7	0	0	0	0	0	112.9	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.69Å; F46-A95 HydrophobicContact CD1-CB 3.74Å; F46-A95 HydrophobicContact CD2-CB 4.1Å; F46-A95 HydrophobicContact CE1-CB 4.37Å; F46-A95 HydrophobicContact CG-CB 3.57Å; Y91-A95 WeakPolarHBondContact O-CB 3.49Å; Y91-A95 PolarHBondContact O-N 3.26Å; A95-R99 WeakPolarHBondContact O-CB 3.37Å; A95-R99 PolarHBondContact O-N 3.3Å
96	Q	98	Very high	97.8	Very high	110 Å²	110	60.6 Å²	60.6	51%	0.514	27%	0.272	S	S	.	.	H	α-helix	trans	-70.1	-39.6	175	-67.1	-58	-37.1	0	0	112.4	K92 R93 Q94 R99 V100	K92-Q96 WeakPolarHBondContact O-CG 3.41Å; K92-Q96 PolarHBondContact O-N 3.05Å; R93-Q96 PolarHBondContact O-N 3.33Å; Q94-Q96 VanDerWaalsContact C-N 3.28Å; Q94-Q96 PolarHBondContact O-N 2.8Å; Q96-R99 PolarHBondContact O-N 3.42Å; Q96-V100 WeakPolarHBondContact O-CG2 3.49Å; Q96-V100 PolarHBondContact O-N 2.95Å
97	A	97.7	Very high	97.8	Very high	39 Å²	39	57.6 Å²	57.6	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-46.8	175	0	0	0	0	0	110.8	R93 Q94 R99 V100 N101	R93-A97 PolarHBondContact O-N 2.74Å; Q94-A97 WeakPolarHBondContact O-CA 3.39Å; Q94-A97 WeakPolarHBondContact O-CB 3.46Å; Q94-A97 PolarHBondContact O-N 3.19Å; A97-R99 PolarHBondContact O-N 2.95Å; A97-V100 CarbonylContact O-C 3.56Å; A97-V100 WeakPolarHBondContact O-CA 3.41Å; A97-V100 WeakPolarHBondContact O-CB 3.48Å; A97-V100 PolarHBondContact O-N 3.34Å; A97-N101 VanDerWaalsContact O-CG 3.23Å; A97-N101 PolarHBondContact O-N 2.91Å; A97-N101 PolarHBondContact O-ND2 2.62Å
98	D	97.9	Very high	97.8	Very high	5 Å²	5	60 Å²	60	3%	0.027	28%	0.283	C	S	.	.	H	α-helix	trans	-67	-35.8	-179.8	-72.2	-14.5	0	0	0	112.7	A35 F46 Q94 V100 N101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.67Å; F46-D98 VanDerWaalsContact CE2-OD2 3.28Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.3Å; Q94-D98 PolarHBondContact NE2-OD1 2.9Å; Q94-D98 PolarHBondContact NE2-OD2 3.44Å; Q94-D98 PolarHBondContact O-N 2.98Å; D98-V100 VanDerWaalsContact C-N 3.27Å; D98-V100 PolarHBondContact O-N 2.94Å; D98-N101 PolarHBondContact O-N 2.85Å; D98-L102 WeakPolarHBondContact O-CB 3.16Å; D98-L102 VanDerWaalsContact O-CG 3.32Å; D98-L102 WeakPolarHBondContact O-CG 3.35Å; D98-L102 PolarHBondContact O-N 2.83Å; D98-L119 HydrophobicContact CB-CD2 4.11Å
99	R	97.7	Very high	97.8	Very high	75 Å²	75	62.6 Å²	62.6	28%	0.283	29%	0.293	S	S	.	.	H	α-helix	trans	-57.7	-40.1	169.3	177.7	-167.8	171.2	176.5	8.9	112.2	E43 P44 A95 Q96 A97 R103	E43-R99 IonicContact OE1-CZ 3.75Å; E43-R99 IonicContact OE1-NE 3.77Å; E43-R99 IonicContact OE1-NH1 3.19Å; E43-R99 PolarHBondContact OE1-NH1 2.96Å; E43-R99 IonicContact OE1-NH2 3.23Å; E43-R99 PolarHBondContact OE1-NH2 2.93Å; E43-R99 VanDerWaalsContact OE2-CD 3.24Å; E43-R99 WeakPolarHBondContact OE2-CD 3.32Å; E43-R99 IonicContact OE2-CZ 3.67Å; E43-R99 IonicContact OE2-NE 3.66Å; E43-R99 PolarHBondContact OE2-NE 3.46Å; E43-R99 IonicContact OE2-NH1 2.89Å; E43-R99 IonicContact OE2-NH2 3.56Å; E43-R99 PolarHBondContact OE2-NH2 3Å; E43-R99 VanDerWaalsContact OE2-NH2 3.11Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.16Å; A95-R99 WeakPolarHBondContact O-CB 3.37Å; A95-R99 PolarHBondContact O-N 3.3Å; Q96-R99 PolarHBondContact O-N 3.42Å; A97-R99 PolarHBondContact O-N 2.95Å; R99-R103 PolarHBondContact O-NE 2.81Å; R99-R103 VanDerWaalsContact O-NE 3.16Å
100	V	97.6	Very high	97.7	Very high	54 Å²	54	64.8 Å²	64.8	33%	0.327	31%	0.308	S	S	.	.	H	α-helix	trans	-71.9	-41.2	176.1	173.8	0	0	0	0	110.3	Q96 A97 D98 R103 K104	Q96-V100 WeakPolarHBondContact O-CG2 3.49Å; Q96-V100 PolarHBondContact O-N 2.95Å; A97-V100 CarbonylContact O-C 3.56Å; A97-V100 WeakPolarHBondContact O-CA 3.41Å; A97-V100 WeakPolarHBondContact O-CB 3.48Å; A97-V100 PolarHBondContact O-N 3.34Å; D98-V100 VanDerWaalsContact C-N 3.27Å; D98-V100 PolarHBondContact O-N 2.94Å; V100-R103 PolarHBondContact O-N 3.44Å; V100-K104 HydrophobicContact CG1-CD 4.25Å; V100-K104 PolarHBondContact O-N 3.47Å; V100-K104 VanDerWaalsContact O-N 3.08Å
101	N	97.9	Very high	97.7	Very high	54 Å²	54	64.3 Å²	64.3	29%	0.289	31%	0.306	S	S	.	.	H	α-helix	trans	-65.8	-42.6	-178.9	-67.8	-25.6	0	0	0	112	A97 D98 R103 K104 L105 L119	A97-N101 VanDerWaalsContact O-CG 3.23Å; A97-N101 PolarHBondContact O-N 2.91Å; A97-N101 PolarHBondContact O-ND2 2.62Å; D98-N101 PolarHBondContact O-N 2.85Å; N101-R103 VanDerWaalsContact C-N 3.27Å; N101-R103 PolarHBondContact O-N 3.43Å; N101-K104 WeakPolarHBondContact O-CB 3.48Å; N101-K104 PolarHBondContact O-N 3.16Å; N101-L105 WeakPolarHBondContact O-CB 3.5Å; N101-L105 VanDerWaalsContact O-CG 3.28Å; N101-L105 WeakPolarHBondContact O-CG 3.42Å; N101-L105 PolarHBondContact O-N 3.47Å; N101-L119 HydrophobicContact CB-CD2 3.73Å
102	L	98.2	Very high	97.6	Very high	8 Å²	8	67.2 Å²	67.2	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-54.7	-42.4	173.5	-77.4	167.1	0	0	0	112.1	A35 P44 D98 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.91Å; P44-L102 HydrophobicContact CB-CD1 3.69Å; P44-L102 HydrophobicContact CG-CD1 3.85Å; D98-L102 WeakPolarHBondContact O-CB 3.16Å; D98-L102 VanDerWaalsContact O-CG 3.32Å; D98-L102 WeakPolarHBondContact O-CG 3.35Å; D98-L102 PolarHBondContact O-N 2.83Å; L102-R106 WeakPolarHBondContact O-CB 3.31Å; L102-R106 PolarHBondContact O-N 3.25Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L102-Y142 HydrophobicContact CD2-CE2 4.03Å
103	R	96.6	Very high	97.2	Very high	126 Å²	126	69.2 Å²	69.2	48%	0.475	34%	0.339	S	S	.	.	H	α-helix	trans	-67	-39.8	176	-74	179.8	-77.9	158.8	-8.6	112.7	R99 V100 N101 G107	R99-R103 PolarHBondContact O-NE 2.81Å; R99-R103 VanDerWaalsContact O-NE 3.16Å; V100-R103 PolarHBondContact O-N 3.44Å; N101-R103 VanDerWaalsContact C-N 3.27Å; N101-R103 PolarHBondContact O-N 3.43Å; R103-G107 PolarHBondContact O-N 2.84Å
104	K	97.1	Very high	96.9	Very high	101 Å²	101	68 Å²	68	44%	0.439	35%	0.345	S	S	.	.	H	α-helix	trans	-66	-47.9	176.8	-72.6	174	179.9	167.3	0	111.5	V100 N101 G107 Y108	V100-K104 HydrophobicContact CG1-CD 4.25Å; V100-K104 PolarHBondContact O-N 3.47Å; V100-K104 VanDerWaalsContact O-N 3.08Å; N101-K104 WeakPolarHBondContact O-CB 3.48Å; N101-K104 PolarHBondContact O-N 3.16Å; K104-G107 CarbonylContact O-C 3.59Å; K104-G107 WeakPolarHBondContact O-CA 3.45Å; K104-G107 PolarHBondContact O-N 2.82Å; K104-G107 VanDerWaalsContact O-N 3.09Å; K104-Y108 WeakPolarHBondContact O-CD1 3.24Å; K104-Y108 PolarHBondContact O-N 2.89Å
105	L	98	Very high	96.7	Very high	7 Å²	7	66.8 Å²	66.8	4%	0.037	35%	0.346	C	S	.	.	H	α-helix	trans	-60.2	-48.4	-179.6	-70.5	167.3	0	0	0	110.7	N101 G107 Y108 Y109 L119 Y142 Y147	N101-L105 WeakPolarHBondContact O-CB 3.5Å; N101-L105 VanDerWaalsContact O-CG 3.28Å; N101-L105 WeakPolarHBondContact O-CG 3.42Å; N101-L105 PolarHBondContact O-N 3.47Å; L105-G107 PolarHBondContact O-N 2.95Å; L105-Y108 HydrophobicContact CD2-CD2 4.47Å; L105-Y108 PolarHBondContact O-N 3.18Å; L105-Y109 HydrophobicContact CD2-CE2 4.32Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.32Å; L105-Y109 PolarHBondContact O-N 3.17Å; L105-L119 HydrophobicContact CD1-CD1 3.85Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å; L105-Y142 HydrophobicContact CB-CD1 4.31Å; L105-Y142 HydrophobicContact CB-CD2 4.2Å; L105-Y142 HydrophobicContact CB-CE1 3.95Å; L105-Y142 HydrophobicContact CB-CE2 3.85Å; L105-Y142 HydrophobicContact CB-CG 4.42Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.95Å; L105-Y142 HydrophobicContact CD1-CG 4.01Å; L105-Y142 HydrophobicContact CG-CD2 4.44Å; L105-Y147 HydrophobicContact CD2-CD1 4.42Å; L105-Y147 HydrophobicContact CD2-CD2 4.07Å; L105-Y147 HydrophobicContact CD2-CE1 3.83Å; L105-Y147 HydrophobicContact CD2-CE2 3.4Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.18Å
106	R	97.1	Very high	96.7	Very high	62 Å²	62	69.6 Å²	69.6	23%	0.234	37%	0.365	C	S	.	.	H	α-helix	trans	-51.5	-42.4	173	-172	-171.4	66.4	177.9	9.6	112.3	L102 N110 Q111 S112 E113	L102-R106 WeakPolarHBondContact O-CB 3.31Å; L102-R106 PolarHBondContact O-N 3.25Å; R106-N110 PolarHBondContact O-N 3.03Å; R106-N110 VanDerWaalsContact O-N 3.12Å; R106-Q111 HydrophobicContact CG-CB 3.79Å; R106-Q111 PolarHBondContact O-N 3.23Å; R106-S112 WeakPolarHBondContact CD-O 3.36Å; R106-E113 IonicContact CZ-OE1 3.75Å; R106-E113 IonicContact NH1-OE1 3.54Å; R106-E113 IonicContact NH2-OE1 3.36Å; R106-E113 PolarHBondContact NH2-OE1 3.21Å
107	G	97.2	Very high	96.7	Very high	43 Å²	43	65.2 Å²	65.2	44%	0.443	34%	0.344	S	S	.	.	H	α-helix	trans	-66.6	-44.3	175.2	0	0	0	0	0	113.6	R103 K104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 2.84Å; K104-G107 CarbonylContact O-C 3.59Å; K104-G107 WeakPolarHBondContact O-CA 3.45Å; K104-G107 PolarHBondContact O-N 2.82Å; K104-G107 VanDerWaalsContact O-N 3.09Å; L105-G107 PolarHBondContact O-N 2.95Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.13Å; G107-N110 PolarHBondContact O-N 3.33Å
108	Y	97.8	Very high	96.7	Very high	57 Å²	57	65.1 Å²	65.1	22%	0.224	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-35.5	178	-65.3	-12.3	0	0	0	112.6	K104 L105 I166 K170	K104-Y108 WeakPolarHBondContact O-CD1 3.24Å; K104-Y108 PolarHBondContact O-N 2.89Å; L105-Y108 HydrophobicContact CD2-CD2 4.47Å; L105-Y108 PolarHBondContact O-N 3.18Å; Y108-I166 HydrophobicContact CD1-CD1 4.24Å; Y108-I166 HydrophobicContact CE1-CD1 4.49Å; Y108-I166 HydrophobicContact CE1-CG2 4.13Å; Y108-I166 HydrophobicContact CE2-CB 4.22Å; Y108-I166 HydrophobicContact CE2-CG2 4.09Å; Y108-I166 HydrophobicContact CG-CD1 4.26Å; Y108-K170 PolarHBondContact OH-NZ 3.47Å
109	Y	97.9	Very high	96.8	Very high	68 Å²	68	65.1 Å²	65.1	27%	0.267	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.3	178.6	-69	-72.1	0	0	0	114	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.32Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.32Å; L105-Y109 PolarHBondContact O-N 3.17Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 3.13Å; Y109-Q111 PolarHBondContact O-N 3.02Å; Y109-Y142 AromaticContact CD2-CD1 3.75Å; Y109-Y142 HydrophobicContact CD2-CD1 3.75Å; Y109-Y142 AromaticContact CD2-CE1 3.53Å; Y109-Y142 HydrophobicContact CD2-CE1 3.53Å; Y109-Y142 AromaticContact CE2-CD1 3.52Å; Y109-Y142 HydrophobicContact CE2-CD1 3.52Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.45Å; Y109-Y147 HydrophobicContact CE2-CD2 4.39Å; Y109-Y147 HydrophobicContact CE2-CE2 4.1Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.38Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.34Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.03Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.32Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.92Å; Y109-D161 PolarHBondContact OH-OD2 3.04Å; Y109-A163 HydrophobicContact CD1-CB 4.18Å; Y109-A163 HydrophobicContact CD2-CB 4.43Å; Y109-A163 HydrophobicContact CE1-CB 3.62Å; Y109-A163 HydrophobicContact CE2-CB 3.89Å; Y109-A163 VanDerWaalsContact CZ-CB 3.46Å
110	N	96.9	Very high	96.8	Very high	150 Å²	150	65.3 Å²	65.3	80%	0.802	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	40.5	-177.6	-56	-61.5	0	0	0	113.5	R106 G107	R106-N110 PolarHBondContact O-N 3.03Å; R106-N110 VanDerWaalsContact O-N 3.12Å; G107-N110 PolarHBondContact O-N 3.33Å
111	Q	97.1	Very high	96.9	Very high	59 Å²	59	64.3 Å²	64.3	28%	0.276	33%	0.334	S	S	.	.			trans	-87.5	154.1	-176.8	-70.5	165.2	-35	0	0	112.1	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.79Å; R106-Q111 PolarHBondContact O-N 3.23Å; Y109-Q111 PolarHBondContact O-N 3.02Å; Q111-H117 PolarHBondContact NE2-CE1 2.91Å; Q111-H117 PolarHBondContact OE1-CE1 2.94Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.24Å; Q111-Y142 PolarHBondContact OE1-OH 2.82Å; Q111-D143 PolarHBondContact NE2-OD2 2.9Å
112	S	94.8	Very high	96.9	Very high	72 Å²	72	62.6 Å²	62.6	50%	0.503	33%	0.325	S	S	.	.			trans	-63.8	150.7	177.7	173.1	0	0	0	0	112.4	R106 D114	R106-S112 WeakPolarHBondContact CD-O 3.36Å; S112-D114 VanDerWaalsContact C-N 3.27Å; S112-D114 PolarHBondContact O-N 3.22Å; S112-D114 PolarHBondContact OG-N 3.45Å; S112-D114 VanDerWaalsContact OG-N 3.16Å
113	E	91.8	Very high	96.9	Very high	127 Å²	127	62.3 Å²	62.3	59%	0.593	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-21.6	174	-56.4	-151.6	127.5	0	0	113.8	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.47Å; P39-E113 WeakPolarHBondContact CG-O 3.46Å; R106-E113 IonicContact CZ-OE1 3.75Å; R106-E113 IonicContact NH1-OE1 3.54Å; R106-E113 IonicContact NH2-OE1 3.36Å; R106-E113 PolarHBondContact NH2-OE1 3.21Å; E113-G115 VanDerWaalsContact C-N 3.28Å
114	D	91.8	Very high	97	Very high	142 Å²	142	56.3 Å²	56.3	76%	0.759	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-10.9	-178.3	-58.7	-39.8	0	0	0	112.5	S112	S112-D114 VanDerWaalsContact C-N 3.27Å; S112-D114 PolarHBondContact O-N 3.22Å; S112-D114 PolarHBondContact OG-N 3.45Å; S112-D114 VanDerWaalsContact OG-N 3.16Å
115	G	93.4	Very high	97	Very high	26 Å²	26	51.5 Å²	51.5	27%	0.268	28%	0.279	S	S	.	.			trans	-75.9	134.2	179.7	0	0	0	0	0	112.9	P39 E113 H117	P39-G115 VanDerWaalsContact CG-O 3.24Å; P39-G115 WeakPolarHBondContact CG-O 3.35Å; E113-G115 VanDerWaalsContact C-N 3.28Å; G115-H117 PolarHBondContact O-CD2 2.89Å; G115-H117 VanDerWaalsContact O-CD2 3.25Å
116	S	97.3	Very high	97	Very high	76 Å²	76	52.3 Å²	52.3	53%	0.531	28%	0.284	S	S	.	.			trans	-83	124.1	166.3	178.2	0	0	0	0	109.4	S37	S37-S116 PolarHBondContact O-OG 3.07Å
117	H	98.4	Very high	97	Very high	18 Å²	18	49.5 Å²	49.5	8%	0.083	27%	0.273	C	S	.	.			trans	-118.8	154.2	177.2	-60.5	-75.4	0	0	0	112.4	S37 L102 Q111 G115 Y142 D143	S37-H117 PolarHBondContact N-O 2.76Å; S37-H117 PolarHBondContact OG-N 3.48Å; S37-H117 PolarHBondContact OG-O 3.23Å; L102-H117 HydrophobicContact CD2-CB 4.28Å; Q111-H117 PolarHBondContact NE2-CE1 2.91Å; Q111-H117 PolarHBondContact OE1-CE1 2.94Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.24Å; G115-H117 PolarHBondContact O-CD2 2.89Å; G115-H117 VanDerWaalsContact O-CD2 3.25Å; H117-Y142 HydrophobicContact CB-CE2 3.76Å; H117-Y142 WeakPolarHBondContact CB-OH 3.33Å; H117-Y142 AromaticContact CG-CZ 3.94Å; H117-Y142 AromaticContact ND1-CZ 3.89Å; H117-Y142 PolarHBondContact ND1-OH 2.92Å; H117-D143 WeakPolarHBondContact CA-OD1 3.33Å; H117-D143 WeakPolarHBondContact CB-OD1 3.22Å; H117-D143 IonicContact CE1-OD2 3.67Å; H117-D143 IonicContact CG-OD1 3.42Å; H117-D143 IonicContact CG-OD2 3.14Å; H117-D143 IonicContact ND1-OD1 2.66Å; H117-D143 IonicContact ND1-OD2 3.26Å; H117-D143 PolarHBondContact ND1-OD2 2.82Å
118	T	98.7	Very high	96.9	Very high	37 Å²	37	47.6 Å²	47.6	23%	0.227	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.9	-178.4	-58.8	0	0	0	0	110	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.05Å; A35-T118 WeakPolarHBondContact O-CA 3.18Å; V36-T118 HydrophobicContact CG2-CG2 4.22Å; T118-Q120 HydrophobicContact CG2-CG 3.93Å; T118-Y142 WeakPolarHBondContact O-CA 3.46Å; T118-Y142 VanDerWaalsContact O-CD2 3.27Å; T118-Y142 WeakPolarHBondContact O-CD2 3.49Å; T118-D143 PolarHBondContact N-OD1 3.22Å; T118-D143 PolarHBondContact O-N 2.73Å
119	L	98.8	Very high	96.4	Very high	5 Å²	5	49 Å²	49	3%	0.026	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.8	169.1	175.5	61.3	0	0	0	108.1	T34 A35 D98 N101 L102 L105	T34-L119 WeakPolarHBondContact CA-O 3.24Å; A35-L119 HydrophobicContact CB-CB 4.45Å; A35-L119 PolarHBondContact N-O 2.98Å; A35-L119 PolarHBondContact O-N 2.71Å; D98-L119 HydrophobicContact CB-CD2 4.11Å; N101-L119 HydrophobicContact CB-CD2 3.73Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.09Å; L105-L119 HydrophobicContact CD1-CD1 3.85Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å
120	Q	98.8	Very high	96	Very high	80 Å²	80	50.4 Å²	50.4	37%	0.374	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	144.5	176.1	-63.7	173.2	-88.3	0	0	109.3	D33 T34 T118 S140 A141	D33-Q120 VanDerWaalsContact O-CA 3.32Å; D33-Q120 WeakPolarHBondContact O-CA 3.42Å; T34-Q120 HydrophobicContact CG2-CG 4.17Å; T118-Q120 HydrophobicContact CG2-CG 3.93Å; Q120-S140 CarbonylContact O-C 3.57Å; Q120-S140 WeakPolarHBondContact O-CA 3.32Å; Q120-A141 HydrophobicContact CB-CB 4.38Å; Q120-A141 PolarHBondContact N-O 2.89Å; Q120-A141 PolarHBondContact O-N 3.16Å
121	W	98.6	Very high	95.7	Very high	33 Å²	33	44.1 Å²	44.1	13%	0.125	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.1	177.1	173.9	67.1	0	0	0	109.8	F32 D33 C123 D138 Q139 W180	F32-W121 WeakPolarHBondContact CA-O 3.37Å; D33-W121 HydrophobicContact CB-CB 4.34Å; D33-W121 HydrophobicContact CB-CE3 3.91Å; D33-W121 PolarHBondContact N-O 3.44Å; D33-W121 PolarHBondContact O-N 2.68Å; D33-W121 WeakPolarHBondContact OD2-CZ3 3.03Å; W121-C123 HydrophobicContact CH2-CB 3.79Å; W121-C123 WeakPolarHBondContact CH2-SG 3.39Å; W121-C123 HydrophobicContact CZ2-CB 3.29Å; W121-C123 WeakPolarHBondContact CZ2-SG 3.22Å; W121-D138 PolarHBondContact NE1-OD1 2.86Å; W121-Q139 CarbonylContact C-O 3.53Å; W121-Q139 WeakPolarHBondContact CA-O 3.29Å; W121-Q139 VanDerWaalsContact CD1-O 3.29Å; W121-W180 AromaticContact CH2-CH2 3.71Å; W121-W180 HydrophobicContact CH2-CH2 3.71Å; W121-W180 HydrophobicContact CH2-CZ3 4.31Å; W121-W180 AromaticContact CZ2-CH2 3.21Å; W121-W180 HydrophobicContact CZ2-CH2 3.21Å; W121-W180 AromaticContact CZ2-CZ2 3.77Å; W121-W180 HydrophobicContact CZ2-CZ2 3.77Å; W121-W180 AromaticContact CZ2-CZ3 3.83Å; W121-W180 HydrophobicContact CZ2-CZ3 3.83Å
122	M	98.6	Very high	95.5	Very high	18 Å²	18	49.5 Å²	49.5	9%	0.089	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.2	175	-173.4	-79.8	-69.8	0	0	109	Y31 F32 Y137 D138 Q139	Y31-M122 VanDerWaalsContact O-CA 3.31Å; Y31-M122 WeakPolarHBondContact O-CA 3.44Å; F32-M122 HydrophobicContact CD1-CB 4.04Å; F32-M122 HydrophobicContact CD1-CG 3.6Å; F32-M122 HydrophobicContact CE1-CB 4.25Å; F32-M122 HydrophobicContact CE1-CG 3.4Å; F32-M122 HydrophobicContact CG-CG 4.44Å; F32-M122 HydrophobicContact CZ-CG 4.1Å; M122-Y137 HydrophobicContact CE-CD1 3.99Å; M122-Y137 HydrophobicContact CE-CG 3.99Å; M122-Y137 HydrophobicContact SD-CG 4.48Å; M122-D138 WeakPolarHBondContact O-CA 3.41Å; M122-Q139 HydrophobicContact CB-CG 4.06Å; M122-Q139 HydrophobicContact CE-CG 3.78Å; M122-Q139 PolarHBondContact N-O 3.16Å; M122-Q139 PolarHBondContact O-N 2.86Å
123	C	98.1	Very high	95.6	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	160.1	169.3	79.9	0	0	0	0	111.6	R30 Y31 W121 Y137	R30-C123 CarbonylContact C-O 3.59Å; R30-C123 WeakPolarHBondContact CA-O 3.34Å; Y31-C123 PolarHBondContact N-O 3.24Å; Y31-C123 PolarHBondContact O-N 2.94Å; Y31-C123 VanDerWaalsContact O-N 3.13Å; W121-C123 HydrophobicContact CH2-CB 3.79Å; W121-C123 WeakPolarHBondContact CH2-SG 3.39Å; W121-C123 HydrophobicContact CZ2-CB 3.29Å; W121-C123 WeakPolarHBondContact CZ2-SG 3.22Å; C123-Y137 WeakPolarHBondContact CA-O 2.78Å; C123-Y137 WeakPolarHBondContact CB-O 3.5Å
124	G	98.4	Very high	95.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.2	-175.4	175.2	0	0	0	0	0	114.3	M29 G136 Y137 L184	M29-G124 CarbonylContact O-C 3.58Å; M29-G124 WeakPolarHBondContact O-CA 3.24Å; G124-G136 CarbonylContact O-C 3.5Å; G124-G136 WeakPolarHBondContact O-CA 3.45Å; G124-Y137 PolarHBondContact N-O 2.7Å; G124-Y137 PolarHBondContact O-N 3.01Å; G124-L184 WeakPolarHBondContact O-CD2 3.12Å
125	C	98.5	Very high	96.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	146.7	-176.8	52.6	0	0	0	0	111.1	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.25Å; M29-C125 PolarHBondContact N-O 3.17Å; M29-C125 PolarHBondContact O-N 3.02Å; C125-L133 HydrophobicContact CB-CD1 3.54Å; C125-R135 CarbonylContact C-O 3.55Å; C125-R135 WeakPolarHBondContact CA-O 2.85Å; C125-C188 HydrophobicContact CB-CB 3.92Å; C125-C188 WeakPolarHBondContact CB-SG 3.39Å; C125-C188 PolarHBondContact N-SG 3.33Å; C125-C188 WeakPolarHBondContact SG-CB 3.03Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.76Å
126	D	98	Very high	96.3	Very high	25 Å²	25	44.6 Å²	44.6	13%	0.134	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.8	171.6	-59.4	-13.4	0	0	0	108.8	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.54Å; H27-D126 WeakPolarHBondContact O-CA 3.46Å; S28-D126 WeakPolarHBondContact CB-OD1 3.41Å; R30-D126 IonicContact CZ-OD1 3.69Å; R30-D126 IonicContact NE-OD1 2.76Å; R30-D126 PolarHBondContact NE-OD1 3.35Å; R30-D126 VanDerWaalsContact NH2-CG 3.32Å; R30-D126 IonicContact NH2-OD1 3.89Å; R30-D126 PolarHBondContact NH2-OD1 3.28Å; R30-D126 IonicContact NH2-OD2 3.52Å; R30-D126 PolarHBondContact NH2-OD2 2.92Å; R30-D126 VanDerWaalsContact NH2-OD2 3.1Å; D126-L134 HydrophobicContact CB-CB 4.42Å; D126-L134 PolarHBondContact O-N 3.12Å; D126-R135 HydrophobicContact CB-CB 4.44Å; D126-R135 PolarHBondContact N-O 3.39Å; D126-R135 PolarHBondContact O-N 2.82Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.15Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.29Å; D126-Y137 PolarHBondContact OD2-OH 2.83Å
127	L	96.9	Very high	96.3	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.2	173.9	-56.6	-176	0	0	0	110.5	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.25Å; S26-L127 WeakPolarHBondContact CA-O 3.39Å; S26-L127 WeakPolarHBondContact CB-O 3.33Å; H27-L127 PolarHBondContact N-O 2.6Å; H27-L127 PolarHBondContact O-N 3.28Å; L127-R132 CarbonylContact C-O 3.58Å; L127-R132 VanDerWaalsContact CA-O 3.26Å; L127-R132 WeakPolarHBondContact CA-O 3.47Å; L127-V189 HydrophobicContact CD1-CG1 4.45Å; L127-V189 HydrophobicContact CD2-CB 4.17Å; L127-V189 HydrophobicContact CD2-CG1 3.8Å; L127-V189 HydrophobicContact CD2-CG2 3.8Å; L127-L192 HydrophobicContact CB-CD2 4.45Å; L127-L192 HydrophobicContact CD1-CB 4.22Å; L127-L192 HydrophobicContact CD1-CD2 3.68Å; L127-L192 HydrophobicContact CD1-CG 3.73Å; L127-L192 HydrophobicContact CG-CD2 3.56Å; L127-L192 HydrophobicContact CG-CG 4.21Å; L127-R193 HydrophobicContact CD1-CG 3.91Å
128	G	93.5	Very high	96.3	Very high	3 Å²	3	42 Å²	42	3%	0.031	21%	0.208	C	C	.	.			trans	-76.4	176.2	169.6	0	0	0	0	0	111.7	D130 G131 R132 L134	G128-D130 PolarHBondContact O-N 3.03Å; G128-G131 WeakPolarHBondContact O-CA 3.27Å; G128-G131 PolarHBondContact O-N 3.48Å; G128-R132 PolarHBondContact N-O 3.42Å; G128-L134 VanDerWaalsContact N-CG 3.34Å
129	P	89.1	Confident	96.3	Very high	86 Å²	86	43.9 Å²	43.9	56%	0.558	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.5	177.9	-18.5	28.3	0	0	0	113.2	A24 G131	A24-P129 HydrophobicContact CB-CB 4.03Å; A24-P129 HydrophobicContact CB-CG 3.21Å; P129-G131 PolarHBondContact O-N 3.25Å
130	D	89	Confident	96.3	Very high	98 Å²	98	44.5 Å²	44.5	52%	0.524	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	3.4	174.5	70.6	-15	0	0	0	113.1	G128 R132	G128-D130 PolarHBondContact O-N 3.03Å; D130-R132 PolarHBondContact O-N 2.86Å; D130-R132 WeakPolarHBondContact OD1-CB 3.43Å; D130-R132 PolarHBondContact OD1-N 3.24Å; D130-R132 WeakPolarHBondContact OD2-CD 3.3Å; D130-R132 VanDerWaalsContact OD2-CG 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.38Å; D130-R132 IonicContact OD2-NE 3.44Å; D130-R132 PolarHBondContact OD2-NE 3.2Å
131	G	89.3	Confident	96.3	Very high	19 Å²	19	41.4 Å²	41.4	20%	0.196	21%	0.207	C	C	.	.	S	Bend	trans	72	9.7	-178.5	0	0	0	0	0	114.1	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.27Å; G128-G131 PolarHBondContact O-N 3.48Å; P129-G131 PolarHBondContact O-N 3.25Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.98Å; G131-R193 PolarHBondContact O-NH2 2.94Å
132	R	93.9	Very high	96.3	Very high	171 Å²	171	40.4 Å²	40.4	65%	0.645	20%	0.204	S	C	*	.			trans	-88.4	153.5	178.9	-62	-173.6	-174.3	172.5	-1.6	111.3	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.58Å; L127-R132 VanDerWaalsContact CA-O 3.26Å; L127-R132 WeakPolarHBondContact CA-O 3.47Å; G128-R132 PolarHBondContact N-O 3.42Å; D130-R132 PolarHBondContact O-N 2.86Å; D130-R132 WeakPolarHBondContact OD1-CB 3.43Å; D130-R132 PolarHBondContact OD1-N 3.24Å; D130-R132 WeakPolarHBondContact OD2-CD 3.3Å; D130-R132 VanDerWaalsContact OD2-CG 3.3Å; D130-R132 WeakPolarHBondContact OD2-CG 3.38Å; D130-R132 IonicContact OD2-NE 3.44Å; D130-R132 PolarHBondContact OD2-NE 3.2Å; R132-L134 PolarHBondContact O-N 3.08Å
133	L	96.8	Very high	96.3	Very high	49 Å²	49	42.7 Å²	42.7	26%	0.257	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	120.3	175.1	-176.2	72.6	0	0	0	110	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.54Å; L133-R135 WeakPolarHBondContact CD1-O 3.29Å; L133-L154 HydrophobicContact CD2-CD1 4.2Å; L133-E185 HydrophobicContact CD2-CB 4.41Å; L133-E185 HydrophobicContact CD2-CG 3.7Å; L133-V189 HydrophobicContact CB-CG2 4.03Å; L133-V189 HydrophobicContact CD1-CG2 4.05Å
134	L	96.3	Very high	96.3	Very high	115 Å²	115	45.4 Å²	45.4	60%	0.602	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90	-45.6	168	-70.5	176.8	0	0	0	110.8	D126 G128 R132	D126-L134 HydrophobicContact CB-CB 4.42Å; D126-L134 PolarHBondContact O-N 3.12Å; G128-L134 VanDerWaalsContact N-CG 3.34Å; R132-L134 PolarHBondContact O-N 3.08Å
135	R	96.8	Very high	96.3	Very high	96 Å²	96	53.1 Å²	53.1	36%	0.362	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	141.2	-175.4	-173.5	162.2	172.8	142.7	11.4	111.7	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.55Å; C125-R135 WeakPolarHBondContact CA-O 2.85Å; D126-R135 HydrophobicContact CB-CB 4.44Å; D126-R135 PolarHBondContact N-O 3.39Å; D126-R135 PolarHBondContact O-N 2.82Å; L133-R135 WeakPolarHBondContact CD1-O 3.29Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.42Å; R135-Y137 VanDerWaalsContact CD-OH 3.23Å; R135-Y137 WeakPolarHBondContact CD-OH 3.24Å; R135-Y137 HydrophobicContact CG-CD2 4.37Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.71Å; R135-E152 VanDerWaalsContact CZ-CG 3.46Å; R135-E152 IonicContact CZ-OE1 3.22Å; R135-E152 IonicContact NH1-OE1 2.8Å; R135-E152 PolarHBondContact NH1-OE1 2.73Å; R135-E152 IonicContact NH1-OE2 2.87Å; R135-E152 VanDerWaalsContact NH2-CG 3.29Å; R135-E152 IonicContact NH2-OE1 3.44Å; R135-E152 PolarHBondContact NH2-OE1 3.11Å
136	G	98.1	Very high	96.3	Very high	4 Å²	4	59.2 Å²	59.2	4%	0.041	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	152	169.4	0	0	0	0	0	110.9	G124	G124-G136 CarbonylContact O-C 3.5Å; G124-G136 WeakPolarHBondContact O-CA 3.45Å
137	Y	98.4	Very high	96.3	Very high	37 Å²	37	58.5 Å²	58.5	15%	0.145	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139	-179.4	-54.6	-97	0	0	0	110.3	R30 M122 C123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.26Å; R30-Y137 PolarHBondContact NH2-OH 3.27Å; M122-Y137 HydrophobicContact CE-CD1 3.99Å; M122-Y137 HydrophobicContact CE-CG 3.99Å; M122-Y137 HydrophobicContact SD-CG 4.48Å; C123-Y137 WeakPolarHBondContact CA-O 2.78Å; C123-Y137 WeakPolarHBondContact CB-O 3.5Å; G124-Y137 PolarHBondContact N-O 2.7Å; G124-Y137 PolarHBondContact O-N 3.01Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.15Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.29Å; D126-Y137 PolarHBondContact OD2-OH 2.83Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-CZ 3.42Å; R135-Y137 VanDerWaalsContact CD-OH 3.23Å; R135-Y137 WeakPolarHBondContact CD-OH 3.24Å; R135-Y137 HydrophobicContact CG-CD2 4.37Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.71Å
138	D	98.3	Very high	96.4	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.011	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	109.5	164.8	173.5	21.3	0	0	0	107.4	W121 M122 L150 W157 W180	W121-D138 PolarHBondContact NE1-OD1 2.86Å; M122-D138 WeakPolarHBondContact O-CA 3.41Å; D138-L150 HydrophobicContact CB-CB 3.92Å; D138-L150 HydrophobicContact CB-CD2 4.12Å; D138-L150 WeakPolarHBondContact O-CB 3.37Å; D138-L150 PolarHBondContact O-N 3.26Å; D138-W157 WeakPolarHBondContact OD2-CH2 3.5Å; D138-W180 HydrophobicContact CB-CD2 4.42Å; D138-W180 VanDerWaalsContact OD2-CE2 3.31Å; D138-W180 PolarHBondContact OD2-NE1 3.44Å
139	Q	98.5	Very high	96.7	Very high	77 Å²	77	59.9 Å²	59.9	36%	0.36	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	145.2	-175.9	62.2	-170.7	56	0	0	111.9	W121 M122 I148 A149	W121-Q139 CarbonylContact C-O 3.53Å; W121-Q139 WeakPolarHBondContact CA-O 3.29Å; W121-Q139 VanDerWaalsContact CD1-O 3.29Å; M122-Q139 HydrophobicContact CB-CG 4.06Å; M122-Q139 HydrophobicContact CE-CG 3.78Å; M122-Q139 PolarHBondContact N-O 3.16Å; M122-Q139 PolarHBondContact O-N 2.86Å; Q139-I148 WeakPolarHBondContact CA-O 3.48Å; Q139-A149 HydrophobicContact CB-CB 3.82Å
140	S	98.6	Very high	97.1	Very high	18 Å²	18	56.5 Å²	56.5	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147	177.1	-59.5	0	0	0	0	111.7	Q120 Y147 I148	Q120-S140 CarbonylContact O-C 3.57Å; Q120-S140 WeakPolarHBondContact O-CA 3.32Å; S140-Y147 WeakPolarHBondContact O-CB 3.4Å; S140-Y147 PolarHBondContact O-N 3.29Å; S140-I148 PolarHBondContact N-O 2.87Å; S140-I148 PolarHBondContact O-N 2.8Å
141	A	98.8	Very high	97.6	Very high	16 Å²	16	53.9 Å²	53.9	13%	0.132	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.2	171.9	0	0	0	0	0	110.4	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.38Å; Q120-A141 PolarHBondContact N-O 2.89Å; Q120-A141 PolarHBondContact O-N 3.16Å; A141-K145 CarbonylContact C-O 3.53Å; A141-K145 WeakPolarHBondContact CA-O 3.29Å; A141-K145 VanDerWaalsContact CB-O 3.25Å; A141-K145 WeakPolarHBondContact CB-O 3.31Å
142	Y	98.8	Very high	98	Very high	12 Å²	12	59.6 Å²	59.6	5%	0.047	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.9	177.4	-174.5	-121	0	0	0	110.1	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.03Å; L105-Y142 HydrophobicContact CB-CD1 4.31Å; L105-Y142 HydrophobicContact CB-CD2 4.2Å; L105-Y142 HydrophobicContact CB-CE1 3.95Å; L105-Y142 HydrophobicContact CB-CE2 3.85Å; L105-Y142 HydrophobicContact CB-CG 4.42Å; L105-Y142 HydrophobicContact CD1-CD2 3.6Å; L105-Y142 HydrophobicContact CD1-CE2 3.95Å; L105-Y142 HydrophobicContact CD1-CG 4.01Å; L105-Y142 HydrophobicContact CG-CD2 4.44Å; Y109-Y142 AromaticContact CD2-CD1 3.75Å; Y109-Y142 HydrophobicContact CD2-CD1 3.75Å; Y109-Y142 AromaticContact CD2-CE1 3.53Å; Y109-Y142 HydrophobicContact CD2-CE1 3.53Å; Y109-Y142 AromaticContact CE2-CD1 3.52Å; Y109-Y142 HydrophobicContact CE2-CD1 3.52Å; Y109-Y142 AromaticContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CE2-CE1 3.83Å; Y109-Y142 HydrophobicContact CG-CE1 4.45Å; Q111-Y142 PolarHBondContact OE1-OH 2.82Å; H117-Y142 HydrophobicContact CB-CE2 3.76Å; H117-Y142 WeakPolarHBondContact CB-OH 3.33Å; H117-Y142 AromaticContact CG-CZ 3.94Å; H117-Y142 AromaticContact ND1-CZ 3.89Å; H117-Y142 PolarHBondContact ND1-OH 2.92Å; T118-Y142 WeakPolarHBondContact O-CA 3.46Å; T118-Y142 VanDerWaalsContact O-CD2 3.27Å; T118-Y142 WeakPolarHBondContact O-CD2 3.49Å; Y142-G144 PolarHBondContact O-N 2.84Å; Y142-K145 PolarHBondContact N-O 2.82Å; Y142-K145 PolarHBondContact O-N 3.36Å; Y142-K145 VanDerWaalsContact O-N 3.08Å
143	D	98.3	Very high	98.1	Very high	65 Å²	65	55.1 Å²	55.1	35%	0.348	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	39.6	-174.5	-65.5	-22.2	0	0	0	113.3	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 2.9Å; H117-D143 WeakPolarHBondContact CA-OD1 3.33Å; H117-D143 WeakPolarHBondContact CB-OD1 3.22Å; H117-D143 IonicContact CE1-OD2 3.67Å; H117-D143 IonicContact CG-OD1 3.42Å; H117-D143 IonicContact CG-OD2 3.14Å; H117-D143 IonicContact ND1-OD1 2.66Å; H117-D143 IonicContact ND1-OD2 3.26Å; H117-D143 PolarHBondContact ND1-OD2 2.82Å; T118-D143 PolarHBondContact N-OD1 3.22Å; T118-D143 PolarHBondContact O-N 2.73Å; D143-K145 VanDerWaalsContact C-N 3.33Å; D143-K145 PolarHBondContact O-N 3.05Å
144	G	97.5	Very high	98.2	Very high	59 Å²	59	53.2 Å²	53.2	61%	0.608	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	9.6	177.8	0	0	0	0	0	115.2	Y142	Y142-G144 PolarHBondContact O-N 2.84Å
145	K	98.6	Very high	98.2	Very high	162 Å²	162	55.6 Å²	55.6	70%	0.704	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	144.3	176.3	-61.2	-179.2	-176.2	177.9	0	110.7	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.53Å; A141-K145 WeakPolarHBondContact CA-O 3.29Å; A141-K145 VanDerWaalsContact CB-O 3.25Å; A141-K145 WeakPolarHBondContact CB-O 3.31Å; Y142-K145 PolarHBondContact N-O 2.82Å; Y142-K145 PolarHBondContact O-N 3.36Å; Y142-K145 VanDerWaalsContact O-N 3.08Å; D143-K145 VanDerWaalsContact C-N 3.33Å; D143-K145 PolarHBondContact O-N 3.05Å; K145-Y147 PolarHBondContact O-N 2.93Å
146	D	98.7	Very high	98.3	Very high	127 Å²	127	53 Å²	53	68%	0.679	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.8	135.4	173.9	-64.9	-33.9	0	0	0	110.6	A160	D146-A160 HydrophobicContact CB-CB 4.44Å; D146-A160 WeakPolarHBondContact O-CB 3.43Å
147	Y	98.8	Very high	98.3	Very high	10 Å²	10	53.2 Å²	53.2	4%	0.039	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-62.1	179.6	179.3	-107	0	0	0	110.3	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.42Å; L105-Y147 HydrophobicContact CD2-CD2 4.07Å; L105-Y147 HydrophobicContact CD2-CE1 3.83Å; L105-Y147 HydrophobicContact CD2-CE2 3.4Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.18Å; Y109-Y147 HydrophobicContact CE2-CD2 4.39Å; Y109-Y147 HydrophobicContact CE2-CE2 4.1Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.38Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.34Å; S140-Y147 WeakPolarHBondContact O-CB 3.4Å; S140-Y147 PolarHBondContact O-N 3.29Å; K145-Y147 PolarHBondContact O-N 2.93Å; Y147-A160 WeakPolarHBondContact O-CB 3.35Å; Y147-A160 PolarHBondContact O-N 2.98Å; Y147-A163 HydrophobicContact CE2-CB 4.44Å; Y147-A163 PolarHBondContact OH-O 2.98Å; Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.4Å; Y147-A164 HydrophobicContact CE2-CB 3.72Å; Y147-A164 HydrophobicContact CG-CB 4.28Å; Y147-A164 WeakPolarHBondContact O-CB 3.47Å; Y147-T167 HydrophobicContact CE1-CG2 4.22Å; Y147-T167 PolarHBondContact OH-OG1 3.17Å
148	I	98.7	Very high	98.3	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	142.7	179.2	-161.2	171.1	0	0	0	110.2	Q139 S140 W157 T158 T167 Q168 W171	Q139-I148 WeakPolarHBondContact CA-O 3.48Å; S140-I148 PolarHBondContact N-O 2.87Å; S140-I148 PolarHBondContact O-N 2.8Å; I148-W157 HydrophobicContact CD1-CB 4.3Å; I148-W157 HydrophobicContact CD1-CD2 4.48Å; I148-W157 HydrophobicContact CD1-CE3 4.27Å; I148-W157 HydrophobicContact CG1-CB 4.35Å; I148-W157 HydrophobicContact CG1-CE3 4.11Å; I148-T158 WeakPolarHBondContact CA-O 3.33Å; I148-T167 HydrophobicContact CD1-CG2 4.01Å; I148-Q168 HydrophobicContact CD1-CB 3.97Å; I148-W171 HydrophobicContact CD1-CE3 4Å; I148-W171 HydrophobicContact CD1-CZ3 4.26Å; I148-W171 HydrophobicContact CG2-CH2 4.06Å; I148-W171 HydrophobicContact CG2-CZ3 3.74Å
149	A	98.8	Very high	98.4	Very high	30 Å²	30	56.1 Å²	56.1	25%	0.248	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140.3	177.7	0	0	0	0	0	111.5	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.82Å; A149-W157 WeakPolarHBondContact O-CA 3.36Å; A149-T158 PolarHBondContact N-O 3.37Å; A149-T158 PolarHBondContact O-N 3.3Å
150	L	98.8	Very high	98.4	Very high	15 Å²	15	55.4 Å²	55.4	8%	0.079	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	129.2	168.6	-174.4	66.3	0	0	0	108.6	D138 L154 W157 A177 W180 L184	D138-L150 HydrophobicContact CB-CB 3.92Å; D138-L150 HydrophobicContact CB-CD2 4.12Å; D138-L150 WeakPolarHBondContact O-CB 3.37Å; D138-L150 PolarHBondContact O-N 3.26Å; L150-L154 HydrophobicContact CD2-CB 4.47Å; L150-L154 HydrophobicContact CD2-CD2 3.79Å; L150-L154 HydrophobicContact CG-CD2 4.33Å; L150-W157 HydrophobicContact CB-CE3 3.99Å; L150-W157 HydrophobicContact CB-CH2 4.11Å; L150-W157 HydrophobicContact CB-CZ3 3.63Å; L150-W157 HydrophobicContact CD1-CD2 4.14Å; L150-W157 HydrophobicContact CD1-CE3 4.25Å; L150-W157 HydrophobicContact CD1-CH2 4.01Å; L150-W157 HydrophobicContact CD1-CZ2 3.9Å; L150-W157 HydrophobicContact CD1-CZ3 4.17Å; L150-W157 HydrophobicContact CG-CZ3 4.47Å; L150-A177 HydrophobicContact CD1-CB 3.9Å; L150-W180 HydrophobicContact CD2-CB 4.06Å; L150-L184 HydrophobicContact CD2-CD1 3.98Å
151	N	98.6	Very high	98.3	Very high	44 Å²	44	57.1 Å²	57.1	24%	0.235	32%	0.317	C	S	.	.			trans	-73	163.4	-179.9	-67.3	-29.9	0	0	0	111.3	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 3.27Å; N151-L154 WeakPolarHBondContact O-CA 3.4Å; N151-L154 PolarHBondContact O-N 3.26Å; N151-S156 WeakPolarHBondContact CB-O 3.38Å; N151-S156 WeakPolarHBondContact CB-OG 3.37Å; N151-S156 PolarHBondContact N-O 3.15Å; N151-S156 PolarHBondContact ND2-O 3.17Å; N151-S156 PolarHBondContact ND2-OG 2.66Å; N151-T158 PolarHBondContact ND2-OG1 2.89Å; N151-T158 WeakPolarHBondContact OD1-CB 3.43Å; N151-T158 PolarHBondContact OD1-OG1 3.36Å
152	E	97.4	Very high	98.3	Very high	138 Å²	138	61.6 Å²	61.6	65%	0.645	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.1	179.9	-68	176.4	-161.7	0	0	113.7	R135 L154	R135-E152 VanDerWaalsContact CZ-CG 3.46Å; R135-E152 IonicContact CZ-OE1 3.22Å; R135-E152 IonicContact NH1-OE1 2.8Å; R135-E152 PolarHBondContact NH1-OE1 2.73Å; R135-E152 IonicContact NH1-OE2 2.87Å; R135-E152 VanDerWaalsContact NH2-CG 3.29Å; R135-E152 IonicContact NH2-OE1 3.44Å; R135-E152 PolarHBondContact NH2-OE1 3.11Å; E152-L154 PolarHBondContact O-N 3.14Å
153	D	97.4	Very high	98.3	Very high	77 Å²	77	61.3 Å²	61.3	41%	0.412	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-8.1	174.7	70.2	3.6	0	0	0	113.9	N151 R155 S156	N151-D153 PolarHBondContact O-N 3.27Å; D153-R155 WeakPolarHBondContact O-CG 3.45Å; D153-R155 PolarHBondContact O-N 3.29Å; D153-R155 PolarHBondContact OD1-N 3.06Å; D153-S156 VanDerWaalsContact CG-OG 3.24Å; D153-S156 PolarHBondContact OD1-N 3.02Å; D153-S156 PolarHBondContact OD1-OG 3.24Å; D153-S156 VanDerWaalsContact OD1-OG 3.12Å; D153-S156 WeakPolarHBondContact OD2-CB 3.35Å; D153-S156 PolarHBondContact OD2-OG 3.01Å
154	L	97.9	Very high	98.3	Very high	9 Å²	9	58.2 Å²	58.2	5%	0.047	33%	0.326	C	S	.	.	S	Bend	trans	53	29.9	-175	-53.5	-178.8	0	0	0	113.4	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.2Å; L150-L154 HydrophobicContact CD2-CB 4.47Å; L150-L154 HydrophobicContact CD2-CD2 3.79Å; L150-L154 HydrophobicContact CG-CD2 4.33Å; N151-L154 WeakPolarHBondContact O-CA 3.4Å; N151-L154 PolarHBondContact O-N 3.26Å; E152-L154 PolarHBondContact O-N 3.14Å; L154-R181 HydrophobicContact CB-CB 4.09Å; L154-R181 HydrophobicContact CB-CG 3.89Å; L154-R181 HydrophobicContact CD1-CG 4.22Å; L154-L184 HydrophobicContact CD2-CD1 3.98Å; L154-E185 HydrophobicContact CD1-CG 4.26Å
155	R	97.5	Very high	98.3	Very high	165 Å²	165	58.9 Å²	58.9	62%	0.623	31%	0.313	S	S	*	.	S	Bend	trans	-136.8	-32.6	-173.7	-71.3	169.4	-174.7	-119.2	10	113	D153 A177	D153-R155 WeakPolarHBondContact O-CG 3.45Å; D153-R155 PolarHBondContact O-N 3.29Å; D153-R155 PolarHBondContact OD1-N 3.06Å; R155-A177 WeakPolarHBondContact O-CB 2.98Å
156	S	97.9	Very high	98.3	Very high	41 Å²	41	53.9 Å²	53.9	29%	0.287	29%	0.294	S	S	.	.			trans	-115.8	161.7	-177.1	63.1	0	0	0	0	111.7	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.38Å; N151-S156 WeakPolarHBondContact CB-OG 3.37Å; N151-S156 PolarHBondContact N-O 3.15Å; N151-S156 PolarHBondContact ND2-O 3.17Å; N151-S156 PolarHBondContact ND2-OG 2.66Å; D153-S156 VanDerWaalsContact CG-OG 3.24Å; D153-S156 PolarHBondContact OD1-N 3.02Å; D153-S156 PolarHBondContact OD1-OG 3.24Å; D153-S156 VanDerWaalsContact OD1-OG 3.12Å; D153-S156 WeakPolarHBondContact OD2-CB 3.35Å; D153-S156 PolarHBondContact OD2-OG 3.01Å
157	W	98.7	Very high	98.3	Very high	10 Å²	10	48.7 Å²	48.7	4%	0.038	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.2	-177.7	-60.3	91.8	0	0	0	110.8	D138 I148 A149 L150 Q168 W171 E176 A177 W180	D138-W157 WeakPolarHBondContact OD2-CH2 3.5Å; I148-W157 HydrophobicContact CD1-CB 4.3Å; I148-W157 HydrophobicContact CD1-CD2 4.48Å; I148-W157 HydrophobicContact CD1-CE3 4.27Å; I148-W157 HydrophobicContact CG1-CB 4.35Å; I148-W157 HydrophobicContact CG1-CE3 4.11Å; A149-W157 WeakPolarHBondContact O-CA 3.36Å; L150-W157 HydrophobicContact CB-CE3 3.99Å; L150-W157 HydrophobicContact CB-CH2 4.11Å; L150-W157 HydrophobicContact CB-CZ3 3.63Å; L150-W157 HydrophobicContact CD1-CD2 4.14Å; L150-W157 HydrophobicContact CD1-CE3 4.25Å; L150-W157 HydrophobicContact CD1-CH2 4.01Å; L150-W157 HydrophobicContact CD1-CZ2 3.9Å; L150-W157 HydrophobicContact CD1-CZ3 4.17Å; L150-W157 HydrophobicContact CG-CZ3 4.47Å; W157-Q168 HydrophobicContact CB-CG 4.15Å; W157-Q168 PolarHBondContact O-NE2 3.28Å; W157-W171 AromaticContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CZ3 4.45Å; W157-W171 AromaticContact CE2-CE3 3.79Å; W157-W171 AromaticContact CE3-CE3 3.76Å; W157-W171 HydrophobicContact CE3-CE3 3.76Å; W157-W171 AromaticContact CE3-CZ3 3.84Å; W157-W171 HydrophobicContact CE3-CZ3 3.84Å; W157-W171 AromaticContact CH2-CE3 3.39Å; W157-W171 HydrophobicContact CH2-CE3 3.39Å; W157-W171 AromaticContact CH2-CZ3 3.39Å; W157-W171 HydrophobicContact CH2-CZ3 3.39Å; W157-W171 HydrophobicContact CZ2-CD2 4.42Å; W157-W171 AromaticContact CZ2-CE3 3.54Å; W157-W171 HydrophobicContact CZ2-CE3 3.54Å; W157-W171 HydrophobicContact CZ2-CZ3 4.05Å; W157-W171 AromaticContact CZ3-CE3 3.52Å; W157-W171 HydrophobicContact CZ3-CE3 3.52Å; W157-W171 HydrophobicContact CZ3-CH2 4.5Å; W157-W171 AromaticContact CZ3-CZ3 3.28Å; W157-W171 HydrophobicContact CZ3-CZ3 3.28Å; W157-E176 HydrophobicContact CZ2-CB 4.19Å; W157-A177 HydrophobicContact CZ2-CB 4.2Å; W157-W180 AromaticContact CH2-CD1 3.94Å
158	T	98.7	Very high	98.3	Very high	78 Å²	78	50.1 Å²	50.1	48%	0.479	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	118.3	165.8	-66.5	0	0	0	0	109	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.33Å; A149-T158 PolarHBondContact N-O 3.37Å; A149-T158 PolarHBondContact O-N 3.3Å; N151-T158 PolarHBondContact ND2-OG1 2.89Å; N151-T158 WeakPolarHBondContact OD1-CB 3.43Å; N151-T158 PolarHBondContact OD1-OG1 3.36Å
159	A	98.7	Very high	98.3	Very high	22 Å²	22	57.2 Å²	57.2	18%	0.182	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	131.4	175.4	0	0	0	0	0	110.2	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.72Å; A159-Q165 HydrophobicContact CB-CG 4.01Å; A159-Q168 HydrophobicContact CB-CB 4.35Å
160	A	98.5	Very high	98.3	Very high	62 Å²	62	61 Å²	61	51%	0.512	31%	0.311	S	S	.	.	S	Bend	trans	-74.1	-31.3	-176.3	0	0	0	0	0	113.4	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.44Å; D146-A160 WeakPolarHBondContact O-CB 3.43Å; Y147-A160 WeakPolarHBondContact O-CB 3.35Å; Y147-A160 PolarHBondContact O-N 2.98Å
161	D	98.3	Very high	98.2	Very high	53 Å²	53	63.2 Å²	63.2	28%	0.283	32%	0.318	S	S	.	.	S	Bend	trans	-150.8	-175.4	-178	68	28.9	0	0	0	113.4	Y109 A163 A164 Q165	Y109-D161 WeakPolarHBondContact CE1-OD2 3.03Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.32Å; Y109-D161 VanDerWaalsContact OH-CG 3.24Å; Y109-D161 PolarHBondContact OH-OD1 2.92Å; Y109-D161 PolarHBondContact OH-OD2 3.04Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.85Å; D161-A163 WeakPolarHBondContact OD1-CA 3.48Å; D161-A163 WeakPolarHBondContact OD1-CB 3.43Å; D161-A163 PolarHBondContact OD1-N 2.65Å; D161-A164 PolarHBondContact O-N 2.85Å; D161-A164 PolarHBondContact OD1-N 3.46Å; D161-Q165 WeakPolarHBondContact O-CG 3.45Å; D161-Q165 PolarHBondContact O-N 3.16Å
162	T	98.1	Very high	98.2	Very high	111 Å²	111	65.6 Å²	65.6	68%	0.681	33%	0.328	S	S	*	.	H	α-helix	trans	-65.2	-28.3	-179.2	51.2	0	0	0	0	114
163	A	98	Very high	98.3	Very high	5 Å²	5	63.3 Å²	63.3	4%	0.041	33%	0.333	C	S	.	.	H	α-helix	trans	-73.6	-43.4	175.4	0	0	0	0	0	110	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.18Å; Y109-A163 HydrophobicContact CD2-CB 4.43Å; Y109-A163 HydrophobicContact CE1-CB 3.62Å; Y109-A163 HydrophobicContact CE2-CB 3.89Å; Y109-A163 VanDerWaalsContact CZ-CB 3.46Å; Y147-A163 HydrophobicContact CE2-CB 4.44Å; Y147-A163 PolarHBondContact OH-O 2.98Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.85Å; D161-A163 WeakPolarHBondContact OD1-CA 3.48Å; D161-A163 WeakPolarHBondContact OD1-CB 3.43Å; D161-A163 PolarHBondContact OD1-N 2.65Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 2.99Å; A163-I166 VanDerWaalsContact O-CB 3.25Å; A163-I166 WeakPolarHBondContact O-CB 3.43Å; A163-I166 PolarHBondContact O-N 2.89Å
164	A	98.5	Very high	98.3	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.9	-35.1	173.6	0	0	0	0	0	113.1	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.4Å; Y147-A164 HydrophobicContact CE2-CB 3.72Å; Y147-A164 HydrophobicContact CG-CB 4.28Å; Y147-A164 WeakPolarHBondContact O-CB 3.47Å; A159-A164 HydrophobicContact CB-CB 3.72Å; D161-A164 PolarHBondContact O-N 2.85Å; D161-A164 PolarHBondContact OD1-N 3.46Å; A164-I166 PolarHBondContact O-N 3Å; A164-T167 WeakPolarHBondContact O-CA 3.4Å; A164-T167 WeakPolarHBondContact O-CB 3.28Å; A164-T167 PolarHBondContact O-N 3.26Å; A164-Q168 PolarHBondContact O-N 3.13Å
165	Q	98.7	Very high	98.3	Very high	73 Å²	73	69.3 Å²	69.3	34%	0.341	36%	0.36	S	S	.	.	H	α-helix	trans	-59.4	-27.9	173.3	-73.2	174.5	10.8	0	0	113	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 4.01Å; D161-Q165 WeakPolarHBondContact O-CG 3.45Å; D161-Q165 PolarHBondContact O-N 3.16Å; A163-Q165 VanDerWaalsContact C-N 3.27Å; A163-Q165 PolarHBondContact O-N 2.99Å; Q165-R169 WeakPolarHBondContact O-CG 3.49Å; Q165-R169 PolarHBondContact O-N 3.49Å; Q165-R169 VanDerWaalsContact O-N 3.12Å
166	I	98.3	Very high	98.3	Very high	58 Å²	58	63.9 Å²	63.9	30%	0.297	34%	0.342	S	S	.	.	H	α-helix	trans	-67.4	-43.2	174.2	-57.1	170.4	0	0	0	109.9	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.24Å; Y108-I166 HydrophobicContact CE1-CD1 4.49Å; Y108-I166 HydrophobicContact CE1-CG2 4.13Å; Y108-I166 HydrophobicContact CE2-CB 4.22Å; Y108-I166 HydrophobicContact CE2-CG2 4.09Å; Y108-I166 HydrophobicContact CG-CD1 4.26Å; A163-I166 VanDerWaalsContact O-CB 3.25Å; A163-I166 WeakPolarHBondContact O-CB 3.43Å; A163-I166 PolarHBondContact O-N 2.89Å; A164-I166 PolarHBondContact O-N 3Å; I166-K170 WeakPolarHBondContact O-CG 3.38Å; I166-K170 PolarHBondContact O-N 3.09Å
167	T	98.3	Very high	98.3	Very high	18 Å²	18	62.4 Å²	62.4	11%	0.11	33%	0.332	C	S	.	.	H	α-helix	trans	-65.2	-47	174.5	-69	0	0	0	0	110.9	Y147 I148 A164 R169 K170 W171	Y147-T167 HydrophobicContact CE1-CG2 4.22Å; Y147-T167 PolarHBondContact OH-OG1 3.17Å; I148-T167 HydrophobicContact CD1-CG2 4.01Å; A164-T167 WeakPolarHBondContact O-CA 3.4Å; A164-T167 WeakPolarHBondContact O-CB 3.28Å; A164-T167 PolarHBondContact O-N 3.26Å; T167-R169 PolarHBondContact O-N 3.36Å; T167-K170 WeakPolarHBondContact O-CB 3.2Å; T167-K170 PolarHBondContact O-N 2.95Å; T167-W171 HydrophobicContact CG2-CD2 3.67Å; T167-W171 HydrophobicContact CG2-CE3 4.16Å; T167-W171 HydrophobicContact CG2-CG 4.05Å; T167-W171 HydrophobicContact CG2-CH2 4.4Å; T167-W171 HydrophobicContact CG2-CZ2 3.92Å; T167-W171 HydrophobicContact CG2-CZ3 4.49Å; T167-W171 PolarHBondContact O-N 3.13Å
168	Q	98.6	Very high	98.3	Very high	40 Å²	40	67.4 Å²	67.4	19%	0.187	36%	0.356	C	S	.	.	H	α-helix	trans	-50.7	-53.5	178	176.1	175.1	16.5	0	0	111.8	I148 W157 A159 A164 K170 W171 E172	I148-Q168 HydrophobicContact CD1-CB 3.97Å; W157-Q168 HydrophobicContact CB-CG 4.15Å; W157-Q168 PolarHBondContact O-NE2 3.28Å; A159-Q168 HydrophobicContact CB-CB 4.35Å; A164-Q168 PolarHBondContact O-N 3.13Å; Q168-K170 VanDerWaalsContact C-N 3.26Å; Q168-K170 PolarHBondContact O-N 3.3Å; Q168-W171 PolarHBondContact O-N 3.05Å; Q168-W171 VanDerWaalsContact O-N 3.14Å; Q168-E172 HydrophobicContact CG-CG 4.27Å; Q168-E172 VanDerWaalsContact CG-OE1 3.23Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.32Å; Q168-E172 PolarHBondContact NE2-OE1 2.9Å; Q168-E172 WeakPolarHBondContact O-CB 3.42Å; Q168-E172 WeakPolarHBondContact O-CG 3.47Å; Q168-E172 PolarHBondContact O-N 2.81Å
169	R	98.6	Very high	98.2	Very high	153 Å²	153	69.6 Å²	69.6	58%	0.577	36%	0.36	S	S	*	.	H	α-helix	trans	-59.4	-36.3	180	-68.8	172.1	-164.3	144.5	9.1	112.7	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.49Å; Q165-R169 PolarHBondContact O-N 3.49Å; Q165-R169 VanDerWaalsContact O-N 3.12Å; T167-R169 PolarHBondContact O-N 3.36Å; R169-A173 VanDerWaalsContact O-CB 3.31Å; R169-A173 WeakPolarHBondContact O-CB 3.32Å; R169-A173 PolarHBondContact O-N 3.06Å; R169-A173 VanDerWaalsContact O-N 3.1Å
170	K	98	Very high	98.2	Very high	110 Å²	110	71.2 Å²	71.2	48%	0.478	36%	0.362	S	S	.	.	H	α-helix	trans	-68.9	-44.1	177.3	-71.7	176	179.9	-177.6	0	111.2	Y108 I166 T167 Q168 A173 A174	Y108-K170 PolarHBondContact OH-NZ 3.47Å; I166-K170 WeakPolarHBondContact O-CG 3.38Å; I166-K170 PolarHBondContact O-N 3.09Å; T167-K170 WeakPolarHBondContact O-CB 3.2Å; T167-K170 PolarHBondContact O-N 2.95Å; Q168-K170 VanDerWaalsContact C-N 3.26Å; Q168-K170 PolarHBondContact O-N 3.3Å; K170-A173 PolarHBondContact O-N 3.29Å; K170-A174 WeakPolarHBondContact O-CB 3.39Å; K170-A174 PolarHBondContact O-N 3.29Å
171	W	98.2	Very high	98.2	Very high	60 Å²	60	71.7 Å²	71.7	23%	0.227	35%	0.35	C	S	.	.	H	α-helix	trans	-69.7	-37.7	-179.8	-74.1	4	0	0	0	112.5	I148 W157 T167 Q168 A174 R175 E176	I148-W171 HydrophobicContact CD1-CE3 4Å; I148-W171 HydrophobicContact CD1-CZ3 4.26Å; I148-W171 HydrophobicContact CG2-CH2 4.06Å; I148-W171 HydrophobicContact CG2-CZ3 3.74Å; W157-W171 AromaticContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CZ3 4.45Å; W157-W171 AromaticContact CE2-CE3 3.79Å; W157-W171 AromaticContact CE3-CE3 3.76Å; W157-W171 HydrophobicContact CE3-CE3 3.76Å; W157-W171 AromaticContact CE3-CZ3 3.84Å; W157-W171 HydrophobicContact CE3-CZ3 3.84Å; W157-W171 AromaticContact CH2-CE3 3.39Å; W157-W171 HydrophobicContact CH2-CE3 3.39Å; W157-W171 AromaticContact CH2-CZ3 3.39Å; W157-W171 HydrophobicContact CH2-CZ3 3.39Å; W157-W171 HydrophobicContact CZ2-CD2 4.42Å; W157-W171 AromaticContact CZ2-CE3 3.54Å; W157-W171 HydrophobicContact CZ2-CE3 3.54Å; W157-W171 HydrophobicContact CZ2-CZ3 4.05Å; W157-W171 AromaticContact CZ3-CE3 3.52Å; W157-W171 HydrophobicContact CZ3-CE3 3.52Å; W157-W171 HydrophobicContact CZ3-CH2 4.5Å; W157-W171 AromaticContact CZ3-CZ3 3.28Å; W157-W171 HydrophobicContact CZ3-CZ3 3.28Å; T167-W171 HydrophobicContact CG2-CD2 3.67Å; T167-W171 HydrophobicContact CG2-CE3 4.16Å; T167-W171 HydrophobicContact CG2-CG 4.05Å; T167-W171 HydrophobicContact CG2-CH2 4.4Å; T167-W171 HydrophobicContact CG2-CZ2 3.92Å; T167-W171 HydrophobicContact CG2-CZ3 4.49Å; T167-W171 PolarHBondContact O-N 3.13Å; Q168-W171 PolarHBondContact O-N 3.05Å; Q168-W171 VanDerWaalsContact O-N 3.14Å; W171-A174 CarbonylContact O-C 3.5Å; W171-A174 PolarHBondContact O-N 2.8Å; W171-R175 WeakPolarHBondContact O-CA 3.38Å; W171-R175 PolarHBondContact O-N 2.87Å; W171-E176 HydrophobicContact CB-CB 4.01Å; W171-E176 HydrophobicContact CB-CG 3.85Å; W171-E176 HydrophobicContact CD2-CG 4.47Å; W171-E176 HydrophobicContact CG-CB 4.2Å; W171-E176 HydrophobicContact CG-CG 3.82Å; W171-E176 PolarHBondContact O-N 3.17Å
172	E	98.4	Very high	98.2	Very high	95 Å²	95	72.2 Å²	72.2	44%	0.444	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-45.7	172.1	-72.9	170.5	173.2	0	0	111.3	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.27Å; Q168-E172 VanDerWaalsContact CG-OE1 3.23Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.32Å; Q168-E172 PolarHBondContact NE2-OE1 2.9Å; Q168-E172 WeakPolarHBondContact O-CB 3.42Å; Q168-E172 WeakPolarHBondContact O-CG 3.47Å; Q168-E172 PolarHBondContact O-N 2.81Å; E172-A174 VanDerWaalsContact C-N 3.28Å; E172-A174 PolarHBondContact O-N 3.04Å; E172-R175 PolarHBondContact O-N 3.08Å; E172-R175 VanDerWaalsContact O-N 3.13Å
173	A	98.3	Very high	98.1	Very high	89 Å²	89	69.6 Å²	69.6	74%	0.736	34%	0.34	S	S	*	.	H	α-helix	trans	-63.1	-34.5	176.5	0	0	0	0	0	112.8	R169 K170	R169-A173 VanDerWaalsContact O-CB 3.31Å; R169-A173 WeakPolarHBondContact O-CB 3.32Å; R169-A173 PolarHBondContact O-N 3.06Å; R169-A173 VanDerWaalsContact O-N 3.1Å; K170-A173 PolarHBondContact O-N 3.29Å
174	A	98	Very high	98.2	Very high	52 Å²	52	69.4 Å²	69.4	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-86.6	-3.7	176.7	0	0	0	0	0	114	K170 W171 E172 E176	K170-A174 WeakPolarHBondContact O-CB 3.39Å; K170-A174 PolarHBondContact O-N 3.29Å; W171-A174 CarbonylContact O-C 3.5Å; W171-A174 PolarHBondContact O-N 2.8Å; E172-A174 VanDerWaalsContact C-N 3.28Å; E172-A174 PolarHBondContact O-N 3.04Å; A174-E176 VanDerWaalsContact C-N 3.28Å; A174-E176 HydrophobicContact CB-CG 4.06Å; A174-E176 PolarHBondContact O-N 3.28Å
175	R	97.8	Very high	98.1	Very high	160 Å²	160	73.7 Å²	73.7	60%	0.604	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	39	-176.4	-56	-179.4	173.7	-156	2.7	113.9	W171 E172 A177 E178	W171-R175 WeakPolarHBondContact O-CA 3.38Å; W171-R175 PolarHBondContact O-N 2.87Å; E172-R175 PolarHBondContact O-N 3.08Å; E172-R175 VanDerWaalsContact O-N 3.13Å; R175-A177 PolarHBondContact O-N 2.73Å; R175-E178 HydrophobicContact CB-CG 4.25Å; R175-E178 IonicContact NH1-OE1 2.92Å; R175-E178 PolarHBondContact NH1-OE1 3.44Å; R175-E178 IonicContact NH1-OE2 3.46Å; R175-E178 WeakPolarHBondContact O-CB 3.28Å; R175-E178 PolarHBondContact O-N 2.85Å
176	E	97.7	Very high	98.1	Very high	52 Å²	52	71.3 Å²	71.3	24%	0.243	35%	0.353	C	S	.	.	H	α-helix	trans	-58.5	-33	-178.1	-65.3	-73.3	-175.3	0	0	112.5	W157 W171 A174 E178 Q179 W180	W157-E176 HydrophobicContact CZ2-CB 4.19Å; W171-E176 HydrophobicContact CB-CB 4.01Å; W171-E176 HydrophobicContact CB-CG 3.85Å; W171-E176 HydrophobicContact CD2-CG 4.47Å; W171-E176 HydrophobicContact CG-CB 4.2Å; W171-E176 HydrophobicContact CG-CG 3.82Å; W171-E176 PolarHBondContact O-N 3.17Å; A174-E176 VanDerWaalsContact C-N 3.28Å; A174-E176 HydrophobicContact CB-CG 4.06Å; A174-E176 PolarHBondContact O-N 3.28Å; E176-E178 PolarHBondContact O-N 3.16Å; E176-Q179 PolarHBondContact O-N 2.6Å; E176-Q179 VanDerWaalsContact O-N 3.1Å; E176-W180 PolarHBondContact O-N 3.1Å
177	A	98.3	Very high	98.1	Very high	9 Å²	9	71 Å²	71	7%	0.074	36%	0.355	C	S	.	.	H	α-helix	trans	-59.8	-33	177.3	0	0	0	0	0	112.8	L150 R155 W157 R175 Q179 R181	L150-A177 HydrophobicContact CD1-CB 3.9Å; R155-A177 WeakPolarHBondContact O-CB 2.98Å; W157-A177 HydrophobicContact CZ2-CB 4.2Å; R175-A177 PolarHBondContact O-N 2.73Å; A177-Q179 VanDerWaalsContact C-N 3.34Å; A177-Q179 PolarHBondContact O-N 3.31Å; A177-R181 WeakPolarHBondContact O-CB 3.45Å; A177-R181 PolarHBondContact O-N 3.47Å
178	E	98	Very high	98.1	Very high	116 Å²	116	70.2 Å²	70.2	54%	0.542	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-37.5	177.2	-64.3	178.2	-175.8	0	0	111.3	R175 E176 A182	R175-E178 HydrophobicContact CB-CG 4.25Å; R175-E178 IonicContact NH1-OE1 2.92Å; R175-E178 PolarHBondContact NH1-OE1 3.44Å; R175-E178 IonicContact NH1-OE2 3.46Å; R175-E178 WeakPolarHBondContact O-CB 3.28Å; R175-E178 PolarHBondContact O-N 2.85Å; E176-E178 PolarHBondContact O-N 3.16Å; E178-A182 WeakPolarHBondContact O-CB 3.37Å; E178-A182 PolarHBondContact O-N 2.63Å; E178-A182 VanDerWaalsContact O-N 3.09Å
179	Q	97.1	Very high	98.1	Very high	123 Å²	123	68.7 Å²	68.7	58%	0.575	34%	0.343	S	S	*	.	H	α-helix	trans	-69.4	-46.2	177.5	-59.3	-176.7	32.4	0	0	111.2	E176 A177 A182 Y183	E176-Q179 PolarHBondContact O-N 2.6Å; E176-Q179 VanDerWaalsContact O-N 3.1Å; A177-Q179 VanDerWaalsContact C-N 3.34Å; A177-Q179 PolarHBondContact O-N 3.31Å; Q179-A182 PolarHBondContact O-N 2.73Å; Q179-Y183 PolarHBondContact O-N 3.47Å
180	W	97.9	Very high	98	Very high	56 Å²	56	67.4 Å²	67.4	21%	0.212	34%	0.344	C	S	.	.	H	α-helix	trans	-63.5	-42.6	177.1	-79.2	116.3	0	0	0	112.2	W121 D138 L150 W157 E176 A182 Y183 L184	W121-W180 AromaticContact CH2-CH2 3.71Å; W121-W180 HydrophobicContact CH2-CH2 3.71Å; W121-W180 HydrophobicContact CH2-CZ3 4.31Å; W121-W180 AromaticContact CZ2-CH2 3.21Å; W121-W180 HydrophobicContact CZ2-CH2 3.21Å; W121-W180 AromaticContact CZ2-CZ2 3.77Å; W121-W180 HydrophobicContact CZ2-CZ2 3.77Å; W121-W180 AromaticContact CZ2-CZ3 3.83Å; W121-W180 HydrophobicContact CZ2-CZ3 3.83Å; D138-W180 HydrophobicContact CB-CD2 4.42Å; D138-W180 VanDerWaalsContact OD2-CE2 3.31Å; D138-W180 PolarHBondContact OD2-NE1 3.44Å; L150-W180 HydrophobicContact CD2-CB 4.06Å; W157-W180 AromaticContact CH2-CD1 3.94Å; E176-W180 PolarHBondContact O-N 3.1Å; W180-A182 VanDerWaalsContact C-N 3.33Å; W180-A182 PolarHBondContact O-N 3.36Å; W180-Y183 AromaticContact CE3-CD1 3.91Å; W180-Y183 HydrophobicContact CE3-CD1 3.91Å; W180-Y183 HydrophobicContact CE3-CG 4.48Å; W180-Y183 AromaticContact CZ3-CD1 3.83Å; W180-Y183 HydrophobicContact CZ3-CD1 3.83Å; W180-Y183 HydrophobicContact CZ3-CE1 4.21Å; W180-Y183 HydrophobicContact CZ3-CG 4.42Å; W180-Y183 PolarHBondContact O-N 3.04Å; W180-L184 WeakPolarHBondContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CG 3.15Å; W180-L184 PolarHBondContact O-N 3.35Å
181	R	98.3	Very high	98	Very high	72 Å²	72	64.2 Å²	64.2	27%	0.272	33%	0.329	S	S	.	.	H	α-helix	trans	-58	-45.2	174.2	-175	172.1	-179.6	-138.2	-13.7	112	L154 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.09Å; L154-R181 HydrophobicContact CB-CG 3.89Å; L154-R181 HydrophobicContact CD1-CG 4.22Å; A177-R181 WeakPolarHBondContact O-CB 3.45Å; A177-R181 PolarHBondContact O-N 3.47Å; R181-Y183 VanDerWaalsContact C-N 3.34Å; R181-Y183 PolarHBondContact O-N 2.84Å; R181-L184 PolarHBondContact O-N 2.97Å; R181-E185 HydrophobicContact CG-CG 4.12Å; R181-E185 IonicContact CZ-OE1 3.39Å; R181-E185 VanDerWaalsContact CZ-OE1 3.29Å; R181-E185 IonicContact CZ-OE2 3.64Å; R181-E185 IonicContact NE-OE1 3.03Å; R181-E185 PolarHBondContact NE-OE1 3.13Å; R181-E185 IonicContact NE-OE2 2.68Å; R181-E185 PolarHBondContact NE-OE2 3.27Å; R181-E185 IonicContact NH2-OE1 2.7Å; R181-E185 PolarHBondContact NH2-OE1 3.32Å; R181-E185 IonicContact NH2-OE2 3.51Å; R181-E185 PolarHBondContact NH2-OE2 3.11Å; R181-E185 WeakPolarHBondContact O-CB 3.24Å; R181-E185 WeakPolarHBondContact O-CG 3.4Å; R181-E185 PolarHBondContact O-N 2.83Å
182	A	98.3	Very high	98	Very high	65 Å²	65	61.3 Å²	61.3	54%	0.537	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-39.9	177.2	0	0	0	0	0	112.6	E178 Q179 W180 G186	E178-A182 WeakPolarHBondContact O-CB 3.37Å; E178-A182 PolarHBondContact O-N 2.63Å; E178-A182 VanDerWaalsContact O-N 3.09Å; Q179-A182 PolarHBondContact O-N 2.73Å; W180-A182 VanDerWaalsContact C-N 3.33Å; W180-A182 PolarHBondContact O-N 3.36Å; A182-G186 PolarHBondContact O-N 2.84Å; A182-G186 VanDerWaalsContact O-N 3.1Å
183	Y	98	Very high	98	Very high	56 Å²	56	62.7 Å²	62.7	22%	0.22	32%	0.319	C	S	.	.	I	π-helix	trans	-65.2	-47.7	174.1	170.3	-99.6	0	0	0	112.1	Q179 W180 R181 G186 T187 C188	Q179-Y183 PolarHBondContact O-N 3.47Å; W180-Y183 AromaticContact CE3-CD1 3.91Å; W180-Y183 HydrophobicContact CE3-CD1 3.91Å; W180-Y183 HydrophobicContact CE3-CG 4.48Å; W180-Y183 AromaticContact CZ3-CD1 3.83Å; W180-Y183 HydrophobicContact CZ3-CD1 3.83Å; W180-Y183 HydrophobicContact CZ3-CE1 4.21Å; W180-Y183 HydrophobicContact CZ3-CG 4.42Å; W180-Y183 PolarHBondContact O-N 3.04Å; R181-Y183 VanDerWaalsContact C-N 3.34Å; R181-Y183 PolarHBondContact O-N 2.84Å; Y183-G186 CarbonylContact O-C 3.58Å; Y183-G186 PolarHBondContact O-N 2.94Å; Y183-T187 HydrophobicContact CD2-CG2 3.95Å; Y183-T187 HydrophobicContact CE2-CG2 3.79Å; Y183-T187 PolarHBondContact O-N 2.51Å; Y183-C188 HydrophobicContact CD1-CB 4.47Å; Y183-C188 HydrophobicContact CE1-CB 4.05Å; Y183-C188 PolarHBondContact O-N 3Å
184	L	98.5	Very high	97.9	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.305	C	S	.	.	I	π-helix	trans	-70.4	-40.1	-174.8	-68.9	170.9	0	0	0	112.5	G124 L150 L154 W180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.12Å; L150-L184 HydrophobicContact CD2-CD1 3.98Å; L154-L184 HydrophobicContact CD2-CD1 3.98Å; W180-L184 WeakPolarHBondContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CG 3.15Å; W180-L184 PolarHBondContact O-N 3.35Å; R181-L184 PolarHBondContact O-N 2.97Å; L184-V189 WeakPolarHBondContact O-CG2 3.37Å
185	E	98	Very high	97.9	Very high	90 Å²	90	61.8 Å²	61.8	42%	0.421	29%	0.285	S	S	.	.	I	π-helix	trans	-78.3	-23.6	176.9	-68.5	-179.5	168.3	0	0	113.1	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.41Å; L133-E185 HydrophobicContact CD2-CG 3.7Å; L154-E185 HydrophobicContact CD1-CG 4.26Å; R181-E185 HydrophobicContact CG-CG 4.12Å; R181-E185 IonicContact CZ-OE1 3.39Å; R181-E185 VanDerWaalsContact CZ-OE1 3.29Å; R181-E185 IonicContact CZ-OE2 3.64Å; R181-E185 IonicContact NE-OE1 3.03Å; R181-E185 PolarHBondContact NE-OE1 3.13Å; R181-E185 IonicContact NE-OE2 2.68Å; R181-E185 PolarHBondContact NE-OE2 3.27Å; R181-E185 IonicContact NH2-OE1 2.7Å; R181-E185 PolarHBondContact NH2-OE1 3.32Å; R181-E185 IonicContact NH2-OE2 3.51Å; R181-E185 PolarHBondContact NH2-OE2 3.11Å; R181-E185 WeakPolarHBondContact O-CB 3.24Å; R181-E185 WeakPolarHBondContact O-CG 3.4Å; R181-E185 PolarHBondContact O-N 2.83Å
186	G	97.8	Very high	97.8	Very high	23 Å²	23	54.9 Å²	54.9	24%	0.237	26%	0.26	C	S	.	.	I	π-helix	trans	-109.5	-90	-177.5	0	0	0	0	0	112.7	A182 Y183 C188 V189 E190	A182-G186 PolarHBondContact O-N 2.84Å; A182-G186 VanDerWaalsContact O-N 3.1Å; Y183-G186 CarbonylContact O-C 3.58Å; Y183-G186 PolarHBondContact O-N 2.94Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 2.87Å; G186-V189 PolarHBondContact O-N 2.98Å; G186-V189 VanDerWaalsContact O-N 3.16Å; G186-E190 WeakPolarHBondContact O-CG 3.36Å; G186-E190 PolarHBondContact O-N 2.92Å
187	T	97.7	Very high	97.7	Very high	53 Å²	53	58.4 Å²	58.4	33%	0.325	28%	0.277	S	S	.	.	I	π-helix	trans	-54.4	-43.9	-171.1	-57.8	0	0	0	0	113.1	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.95Å; Y183-T187 HydrophobicContact CE2-CG2 3.79Å; Y183-T187 PolarHBondContact O-N 2.51Å; T187-V189 PolarHBondContact O-N 2.91Å; T187-E190 PolarHBondContact O-N 2.81Å; T187-W191 VanDerWaalsContact CG2-CD1 3.48Å; T187-W191 WeakPolarHBondContact O-CB 3.23Å; T187-W191 PolarHBondContact O-N 2.83Å
188	C	98.3	Very high	97.6	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-60.5	-49	-179.9	-171.1	0	0	0	0	111.5	M29 C125 Y183 G186 E190 W191 L192	M29-C188 HydrophobicContact CE-CB 4.17Å; M29-C188 WeakPolarHBondContact CE-O 3.23Å; M29-C188 WeakPolarHBondContact CE-SG 3.38Å; C125-C188 HydrophobicContact CB-CB 3.92Å; C125-C188 WeakPolarHBondContact CB-SG 3.39Å; C125-C188 PolarHBondContact N-SG 3.33Å; C125-C188 WeakPolarHBondContact SG-CB 3.03Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 2.76Å; Y183-C188 HydrophobicContact CD1-CB 4.47Å; Y183-C188 HydrophobicContact CE1-CB 4.05Å; Y183-C188 PolarHBondContact O-N 3Å; G186-C188 VanDerWaalsContact C-N 3.33Å; G186-C188 PolarHBondContact O-N 2.87Å; C188-E190 PolarHBondContact O-N 3Å; C188-W191 PolarHBondContact O-N 3Å; C188-L192 WeakPolarHBondContact O-CB 3.33Å; C188-L192 PolarHBondContact O-N 3.05Å
189	V	98.3	Very high	97.5	Very high	9 Å²	9	55 Å²	55	6%	0.055	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-45.3	178.5	175	0	0	0	0	111.1	L127 L133 L184 G186 T187 R193	L127-V189 HydrophobicContact CD1-CG1 4.45Å; L127-V189 HydrophobicContact CD2-CB 4.17Å; L127-V189 HydrophobicContact CD2-CG1 3.8Å; L127-V189 HydrophobicContact CD2-CG2 3.8Å; L133-V189 HydrophobicContact CB-CG2 4.03Å; L133-V189 HydrophobicContact CD1-CG2 4.05Å; L184-V189 WeakPolarHBondContact O-CG2 3.37Å; G186-V189 PolarHBondContact O-N 2.98Å; G186-V189 VanDerWaalsContact O-N 3.16Å; T187-V189 PolarHBondContact O-N 2.91Å; V189-R193 WeakPolarHBondContact O-CG 3.43Å; V189-R193 PolarHBondContact O-N 3.45Å
190	E	98	Very high	97.3	Very high	125 Å²	125	54.5 Å²	54.5	58%	0.584	26%	0.257	S	S	*	.	H	α-helix	trans	-61.6	-46.5	179.7	-72.4	175.1	175.4	0	0	112.2	G186 T187 C188 R194	G186-E190 WeakPolarHBondContact O-CG 3.36Å; G186-E190 PolarHBondContact O-N 2.92Å; T187-E190 PolarHBondContact O-N 2.81Å; C188-E190 PolarHBondContact O-N 3Å; E190-R194 PolarHBondContact O-N 3.43Å; E190-R194 VanDerWaalsContact O-N 3.09Å
191	W	98	Very high	97	Very high	43 Å²	43	60.5 Å²	60.5	16%	0.163	29%	0.288	C	S	.	.	H	α-helix	trans	-68.9	-41.4	179.1	-82.3	100	0	0	0	112.4	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.08Å; M29-W191 HydrophobicContact SD-CB 4.43Å; Y83-W191 AromaticContact CD2-CH2 3.52Å; Y83-W191 HydrophobicContact CD2-CH2 3.52Å; Y83-W191 HydrophobicContact CD2-CZ2 4.28Å; Y83-W191 AromaticContact CD2-CZ3 3.74Å; Y83-W191 HydrophobicContact CD2-CZ3 3.74Å; Y83-W191 HydrophobicContact CE2-CE3 4.16Å; Y83-W191 AromaticContact CE2-CH2 3.81Å; Y83-W191 HydrophobicContact CE2-CH2 3.81Å; Y83-W191 HydrophobicContact CE2-CZ2 4.49Å; Y83-W191 AromaticContact CE2-CZ3 3.6Å; Y83-W191 HydrophobicContact CE2-CZ3 3.6Å; T187-W191 VanDerWaalsContact CG2-CD1 3.48Å; T187-W191 WeakPolarHBondContact O-CB 3.23Å; T187-W191 PolarHBondContact O-N 2.83Å; C188-W191 PolarHBondContact O-N 3Å; W191-R193 PolarHBondContact O-N 2.88Å; W191-R194 WeakPolarHBondContact O-CB 3.37Å; W191-R194 PolarHBondContact O-N 2.8Å; W191-Y195 HydrophobicContact CB-CE2 4.07Å; W191-Y195 HydrophobicContact CE3-CD1 4.39Å; W191-Y195 AromaticContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE2 4.27Å; W191-Y195 AromaticContact CE3-CZ 3.43Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.43Å; W191-Y195 VanDerWaalsContact CE3-OH 3.25Å; W191-Y195 AromaticContact CZ3-CE1 3.91Å; W191-Y195 HydrophobicContact CZ3-CE1 3.91Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.29Å; W191-Y195 VanDerWaalsContact O-CG 3.24Å; W191-Y195 PolarHBondContact O-N 2.83Å
192	L	98.1	Very high	96.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-45	176.5	174.4	50.6	0	0	0	111.1	H27 M29 V52 L127 C188 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.47Å; M29-L192 HydrophobicContact CB-CB 4.03Å; M29-L192 HydrophobicContact CB-CD1 4.02Å; M29-L192 HydrophobicContact CB-CD2 3.95Å; M29-L192 HydrophobicContact CB-CG 4.21Å; M29-L192 HydrophobicContact CE-CB 4.28Å; M29-L192 HydrophobicContact SD-CB 4.46Å; V52-L192 HydrophobicContact CG1-CD1 3.6Å; V52-L192 HydrophobicContact CG2-CD1 4.26Å; L127-L192 HydrophobicContact CB-CD2 4.45Å; L127-L192 HydrophobicContact CD1-CB 4.22Å; L127-L192 HydrophobicContact CD1-CD2 3.68Å; L127-L192 HydrophobicContact CD1-CG 3.73Å; L127-L192 HydrophobicContact CG-CD2 3.56Å; L127-L192 HydrophobicContact CG-CG 4.21Å; C188-L192 WeakPolarHBondContact O-CB 3.33Å; C188-L192 PolarHBondContact O-N 3.05Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 3.17Å; L192-Y195 PolarHBondContact O-N 3.23Å; L192-L196 HydrophobicContact CD1-CD1 3.82Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.81Å; L192-L196 HydrophobicContact CG-CD1 4.01Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.33Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.16Å; L192-L196 PolarHBondContact O-N 2.89Å
193	R	96.9	Very high	96.3	Very high	123 Å²	123	56.4 Å²	56.4	46%	0.464	26%	0.264	S	S	.	.	H	α-helix	trans	-58.8	-43.4	174.1	-72.5	174.8	-178.5	172.2	0.1	112.4	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.91Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.98Å; G131-R193 PolarHBondContact O-NH2 2.94Å; V189-R193 WeakPolarHBondContact O-CG 3.43Å; V189-R193 PolarHBondContact O-N 3.45Å; W191-R193 PolarHBondContact O-N 2.88Å; R193-L196 PolarHBondContact O-N 3.26Å; R193-E197 PolarHBondContact O-N 3.29Å
194	R	97.1	Very high	95.8	Very high	121 Å²	121	58.1 Å²	58.1	46%	0.457	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-44.7	176.6	176.8	175.9	173.1	139.4	1	111.7	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 3.73Å; E79-R194 VanDerWaalsContact OE1-CZ 3.22Å; E79-R194 IonicContact OE1-NE 3.29Å; E79-R194 PolarHBondContact OE1-NE 2.88Å; E79-R194 IonicContact OE1-NH2 3.45Å; E79-R194 PolarHBondContact OE1-NH2 3.35Å; E79-R194 IonicContact OE2-CZ 3.47Å; E79-R194 IonicContact OE2-NE 3.93Å; E79-R194 IonicContact OE2-NH2 2.78Å; E79-R194 PolarHBondContact OE2-NH2 3.31Å; E190-R194 PolarHBondContact O-N 3.43Å; E190-R194 VanDerWaalsContact O-N 3.09Å; W191-R194 WeakPolarHBondContact O-CB 3.37Å; W191-R194 PolarHBondContact O-N 2.8Å; L192-R194 VanDerWaalsContact C-N 3.33Å; L192-R194 PolarHBondContact O-N 3.17Å; R194-E197 PolarHBondContact O-N 3.16Å; R194-N198 VanDerWaalsContact O-CB 3.27Å; R194-N198 WeakPolarHBondContact O-CB 3.39Å; R194-N198 PolarHBondContact O-N 3.1Å; R194-N198 PolarHBondContact O-OD1 3.5Å
195	Y	97.4	Very high	95.4	Very high	2 Å²	2	62.3 Å²	62.3	1%	0.008	29%	0.29	C	S	.	.	H	α-helix	trans	-67	-38.9	178.5	-62	-32.4	0	0	0	112.4	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.73Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å; V52-Y195 HydrophobicContact CG2-CD2 3.94Å; V52-Y195 HydrophobicContact CG2-CG 4.44Å; F57-Y195 HydrophobicContact CD2-CE2 4.44Å; F57-Y195 HydrophobicContact CE2-CD2 4.29Å; F57-Y195 AromaticContact CE2-CE2 3.63Å; F57-Y195 HydrophobicContact CE2-CE2 3.63Å; F57-Y195 AromaticContact CE2-CZ 3.8Å; F57-Y195 HydrophobicContact CZ-CD2 4.33Å; F57-Y195 AromaticContact CZ-CE2 3.76Å; F57-Y195 HydrophobicContact CZ-CE2 3.76Å; W75-Y195 HydrophobicContact CE3-CD1 4.29Å; W75-Y195 HydrophobicContact CH2-CG 4.16Å; W75-Y195 AromaticContact CZ3-CD1 3.63Å; W75-Y195 HydrophobicContact CZ3-CD1 3.63Å; W75-Y195 HydrophobicContact CZ3-CD2 4.32Å; W75-Y195 HydrophobicContact CZ3-CE1 4.36Å; W75-Y195 AromaticContact CZ3-CG 3.61Å; W75-Y195 HydrophobicContact CZ3-CG 3.61Å; V76-Y195 HydrophobicContact CG2-CE1 4.42Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.25Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.46Å; Y83-Y195 PolarHBondContact OH-OH 3.2Å; W191-Y195 HydrophobicContact CB-CE2 4.07Å; W191-Y195 HydrophobicContact CE3-CD1 4.39Å; W191-Y195 AromaticContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE1 3.51Å; W191-Y195 HydrophobicContact CE3-CE2 4.27Å; W191-Y195 AromaticContact CE3-CZ 3.43Å; W191-Y195 VanDerWaalsContact CE3-CZ 3.43Å; W191-Y195 VanDerWaalsContact CE3-OH 3.25Å; W191-Y195 AromaticContact CZ3-CE1 3.91Å; W191-Y195 HydrophobicContact CZ3-CE1 3.91Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.29Å; W191-Y195 VanDerWaalsContact O-CG 3.24Å; W191-Y195 PolarHBondContact O-N 2.83Å; L192-Y195 PolarHBondContact O-N 3.23Å; Y195-E197 VanDerWaalsContact C-N 3.31Å; Y195-E197 PolarHBondContact O-N 3.23Å; Y195-N198 PolarHBondContact O-N 2.77Å; Y195-G199 WeakPolarHBondContact O-CA 3.47Å; Y195-G199 PolarHBondContact O-N 2.89Å; Y195-L203 WeakPolarHBondContact O-CD1 3.25Å
196	L	96.1	Very high	95.1	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-36.1	174.6	-71.6	169.7	0	0	0	112.5	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.68Å; H27-L196 HydrophobicContact CB-CD2 3.98Å; H27-L196 HydrophobicContact CB-CG 4.41Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.46Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; L192-L196 HydrophobicContact CD1-CD1 3.82Å; L192-L196 HydrophobicContact CD1-CD2 4.36Å; L192-L196 HydrophobicContact CD1-CG 3.81Å; L192-L196 HydrophobicContact CG-CD1 4.01Å; L192-L196 HydrophobicContact CG-CG 4.47Å; L192-L196 WeakPolarHBondContact O-CB 3.33Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.16Å; L192-L196 PolarHBondContact O-N 2.89Å; R193-L196 PolarHBondContact O-N 3.26Å; L196-K200 WeakPolarHBondContact O-CA 3.45Å; L196-K200 WeakPolarHBondContact O-CB 3.39Å; L196-K200 PolarHBondContact O-N 3.16Å; L196-K200 VanDerWaalsContact O-N 3.11Å; L196-L203 HydrophobicContact CD2-CB 4.14Å; L196-L203 HydrophobicContact CD2-CD1 4.32Å; L196-Q204 PolarHBondContact O-NE2 3.12Å
197	E	95.8	Very high	94.9	Very high	125 Å²	125	61.7 Å²	61.7	58%	0.584	29%	0.287	S	S	*	.	H	α-helix	trans	-71.7	-48.2	174.3	-172.3	60.1	-152.2	0	0	111.1	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 3.29Å; R194-E197 PolarHBondContact O-N 3.16Å; Y195-E197 VanDerWaalsContact C-N 3.31Å; Y195-E197 PolarHBondContact O-N 3.23Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 2.99Å; E197-K200 WeakPolarHBondContact O-CB 3.41Å; E197-K200 PolarHBondContact O-N 3.32Å
198	N	96.5	Very high	94.8	Very high	53 Å²	53	64.7 Å²	64.7	28%	0.283	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-39.1	179	-78.1	1.8	0	0	0	113	W75 Q78 E79 R194 Y195	W75-N198 WeakPolarHBondContact CB-O 3.43Å; Q78-N198 PolarHBondContact NE2-ND2 3.43Å; E79-N198 PolarHBondContact OE1-ND2 2.87Å; R194-N198 VanDerWaalsContact O-CB 3.27Å; R194-N198 WeakPolarHBondContact O-CB 3.39Å; R194-N198 PolarHBondContact O-N 3.1Å; R194-N198 PolarHBondContact O-OD1 3.5Å; Y195-N198 PolarHBondContact O-N 2.77Å
199	G	95.4	Very high	94.8	Very high	2 Å²	2	65.1 Å²	65.1	2%	0.021	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	19.9	-176	0	0	0	0	0	113.5	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.47Å; Y195-G199 PolarHBondContact O-N 2.89Å; E197-G199 VanDerWaalsContact C-N 3.31Å; E197-G199 PolarHBondContact O-N 2.99Å; G199-E201 VanDerWaalsContact C-N 3.27Å; G199-E201 PolarHBondContact O-N 3.2Å; G199-E201 VanDerWaalsContact O-N 3.16Å; G199-T202 CarbonylContact O-C 3.57Å; G199-T202 PolarHBondContact O-N 3.34Å; G199-T202 PolarHBondContact O-OG1 2.98Å; G199-L203 WeakPolarHBondContact O-CB 3.21Å; G199-L203 PolarHBondContact O-N 2.64Å
200	K	93.3	Very high	94.8	Very high	111 Å²	111	72.1 Å²	72.1	48%	0.483	33%	0.33	S	S	.	.	H	α-helix	trans	-49.5	-44.5	-171.8	-176.9	173.5	-173.7	172.8	0	113.8	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.45Å; L196-K200 WeakPolarHBondContact O-CB 3.39Å; L196-K200 PolarHBondContact O-N 3.16Å; L196-K200 VanDerWaalsContact O-N 3.11Å; E197-K200 WeakPolarHBondContact O-CB 3.41Å; E197-K200 PolarHBondContact O-N 3.32Å; K200-T202 PolarHBondContact O-N 3Å; K200-Q204 WeakPolarHBondContact O-CB 3.25Å; K200-Q204 PolarHBondContact O-N 3.46Å; K200-Q204 VanDerWaalsContact O-N 3.16Å
201	E	90.7	Very high	94.8	Very high	182 Å²	182	67.7 Å²	67.7	85%	0.85	31%	0.312	S	S	*	.	H	α-helix	trans	-63.4	-27.4	-180	-62.7	-175.5	166.9	0	0	113.2	G199 R205	G199-E201 VanDerWaalsContact C-N 3.27Å; G199-E201 PolarHBondContact O-N 3.2Å; G199-E201 VanDerWaalsContact O-N 3.16Å; E201-R205 WeakPolarHBondContact O-CD 3.48Å
202	T	90.2	Very high	94.7	Very high	48 Å²	48	69.5 Å²	69.5	29%	0.294	32%	0.322	S	S	.	.	H	α-helix	trans	-104.3	-33.3	-176.4	50.8	0	0	0	0	114.5	W75 G199 K200 R205	W75-T202 VanDerWaalsContact CD1-OG1 3.24Å; G199-T202 CarbonylContact O-C 3.57Å; G199-T202 PolarHBondContact O-N 3.34Å; G199-T202 PolarHBondContact O-OG1 2.98Å; K200-T202 PolarHBondContact O-N 3Å; T202-R205 WeakPolarHBondContact O-CG 3.46Å; T202-R205 PolarHBondContact O-NE 2.86Å
203	L	91.4	Very high	94.7	Very high	4 Å²	4	70.6 Å²	70.6	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-94.2	-30.2	-173	-65	172.3	0	0	0	112.3	V52 T55 W75 Y195 L196 G199	V52-L203 HydrophobicContact CB-CD1 4.27Å; V52-L203 HydrophobicContact CB-CD2 4.14Å; V52-L203 HydrophobicContact CG1-CD1 3.87Å; V52-L203 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CG1-CG 4.49Å; T55-L203 HydrophobicContact CG2-CD2 4.11Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.36Å; W75-L203 HydrophobicContact CZ2-CD1 3.83Å; W75-L203 HydrophobicContact CZ2-CD2 4.12Å; W75-L203 HydrophobicContact CZ2-CG 4.38Å; Y195-L203 WeakPolarHBondContact O-CD1 3.25Å; L196-L203 HydrophobicContact CD2-CB 4.14Å; L196-L203 HydrophobicContact CD2-CD1 4.32Å; G199-L203 WeakPolarHBondContact O-CB 3.21Å; G199-L203 PolarHBondContact O-N 2.64Å
204	Q	89	Confident	94.7	Very high	91 Å²	91	66.4 Å²	66.4	43%	0.425	32%	0.316	S	S	.	.	S	Bend	trans	-102.2	18.8	178.6	-57	178.3	29.9	0	0	112	L196 K200	L196-Q204 PolarHBondContact O-NE2 3.12Å; K200-Q204 WeakPolarHBondContact O-CB 3.25Å; K200-Q204 PolarHBondContact O-N 3.46Å; K200-Q204 VanDerWaalsContact O-N 3.16Å
205	R	89.3	Confident	94.7	Very high	88 Å²	88	63.1 Å²	63.1	33%	0.332	31%	0.306	S	S	.	.			trans	-92.7	146.5	170.5	73.8	-173.3	170.9	152.7	11.4	109.2	E201 T202 E207 Y233	E201-R205 WeakPolarHBondContact O-CD 3.48Å; T202-R205 WeakPolarHBondContact O-CG 3.46Å; T202-R205 PolarHBondContact O-NE 2.86Å; R205-E207 IonicContact CZ-OE1 3.11Å; R205-E207 IonicContact NE-OE1 2.73Å; R205-E207 IonicContact NH1-OE1 3.03Å; R205-E207 PolarHBondContact NH1-OE1 2.85Å; R205-E207 IonicContact NH2-OE1 2.63Å; R205-E207 PolarHBondContact NH2-OE1 2.64Å; R205-Y233 HydrophobicContact CG-CD1 4.34Å; R205-Y233 WeakPolarHBondContact O-CD1 3.49Å
206	A	91.9	Very high	94.5	Very high	39 Å²	39	67 Å²	67	32%	0.322	32%	0.324	S	S	.	.			trans	-117.7	119.6	165.1	0	0	0	0	0	108.6	Y233	A206-Y233 CarbonylContact C-O 3.56Å; A206-Y233 VanDerWaalsContact CA-O 3.32Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å
207	E	94.1	Very high	94.4	Very high	61 Å²	61	71 Å²	71	29%	0.285	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-95.9	118	173.5	-67.1	-170.3	-157.9	0	0	108.5	R205 F232 Y233 T264 H287	R205-E207 IonicContact CZ-OE1 3.11Å; R205-E207 IonicContact NE-OE1 2.73Å; R205-E207 IonicContact NH1-OE1 3.03Å; R205-E207 PolarHBondContact NH1-OE1 2.85Å; R205-E207 IonicContact NH2-OE1 2.63Å; R205-E207 PolarHBondContact NH2-OE1 2.64Å; E207-F232 WeakPolarHBondContact O-CA 3.36Å; E207-F232 WeakPolarHBondContact O-CB 3.33Å; E207-Y233 PolarHBondContact N-O 3.04Å; E207-Y233 PolarHBondContact O-N 2.94Å; E207-T264 WeakPolarHBondContact OE2-CG2 3.47Å; E207-H287 PolarHBondContact O-CE1 2.83Å
208	H	95.3	Very high	94.2	Very high	117 Å²	117	69.5 Å²	69.5	54%	0.542	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-70.6	144.3	-179.1	20.5	-94.3	0	0	0	112.1	K210 G289 L290	H208-K210 PolarHBondContact O-N 2.89Å; H208-G289 PolarHBondContact ND1-O 3.24Å; H208-L290 HydrophobicContact CB-CD2 3.83Å; H208-L290 HydrophobicContact CB-CG 4.41Å
209	P	97.6	Very high	93.9	Very high	8 Å²	8	69.5 Å²	69.5	5%	0.052	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-66.7	131.9	179.3	28.1	-35.2	0	0	0	111.8	T211 A229 F232 I237 V285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.92Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-T211 PolarHBondContact O-N 2.73Å; P209-A229 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.92Å; P209-F232 HydrophobicContact CB-CG 4.16Å; P209-I237 HydrophobicContact CB-CD1 4.02Å; P209-I237 HydrophobicContact CG-CD1 4.1Å; P209-V285 HydrophobicContact CG-CG1 3.97Å; P209-H287 HydrophobicContact CG-CB 4.1Å; P209-L290 HydrophobicContact CG-CD1 3.83Å; P209-L290 HydrophobicContact CG-CD2 4.41Å; P209-L290 HydrophobicContact CG-CG 4.19Å
210	K	97.9	Very high	93.7	Very high	156 Å²	156	76.6 Å²	76.6	68%	0.678	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	108	164.2	-64.9	171.6	-172.3	164.8	0	108	H208 L230	H208-K210 PolarHBondContact O-N 2.89Å; K210-L230 PolarHBondContact N-O 3.06Å; K210-L230 PolarHBondContact O-N 2.85Å
211	T	97.9	Very high	93.6	Very high	33 Å²	33	78.2 Å²	78.2	20%	0.202	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	142.7	-172.3	58.7	0	0	0	0	113.3	P209 W228 A229 V285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.92Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-T211 PolarHBondContact O-N 2.73Å; T211-W228 WeakPolarHBondContact CA-O 3.15Å; T211-A229 HydrophobicContact CG2-CB 4.31Å; T211-V285 HydrophobicContact CG2-CB 4.44Å; T211-V285 HydrophobicContact CG2-CG1 4.16Å; T211-V285 HydrophobicContact CG2-CG2 4.06Å; T211-L294 HydrophobicContact CG2-CD1 4.3Å; T211-L296 VanDerWaalsContact CB-CD1 3.45Å; T211-L296 HydrophobicContact CG2-CD1 4.11Å
212	H	97.2	Very high	93.8	Very high	81 Å²	81	74 Å²	74	38%	0.375	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	158.7	171.2	63.1	-74.8	0	0	0	110.8	W228	H212-W228 VanDerWaalsContact CE1-CB 3.43Å; H212-W228 WeakPolarHBondContact CE1-CB 3.38Å; H212-W228 AromaticContact CE1-CD1 3.94Å; H212-W228 AromaticContact CE1-CG 3.7Å; H212-W228 PolarHBondContact N-O 2.74Å; H212-W228 AromaticContact NE2-CD1 3.52Å; H212-W228 AromaticContact NE2-CG 3.74Å; H212-W228 PolarHBondContact O-N 2.94Å
213	V	98.2	Very high	94.1	Very high	23 Å²	23	71.7 Å²	71.7	14%	0.139	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	128.3	176.3	-179.2	0	0	0	0	109.3	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.38Å; V213-L225 HydrophobicContact CG1-CD2 4.43Å; V213-R226 WeakPolarHBondContact CA-O 3.46Å; V213-C227 HydrophobicContact CG2-CB 4.41Å; V213-W241 HydrophobicContact CG1-CH2 3.87Å; V213-W241 HydrophobicContact CG1-CZ2 4.33Å; V213-W241 HydrophobicContact CG2-CH2 4.3Å; V213-L296 HydrophobicContact CG2-CB 3.88Å; V213-W298 HydrophobicContact CB-CB 4.47Å; V213-W298 HydrophobicContact CG1-CB 3.81Å
214	T	96.8	Very high	94.4	Very high	34 Å²	34	72.6 Å²	72.6	21%	0.209	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	146	175.6	53.5	0	0	0	0	110.2	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3.18Å; T214-H216 VanDerWaalsContact OG1-CE1 3.31Å; T214-L225 WeakPolarHBondContact O-CA 3.42Å; T214-R226 PolarHBondContact N-O 3.03Å; T214-R226 PolarHBondContact O-N 2.86Å; T214-R226 WeakPolarHBondContact OG1-CB 3.21Å; T214-R226 PolarHBondContact OG1-O 3.33Å; T214-R226 VanDerWaalsContact OG1-O 3.12Å; T214-W228 PolarHBondContact OG1-NE1 2.8Å
215	H	96	Very high	94.8	Very high	53 Å²	53	68.2 Å²	68.2	25%	0.245	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.5	-179.1	168.7	-91.4	0	0	0	109.7	A223 L225 E278 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.23Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; H215-E278 IonicContact NE2-OE1 3.79Å; H215-W298 HydrophobicContact CB-CD2 4.06Å; H215-W298 VanDerWaalsContact CB-CE2 3.49Å; H215-W298 HydrophobicContact CB-CG 4.12Å; H215-W298 HydrophobicContact CB-CZ2 3.97Å; H215-W298 VanDerWaalsContact CB-NE1 3.25Å; H215-W298 AromaticContact CG-CE2 3.76Å; H215-W298 AromaticContact CG-CZ2 3.77Å; H215-W298 AromaticContact ND1-CZ2 3.96Å
216	H	94.5	Very high	95.3	Very high	82 Å²	82	66.5 Å²	66.5	38%	0.38	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	105.8	-179.3	-59	83.2	0	0	0	109.1	T214 V218 A223 T224 R226	T214-H216 PolarHBondContact OG1-CE1 3.18Å; T214-H216 VanDerWaalsContact OG1-CE1 3.31Å; H216-V218 PolarHBondContact O-N 3.32Å; H216-A223 CarbonylContact O-C 3.6Å; H216-A223 WeakPolarHBondContact O-CA 3.44Å; H216-T224 PolarHBondContact N-O 2.82Å; H216-T224 PolarHBondContact O-N 2.94Å; H216-R226 PolarHBondContact CE1-NH1 2.85Å; H216-R226 VanDerWaalsContact CE1-NH1 3.34Å
217	P	93.6	Very high	95.6	Very high	99 Å²	99	64.6 Å²	64.6	64%	0.643	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	131	172.9	-19.6	30.1	0	0	0	110.6
218	V	90.9	Very high	95.8	Very high	94 Å²	94	64.1 Å²	64.1	57%	0.57	33%	0.326	S	S	*	.			trans	-104.4	-41.4	176	-178.8	0	0	0	0	110	H216 E222 T224	H216-V218 PolarHBondContact O-N 3.32Å; V218-E222 PolarHBondContact N-O 2.82Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.47Å
219	S	91.8	Very high	95.9	Very high	53 Å²	53	58.5 Å²	58.5	37%	0.371	30%	0.3	S	S	.	.	S	Bend	trans	-147.6	-178.4	175.3	72.3	0	0	0	0	110.6	H221 E222	S219-H221 PolarHBondContact O-N 2.91Å; S219-H221 PolarHBondContact OG-N 3.06Å; S219-E222 PolarHBondContact N-O 2.65Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 3.02Å
220	D	89.3	Confident	95.9	Very high	152 Å²	152	60.7 Å²	60.7	81%	0.813	31%	0.311	S	S	*	.	S	Bend	trans	-66.2	-10.3	172.8	-65.6	-23.1	0	0	0	113.3
221	H	92.8	Very high	95.9	Very high	145 Å²	145	54.2 Å²	54.2	67%	0.671	29%	0.288	S	S	*	.	S	Bend	trans	-117	-15.2	-175.6	-56.3	-42.9	0	0	0	113.4	S219 P274 S275	S219-H221 PolarHBondContact O-N 2.91Å; S219-H221 PolarHBondContact OG-N 3.06Å; H221-P274 CarbonylContact O-C 3.59Å; H221-P274 WeakPolarHBondContact O-CA 3.4Å; H221-S275 PolarHBondContact O-N 2.8Å; H221-S275 PolarHBondContact O-OG 2.83Å
222	E	95.1	Very high	95.9	Very high	92 Å²	92	52.6 Å²	52.6	43%	0.43	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	144.2	-171.3	-66.5	-179.8	164.7	0	0	112.1	V218 S219 V272 V273 S275	V218-E222 PolarHBondContact N-O 2.82Å; S219-E222 PolarHBondContact N-O 2.65Å; S219-E222 VanDerWaalsContact O-O 3.1Å; S219-E222 PolarHBondContact OG-N 3.02Å; E222-V272 HydrophobicContact CB-CG1 4.1Å; E222-V272 HydrophobicContact CG-CG1 4.31Å; E222-V273 WeakPolarHBondContact CA-O 3.43Å; E222-S275 PolarHBondContact N-OG 3.17Å
223	A	95.8	Very high	95.8	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.008	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	155.5	171	0	0	0	0	0	110.5	H215 H216 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.23Å; H216-A223 CarbonylContact O-C 3.6Å; H216-A223 WeakPolarHBondContact O-CA 3.44Å; A223-V273 HydrophobicContact CB-CG2 4.43Å; A223-V273 PolarHBondContact N-O 2.85Å; A223-V273 WeakPolarHBondContact O-CG2 3.48Å; A223-V273 PolarHBondContact O-N 3.34Å
224	T	97.5	Very high	95.6	Very high	22 Å²	22	48.7 Å²	48.7	14%	0.135	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	121.3	170.1	-54.6	0	0	0	0	109.5	H216 V218 A270 V271	H216-T224 PolarHBondContact N-O 2.82Å; H216-T224 PolarHBondContact O-N 2.94Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.47Å; T224-A270 HydrophobicContact CG2-CB 3.89Å; T224-V271 WeakPolarHBondContact CA-O 3.45Å
225	L	98	Very high	95.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	126.7	165.1	-63.2	-175.7	0	0	0	108.9	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.38Å; V213-L225 HydrophobicContact CG1-CD2 4.43Å; T214-L225 WeakPolarHBondContact O-CA 3.42Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; L225-W241 HydrophobicContact CB-CH2 3.67Å; L225-W241 HydrophobicContact CB-CZ2 3.79Å; L225-W241 HydrophobicContact CB-CZ3 4.46Å; L225-W241 HydrophobicContact CD1-CH2 4.05Å; L225-W241 HydrophobicContact CD1-CZ3 4.21Å; L225-A270 CarbonylContact O-C 3.54Å; L225-A270 WeakPolarHBondContact O-CA 3.39Å; L225-V271 HydrophobicContact CB-CG1 4.25Å; L225-V271 PolarHBondContact N-O 3.12Å; L225-V271 PolarHBondContact O-N 3.04Å; L225-V273 HydrophobicContact CD1-CG1 3.99Å; L225-V273 HydrophobicContact CD1-CG2 4.08Å; L225-V273 HydrophobicContact CG-CG1 4.13Å; L225-V273 HydrophobicContact CG-CG2 3.84Å; L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CB 4.47Å; L225-E278 HydrophobicContact CD2-CG 4.3Å; L225-W298 HydrophobicContact CD1-CB 4.43Å; L225-W298 HydrophobicContact CD2-CB 3.84Å; L225-W298 HydrophobicContact CD2-CD2 4.39Å; L225-W298 HydrophobicContact CD2-CG 3.98Å
226	R	98.3	Very high	95.6	Very high	51 Å²	51	52.1 Å²	52.1	19%	0.192	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	116.8	176.3	-177.8	-177.6	-62.1	115.3	3.1	110.3	V213 T214 H216 W228 W268 A269 A270	V213-R226 WeakPolarHBondContact CA-O 3.46Å; T214-R226 PolarHBondContact N-O 3.03Å; T214-R226 PolarHBondContact O-N 2.86Å; T214-R226 WeakPolarHBondContact OG1-CB 3.21Å; T214-R226 PolarHBondContact OG1-O 3.33Å; T214-R226 VanDerWaalsContact OG1-O 3.12Å; H216-R226 PolarHBondContact CE1-NH1 2.85Å; H216-R226 VanDerWaalsContact CE1-NH1 3.34Å; R226-W228 HydrophobicContact CG-CZ2 4.42Å; R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.1Å; R226-W268 HydrophobicContact CG-CE3 3.86Å; R226-W268 HydrophobicContact CG-CG 4.22Å; R226-A269 WeakPolarHBondContact CA-O 3.32Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.08Å
227	C	98.3	Very high	95.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.2	175.2	-174	0	0	0	0	109.4	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.41Å; C227-W241 HydrophobicContact CB-CH2 4.46Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; C227-W268 CarbonylContact O-C 3.58Å; C227-W268 WeakPolarHBondContact O-CA 3.48Å; C227-W268 WeakPolarHBondContact O-CB 3.44Å; C227-A269 PolarHBondContact N-O 3.39Å; C227-A269 PolarHBondContact O-N 3.25Å; C227-C283 HydrophobicContact CB-CB 3.51Å; C227-C283 WeakPolarHBondContact CB-SG 3.16Å; C227-C283 WeakPolarHBondContact SG-CB 3.5Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 3.19Å
228	W	98.4	Very high	95.9	Very high	50 Å²	50	46.7 Å²	46.7	19%	0.189	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	141.9	179.9	-69.3	89.4	0	0	0	110.4	T211 H212 T214 R226 L230 W268	T211-W228 WeakPolarHBondContact CA-O 3.15Å; H212-W228 VanDerWaalsContact CE1-CB 3.43Å; H212-W228 WeakPolarHBondContact CE1-CB 3.38Å; H212-W228 AromaticContact CE1-CD1 3.94Å; H212-W228 AromaticContact CE1-CG 3.7Å; H212-W228 PolarHBondContact N-O 2.74Å; H212-W228 AromaticContact NE2-CD1 3.52Å; H212-W228 AromaticContact NE2-CG 3.74Å; H212-W228 PolarHBondContact O-N 2.94Å; T214-W228 PolarHBondContact OG1-NE1 2.8Å; R226-W228 HydrophobicContact CG-CZ2 4.42Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.45Å; W228-W268 HydrophobicContact CD2-CB 3.97Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.87Å; W228-W268 HydrophobicContact CE3-CG 4.18Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.69Å; W228-W268 HydrophobicContact CH2-CG 4.3Å; W228-W268 HydrophobicContact CZ3-CB 4.32Å; W228-W268 AromaticContact CZ3-CD1 3.42Å; W228-W268 VanDerWaalsContact CZ3-CD1 3.42Å; W228-W268 HydrophobicContact CZ3-CG 4.11Å
229	A	98.5	Very high	96.2	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.8	162.3	0	0	0	0	0	107.7	P209 T211 F232 I237 L239 Q266 K267	P209-A229 HydrophobicContact CB-CB 3.87Å; T211-A229 HydrophobicContact CG2-CB 4.31Å; A229-F232 HydrophobicContact CB-CD1 4.05Å; A229-F232 HydrophobicContact CB-CE1 3.8Å; A229-F232 WeakPolarHBondContact O-CE1 3.4Å; A229-I237 HydrophobicContact CB-CD1 3.71Å; A229-L239 HydrophobicContact CB-CD1 4.05Å; A229-L239 HydrophobicContact CB-CD2 4.18Å; A229-Q266 VanDerWaalsContact O-CA 3.3Å; A229-Q266 WeakPolarHBondContact O-CA 3.16Å; A229-K267 PolarHBondContact N-O 3.11Å; A229-K267 PolarHBondContact O-N 3.31Å; A229-K267 VanDerWaalsContact O-O 3.08Å
230	L	98.3	Very high	96.5	Very high	54 Å²	54	41.9 Å²	41.9	28%	0.283	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147.1	-174.7	-58.5	176.7	0	0	0	111	K210 W228 Q266	K210-L230 PolarHBondContact N-O 3.06Å; K210-L230 PolarHBondContact O-N 2.85Å; W228-L230 HydrophobicContact CE3-CD2 3.9Å; W228-L230 HydrophobicContact CZ3-CD2 4.45Å; L230-Q266 HydrophobicContact CD2-CB 3.56Å
231	G	97.3	Very high	96.9	Very high	19 Å²	19	34.7 Å²	34.7	20%	0.196	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68	36.9	168.5	0	0	0	0	0	113.5	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.48Å; G231-F265 PolarHBondContact N-O 3.04Å
232	F	97.1	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	-107.6	155.1	179.1	59.3	-90.4	0	0	0	112.4	E207 P209 A229 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.36Å; E207-F232 WeakPolarHBondContact O-CB 3.33Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.92Å; P209-F232 HydrophobicContact CB-CG 4.16Å; A229-F232 HydrophobicContact CB-CD1 4.05Å; A229-F232 HydrophobicContact CB-CE1 3.8Å; A229-F232 WeakPolarHBondContact O-CE1 3.4Å; F232-P234 WeakPolarHBondContact CD2-O 3.37Å; F232-I237 HydrophobicContact CD1-CD1 3.89Å; F232-I237 HydrophobicContact CD2-CB 4.27Å; F232-I237 HydrophobicContact CD2-CD1 3.97Å; F232-I237 HydrophobicContact CE1-CD1 3.82Å; F232-I237 HydrophobicContact CE1-CG2 4.42Å; F232-I237 HydrophobicContact CE2-CB 3.74Å; F232-I237 HydrophobicContact CE2-CD1 3.92Å; F232-I237 HydrophobicContact CE2-CG1 4.42Å; F232-I237 HydrophobicContact CE2-CG2 3.55Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.13Å; F232-I237 HydrophobicContact CZ-CD1 3.86Å; F232-I237 HydrophobicContact CZ-CG2 3.52Å; F232-T257 HydrophobicContact CE2-CG2 4.06Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; F232-T264 CarbonylContact O-C 3.53Å; F232-T264 WeakPolarHBondContact O-CA 3.44Å; F232-F265 WeakPolarHBondContact CD1-O 3.43Å; F232-F265 HydrophobicContact CD2-CB 3.92Å; F232-F265 HydrophobicContact CE1-CB 4.28Å; F232-F265 WeakPolarHBondContact CE1-O 3.17Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CE2-CG 4.47Å; F232-F265 HydrophobicContact CG-CB 4.48Å; F232-F265 HydrophobicContact CZ-CB 3.65Å; F232-F265 PolarHBondContact N-O 3.19Å; F232-F265 PolarHBondContact O-N 2.74Å; F232-K267 HydrophobicContact CE1-CB 4.39Å; F232-K267 HydrophobicContact CZ-CB 4.11Å; F232-H287 AromaticContact CD2-CD2 3.84Å; F232-H287 AromaticContact CD2-NE2 3.66Å
233	Y	95.4	Very high	97.2	Very high	3 Å²	3	28.9 Å²	28.9	1%	0.012	15%	0.147	C	C	.	.	B	Isolated β-bridge	trans	-151	135.8	173.5	178.9	-84	0	0	0	108.7	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.02Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.37Å; T55-Y233 PolarHBondContact OG1-OH 2.92Å; R205-Y233 HydrophobicContact CG-CD1 4.34Å; R205-Y233 WeakPolarHBondContact O-CD1 3.49Å; A206-Y233 CarbonylContact C-O 3.56Å; A206-Y233 VanDerWaalsContact CA-O 3.32Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å; E207-Y233 PolarHBondContact N-O 3.04Å; E207-Y233 PolarHBondContact O-N 2.94Å; Y233-G263 WeakPolarHBondContact CD2-O 3.46Å; Y233-F265 HydrophobicContact CD2-CD2 4.44Å; Y233-F265 AromaticContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CE2-CE2 4.42Å; Y233-H287 PolarHBondContact O-CE1 3.18Å; Y233-H287 VanDerWaalsContact O-CE1 3.22Å
234	P	94.9	Very high	97.2	Very high	18 Å²	18	33.6 Å²	33.6	12%	0.117	17%	0.172	C	C	.	.	S	Bend	cis	-72.3	178.7	3.1	30.5	-36.4	0	0	0	113.4	D54 F232 E236 H287	D54-P234 VanDerWaalsContact OD2-CB 3.29Å; D54-P234 WeakPolarHBondContact OD2-CB 3.42Å; F232-P234 WeakPolarHBondContact CD2-O 3.37Å; P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.25Å; P234-H287 PolarHBondContact O-NE2 2.96Å
235	A	96.1	Very high	96.9	Very high	14 Å²	14	34.8 Å²	34.8	12%	0.116	19%	0.189	C	C	.	.	S	Bend	trans	-70.2	-25.5	-175.6	0	0	0	0	0	113.8	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.41Å; D54-A235 PolarHBondContact OD2-N 3.24Å; A235-I237 PolarHBondContact O-N 3.26Å; A235-T257 HydrophobicContact CB-CG2 4.29Å; A235-T257 WeakPolarHBondContact O-CG2 3.07Å; A235-F265 HydrophobicContact CB-CD1 3.72Å; A235-F265 HydrophobicContact CB-CD2 3.69Å; A235-F265 HydrophobicContact CB-CE1 3.69Å; A235-F265 HydrophobicContact CB-CE2 3.68Å; A235-F265 HydrophobicContact CB-CG 3.74Å; A235-F265 HydrophobicContact CB-CZ 3.7Å
236	E	95.5	Very high	96.8	Very high	145 Å²	145	41.6 Å²	41.6	68%	0.678	22%	0.221	S	C	*	.			trans	-64.9	116.1	179.6	-171.6	58.1	-144.9	0	0	110.1	P234 H287	P234-E236 VanDerWaalsContact C-N 3.32Å; P234-E236 PolarHBondContact O-N 3.25Å; E236-H287 PolarHBondContact O-CD2 3.05Å
237	I	96.4	Very high	96.6	Very high	10 Å²	10	43.7 Å²	43.7	5%	0.051	24%	0.235	C	C	.	.			trans	-151.6	141.7	-178.6	-164.3	170.5	0	0	0	109.6	P209 A229 F232 A235 L239 K267 V285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.02Å; P209-I237 HydrophobicContact CG-CD1 4.1Å; A229-I237 HydrophobicContact CB-CD1 3.71Å; F232-I237 HydrophobicContact CD1-CD1 3.89Å; F232-I237 HydrophobicContact CD2-CB 4.27Å; F232-I237 HydrophobicContact CD2-CD1 3.97Å; F232-I237 HydrophobicContact CE1-CD1 3.82Å; F232-I237 HydrophobicContact CE1-CG2 4.42Å; F232-I237 HydrophobicContact CE2-CB 3.74Å; F232-I237 HydrophobicContact CE2-CD1 3.92Å; F232-I237 HydrophobicContact CE2-CG1 4.42Å; F232-I237 HydrophobicContact CE2-CG2 3.55Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.13Å; F232-I237 HydrophobicContact CZ-CD1 3.86Å; F232-I237 HydrophobicContact CZ-CG2 3.52Å; A235-I237 PolarHBondContact O-N 3.26Å; I237-L239 HydrophobicContact CB-CD1 4.47Å; I237-L239 HydrophobicContact CD1-CD1 3.69Å; I237-L239 HydrophobicContact CG1-CD1 3.66Å; I237-L239 HydrophobicContact CG2-CD1 4.08Å; I237-K267 HydrophobicContact CG2-CB 4.24Å; I237-K267 HydrophobicContact CG2-CD 3.61Å; I237-V285 HydrophobicContact CD1-CG1 3.96Å; I237-V285 HydrophobicContact CG1-CG1 4.3Å; I237-Q286 VanDerWaalsContact CG1-O 3.31Å; I237-Q286 WeakPolarHBondContact CG1-O 3.04Å; I237-H287 HydrophobicContact CD1-CB 4.21Å; I237-H287 HydrophobicContact CG1-CB 4.01Å
238	T	97.3	Very high	96.5	Very high	58 Å²	58	44.9 Å²	44.9	36%	0.356	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.8	174.6	-63.2	0	0	0	0	110.3	T240 V285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.03Å; T238-V285 WeakPolarHBondContact O-CA 3.19Å; T238-Q286 PolarHBondContact N-O 2.87Å; T238-Q286 PolarHBondContact O-N 2.88Å
239	L	97.9	Very high	96.1	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.037	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.8	172.4	-86.1	62.8	0	0	0	108.6	A229 I237 L254 K267 A269 H284 V285	A229-L239 HydrophobicContact CB-CD1 4.05Å; A229-L239 HydrophobicContact CB-CD2 4.18Å; I237-L239 HydrophobicContact CB-CD1 4.47Å; I237-L239 HydrophobicContact CD1-CD1 3.69Å; I237-L239 HydrophobicContact CG1-CD1 3.66Å; I237-L239 HydrophobicContact CG2-CD1 4.08Å; L239-L254 HydrophobicContact CB-CD1 4.16Å; L239-K267 HydrophobicContact CD1-CD 4.27Å; L239-K267 HydrophobicContact CD2-CB 4.39Å; L239-K267 HydrophobicContact CD2-CG 4.46Å; L239-A269 HydrophobicContact CB-CB 4.03Å; L239-A269 HydrophobicContact CD2-CB 4.31Å; L239-H284 WeakPolarHBondContact CA-O 3.02Å; L239-V285 HydrophobicContact CD1-CG1 4.09Å; L239-V285 HydrophobicContact CG-CG2 4.31Å
240	T	97.6	Very high	95.6	Very high	38 Å²	38	56.6 Å²	56.6	23%	0.233	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	144	178.3	49.7	0	0	0	0	111	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.03Å; T240-C283 CarbonylContact O-C 3.47Å; T240-C283 WeakPolarHBondContact O-CA 3.22Å; T240-H284 PolarHBondContact N-O 3.31Å; T240-H284 PolarHBondContact O-N 2.04Å; T240-H284 WeakPolarHBondContact OG1-CB 3.41Å
241	W	98.2	Very high	95.1	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.008	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	136.4	170	-83.1	105.8	0	0	0	109.8	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.87Å; V213-W241 HydrophobicContact CG1-CZ2 4.33Å; V213-W241 HydrophobicContact CG2-CH2 4.3Å; L225-W241 HydrophobicContact CB-CH2 3.67Å; L225-W241 HydrophobicContact CB-CZ2 3.79Å; L225-W241 HydrophobicContact CB-CZ3 4.46Å; L225-W241 HydrophobicContact CD1-CH2 4.05Å; L225-W241 HydrophobicContact CD1-CZ3 4.21Å; C227-W241 HydrophobicContact CB-CH2 4.46Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; W241-Q248 HydrophobicContact CB-CB 4.23Å; W241-Q248 PolarHBondContact O-N 3.11Å; W241-A269 PolarHBondContact NE1-O 3.24Å; W241-V271 HydrophobicContact CB-CG1 4.38Å; W241-V271 HydrophobicContact CD2-CB 4.47Å; W241-V271 HydrophobicContact CD2-CG1 3.6Å; W241-V271 HydrophobicContact CE3-CG1 4Å; W241-V271 HydrophobicContact CG-CB 4.15Å; W241-V271 HydrophobicContact CG-CG1 3.78Å; W241-V271 HydrophobicContact CZ2-CG1 4.32Å; W241-T282 WeakPolarHBondContact CA-O 3.34Å; W241-T282 VanDerWaalsContact CE3-C 3.43Å; W241-C283 HydrophobicContact CD2-CB 4.15Å; W241-C283 HydrophobicContact CE3-CB 4.07Å; W241-C283 HydrophobicContact CH2-CB 3.97Å; W241-C283 HydrophobicContact CZ2-CB 4.06Å; W241-C283 HydrophobicContact CZ3-CB 3.98Å
242	Q	97.9	Very high	95	Very high	42 Å²	42	59.6 Å²	59.6	20%	0.196	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146.5	171.8	-69.7	-173.6	-5.6	0	0	110.4	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.55Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.25Å; Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.21Å; Q242-D247 PolarHBondContact NE2-OD1 2.73Å; Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.33Å; Q242-T282 PolarHBondContact N-O 3.02Å; Q242-T282 PolarHBondContact O-N 3.47Å; Q242-H284 PolarHBondContact OE1-NE2 3.5Å
243	R	97.3	Very high	95	Very high	72 Å²	72	65 Å²	65	27%	0.272	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.3	168.5	-176.5	-172.2	-176.1	179.7	0.4	108.2	G245 E246 Q248 E277 R280 Y281	R243-G245 PolarHBondContact O-N 3.46Å; R243-E246 PolarHBondContact N-O 3.31Å; R243-E246 PolarHBondContact O-N 2.94Å; R243-Q248 HydrophobicContact CB-CG 4.02Å; R243-E277 IonicContact CZ-OE2 3.81Å; R243-E277 IonicContact NE-OE2 3.95Å; R243-E277 IonicContact NH2-OE1 2.73Å; R243-E277 IonicContact NH2-OE2 3.77Å; R243-E277 PolarHBondContact NH2-OE2 3.08Å; R243-R280 WeakPolarHBondContact CA-O 3.48Å; R243-R280 HydrophobicContact CG-CB 4.39Å; R243-Y281 HydrophobicContact CB-CD1 4.12Å; R243-Y281 HydrophobicContact CB-CE1 3.92Å; R243-Y281 HydrophobicContact CG-CD1 4.5Å; R243-Y281 HydrophobicContact CG-CD2 4.47Å; R243-Y281 HydrophobicContact CG-CE1 4.13Å; R243-Y281 HydrophobicContact CG-CE2 4.07Å
244	D	95.1	Very high	95.1	Very high	100 Å²	100	69.2 Å²	69.2	54%	0.535	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	29.6	-175.3	-52.8	-53.2	0	0	0	114.4	R280	D244-R280 PolarHBondContact N-O 2.83Å; D244-R280 IonicContact OD1-NE 2.7Å; D244-R280 PolarHBondContact OD1-NE 3.05Å; D244-R280 IonicContact OD2-CZ 2.67Å; D244-R280 IonicContact OD2-NE 2.62Å; D244-R280 PolarHBondContact OD2-NE 2.91Å; D244-R280 IonicContact OD2-NH2 3.74Å; D244-R280 PolarHBondContact OD2-NH2 2.89Å
245	G	91.3	Very high	95.2	Very high	48 Å²	48	70 Å²	70	50%	0.495	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-0.3	-177.8	0	0	0	0	0	115.6	R243	R243-G245 PolarHBondContact O-N 3.46Å
246	E	95.5	Very high	95.2	Very high	143 Å²	143	77.6 Å²	77.6	67%	0.668	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.2	175.7	-63.3	-173.2	169.7	0	0	111.9	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.55Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.25Å; R243-E246 PolarHBondContact N-O 3.31Å; R243-E246 PolarHBondContact O-N 2.94Å; E246-Q248 PolarHBondContact O-NE2 3.02Å
247	D	95.3	Very high	95.3	Very high	94 Å²	94	72.8 Å²	72.8	50%	0.503	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	133.9	-179.8	-68.4	-21	0	0	0	112.5	Q242	Q242-D247 VanDerWaalsContact CG-OD1 3.23Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.21Å; Q242-D247 PolarHBondContact NE2-OD1 2.73Å
248	Q	95.3	Very high	95.3	Very high	25 Å²	25	76.8 Å²	76.8	12%	0.117	40%	0.398	C	S	.	.			trans	-104.3	37.4	-177.5	-57.6	-60.2	-68.4	0	0	112.2	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.23Å; W241-Q248 PolarHBondContact O-N 3.11Å; R243-Q248 HydrophobicContact CB-CG 4.02Å; E246-Q248 PolarHBondContact O-NE2 3.02Å; Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.41Å; Q248-D251 PolarHBondContact O-N 2.88Å; Q248-T252 WeakPolarHBondContact O-CB 3.4Å; Q248-T252 PolarHBondContact O-N 3.44Å; Q248-T252 PolarHBondContact O-OG1 2.78Å; Q248-Y281 HydrophobicContact CG-CE1 4.35Å
249	T	89.4	Confident	95.3	Very high	105 Å²	105	78.5 Å²	78.5	64%	0.644	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-35.8	-168.8	-49.9	0	0	0	0	114.1
250	Q	89.5	Confident	95.2	Very high	191 Å²	191	80.6 Å²	80.6	89%	0.893	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-31.8	-179.1	-67.4	-173.7	2.7	0	0	113.2	Q248 T252	Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.41Å; Q250-T252 VanDerWaalsContact C-N 3.34Å
251	D	87.4	Confident	95	Very high	111 Å²	111	82.5 Å²	82.5	59%	0.594	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	0.5	-178	-57.7	-51.9	0	0	0	112.3	Q248	Q248-D251 PolarHBondContact O-N 2.88Å
252	T	94.8	Very high	94.7	Very high	26 Å²	26	87.8 Å²	87.8	16%	0.16	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.5	179.7	-63.6	0	0	0	0	110.8	Q248 Q250 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.4Å; Q248-T252 PolarHBondContact O-N 3.44Å; Q248-T252 PolarHBondContact O-OG1 2.78Å; Q250-T252 VanDerWaalsContact C-N 3.34Å; T252-L254 HydrophobicContact CG2-CB 4.43Å; T252-L254 PolarHBondContact O-N 3.37Å; T252-A269 HydrophobicContact CG2-CB 3.91Å; T252-A270 CarbonylContact C-O 3.42Å; T252-A270 VanDerWaalsContact CA-O 3.32Å; T252-A270 WeakPolarHBondContact CA-O 3.43Å
253	E	96.8	Very high	94.4	Very high	114 Å²	114	87.7 Å²	87.7	53%	0.533	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	106.8	163.5	-173.4	-174.8	-171.6	0	0	108.9	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.22Å; E253-W268 HydrophobicContact CG-CH2 3.9Å; E253-W268 HydrophobicContact CG-CZ3 3.84Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.28Å; E253-A269 CarbonylContact O-C 3.51Å; E253-A269 WeakPolarHBondContact O-CA 3.31Å; E253-A270 HydrophobicContact CB-CB 4.42Å; E253-A270 PolarHBondContact N-O 3.3Å; E253-A270 PolarHBondContact O-N 2.93Å
254	L	96.8	Very high	94.3	Very high	91 Å²	91	84.6 Å²	84.6	48%	0.476	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.7	178.2	-173.9	68.3	0	0	0	110	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.16Å; T252-L254 HydrophobicContact CG2-CB 4.43Å; T252-L254 PolarHBondContact O-N 3.37Å; L254-K267 HydrophobicContact CD1-CD 4.43Å; L254-A269 HydrophobicContact CD1-CB 3.65Å
255	V	96.8	Very high	94.5	Very high	33 Å²	33	81 Å²	81	20%	0.2	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-84.3	153.5	175	-64.8	0	0	0	0	112.2	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.41Å; V255-K267 VanDerWaalsContact O-CE 3.3Å; V255-K267 WeakPolarHBondContact O-CE 3.37Å; V255-K267 WeakPolarHBondContact O-CG 3.37Å; V255-K267 PolarHBondContact O-NZ 3.01Å; V255-W268 HydrophobicContact CB-CZ2 4.4Å; V255-W268 HydrophobicContact CG1-CD2 3.98Å; V255-W268 HydrophobicContact CG1-CE3 4.29Å; V255-W268 HydrophobicContact CG1-CH2 3.58Å; V255-W268 HydrophobicContact CG1-CZ2 3.18Å; V255-W268 HydrophobicContact CG1-CZ3 4.1Å; V255-W268 HydrophobicContact CG2-CD2 3.76Å; V255-W268 HydrophobicContact CG2-CE3 4.49Å; V255-W268 HydrophobicContact CG2-CG 3.74Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.38Å; V255-W268 PolarHBondContact N-O 2.71Å
256	E	96.7	Very high	94.8	Very high	174 Å²	174	80.9 Å²	80.9	81%	0.813	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-57	147.4	167.3	-67.9	-177.3	175.1	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.43Å
257	T	97.8	Very high	95	Very high	45 Å²	45	75.1 Å²	75.1	28%	0.276	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-67.8	129.6	173.9	-56.6	0	0	0	0	108.4	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.06Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; A235-T257 HydrophobicContact CB-CG2 4.29Å; A235-T257 WeakPolarHBondContact O-CG2 3.07Å; T257-F265 HydrophobicContact CG2-CB 3.76Å; T257-F265 HydrophobicContact CG2-CD1 3.91Å; T257-F265 HydrophobicContact CG2-CG 4.1Å; T257-K267 WeakPolarHBondContact OG1-CD 3.43Å; T257-K267 PolarHBondContact OG1-NZ 2.89Å
258	R	97.3	Very high	95.1	Very high	94 Å²	94	71.8 Å²	71.8	36%	0.355	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145	-174.3	68.6	-167.2	-179.6	-169.7	2.7	111.4	E256 F265 Q266	E256-R258 PolarHBondContact O-N 3.43Å; R258-F265 WeakPolarHBondContact O-CA 3.43Å; R258-Q266 HydrophobicContact CG-CG 3.59Å; R258-Q266 PolarHBondContact N-O 2.91Å; R258-Q266 WeakPolarHBondContact O-CG 3.4Å; R258-Q266 PolarHBondContact O-N 3.22Å
259	P	97.1	Very high	95.2	Very high	94 Å²	94	70.6 Å²	70.6	61%	0.61	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	144.1	178	28.4	-34.5	0	0	0	111	F265	P259-F265 HydrophobicContact CB-CE1 4.3Å
260	A	96.4	Very high	95.7	Very high	51 Å²	51	65.8 Å²	65.8	42%	0.421	37%	0.368	S	S	.	.			trans	-87.3	-18.3	172.9	0	0	0	0	0	112.8	D262 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.27Å; A260-T264 WeakPolarHBondContact CB-O 3.43Å; A260-T264 PolarHBondContact N-O 2.87Å
261	G	92.9	Very high	96.1	Very high	77 Å²	77	56.8 Å²	56.8	79%	0.794	33%	0.326	S	S	*	.	S	Bend	trans	96.9	-6.5	178.9	0	0	0	0	0	114.9
262	D	92.1	Very high	96.5	Very high	113 Å²	113	55.1 Å²	55.1	60%	0.604	32%	0.32	S	S	*	.	S	Bend	trans	-105	12.2	175.9	60.5	0.9	0	0	0	113	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.27Å; D262-T264 WeakPolarHBondContact OD1-CB 3.2Å; D262-T264 PolarHBondContact OD1-N 3.4Å; D262-T264 PolarHBondContact OD1-OG1 3.37Å
263	G	91	Very high	96.6	Very high	41 Å²	41	54 Å²	54	42%	0.423	31%	0.313	S	S	.	.	S	Bend	trans	89.5	-2.4	-173.9	0	0	0	0	0	114.2	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.46Å
264	T	96.1	Very high	96.6	Very high	7 Å²	7	50.7 Å²	50.7	4%	0.043	30%	0.301	C	S	.	.			trans	-103.6	173	174.2	74.3	0	0	0	0	112.4	E207 G231 F232 A260 D262	E207-T264 WeakPolarHBondContact OE2-CG2 3.47Å; G231-T264 WeakPolarHBondContact CA-OG1 3.48Å; F232-T264 CarbonylContact O-C 3.53Å; F232-T264 WeakPolarHBondContact O-CA 3.44Å; A260-T264 WeakPolarHBondContact CB-O 3.43Å; A260-T264 PolarHBondContact N-O 2.87Å; D262-T264 WeakPolarHBondContact OD1-CB 3.2Å; D262-T264 PolarHBondContact OD1-N 3.4Å; D262-T264 PolarHBondContact OD1-OG1 3.37Å
265	F	97.9	Very high	96.4	Very high	25 Å²	25	49 Å²	49	11%	0.11	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	162.8	-177.6	-63.9	-86	0	0	0	112.3	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.76Å; D54-F265 HydrophobicContact CB-CZ 3.68Å; G231-F265 PolarHBondContact N-O 3.04Å; F232-F265 WeakPolarHBondContact CD1-O 3.43Å; F232-F265 HydrophobicContact CD2-CB 3.92Å; F232-F265 HydrophobicContact CE1-CB 4.28Å; F232-F265 WeakPolarHBondContact CE1-O 3.17Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CE2-CG 4.47Å; F232-F265 HydrophobicContact CG-CB 4.48Å; F232-F265 HydrophobicContact CZ-CB 3.65Å; F232-F265 PolarHBondContact N-O 3.19Å; F232-F265 PolarHBondContact O-N 2.74Å; Y233-F265 HydrophobicContact CD2-CD2 4.44Å; Y233-F265 AromaticContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CE2-CE2 4.42Å; A235-F265 HydrophobicContact CB-CD1 3.72Å; A235-F265 HydrophobicContact CB-CD2 3.69Å; A235-F265 HydrophobicContact CB-CE1 3.69Å; A235-F265 HydrophobicContact CB-CE2 3.68Å; A235-F265 HydrophobicContact CB-CG 3.74Å; A235-F265 HydrophobicContact CB-CZ 3.7Å; T257-F265 HydrophobicContact CG2-CB 3.76Å; T257-F265 HydrophobicContact CG2-CD1 3.91Å; T257-F265 HydrophobicContact CG2-CG 4.1Å; R258-F265 WeakPolarHBondContact O-CA 3.43Å; P259-F265 HydrophobicContact CB-CE1 4.3Å
266	Q	98.3	Very high	96.1	Very high	45 Å²	45	50.6 Å²	50.6	21%	0.21	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	145.9	174	42.4	166.4	-21.4	0	0	110.1	A229 L230 R258	A229-Q266 VanDerWaalsContact O-CA 3.3Å; A229-Q266 WeakPolarHBondContact O-CA 3.16Å; L230-Q266 HydrophobicContact CD2-CB 3.56Å; R258-Q266 HydrophobicContact CG-CG 3.59Å; R258-Q266 PolarHBondContact N-O 2.91Å; R258-Q266 WeakPolarHBondContact O-CG 3.4Å; R258-Q266 PolarHBondContact O-N 3.22Å
267	K	98.5	Very high	96.1	Very high	21 Å²	21	45 Å²	45	9%	0.091	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.7	176.9	-162	-175.1	-172.1	69.5	0	109	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 3.11Å; A229-K267 PolarHBondContact O-N 3.31Å; A229-K267 VanDerWaalsContact O-O 3.08Å; F232-K267 HydrophobicContact CE1-CB 4.39Å; F232-K267 HydrophobicContact CZ-CB 4.11Å; I237-K267 HydrophobicContact CG2-CB 4.24Å; I237-K267 HydrophobicContact CG2-CD 3.61Å; L239-K267 HydrophobicContact CD1-CD 4.27Å; L239-K267 HydrophobicContact CD2-CB 4.39Å; L239-K267 HydrophobicContact CD2-CG 4.46Å; L254-K267 HydrophobicContact CD1-CD 4.43Å; V255-K267 HydrophobicContact CG2-CG 4.41Å; V255-K267 VanDerWaalsContact O-CE 3.3Å; V255-K267 WeakPolarHBondContact O-CE 3.37Å; V255-K267 WeakPolarHBondContact O-CG 3.37Å; V255-K267 PolarHBondContact O-NZ 3.01Å; T257-K267 WeakPolarHBondContact OG1-CD 3.43Å; T257-K267 PolarHBondContact OG1-NZ 2.89Å
268	W	98.3	Very high	95.9	Very high	25 Å²	25	43.8 Å²	43.8	10%	0.095	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	156.4	169.1	58.7	-97.9	0	0	0	111.4	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4.01Å; R226-W268 HydrophobicContact CG-CD2 4.1Å; R226-W268 HydrophobicContact CG-CE3 3.86Å; R226-W268 HydrophobicContact CG-CG 4.22Å; C227-W268 CarbonylContact O-C 3.58Å; C227-W268 WeakPolarHBondContact O-CA 3.48Å; C227-W268 WeakPolarHBondContact O-CB 3.44Å; W228-W268 HydrophobicContact CD2-CB 3.97Å; W228-W268 HydrophobicContact CD2-CG 4.46Å; W228-W268 HydrophobicContact CE3-CB 3.88Å; W228-W268 AromaticContact CE3-CD1 3.87Å; W228-W268 HydrophobicContact CE3-CG 4.18Å; W228-W268 HydrophobicContact CG-CB 4.39Å; W228-W268 AromaticContact CH2-CD1 3.69Å; W228-W268 HydrophobicContact CH2-CG 4.3Å; W228-W268 HydrophobicContact CZ3-CB 4.32Å; W228-W268 AromaticContact CZ3-CD1 3.42Å; W228-W268 VanDerWaalsContact CZ3-CD1 3.42Å; W228-W268 HydrophobicContact CZ3-CG 4.11Å; E253-W268 HydrophobicContact CB-CZ3 4.22Å; E253-W268 HydrophobicContact CG-CH2 3.9Å; E253-W268 HydrophobicContact CG-CZ3 3.84Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.46Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.28Å; V255-W268 HydrophobicContact CB-CZ2 4.4Å; V255-W268 HydrophobicContact CG1-CD2 3.98Å; V255-W268 HydrophobicContact CG1-CE3 4.29Å; V255-W268 HydrophobicContact CG1-CH2 3.58Å; V255-W268 HydrophobicContact CG1-CZ2 3.18Å; V255-W268 HydrophobicContact CG1-CZ3 4.1Å; V255-W268 HydrophobicContact CG2-CD2 3.76Å; V255-W268 HydrophobicContact CG2-CE3 4.49Å; V255-W268 HydrophobicContact CG2-CG 3.74Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.38Å; V255-W268 PolarHBondContact N-O 2.71Å; W268-A270 HydrophobicContact CE3-CB 3.92Å; W268-A270 HydrophobicContact CZ3-CB 3.63Å
269	A	98.3	Very high	95.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.5	173.6	0	0	0	0	0	108.3	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.32Å; C227-A269 PolarHBondContact N-O 3.39Å; C227-A269 PolarHBondContact O-N 3.25Å; L239-A269 HydrophobicContact CB-CB 4.03Å; L239-A269 HydrophobicContact CD2-CB 4.31Å; W241-A269 PolarHBondContact NE1-O 3.24Å; T252-A269 HydrophobicContact CG2-CB 3.91Å; E253-A269 CarbonylContact O-C 3.51Å; E253-A269 WeakPolarHBondContact O-CA 3.31Å; L254-A269 HydrophobicContact CD1-CB 3.65Å
270	A	98	Very high	95.8	Very high	3 Å²	3	43.9 Å²	43.9	3%	0.025	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.3	179.5	0	0	0	0	0	111.9	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.89Å; L225-A270 CarbonylContact O-C 3.54Å; L225-A270 WeakPolarHBondContact O-CA 3.39Å; R226-A270 HydrophobicContact CB-CB 3.98Å; R226-A270 HydrophobicContact CG-CB 4.08Å; T252-A270 CarbonylContact C-O 3.42Å; T252-A270 VanDerWaalsContact CA-O 3.32Å; T252-A270 WeakPolarHBondContact CA-O 3.43Å; E253-A270 HydrophobicContact CB-CB 4.42Å; E253-A270 PolarHBondContact N-O 3.3Å; E253-A270 PolarHBondContact O-N 2.93Å; W268-A270 HydrophobicContact CE3-CB 3.92Å; W268-A270 HydrophobicContact CZ3-CB 3.63Å
271	V	97.8	Very high	95.9	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	141.8	176.6	63.5	0	0	0	0	109	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.45Å; L225-V271 HydrophobicContact CB-CG1 4.25Å; L225-V271 PolarHBondContact N-O 3.12Å; L225-V271 PolarHBondContact O-N 3.04Å; W241-V271 HydrophobicContact CB-CG1 4.38Å; W241-V271 HydrophobicContact CD2-CB 4.47Å; W241-V271 HydrophobicContact CD2-CG1 3.6Å; W241-V271 HydrophobicContact CE3-CG1 4Å; W241-V271 HydrophobicContact CG-CB 4.15Å; W241-V271 HydrophobicContact CG-CG1 3.78Å; W241-V271 HydrophobicContact CZ2-CG1 4.32Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.46Å; V271-Y281 HydrophobicContact CG1-CD1 4.01Å; V271-Y281 HydrophobicContact CG1-CE1 4.41Å; V271-Y281 HydrophobicContact CG2-CD1 4.42Å; V271-Y281 HydrophobicContact CG2-CE1 4.05Å
272	V	97.3	Very high	96.1	Very high	76 Å²	76	38.8 Å²	38.8	46%	0.461	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.5	171.7	-178.4	0	0	0	0	108.1	E222	E222-V272 HydrophobicContact CB-CG1 4.1Å; E222-V272 HydrophobicContact CG-CG1 4.31Å
273	V	96.6	Very high	96.4	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	144.9	-175.6	-52.2	0	0	0	0	110.6	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.43Å; A223-V273 HydrophobicContact CB-CG2 4.43Å; A223-V273 PolarHBondContact N-O 2.85Å; A223-V273 WeakPolarHBondContact O-CG2 3.48Å; A223-V273 PolarHBondContact O-N 3.34Å; L225-V273 HydrophobicContact CD1-CG1 3.99Å; L225-V273 HydrophobicContact CD1-CG2 4.08Å; L225-V273 HydrophobicContact CG-CG1 4.13Å; L225-V273 HydrophobicContact CG-CG2 3.84Å; V271-V273 HydrophobicContact CG1-CG1 3.79Å; V271-V273 HydrophobicContact CG2-CG1 4.46Å; V273-E278 HydrophobicContact CG2-CG 3.93Å; V273-Y281 HydrophobicContact CB-CD2 4.05Å; V273-Y281 HydrophobicContact CB-CE2 3.74Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.64Å; V273-Y281 HydrophobicContact CG1-CE1 3.64Å; V273-Y281 HydrophobicContact CG1-CE2 3.59Å; V273-Y281 HydrophobicContact CG1-CG 3.7Å
274	P	96.3	Very high	96.7	Very high	46 Å²	46	33.1 Å²	33.1	30%	0.299	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	139.5	169.8	-20.4	32.4	0	0	0	111.2	H221 G276 E277	H221-P274 CarbonylContact O-C 3.59Å; H221-P274 WeakPolarHBondContact O-CA 3.4Å; P274-G276 PolarHBondContact O-N 3.14Å; P274-E277 HydrophobicContact CB-CB 4.31Å; P274-E277 HydrophobicContact CB-CG 4.12Å; P274-E277 WeakPolarHBondContact O-CB 3.34Å; P274-E277 PolarHBondContact O-N 2.83Å
275	S	92.6	Very high	96.8	Very high	56 Å²	56	32.8 Å²	32.8	39%	0.392	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	129.4	176.7	-62.6	0	0	0	0	111.3	H221 E222 E278	H221-S275 PolarHBondContact O-N 2.8Å; H221-S275 PolarHBondContact O-OG 2.83Å; E222-S275 PolarHBondContact N-OG 3.17Å; S275-E278 WeakPolarHBondContact CA-OE1 3.23Å
276	G	91.4	Very high	96.8	Very high	66 Å²	66	36.3 Å²	36.3	68%	0.68	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.5	-7.4	-176.4	0	0	0	0	0	114.7	P274 E278	P274-G276 PolarHBondContact O-N 3.14Å; G276-E278 WeakPolarHBondContact CA-OE2 3.49Å; G276-E278 VanDerWaalsContact N-CD 3.29Å; G276-E278 PolarHBondContact N-OE1 3.12Å; G276-E278 PolarHBondContact N-OE2 3.46Å
277	E	95.3	Very high	96.6	Very high	56 Å²	56	34.5 Å²	34.5	26%	0.262	19%	0.19	S	C	.	.			trans	-100	4.1	176.1	-65.2	-159.6	-153.6	0	0	113.6	R243 P274 Q279 R280 Y281	R243-E277 IonicContact CZ-OE2 3.81Å; R243-E277 IonicContact NE-OE2 3.95Å; R243-E277 IonicContact NH2-OE1 2.73Å; R243-E277 IonicContact NH2-OE2 3.77Å; R243-E277 PolarHBondContact NH2-OE2 3.08Å; P274-E277 HydrophobicContact CB-CB 4.31Å; P274-E277 HydrophobicContact CB-CG 4.12Å; P274-E277 WeakPolarHBondContact O-CB 3.34Å; P274-E277 PolarHBondContact O-N 2.83Å; E277-Q279 PolarHBondContact O-N 2.66Å; E277-R280 WeakPolarHBondContact O-CB 3.35Å; E277-R280 PolarHBondContact O-N 2.85Å; E277-R280 IonicContact OE1-NH1 3.42Å; E277-R280 IonicContact OE2-CZ 3.54Å; E277-R280 IonicContact OE2-NE 3.1Å; E277-R280 IonicContact OE2-NH1 3.51Å; E277-R280 PolarHBondContact OE2-NH1 3.3Å; E277-Y281 HydrophobicContact CB-CE2 4.42Å; E277-Y281 WeakPolarHBondContact O-CD2 3.43Å
278	E	94.9	Very high	96.3	Very high	19 Å²	19	37 Å²	37	9%	0.089	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-57.3	-32.4	-171	-57.4	81.1	-177.5	0	0	112.7	H215 L225 V273 S275 G276 R280 Y281 W298	H215-E278 IonicContact NE2-OE1 3.79Å; L225-E278 HydrophobicContact CD1-CB 4.11Å; L225-E278 HydrophobicContact CD2-CB 4.47Å; L225-E278 HydrophobicContact CD2-CG 4.3Å; V273-E278 HydrophobicContact CG2-CG 3.93Å; S275-E278 WeakPolarHBondContact CA-OE1 3.23Å; G276-E278 WeakPolarHBondContact CA-OE2 3.49Å; G276-E278 VanDerWaalsContact N-CD 3.29Å; G276-E278 PolarHBondContact N-OE1 3.12Å; G276-E278 PolarHBondContact N-OE2 3.46Å; E278-R280 VanDerWaalsContact C-N 3.26Å; E278-R280 PolarHBondContact O-N 2.88Å; E278-Y281 PolarHBondContact O-N 3.03Å; E278-W298 HydrophobicContact CB-CD2 4.44Å; E278-W298 HydrophobicContact CB-CE3 3.42Å; E278-W298 VanDerWaalsContact CB-CE3 3.42Å; E278-W298 HydrophobicContact CB-CZ3 3.84Å; E278-W298 HydrophobicContact CG-CE3 3.71Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å
279	Q	95.1	Very high	95.9	Very high	90 Å²	90	36.4 Å²	36.4	42%	0.421	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-72.9	-15.2	-179.2	-62.6	-57.1	-46.6	0	0	114.1	E277 Y281 W298	E277-Q279 PolarHBondContact O-N 2.66Å; Q279-Y281 VanDerWaalsContact C-N 3.26Å; Q279-W298 PolarHBondContact NE2-O 3.48Å
280	R	96.7	Very high	95.7	Very high	100 Å²	100	37 Å²	37	38%	0.377	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-77.4	-16.5	172.9	-63.4	174.4	67.8	178.5	5.7	112.2	R243 D244 E277 E278	R243-R280 WeakPolarHBondContact CA-O 3.48Å; R243-R280 HydrophobicContact CG-CB 4.39Å; D244-R280 PolarHBondContact N-O 2.83Å; D244-R280 IonicContact OD1-NE 2.7Å; D244-R280 PolarHBondContact OD1-NE 3.05Å; D244-R280 IonicContact OD2-CZ 2.67Å; D244-R280 IonicContact OD2-NE 2.62Å; D244-R280 PolarHBondContact OD2-NE 2.91Å; D244-R280 IonicContact OD2-NH2 3.74Å; D244-R280 PolarHBondContact OD2-NH2 2.89Å; E277-R280 WeakPolarHBondContact O-CB 3.35Å; E277-R280 PolarHBondContact O-N 2.85Å; E277-R280 IonicContact OE1-NH1 3.42Å; E277-R280 IonicContact OE2-CZ 3.54Å; E277-R280 IonicContact OE2-NE 3.1Å; E277-R280 IonicContact OE2-NH1 3.51Å; E277-R280 PolarHBondContact OE2-NH1 3.3Å; E278-R280 VanDerWaalsContact C-N 3.26Å; E278-R280 PolarHBondContact O-N 2.88Å
281	Y	97.6	Very high	95.4	Very high	8 Å²	8	42.9 Å²	42.9	3%	0.031	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.6	-177.3	-69.5	-100.8	0	0	0	111.2	Q242 R243 Q248 V271 V273 E277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.25Å; Q242-Y281 WeakPolarHBondContact O-CA 3.33Å; R243-Y281 HydrophobicContact CB-CD1 4.12Å; R243-Y281 HydrophobicContact CB-CE1 3.92Å; R243-Y281 HydrophobicContact CG-CD1 4.5Å; R243-Y281 HydrophobicContact CG-CD2 4.47Å; R243-Y281 HydrophobicContact CG-CE1 4.13Å; R243-Y281 HydrophobicContact CG-CE2 4.07Å; Q248-Y281 HydrophobicContact CG-CE1 4.35Å; V271-Y281 HydrophobicContact CG1-CD1 4.01Å; V271-Y281 HydrophobicContact CG1-CE1 4.41Å; V271-Y281 HydrophobicContact CG2-CD1 4.42Å; V271-Y281 HydrophobicContact CG2-CE1 4.05Å; V273-Y281 HydrophobicContact CB-CD2 4.05Å; V273-Y281 HydrophobicContact CB-CE2 3.74Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.64Å; V273-Y281 HydrophobicContact CG1-CE1 3.64Å; V273-Y281 HydrophobicContact CG1-CE2 3.59Å; V273-Y281 HydrophobicContact CG1-CG 3.7Å; E277-Y281 HydrophobicContact CB-CE2 4.42Å; E277-Y281 WeakPolarHBondContact O-CD2 3.43Å; E278-Y281 PolarHBondContact O-N 3.03Å; Q279-Y281 VanDerWaalsContact C-N 3.26Å
282	T	97.9	Very high	95.2	Very high	13 Å²	13	49.9 Å²	49.9	8%	0.08	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	133.8	175.6	47	0	0	0	0	110.5	W241 Q242 H284 T295 L296 R297	W241-T282 WeakPolarHBondContact CA-O 3.34Å; W241-T282 VanDerWaalsContact CE3-C 3.43Å; Q242-T282 PolarHBondContact N-O 3.02Å; Q242-T282 PolarHBondContact O-N 3.47Å; T282-H284 PolarHBondContact OG1-NE2 3.16Å; T282-T295 HydrophobicContact CG2-CG2 3.94Å; T282-L296 CarbonylContact C-O 3.53Å; T282-L296 WeakPolarHBondContact CA-O 3.33Å; T282-R297 HydrophobicContact CG2-CG 3.63Å; T282-R297 VanDerWaalsContact CG2-NE 3.3Å
283	C	98.2	Very high	95.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.5	169.7	174.3	0	0	0	0	109.5	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.51Å; C227-C283 WeakPolarHBondContact CB-SG 3.16Å; C227-C283 WeakPolarHBondContact SG-CB 3.5Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 3.19Å; T240-C283 CarbonylContact O-C 3.47Å; T240-C283 WeakPolarHBondContact O-CA 3.22Å; W241-C283 HydrophobicContact CD2-CB 4.15Å; W241-C283 HydrophobicContact CE3-CB 4.07Å; W241-C283 HydrophobicContact CH2-CB 3.97Å; W241-C283 HydrophobicContact CZ2-CB 4.06Å; W241-C283 HydrophobicContact CZ3-CB 3.98Å; C283-T295 CarbonylContact O-C 3.53Å; C283-T295 WeakPolarHBondContact O-CA 3.19Å; C283-L296 HydrophobicContact CB-CB 4.29Å; C283-L296 PolarHBondContact N-O 3.48Å; C283-L296 PolarHBondContact O-N 2.81Å
284	H	97.9	Very high	95.1	Very high	35 Å²	35	52.3 Å²	52.3	16%	0.162	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.2	176.5	-63.6	-102.1	0	0	0	109.8	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.02Å; T240-H284 PolarHBondContact N-O 3.31Å; T240-H284 PolarHBondContact O-N 2.04Å; T240-H284 WeakPolarHBondContact OG1-CB 3.41Å; Q242-H284 PolarHBondContact OE1-NE2 3.5Å; T282-H284 PolarHBondContact OG1-NE2 3.16Å; H284-L294 CarbonylContact C-O 3.53Å; H284-L294 VanDerWaalsContact CA-O 3.32Å; H284-L294 WeakPolarHBondContact CA-O 3.33Å; H284-T295 PolarHBondContact CE1-OG1 2.98Å; H284-T295 PolarHBondContact ND1-OG1 3.43Å
285	V	98	Very high	95.2	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.3	-178.2	-174.3	0	0	0	0	109.2	P209 T211 I237 T238 L239 L290 P293 L294 L296	P209-V285 HydrophobicContact CG-CG1 3.97Å; T211-V285 HydrophobicContact CG2-CB 4.44Å; T211-V285 HydrophobicContact CG2-CG1 4.16Å; T211-V285 HydrophobicContact CG2-CG2 4.06Å; I237-V285 HydrophobicContact CD1-CG1 3.96Å; I237-V285 HydrophobicContact CG1-CG1 4.3Å; T238-V285 WeakPolarHBondContact O-CA 3.19Å; L239-V285 HydrophobicContact CD1-CG1 4.09Å; L239-V285 HydrophobicContact CG-CG2 4.31Å; V285-L290 HydrophobicContact CG1-CD1 4.24Å; V285-P293 WeakPolarHBondContact O-CA 3.45Å; V285-L294 HydrophobicContact CB-CB 4.32Å; V285-L294 PolarHBondContact N-O 2.89Å; V285-L294 PolarHBondContact O-N 3.36Å; V285-L296 HydrophobicContact CG2-CD1 3.88Å
286	Q	97.2	Very high	95.4	Very high	100 Å²	100	53 Å²	53	47%	0.467	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.2	174	-57.2	177.5	12.8	0	0	109	I237 T238 P293	I237-Q286 VanDerWaalsContact CG1-O 3.31Å; I237-Q286 WeakPolarHBondContact CG1-O 3.04Å; T238-Q286 PolarHBondContact N-O 2.87Å; T238-Q286 PolarHBondContact O-N 2.88Å; Q286-P293 HydrophobicContact CG-CB 3.99Å; Q286-P293 HydrophobicContact CG-CG 4.11Å
287	H	95.4	Very high	95.6	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.028	28%	0.284	C	S	.	.			trans	-157.3	144.8	-177.6	-174.5	-102	0	0	0	109	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 WeakPolarHBondContact CH2-O 3.06Å; W23-H287 WeakPolarHBondContact CZ2-O 3.36Å; E207-H287 PolarHBondContact O-CE1 2.83Å; P209-H287 HydrophobicContact CG-CB 4.1Å; F232-H287 AromaticContact CD2-CD2 3.84Å; F232-H287 AromaticContact CD2-NE2 3.66Å; Y233-H287 PolarHBondContact O-CE1 3.18Å; Y233-H287 VanDerWaalsContact O-CE1 3.22Å; P234-H287 PolarHBondContact O-NE2 2.96Å; E236-H287 PolarHBondContact O-CD2 3.05Å; I237-H287 HydrophobicContact CD1-CB 4.21Å; I237-H287 HydrophobicContact CG1-CB 4.01Å; H287-G289 PolarHBondContact CE1-N 3.12Å; H287-G289 WeakPolarHBondContact ND1-CA 3.26Å; H287-G289 PolarHBondContact ND1-N 3.38Å; H287-G289 PolarHBondContact O-N 3.02Å; H287-G289 VanDerWaalsContact O-N 3.13Å; H287-L290 HydrophobicContact CB-CD1 3.96Å; H287-L290 HydrophobicContact CB-CG 4.21Å; H287-L290 WeakPolarHBondContact O-CB 3.34Å; H287-L290 PolarHBondContact O-N 2.7Å
288	E	91.3	Very high	95.6	Very high	74 Å²	74	56.3 Å²	56.3	35%	0.346	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.4	178.9	-165.7	-169.8	146.3	0	0	113.8	W23 C25 L290	W23-E288 HydrophobicContact CE3-CG 4.29Å; W23-E288 VanDerWaalsContact CH2-O 3.24Å; W23-E288 WeakPolarHBondContact CH2-O 3.34Å; W23-E288 VanDerWaalsContact CZ3-C 3.42Å; W23-E288 HydrophobicContact CZ3-CG 4.25Å; W23-E288 WeakPolarHBondContact CZ3-O 3.43Å; C25-E288 PolarHBondContact SG-OE1 3.35Å; E288-L290 VanDerWaalsContact C-N 3.29Å; E288-L290 PolarHBondContact O-N 3.03Å
289	G	91	Very high	95.4	Very high	12 Å²	12	63.2 Å²	63.2	12%	0.124	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.3	174.7	0	0	0	0	0	114.5	H208 H287	H208-G289 PolarHBondContact ND1-O 3.24Å; H287-G289 PolarHBondContact CE1-N 3.12Å; H287-G289 WeakPolarHBondContact ND1-CA 3.26Å; H287-G289 PolarHBondContact ND1-N 3.38Å; H287-G289 PolarHBondContact O-N 3.02Å; H287-G289 VanDerWaalsContact O-N 3.13Å
290	L	93.6	Very high	94.7	Very high	12 Å²	12	62.6 Å²	62.6	6%	0.063	32%	0.316	C	S	.	.			trans	-106.3	119	-171.8	-67.2	171.6	0	0	0	112.8	W23 H208 P209 V285 H287 E288 E292 L294	W23-L290 WeakPolarHBondContact CH2-O 3.34Å; W23-L290 VanDerWaalsContact CZ2-O 3.29Å; W23-L290 WeakPolarHBondContact CZ2-O 3.44Å; H208-L290 HydrophobicContact CB-CD2 3.83Å; H208-L290 HydrophobicContact CB-CG 4.41Å; P209-L290 HydrophobicContact CG-CD1 3.83Å; P209-L290 HydrophobicContact CG-CD2 4.41Å; P209-L290 HydrophobicContact CG-CG 4.19Å; V285-L290 HydrophobicContact CG1-CD1 4.24Å; H287-L290 HydrophobicContact CB-CD1 3.96Å; H287-L290 HydrophobicContact CB-CG 4.21Å; H287-L290 WeakPolarHBondContact O-CB 3.34Å; H287-L290 PolarHBondContact O-N 2.7Å; E288-L290 VanDerWaalsContact C-N 3.29Å; E288-L290 PolarHBondContact O-N 3.03Å; L290-E292 PolarHBondContact O-N 3.46Å; L290-L294 HydrophobicContact CD1-CD1 3.93Å; L290-L294 HydrophobicContact CD1-CG 3.86Å; L290-L294 HydrophobicContact CD2-CD1 3.67Å; L290-L294 HydrophobicContact CD2-CD2 4.5Å; L290-L294 HydrophobicContact CD2-CG 3.93Å; L290-L294 HydrophobicContact CG-CD1 4.47Å; L290-L294 HydrophobicContact CG-CG 4.5Å
291	P	91.6	Very high	93.2	Very high	128 Å²	128	63 Å²	63	83%	0.831	33%	0.334	S	S	*	.	S	Bend	trans	-58.3	-30	-179.5	25.9	-35.1	0	0	0	113.3
292	E	92.9	Very high	90.9	Very high	150 Å²	150	68 Å²	68	70%	0.701	37%	0.371	S	S	*	.	S	Bend	trans	-140.6	150.9	172.3	-64.9	-178.1	178.8	0	0	109.6	L290 L294	L290-E292 PolarHBondContact O-N 3.46Å; E292-L294 PolarHBondContact O-N 2.94Å
293	P	95.3	Very high	88.5	Confident	65 Å²	65	75.2 Å²	75.2	42%	0.422	40%	0.403	S	S	.	.			trans	-54.4	136.7	173.7	-27.4	36.3	0	0	0	112.7	V285 Q286	V285-P293 WeakPolarHBondContact O-CA 3.45Å; Q286-P293 HydrophobicContact CG-CB 3.99Å; Q286-P293 HydrophobicContact CG-CG 4.11Å
294	L	96.8	Very high	85.9	Confident	62 Å²	62	80.3 Å²	80.3	33%	0.325	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	141.1	175.9	-63.6	176.8	0	0	0	110.6	T211 H284 V285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.3Å; H284-L294 CarbonylContact C-O 3.53Å; H284-L294 VanDerWaalsContact CA-O 3.32Å; H284-L294 WeakPolarHBondContact CA-O 3.33Å; V285-L294 HydrophobicContact CB-CB 4.32Å; V285-L294 PolarHBondContact N-O 2.89Å; V285-L294 PolarHBondContact O-N 3.36Å; L290-L294 HydrophobicContact CD1-CD1 3.93Å; L290-L294 HydrophobicContact CD1-CG 3.86Å; L290-L294 HydrophobicContact CD2-CD1 3.67Å; L290-L294 HydrophobicContact CD2-CD2 4.5Å; L290-L294 HydrophobicContact CD2-CG 3.93Å; L290-L294 HydrophobicContact CG-CD1 4.47Å; L290-L294 HydrophobicContact CG-CG 4.5Å; E292-L294 PolarHBondContact O-N 2.94Å
295	T	97.6	Very high	83.8	Confident	83 Å²	83	84.9 Å²	84.9	51%	0.509	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.2	170.6	-57	0	0	0	0	108.7	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 3.94Å; C283-T295 CarbonylContact O-C 3.53Å; C283-T295 WeakPolarHBondContact O-CA 3.19Å; H284-T295 PolarHBondContact CE1-OG1 2.98Å; H284-T295 PolarHBondContact ND1-OG1 3.43Å
296	L	97.1	Very high	81.8	Confident	34 Å²	34	89.7 Å²	89.7	18%	0.178	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.4	-173.5	-61.5	150.4	0	0	0	110	T211 V213 T282 C283 V285	T211-L296 VanDerWaalsContact CB-CD1 3.45Å; T211-L296 HydrophobicContact CG2-CD1 4.11Å; V213-L296 HydrophobicContact CG2-CB 3.88Å; T282-L296 CarbonylContact C-O 3.53Å; T282-L296 WeakPolarHBondContact CA-O 3.33Å; C283-L296 HydrophobicContact CB-CB 4.29Å; C283-L296 PolarHBondContact N-O 3.48Å; C283-L296 PolarHBondContact O-N 2.81Å; V285-L296 HydrophobicContact CG2-CD1 3.88Å
297	R	96.2	Very high	79.9	Confident	144 Å²	144	89 Å²	89	54%	0.543	50%	0.496	S	S	.	.			trans	-117.9	161.7	166.8	-70.6	-175.2	177.2	157.2	0.3	109.3	T282 E299	T282-R297 HydrophobicContact CG2-CG 3.63Å; T282-R297 VanDerWaalsContact CG2-NE 3.3Å; R297-E299 PolarHBondContact O-N 3.42Å
298	W	95.8	Very high	78.3	Confident	47 Å²	47	94.4 Å²	94.4	18%	0.178	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-69.8	122	167.9	170.8	57.1	0	0	0	110.1	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.47Å; V213-W298 HydrophobicContact CG1-CB 3.81Å; H215-W298 HydrophobicContact CB-CD2 4.06Å; H215-W298 VanDerWaalsContact CB-CE2 3.49Å; H215-W298 HydrophobicContact CB-CG 4.12Å; H215-W298 HydrophobicContact CB-CZ2 3.97Å; H215-W298 VanDerWaalsContact CB-NE1 3.25Å; H215-W298 AromaticContact CG-CE2 3.76Å; H215-W298 AromaticContact CG-CZ2 3.77Å; H215-W298 AromaticContact ND1-CZ2 3.96Å; L225-W298 HydrophobicContact CD1-CB 4.43Å; L225-W298 HydrophobicContact CD2-CB 3.84Å; L225-W298 HydrophobicContact CD2-CD2 4.39Å; L225-W298 HydrophobicContact CD2-CG 3.98Å; E278-W298 HydrophobicContact CB-CD2 4.44Å; E278-W298 HydrophobicContact CB-CE3 3.42Å; E278-W298 VanDerWaalsContact CB-CE3 3.42Å; E278-W298 HydrophobicContact CB-CZ3 3.84Å; E278-W298 HydrophobicContact CG-CE3 3.71Å; E278-W298 HydrophobicContact CG-CZ3 3.75Å; Q279-W298 PolarHBondContact NE2-O 3.48Å; W298-P300 HydrophobicContact CE3-CG 4.42Å; W298-P300 HydrophobicContact CH2-CB 4.29Å; W298-P300 HydrophobicContact CH2-CG 3.94Å; W298-P300 HydrophobicContact CZ2-CB 4.07Å; W298-P300 HydrophobicContact CZ2-CG 4.06Å; W298-P300 HydrophobicContact CZ3-CG 4.12Å
299	E	89.4	Confident	76.9	Confident	164 Å²	164	96.7 Å²	96.7	77%	0.766	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-100.3	119.9	169.8	-71.1	-176.6	176	0	0	109.3	R297 S301	R297-E299 PolarHBondContact O-N 3.42Å; E299-S301 PolarHBondContact O-N 2.99Å
300	P	81.1	Confident	75.8	Confident	78 Å²	78	98.3 Å²	98.3	51%	0.506	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-58.8	128.9	171.2	-19.7	30.4	0	0	0	109.1	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.42Å; W298-P300 HydrophobicContact CH2-CB 4.29Å; W298-P300 HydrophobicContact CH2-CG 3.94Å; W298-P300 HydrophobicContact CZ2-CB 4.07Å; W298-P300 HydrophobicContact CZ2-CG 4.06Å; W298-P300 HydrophobicContact CZ3-CG 4.12Å; P300-S302 PolarHBondContact O-N 3.05Å
301	S	64.7	Low	74.8	Confident	108 Å²	108	102 Å²	102	76%	0.755	58%	0.578	S	S	*	*			trans	-57	110	179.8	63.4	0	0	0	0	109.8	E299 Q303	E299-S301 PolarHBondContact O-N 2.99Å; S301-Q303 PolarHBondContact O-N 3.3Å
302	S	50.8	Low	74	Confident	114 Å²	114	100.3 Å²	100.3	80%	0.797	56%	0.564	S	S	*	*			trans	-77	72	166.9	50.5	0	0	0	0	107.9	P300 P304	P300-S302 PolarHBondContact O-N 3.05Å; S302-P304 WeakPolarHBondContact O-CD 3.47Å; S302-P304 VanDerWaalsContact O-N 3.16Å
303	Q	46.3	Very low	73.1	Confident	163 Å²	163	95.6 Å²	95.6	76%	0.762	55%	0.552	S	S	*	*			trans	-65.3	111.9	155.2	-80.7	-167.9	-17.6	0	0	105.5	S301 T305	S301-Q303 PolarHBondContact O-N 3.3Å; Q303-T305 PolarHBondContact O-N 3.19Å
304	P	44.5	Very low	72.4	Confident	107 Å²	107	94.1 Å²	94.1	70%	0.695	55%	0.548	S	S	*	.			trans	-59.5	114.1	166	26.2	-30.2	0	0	0	104.6	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.47Å; S302-P304 VanDerWaalsContact O-N 3.16Å; P304-I306 PolarHBondContact O-N 2.74Å
305	T	52.5	Low	71.8	Confident	131 Å²	131	96.4 Å²	96.4	80%	0.804	56%	0.56	S	S	*	*			trans	-66.7	82.8	163.8	-48.9	0	0	0	0	104.4	Q303 P307	Q303-T305 PolarHBondContact O-N 3.19Å; T305-P307 VanDerWaalsContact O-CD 3.3Å; T305-P307 WeakPolarHBondContact O-CD 3.21Å
306	I	57	Low	71.1	Confident	102 Å²	102	95 Å²	95	52%	0.523	56%	0.557	S	S	.	*			trans	-51	119.8	166.7	-63.2	175.3	0	0	0	103	P304 I308 I311	P304-I306 PolarHBondContact O-N 2.74Å; I306-I308 HydrophobicContact CG2-CG1 4.43Å; I306-I308 PolarHBondContact O-N 3.23Å; I306-I311 HydrophobicContact CG2-CD1 3.93Å
307	P	57.9	Low	70.5	Confident	85 Å²	85	97.7 Å²	97.7	55%	0.552	57%	0.574	S	S	*	*			trans	-73.3	78.8	-176.6	29.4	-32.7	0	0	0	107	T305 V309 G310 I311	T305-P307 VanDerWaalsContact O-CD 3.3Å; T305-P307 WeakPolarHBondContact O-CD 3.21Å; P307-V309 PolarHBondContact O-N 3.35Å; P307-V309 VanDerWaalsContact O-N 3.16Å; P307-G310 WeakPolarHBondContact O-CA 3.32Å; P307-G310 PolarHBondContact O-N 3.18Å; P307-I311 PolarHBondContact O-N 3.04Å; P307-I311 VanDerWaalsContact O-N 3.12Å
308	I	61.2	Low	69.9	Low	120 Å²	120	96.2 Å²	96.2	62%	0.615	58%	0.577	S	S	*	*	H	α-helix	trans	-54.6	-35.2	177.6	-66.8	168.3	0	0	0	108.4	I306 G310 I311 V312	I306-I308 HydrophobicContact CG2-CG1 4.43Å; I306-I308 PolarHBondContact O-N 3.23Å; I308-G310 PolarHBondContact O-N 2.87Å; I308-I311 PolarHBondContact O-N 3.42Å; I308-V312 HydrophobicContact CG2-CG2 4.27Å; I308-V312 WeakPolarHBondContact O-CB 3.35Å; I308-V312 WeakPolarHBondContact O-CG2 3.34Å; I308-V312 PolarHBondContact O-N 2.9Å
309	V	62.3	Low	69.4	Low	122 Å²	122	96.7 Å²	96.7	74%	0.739	59%	0.59	S	S	*	*	H	α-helix	trans	-61.4	-41.2	173.3	-179	0	0	0	0	112.5	P307 A313	P307-V309 PolarHBondContact O-N 3.35Å; P307-V309 VanDerWaalsContact O-N 3.16Å; V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.27Å; V309-A313 PolarHBondContact O-N 3.39Å
310	G	67.3	Low	69.1	Low	45 Å²	45	93 Å²	93	46%	0.464	58%	0.579	S	S	.	*	H	α-helix	trans	-68.6	-38.2	179	0	0	0	0	0	112.9	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.32Å; P307-G310 PolarHBondContact O-N 3.18Å; I308-G310 PolarHBondContact O-N 2.87Å; G310-G314 PolarHBondContact O-N 3.09Å
311	I	73.4	Confident	69.3	Low	91 Å²	91	94.2 Å²	94.2	47%	0.467	58%	0.581	S	S	.	*	H	α-helix	trans	-69.7	-44.6	176.5	-61.8	173.7	0	0	0	110.5	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 3.93Å; P307-I311 PolarHBondContact O-N 3.04Å; P307-I311 VanDerWaalsContact O-N 3.12Å; I308-I311 PolarHBondContact O-N 3.42Å; I311-G314 PolarHBondContact O-N 2.87Å; I311-L315 HydrophobicContact CG2-CD1 4Å; I311-L315 HydrophobicContact CG2-CG 4.48Å; I311-L315 WeakPolarHBondContact O-CB 3.44Å; I311-L315 WeakPolarHBondContact O-CG 3.4Å; I311-L315 PolarHBondContact O-N 3.39Å
312	V	74.3	Confident	70.2	Confident	91 Å²	91	92.2 Å²	92.2	55%	0.552	57%	0.57	S	S	*	*	H	α-helix	trans	-65.1	-42.5	178.2	172.9	0	0	0	0	111.2	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.27Å; I308-V312 WeakPolarHBondContact O-CB 3.35Å; I308-V312 WeakPolarHBondContact O-CG2 3.34Å; I308-V312 PolarHBondContact O-N 2.9Å; V312-L315 PolarHBondContact O-N 2.97Å; V312-A316 WeakPolarHBondContact O-CB 3.25Å; V312-A316 PolarHBondContact O-N 2.86Å
313	A	74.4	Confident	71.7	Confident	52 Å²	52	91.1 Å²	91.1	43%	0.43	56%	0.559	S	S	.	*	H	α-helix	trans	-63.2	-43.3	174.7	0	0	0	0	0	111.8	V309 A316 V317	V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.27Å; V309-A313 PolarHBondContact O-N 3.39Å; A313-A316 PolarHBondContact O-N 3.06Å; A313-V317 WeakPolarHBondContact O-CG2 3.48Å; A313-V317 PolarHBondContact O-N 3.17Å
314	G	80.6	Confident	73.3	Confident	34 Å²	34	88 Å²	88	35%	0.351	55%	0.547	S	S	.	.	H	α-helix	trans	-61.6	-43.8	176.8	0	0	0	0	0	113.1	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 3.09Å; I311-G314 PolarHBondContact O-N 2.87Å; G314-V317 PolarHBondContact O-N 3.18Å; G314-L318 PolarHBondContact O-N 3.31Å
315	L	84.6	Confident	75.1	Confident	110 Å²	110	85 Å²	85	58%	0.576	54%	0.535	S	S	*	.	H	α-helix	trans	-66.9	-38.3	176.8	-72.6	172.4	0	0	0	112.4	I311 V312 L318 A319	I311-L315 HydrophobicContact CG2-CD1 4Å; I311-L315 HydrophobicContact CG2-CG 4.48Å; I311-L315 WeakPolarHBondContact O-CB 3.44Å; I311-L315 WeakPolarHBondContact O-CG 3.4Å; I311-L315 PolarHBondContact O-N 3.39Å; V312-L315 PolarHBondContact O-N 2.97Å; L315-L318 PolarHBondContact O-N 3.44Å; L315-A319 WeakPolarHBondContact O-CB 3.29Å; L315-A319 PolarHBondContact O-N 2.71Å
316	A	82.2	Confident	76.3	Confident	54 Å²	54	81.3 Å²	81.3	45%	0.446	52%	0.518	S	S	.	.	H	α-helix	trans	-63.4	-43	175.5	0	0	0	0	0	111.7	V312 A313 A319 V320	V312-A316 WeakPolarHBondContact O-CB 3.25Å; V312-A316 PolarHBondContact O-N 2.86Å; A313-A316 PolarHBondContact O-N 3.06Å; A316-A319 PolarHBondContact O-N 2.87Å; A316-V320 WeakPolarHBondContact O-CG2 3.34Å; A316-V320 PolarHBondContact O-N 3.32Å
317	V	84.4	Confident	77.3	Confident	89 Å²	89	80.2 Å²	80.2	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-63.3	-44.4	176.1	172.6	0	0	0	0	111.1	A313 G314 A319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.48Å; A313-V317 PolarHBondContact O-N 3.17Å; G314-V317 PolarHBondContact O-N 3.18Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 3.29Å; V317-V320 PolarHBondContact O-N 3.19Å; V317-L321 HydrophobicContact CG1-CD1 4.02Å; V317-L321 HydrophobicContact CG1-CG 4.43Å; V317-L321 WeakPolarHBondContact O-CG 3.43Å; V317-L321 PolarHBondContact O-N 3.05Å
318	L	84.1	Confident	78.1	Confident	114 Å²	114	81.9 Å²	81.9	60%	0.597	52%	0.518	S	S	*	.	H	α-helix	trans	-61.6	-41.3	176.7	-83.4	164.5	0	0	0	112.5	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.31Å; L315-L318 PolarHBondContact O-N 3.44Å; L318-L321 PolarHBondContact O-N 3.43Å; L318-A322 WeakPolarHBondContact O-CB 3.32Å; L318-A322 PolarHBondContact O-N 3.37Å
319	A	84.3	Confident	78.7	Confident	56 Å²	56	78.8 Å²	78.8	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-43.3	176.4	0	0	0	0	0	111.8	L315 A316 V317 A322 V323	L315-A319 WeakPolarHBondContact O-CB 3.29Å; L315-A319 PolarHBondContact O-N 2.71Å; A316-A319 PolarHBondContact O-N 2.87Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 3.29Å; A319-A322 PolarHBondContact O-N 2.8Å; A319-V323 WeakPolarHBondContact O-CG2 3.44Å; A319-V323 PolarHBondContact O-N 3.36Å
320	V	84.3	Confident	79.2	Confident	86 Å²	86	76.7 Å²	76.7	52%	0.521	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-44	176.3	172	0	0	0	0	111.1	A316 V317 A322 V323 L324	A316-V320 WeakPolarHBondContact O-CG2 3.34Å; A316-V320 PolarHBondContact O-N 3.32Å; V317-V320 PolarHBondContact O-N 3.19Å; V320-A322 PolarHBondContact O-N 3.1Å; V320-V323 PolarHBondContact O-N 2.99Å; V320-L324 HydrophobicContact CG1-CD1 3.97Å; V320-L324 HydrophobicContact CG1-CG 4.49Å; V320-L324 WeakPolarHBondContact O-CG 3.31Å; V320-L324 PolarHBondContact O-N 3.19Å
321	L	84.6	Confident	79.4	Confident	105 Å²	105	78 Å²	78	55%	0.55	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-39.1	177.3	-70.9	173.8	0	0	0	112.3	V317 L318 L324 G325	V317-L321 HydrophobicContact CG1-CD1 4.02Å; V317-L321 HydrophobicContact CG1-CG 4.43Å; V317-L321 WeakPolarHBondContact O-CG 3.43Å; V317-L321 PolarHBondContact O-N 3.05Å; L318-L321 PolarHBondContact O-N 3.43Å; L321-L324 PolarHBondContact O-N 3.37Å; L321-G325 PolarHBondContact O-N 3.13Å
322	A	82.5	Confident	79.3	Confident	65 Å²	65	80 Å²	80	54%	0.537	51%	0.505	S	S	.	.	H	α-helix	trans	-64.1	-42.1	175.8	0	0	0	0	0	111.9	L318 A319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.32Å; L318-A322 PolarHBondContact O-N 3.37Å; A319-A322 PolarHBondContact O-N 2.8Å; V320-A322 PolarHBondContact O-N 3.1Å; A322-G325 PolarHBondContact O-N 3.04Å; A322-A326 WeakPolarHBondContact O-CB 3.32Å; A322-A326 PolarHBondContact O-N 2.88Å
323	V	82.3	Confident	78.7	Confident	92 Å²	92	79.9 Å²	79.9	56%	0.558	51%	0.507	S	S	*	.	H	α-helix	trans	-64.3	-45.4	175.8	173.1	0	0	0	0	110.9	A319 V320 G325 A326 V327	A319-V323 WeakPolarHBondContact O-CG2 3.44Å; A319-V323 PolarHBondContact O-N 3.36Å; V320-V323 PolarHBondContact O-N 2.99Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 3.25Å; V323-A326 PolarHBondContact O-N 2.97Å; V323-V327 HydrophobicContact CG1-CG2 4.45Å; V323-V327 VanDerWaalsContact O-CG2 3.3Å; V323-V327 WeakPolarHBondContact O-CG2 3.35Å; V323-V327 PolarHBondContact O-N 3.49Å
324	L	81.7	Confident	78	Confident	98 Å²	98	86.5 Å²	86.5	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-42.4	176.2	-72.5	169.5	0	0	0	111.7	V320 L321 V327 M328	V320-L324 HydrophobicContact CG1-CD1 3.97Å; V320-L324 HydrophobicContact CG1-CG 4.49Å; V320-L324 WeakPolarHBondContact O-CG 3.31Å; V320-L324 PolarHBondContact O-N 3.19Å; L321-L324 PolarHBondContact O-N 3.37Å; L324-V327 PolarHBondContact O-N 3.2Å; L324-M328 WeakPolarHBondContact O-CB 3.48Å; L324-M328 VanDerWaalsContact O-CG 3.3Å; L324-M328 WeakPolarHBondContact O-CG 3.48Å; L324-M328 PolarHBondContact O-N 3.06Å
325	G	80.8	Confident	76.8	Confident	42 Å²	42	94.8 Å²	94.8	43%	0.433	54%	0.542	S	S	.	.	H	α-helix	trans	-60.2	-44.5	174.6	0	0	0	0	0	112.6	L321 A322 V323 M328 A329	L321-G325 PolarHBondContact O-N 3.13Å; A322-G325 PolarHBondContact O-N 3.04Å; V323-G325 VanDerWaalsContact C-N 3.34Å; V323-G325 PolarHBondContact O-N 3.25Å; G325-M328 PolarHBondContact O-N 3.1Å; G325-A329 WeakPolarHBondContact O-CB 3.46Å; G325-A329 PolarHBondContact O-N 2.87Å
326	A	78.1	Confident	75.2	Confident	55 Å²	55	98.4 Å²	98.4	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-64.3	-42.4	176.5	0	0	0	0	0	112.2	A322 V323 A329 V330	A322-A326 WeakPolarHBondContact O-CB 3.32Å; A322-A326 PolarHBondContact O-N 2.88Å; V323-A326 PolarHBondContact O-N 2.97Å; A326-A329 PolarHBondContact O-N 3.27Å; A326-V330 WeakPolarHBondContact O-CG2 3.1Å; A326-V330 PolarHBondContact O-N 2.83Å
327	V	78.6	Confident	73.7	Confident	79 Å²	79	100.4 Å²	100.4	48%	0.479	56%	0.563	S	S	.	*	H	α-helix	trans	-62.6	-45	176.3	171.8	0	0	0	0	110.8	V323 L324 A329 V330 V331	V323-V327 HydrophobicContact CG1-CG2 4.45Å; V323-V327 VanDerWaalsContact O-CG2 3.3Å; V323-V327 WeakPolarHBondContact O-CG2 3.35Å; V323-V327 PolarHBondContact O-N 3.49Å; L324-V327 PolarHBondContact O-N 3.2Å; V327-A329 PolarHBondContact O-N 3.44Å; V327-V330 PolarHBondContact O-N 2.78Å; V327-V331 HydrophobicContact CG1-CG2 4.38Å; V327-V331 WeakPolarHBondContact O-CB 3.3Å; V327-V331 VanDerWaalsContact O-CG2 3.29Å; V327-V331 WeakPolarHBondContact O-CG2 3.49Å; V327-V331 PolarHBondContact O-N 3.33Å
328	M	74.2	Confident	72	Confident	119 Å²	119	101.1 Å²	101.1	59%	0.586	57%	0.572	S	S	*	*	H	α-helix	trans	-62.7	-40.9	176.8	-71.8	-63.2	-70.8	0	0	112.2	L324 G325 V331 M332	L324-M328 WeakPolarHBondContact O-CB 3.48Å; L324-M328 VanDerWaalsContact O-CG 3.3Å; L324-M328 WeakPolarHBondContact O-CG 3.48Å; L324-M328 PolarHBondContact O-N 3.06Å; G325-M328 PolarHBondContact O-N 3.1Å; M328-V331 PolarHBondContact O-N 3.45Å; M328-M332 WeakPolarHBondContact O-CB 3.46Å; M328-M332 WeakPolarHBondContact O-CG 3.17Å; M328-M332 PolarHBondContact O-N 3.41Å
329	A	73.1	Confident	69.9	Low	55 Å²	55	98.9 Å²	98.9	46%	0.455	58%	0.577	S	S	.	*	H	α-helix	trans	-62.9	-43.1	174.8	0	0	0	0	0	112.2	G325 A326 V327 M332 C333	G325-A329 WeakPolarHBondContact O-CB 3.46Å; G325-A329 PolarHBondContact O-N 2.87Å; A326-A329 PolarHBondContact O-N 3.27Å; V327-A329 PolarHBondContact O-N 3.44Å; A329-M332 PolarHBondContact O-N 3.1Å; A329-C333 WeakPolarHBondContact O-CB 3.46Å; A329-C333 PolarHBondContact O-N 3.09Å; A329-C333 PolarHBondContact O-SG 3.2Å
330	V	73	Confident	67.6	Low	79 Å²	79	100.3 Å²	100.3	48%	0.479	60%	0.597	S	S	.	*	H	α-helix	trans	-64.8	-41.5	176	170.4	0	0	0	0	111.5	A326 V327 C333 R334	A326-V330 WeakPolarHBondContact O-CG2 3.1Å; A326-V330 PolarHBondContact O-N 2.83Å; V327-V330 PolarHBondContact O-N 2.78Å; V330-C333 PolarHBondContact O-N 3.02Å; V330-R334 WeakPolarHBondContact O-CB 3.32Å; V330-R334 WeakPolarHBondContact O-CG 3.38Å; V330-R334 PolarHBondContact O-N 2.86Å
331	V	72.7	Confident	65.2	Low	72 Å²	72	106.7 Å²	106.7	44%	0.436	62%	0.618	S	S	.	*	H	α-helix	trans	-65.9	-40.3	177.2	171.1	0	0	0	0	111.2	V327 M328 R334 R335	V327-V331 HydrophobicContact CG1-CG2 4.38Å; V327-V331 WeakPolarHBondContact O-CB 3.3Å; V327-V331 VanDerWaalsContact O-CG2 3.29Å; V327-V331 WeakPolarHBondContact O-CG2 3.49Å; V327-V331 PolarHBondContact O-N 3.33Å; M328-V331 PolarHBondContact O-N 3.45Å; V331-R334 PolarHBondContact O-N 3.47Å; V331-R335 PolarHBondContact O-N 3.49Å
332	M	70.3	Confident	62.7	Low	134 Å²	134	105.5 Å²	105.5	66%	0.66	63%	0.631	S	S	*	*	H	α-helix	trans	-66.3	-41	174.3	-74.5	-172.7	71.5	0	0	112.3	M328 A329 R334 R335 K336	M328-M332 WeakPolarHBondContact O-CB 3.46Å; M328-M332 WeakPolarHBondContact O-CG 3.17Å; M328-M332 PolarHBondContact O-N 3.41Å; A329-M332 PolarHBondContact O-N 3.1Å; M332-R334 VanDerWaalsContact C-N 3.32Å; M332-R334 PolarHBondContact O-N 3.4Å; M332-R335 PolarHBondContact O-N 3.45Å; M332-K336 WeakPolarHBondContact O-CB 3.22Å; M332-K336 PolarHBondContact O-N 3.46Å
333	C	61.2	Low	60.2	Low	88 Å²	88	106.5 Å²	106.5	60%	0.595	65%	0.648	S	S	*	*	H	α-helix	trans	-63.9	-35.6	173.4	-78.9	0	0	0	0	112.4	A329 V330 K336 S337	A329-C333 WeakPolarHBondContact O-CB 3.46Å; A329-C333 PolarHBondContact O-N 3.09Å; A329-C333 PolarHBondContact O-SG 3.2Å; V330-C333 PolarHBondContact O-N 3.02Å; C333-K336 PolarHBondContact O-N 2.92Å; C333-S337 PolarHBondContact O-N 3.06Å; C333-S337 PolarHBondContact O-OG 2.84Å
334	R	59.8	Low	57.9	Low	190 Å²	190	107.4 Å²	107.4	72%	0.717	66%	0.658	S	S	*	*	H	α-helix	trans	-72.7	-34.3	174	-79.4	-173.5	151.4	160.8	-3.6	113.3	V330 V331 M332 K336 S337	V330-R334 WeakPolarHBondContact O-CB 3.32Å; V330-R334 WeakPolarHBondContact O-CG 3.38Å; V330-R334 PolarHBondContact O-N 2.86Å; V331-R334 PolarHBondContact O-N 3.47Å; M332-R334 VanDerWaalsContact C-N 3.32Å; M332-R334 PolarHBondContact O-N 3.4Å; R334-K336 VanDerWaalsContact C-N 3.34Å; R334-S337 WeakPolarHBondContact CA-OG 3.43Å; R334-S337 PolarHBondContact O-OG 2.98Å
335	R	56.8	Low	55.5	Low	209 Å²	209	108.2 Å²	108.2	79%	0.789	67%	0.671	S	S	*	*	H	α-helix	trans	-69.5	-30.5	171.1	-102.1	-177.9	169.3	172.9	-2.6	112.9	V331 M332	V331-R335 PolarHBondContact O-N 3.49Å; M332-R335 PolarHBondContact O-N 3.45Å
336	K	49.9	Very low	53.3	Low	186 Å²	186	111.6 Å²	111.6	81%	0.809	69%	0.688	S	S	*	*	H	α-helix	trans	-82.8	-12.6	179.2	-161.7	168.1	-179	178.7	0	113.7	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.22Å; M332-K336 PolarHBondContact O-N 3.46Å; C333-K336 PolarHBondContact O-N 2.92Å; R334-K336 VanDerWaalsContact C-N 3.34Å
337	S	51.4	Low	51.2	Low	95 Å²	95	118.2 Å²	118.2	66%	0.664	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	3.7	178.9	42	0	0	0	0	114.6	C333 R334	C333-S337 PolarHBondContact O-N 3.06Å; C333-S337 PolarHBondContact O-OG 2.84Å; R334-S337 WeakPolarHBondContact CA-OG 3.43Å; R334-S337 PolarHBondContact O-OG 2.98Å
338	S	48.2	Very low	49.2	Very low	104 Å²	104	119.5 Å²	119.5	73%	0.727	73%	0.728	S	S	*	*	S	Bend	trans	-104.9	34.7	175.4	73.5	0	0	0	0	113.9
339	G	39.9	Very low	47.3	Very low	68 Å²	68	118.4 Å²	118.4	70%	0.701	74%	0.738	S	S	*	*	S	Bend	trans	-169.8	108.2	173.8	0	0	0	0	0	113.9
340	G	35.3	Very low	45.4	Very low	85 Å²	85	121.3 Å²	121.3	88%	0.876	76%	0.755	S	S	*	*			trans	114.4	113.2	154.3	0	0	0	0	0	116.5
341	K	34.2	Very low	43.6	Very low	220 Å²	220	122.6 Å²	122.6	96%	0.957	77%	0.767	S	S	*	*			trans	-101.6	139.4	-179.6	-174.6	165.4	-178.7	171.2	0	109.1
342	G	32	Very low	41.9	Very low	81 Å²	81	126.9 Å²	126.9	84%	0.835	79%	0.788	S	S	*	*			trans	147.2	129.6	158.5	0	0	0	0	0	116.5
343	G	31	Very low	40.4	Very low	85 Å²	85	126.6 Å²	126.6	88%	0.876	80%	0.799	S	S	*	*			trans	124.5	81.7	144.1	0	0	0	0	0	119
344	S	33.5	Very low	39.3	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	81%	0.807	S	S	*	*			trans	-25.2	148.5	157.8	-175.9	0	0	0	0	122.2
345	C	31.9	Very low	38.2	Very low	115 Å²	115	127.4 Å²	127.4	78%	0.777	82%	0.818	S	S	*	*			trans	48	127.1	147	-82.6	0	0	0	0	123
346	S	33.3	Very low	37	Very low	113 Å²	113	120.7 Å²	120.7	79%	0.79	81%	0.814	S	S	*	*				-171.8	127.5	100.8	23.5	0	0	0	0	113.9
347	Q	35	Very low	36.4	Very low	194 Å²	194	117.8 Å²	117.8	91%	0.907	82%	0.817	S	S	*	*			trans	38.2	114.7	133.5	-121.5	160.1	-10.8	0	0	120.8
348	A	35.9	Very low	35.7	Very low	106 Å²	106	121.2 Å²	121.2	88%	0.876	83%	0.828	S	S	*	*			trans	-77	138	163	0	0	0	0	0	111.2
349	A	34.1	Very low	34.9	Very low	96 Å²	96	125.2 Å²	125.2	79%	0.793	84%	0.835	S	S	*	*			trans	-134.5	135.7	163	0	0	0	0	0	110.1
350	S	34	Very low	34.7	Very low	115 Å²	115	128 Å²	128	80%	0.804	84%	0.844	S	S	*	*			trans	-43.2	160	166.8	55.3	0	0	0	0	113.9
351	S	34.2	Very low	34.6	Very low	106 Å²	106	132 Å²	132	74%	0.741	84%	0.844	S	S	*	*			cis	-172.9	146.7	35.1	36.3	0	0	0	0	111.5
352	N	37.4	Very low	34.7	Very low	162 Å²	162	129.3 Å²	129.3	87%	0.866	84%	0.839	S	S	*	*			trans	16.3	134.1	142.9	-66.2	-11.3	0	0	0	122.1
353	S	39.9	Very low	34.8	Very low	128 Å²	128	129.7 Å²	129.7	90%	0.895	83%	0.834	S	S	*	*				-152.6	135	123.9	25.4	0	0	0	0	110.1
354	A	37.1	Very low	34.7	Very low	93 Å²	93	132 Å²	132	77%	0.769	84%	0.835	S	S	*	*			trans	-112.7	144.7	176.6	0	0	0	0	0	108.3
355	Q	36.8	Very low	34.7	Very low	203 Å²	203	136.6 Å²	136.6	95%	0.949	84%	0.841	S	S	*	*			trans	-177.1	133	132	-119	165.7	-18.1	0	0	114.5
356	G	31.2	Very low	34.8	Very low	68 Å²	68	139.6 Å²	139.6	70%	0.701	87%	0.874	S	S	*	*			trans	99.8	131.4	141.1	0	0	0	0	0	116.1
357	S	38.1	Very low	34.9	Very low	124 Å²	124	140.9 Å²	140.9	87%	0.867	88%	0.878	S	S	*	*			cis	-164.6	136.3	-6.2	-55.9	0	0	0	0	105.7
358	D	36.1	Very low	34.9	Very low	167 Å²	167	138.1 Å²	138.1	89%	0.893	88%	0.876	S	S	*	*			trans	-89.2	139.7	169.4	-91.4	-36	0	0	0	110.3
359	E	32.5	Very low	34.8	Very low	189 Å²	189	139.9 Å²	139.9	88%	0.883	88%	0.877	S	S	*	*			trans	-173.6	118.1	138.4	-113.9	-170.6	157	0	0	111.5
360	S	34.1	Very low	34.9	Very low	126 Å²	126	142.5 Å²	142.5	88%	0.881	88%	0.881	S	S	*	*				174.5	106	127.8	44.5	0	0	0	0	111.1
361	L	34.5	Very low	34.9	Very low	170 Å²	170	144.2 Å²	144.2	89%	0.89	89%	0.886	S	S	*	*			trans	-135.2	114.6	161	-105	169.3	0	0	0	106.1
362	I	36.6	Very low	35	Very low	163 Å²	163	146.7 Å²	146.7	84%	0.836	90%	0.896	S	S	*	*			trans	-136.6	119	152.7	-68	-170.9	0	0	0	108.4
363	A	33.6	Very low	34.8	Very low	88 Å²	88	145.6 Å²	145.6	73%	0.727	90%	0.898	S	S	*	*			trans	-77.8	150.9	160.3	0	0	0	0	0	110.1
364	C	29.8	Very low	34.4	Very low	134 Å²	134	147 Å²	147	91%	0.905	90%	0.898	S	S	*	*			trans	-129.8	127.6	151.8	-92	0	0	0	0	109
365	K	33.5	Very low	34.2	Very low	208 Å²	208	151.5 Å²	151.5	90%	0.904	91%	0.909	S	S	*	*			trans	-126.8	122.6	170	-158.4	-172.1	-165.3	-175.3	0	105.7
366	A	33.6	Very low	34	Very low	178 Å²	178	146.8 Å²	146.8	100%	1.471	91%	0.905	S	S	*	*			trans	-168.9	0	148.1	0	0	0	0	0	106.5

Retrieved 366 of 366 residues in 1513.7 ms (Link to these results)

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