A0A090KF00_HUMAN Loading...

HLA class I antigen

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

AlphaFold DB , UniProt , Accession A0A090KF00, 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	34.5	Very low	43.6	Very low	242 Å²	242	141 Å²	141	100%	1.192	71%	0.705	S	S	*	*				0	127.9	0	-75	146.2	137.3	0	0	108.4
2	R	35.2	Very low	43.8	Very low	249 Å²	249	139.7 Å²	139.7	94%	0.94	70%	0.701	S	S	*	*			trans	-79.1	118.4	168.1	-87.9	-179	171	162.4	-3.5	107.8	M4	R2-M4 PolarHBondContact O-N 3.33Å; R2-M4 VanDerWaalsContact O-N 3.16Å
3	V	37.4	Very low	43.4	Very low	139 Å²	139	136.6 Å²	136.6	84%	0.842	69%	0.687	S	S	*	*			trans	-73	104.5	169.7	179.4	0	0	0	0	107.2	A5	V3-A5 PolarHBondContact O-N 3.49Å
4	M	40.5	Very low	43.3	Very low	171 Å²	171	131.6 Å²	131.6	84%	0.842	67%	0.671	S	S	*	*			trans	-72.8	104.3	166.1	-86.5	169.8	47.5	0	0	108	R2	R2-M4 PolarHBondContact O-N 3.33Å; R2-M4 VanDerWaalsContact O-N 3.16Å
5	A	45.4	Very low	43.4	Very low	51 Å²	51	125.1 Å²	125.1	42%	0.421	65%	0.65	S	S	.	*			trans	-58.6	140.4	163	0	0	0	0	0	109	V3 R7 I10	V3-A5 PolarHBondContact O-N 3.49Å; A5-R7 PolarHBondContact O-N 2.88Å; A5-I10 HydrophobicContact CB-CD1 4.31Å
6	P	45.1	Very low	43.3	Very low	72 Å²	72	120.3 Å²	120.3	47%	0.468	63%	0.634	S	S	.	*			trans	-61.2	129.6	-179.9	-20.5	31.6	0	0	0	110.2	T8 L9 I10	P6-T8 PolarHBondContact O-N 3.29Å; P6-T8 VanDerWaalsContact O-N 3.16Å; P6-L9 HydrophobicContact CB-CB 4.31Å; P6-L9 WeakPolarHBondContact O-CB 3.37Å; P6-L9 PolarHBondContact O-N 3.45Å; P6-I10 PolarHBondContact O-N 3.05Å
7	R	48.7	Very low	42.8	Very low	215 Å²	215	119.7 Å²	119.7	81%	0.811	63%	0.631	S	S	*	*	H	α-helix	trans	-56.5	-31.7	177.9	-81.4	178.5	163.9	144.5	-7	112.7	A5 I10 L11	A5-R7 PolarHBondContact O-N 2.88Å; R7-I10 PolarHBondContact O-N 3.36Å; R7-L11 WeakPolarHBondContact O-CG 3.34Å; R7-L11 PolarHBondContact O-N 2.91Å
8	T	50.9	Low	42.5	Very low	99 Å²	99	116.2 Å²	116.2	61%	0.607	62%	0.622	S	S	*	*	H	α-helix	trans	-60.5	-39.4	171.4	23.9	0	0	0	0	113.3	P6 L11 L12	P6-T8 PolarHBondContact O-N 3.29Å; P6-T8 VanDerWaalsContact O-N 3.16Å; T8-L11 PolarHBondContact O-N 3.37Å; T8-L12 WeakPolarHBondContact O-CB 3.31Å; T8-L12 WeakPolarHBondContact O-CG 3.49Å; T8-L12 PolarHBondContact O-N 3.35Å
9	L	43.4	Very low	42.3	Very low	98 Å²	98	114.5 Å²	114.5	51%	0.513	61%	0.612	S	S	.	*	H	α-helix	trans	-68.9	-37.8	179.1	-146.7	98.5	0	0	0	111.3	P6 L13	P6-L9 HydrophobicContact CB-CB 4.31Å; P6-L9 WeakPolarHBondContact O-CB 3.37Å; P6-L9 PolarHBondContact O-N 3.45Å; L9-L13 HydrophobicContact CD2-CD1 4.33Å; L9-L13 WeakPolarHBondContact O-CB 3.35Å; L9-L13 WeakPolarHBondContact O-CD1 3.46Å; L9-L13 WeakPolarHBondContact O-CG 3.29Å; L9-L13 PolarHBondContact O-N 3.35Å
10	I	47.4	Very low	42.1	Very low	91 Å²	91	113.4 Å²	113.4	47%	0.467	61%	0.61	S	S	.	*	H	α-helix	trans	-66.7	-44.4	176.6	-62.4	172.4	0	0	0	110.3	A5 P6 R7 L13 S14	A5-I10 HydrophobicContact CB-CD1 4.31Å; P6-I10 PolarHBondContact O-N 3.05Å; R7-I10 PolarHBondContact O-N 3.36Å; I10-L13 PolarHBondContact O-N 3.06Å; I10-S14 PolarHBondContact O-N 3.3Å; I10-S14 PolarHBondContact O-OG 2.92Å
11	L	51.5	Low	41.9	Very low	124 Å²	124	115.7 Å²	115.7	65%	0.649	62%	0.617	S	S	*	*	H	α-helix	trans	-64.2	-41	177.2	-73.4	167.1	0	0	0	112.7	R7 T8 S14 G15	R7-L11 WeakPolarHBondContact O-CG 3.34Å; R7-L11 PolarHBondContact O-N 2.91Å; T8-L11 PolarHBondContact O-N 3.37Å; L11-S14 PolarHBondContact O-N 2.91Å; L11-G15 PolarHBondContact O-N 2.93Å
12	L	45.4	Very low	42.2	Very low	125 Å²	125	109.2 Å²	109.2	65%	0.654	59%	0.591	S	S	*	*	H	α-helix	trans	-63.4	-41.2	174.4	-75.5	166.1	0	0	0	112	T8 G15 A16	T8-L12 WeakPolarHBondContact O-CB 3.31Å; T8-L12 WeakPolarHBondContact O-CG 3.49Å; T8-L12 PolarHBondContact O-N 3.35Å; L12-G15 PolarHBondContact O-N 2.88Å; L12-A16 VanDerWaalsContact O-CB 3.28Å; L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 2.89Å
13	L	38.3	Very low	42.9	Very low	100 Å²	100	101.8 Å²	101.8	52%	0.524	56%	0.563	S	S	.	*	H	α-helix	trans	-66.9	-36.1	174	-78.1	163	0	0	0	112.5	L9 I10 L17	L9-L13 HydrophobicContact CD2-CD1 4.33Å; L9-L13 WeakPolarHBondContact O-CB 3.35Å; L9-L13 WeakPolarHBondContact O-CD1 3.46Å; L9-L13 WeakPolarHBondContact O-CG 3.29Å; L9-L13 PolarHBondContact O-N 3.35Å; I10-L13 PolarHBondContact O-N 3.06Å; L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 WeakPolarHBondContact O-CD1 3.34Å; L13-L17 VanDerWaalsContact O-CG 3.32Å; L13-L17 WeakPolarHBondContact O-CG 3.38Å; L13-L17 PolarHBondContact O-N 3.47Å
14	S	42.7	Very low	43.6	Very low	67 Å²	67	97.4 Å²	97.4	47%	0.469	54%	0.541	S	S	.	.	H	α-helix	trans	-67.1	-42.5	174.3	-60.4	0	0	0	0	112.3	I10 L11 L17 A18	I10-S14 PolarHBondContact O-N 3.3Å; I10-S14 PolarHBondContact O-OG 2.92Å; L11-S14 PolarHBondContact O-N 2.91Å; S14-L17 PolarHBondContact O-N 2.91Å; S14-A18 WeakPolarHBondContact O-CB 3.38Å; S14-A18 PolarHBondContact O-N 3.43Å; S14-A18 VanDerWaalsContact O-N 3.07Å
15	G	44.6	Very low	45	Very low	34 Å²	34	92.2 Å²	92.2	35%	0.351	52%	0.521	S	S	.	.	H	α-helix	trans	-62.9	-46.4	173.4	0	0	0	0	0	111.8	L11 L12 L17 A18 L19	L11-G15 PolarHBondContact O-N 2.93Å; L12-G15 PolarHBondContact O-N 2.88Å; G15-L17 PolarHBondContact O-N 3.36Å; G15-A18 PolarHBondContact O-N 2.86Å; G15-L19 VanDerWaalsContact O-CB 3.27Å; G15-L19 WeakPolarHBondContact O-CB 3.38Å; G15-L19 WeakPolarHBondContact O-CD1 3.43Å; G15-L19 VanDerWaalsContact O-CG 3.29Å; G15-L19 WeakPolarHBondContact O-CG 3.47Å; G15-L19 PolarHBondContact O-N 3.39Å
16	A	41.9	Very low	47.1	Very low	48 Å²	48	93.4 Å²	93.4	40%	0.397	53%	0.526	S	S	.	.	H	α-helix	trans	-63.2	-39.4	177.1	0	0	0	0	0	113	L12 L19 T20	L12-A16 VanDerWaalsContact O-CB 3.28Å; L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 2.89Å; A16-L19 CarbonylContact O-C 3.58Å; A16-L19 PolarHBondContact O-N 2.9Å; A16-T20 WeakPolarHBondContact O-CG2 3.49Å; A16-T20 PolarHBondContact O-N 2.94Å; A16-T20 PolarHBondContact O-OG1 3.29Å
17	L	34.8	Very low	49.5	Very low	110 Å²	110	91.5 Å²	91.5	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-67.5	-44.4	177.6	-80.7	163.6	0	0	0	112.1	L13 S14 G15 L19 T20 E21	L13-L17 VanDerWaalsContact O-CB 3.31Å; L13-L17 WeakPolarHBondContact O-CB 3.44Å; L13-L17 WeakPolarHBondContact O-CD1 3.34Å; L13-L17 VanDerWaalsContact O-CG 3.32Å; L13-L17 WeakPolarHBondContact O-CG 3.38Å; L13-L17 PolarHBondContact O-N 3.47Å; S14-L17 PolarHBondContact O-N 2.91Å; G15-L17 PolarHBondContact O-N 3.36Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 3.43Å; L17-T20 WeakPolarHBondContact CA-OG1 3.42Å; L17-T20 PolarHBondContact O-N 3.4Å; L17-T20 VanDerWaalsContact O-N 3.11Å; L17-T20 PolarHBondContact O-OG1 3.31Å; L17-E21 PolarHBondContact O-N 3.03Å
18	A	37.7	Very low	51.7	Low	57 Å²	57	82.4 Å²	82.4	47%	0.471	48%	0.481	S	S	.	.	H	α-helix	trans	-61.8	-38.5	172.5	0	0	0	0	0	111.9	S14 G15 T20 E21 T22	S14-A18 WeakPolarHBondContact O-CB 3.38Å; S14-A18 PolarHBondContact O-N 3.43Å; S14-A18 VanDerWaalsContact O-N 3.07Å; G15-A18 PolarHBondContact O-N 2.86Å; A18-T20 VanDerWaalsContact C-N 3.32Å; A18-T20 PolarHBondContact O-N 3.31Å; A18-E21 PolarHBondContact O-N 3.48Å; A18-T22 PolarHBondContact O-N 2.94Å; A18-T22 PolarHBondContact O-OG1 3.42Å
19	L	38.8	Very low	54	Low	84 Å²	84	77.7 Å²	77.7	44%	0.44	45%	0.452	S	S	.	.	H	α-helix	trans	-69	-23.2	173.3	-79.6	163.1	0	0	0	113.6	G15 A16 L17 T22	G15-L19 VanDerWaalsContact O-CB 3.27Å; G15-L19 WeakPolarHBondContact O-CB 3.38Å; G15-L19 WeakPolarHBondContact O-CD1 3.43Å; G15-L19 VanDerWaalsContact O-CG 3.29Å; G15-L19 WeakPolarHBondContact O-CG 3.47Å; G15-L19 PolarHBondContact O-N 3.39Å; A16-L19 CarbonylContact O-C 3.58Å; A16-L19 PolarHBondContact O-N 2.9Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 3.43Å; L19-T22 PolarHBondContact O-OG1 3.34Å
20	T	37.5	Very low	56.6	Low	91 Å²	91	75.4 Å²	75.4	56%	0.558	44%	0.436	S	S	*	.	H	α-helix	trans	-85.3	-30.1	173.1	48.9	0	0	0	0	113.3	A16 L17 A18 T22 W23	A16-T20 WeakPolarHBondContact O-CG2 3.49Å; A16-T20 PolarHBondContact O-N 2.94Å; A16-T20 PolarHBondContact O-OG1 3.29Å; L17-T20 WeakPolarHBondContact CA-OG1 3.42Å; L17-T20 PolarHBondContact O-N 3.4Å; L17-T20 VanDerWaalsContact O-N 3.11Å; L17-T20 PolarHBondContact O-OG1 3.31Å; A18-T20 VanDerWaalsContact C-N 3.32Å; A18-T20 PolarHBondContact O-N 3.31Å; T20-T22 VanDerWaalsContact C-N 3.31Å; T20-W23 PolarHBondContact O-N 3.01Å
21	E	37.3	Very low	59	Low	163 Å²	163	71 Å²	71	76%	0.762	41%	0.414	S	S	*	.	H	α-helix	trans	-68.5	-30.4	174.6	-79.5	-172.3	142.6	0	0	112.2	L17 A18 W23	L17-E21 PolarHBondContact O-N 3.03Å; A18-E21 PolarHBondContact O-N 3.48Å; E21-W23 PolarHBondContact O-N 3.5Å
22	T	41.6	Very low	61.3	Low	106 Å²	106	69.4 Å²	69.4	65%	0.65	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-3.5	176.9	48.9	0	0	0	0	115	A18 L19 T20	A18-T22 PolarHBondContact O-N 2.94Å; A18-T22 PolarHBondContact O-OG1 3.42Å; L19-T22 PolarHBondContact O-OG1 3.34Å; T20-T22 VanDerWaalsContact C-N 3.31Å
23	W	49	Very low	63.8	Low	93 Å²	93	64 Å²	64	35%	0.352	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	4.5	-178.8	-73.7	62.2	0	0	0	113.3	T20 E21 C25 H287 E288 L290	T20-W23 PolarHBondContact O-N 3.01Å; E21-W23 PolarHBondContact O-N 3.5Å; W23-C25 PolarHBondContact O-N 3.35Å; W23-H287 WeakPolarHBondContact CH2-O 3.42Å; W23-E288 WeakPolarHBondContact CZ3-O 3.3Å; W23-L290 WeakPolarHBondContact CH2-O 3.23Å; W23-L290 WeakPolarHBondContact CZ3-O 3.38Å
24	A	53.2	Low	66.7	Low	46 Å²	46	61.1 Å²	61.1	38%	0.38	36%	0.359	S	S	.	.	S	Bend	trans	-83.3	98.1	175.5	0	0	0	0	0	107.8	S26 P129	A24-S26 PolarHBondContact O-N 2.88Å; A24-P129 HydrophobicContact CB-CB 4.44Å; A24-P129 HydrophobicContact CB-CG 3.38Å
25	C	70.1	Confident	69.4	Low	63 Å²	63	58 Å²	58	43%	0.426	34%	0.338	S	S	.	.			trans	-42.5	102	-172.8	-54.9	0	0	0	0	112.5	W23 E288	W23-C25 PolarHBondContact O-N 3.35Å; C25-E288 PolarHBondContact SG-OE1 3.03Å
26	S	89.5	Confident	71.9	Confident	75 Å²	75	58.8 Å²	58.8	52%	0.524	34%	0.336	S	S	.	.			trans	-98.1	138	172.6	61.7	0	0	0	0	109.1	A24 L127	A24-S26 PolarHBondContact O-N 2.88Å; S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.47Å; S26-L127 WeakPolarHBondContact CB-O 3.4Å
27	H	94.4	Very high	74.6	Confident	32 Å²	32	57.4 Å²	57.4	15%	0.148	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	143.5	179.9	-68.4	-73.4	0	0	0	111.1	D53 D126 L127 L196	H27-D53 VanDerWaalsContact CA-OD1 3.29Å; H27-D53 WeakPolarHBondContact CA-OD1 3.36Å; H27-D53 IonicContact CE1-OD2 3.13Å; H27-D53 IonicContact CG-OD2 3.64Å; H27-D53 IonicContact ND1-OD1 3.15Å; H27-D53 IonicContact ND1-OD2 3.52Å; H27-D53 PolarHBondContact ND1-OD2 3.01Å; H27-D126 CarbonylContact O-C 3.56Å; H27-D126 WeakPolarHBondContact O-CA 3.36Å; H27-L127 PolarHBondContact N-O 2.73Å; H27-L127 VanDerWaalsContact N-O 3.08Å; H27-L127 PolarHBondContact O-N 2.99Å; H27-L196 HydrophobicContact CB-CD1 3.65Å; H27-L196 HydrophobicContact CB-CD2 3.94Å; H27-L196 HydrophobicContact CB-CG 4.39Å; H27-L196 VanDerWaalsContact CG-CD2 3.49Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.37Å
28	S	96.4	Very high	77.5	Confident	25 Å²	25	55.7 Å²	55.7	18%	0.175	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	154.9	-179.7	68.8	0	0	0	0	111.8	V52 D53 C125 D126	S28-V52 WeakPolarHBondContact O-CA 3.44Å; S28-D53 PolarHBondContact N-OD1 2.72Å; S28-D53 PolarHBondContact O-N 3.15Å; S28-D53 PolarHBondContact OG-OD1 3.48Å; S28-C125 CarbonylContact C-O 3.55Å; S28-C125 VanDerWaalsContact CA-O 3.31Å; S28-C125 WeakPolarHBondContact CA-O 2.91Å; S28-D126 WeakPolarHBondContact CB-OD1 3.4Å
29	M	98	Very high	80.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	120.3	165.1	179.5	174.8	40.7	0	0	109.6	Y31 Y51 V52 F57 G124 C125 R188 W191 L192 Y195	M29-Y31 HydrophobicContact CG-CD2 4.39Å; M29-Y31 HydrophobicContact CG-CE2 3.91Å; M29-Y31 HydrophobicContact SD-CE2 3.85Å; M29-Y51 VanDerWaalsContact CA-O 3.31Å; M29-Y51 WeakPolarHBondContact CA-O 3.09Å; M29-Y51 WeakPolarHBondContact CG-O 3.46Å; M29-V52 HydrophobicContact CB-CG2 4.38Å; M29-V52 HydrophobicContact CG-CG2 4.17Å; M29-V52 HydrophobicContact SD-CG2 4.38Å; M29-F57 HydrophobicContact CG-CE1 4.33Å; M29-F57 HydrophobicContact SD-CE1 4.41Å; M29-F57 HydrophobicContact SD-CZ 4.08Å; M29-G124 CarbonylContact O-C 3.56Å; M29-G124 WeakPolarHBondContact O-CA 3.07Å; M29-C125 PolarHBondContact N-O 2.88Å; M29-C125 PolarHBondContact O-N 2.85Å; M29-R188 HydrophobicContact CE-CG 3.88Å; M29-R188 WeakPolarHBondContact CE-O 3.42Å; M29-W191 HydrophobicContact CE-CB 4.2Å; M29-L192 HydrophobicContact CB-CD1 4.05Å; M29-L192 HydrophobicContact CB-CD2 3.92Å; M29-L192 HydrophobicContact CB-CG 4.4Å; M29-L192 HydrophobicContact CE-CB 3.83Å; M29-Y195 HydrophobicContact SD-CD2 3.67Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å
30	R	98.3	Very high	82.7	Confident	49 Å²	49	55.9 Å²	55.9	19%	0.185	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	138.1	-175.2	-52.2	-60	-176.7	78.6	3.7	110	F32 G50 Y51 M122 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.4Å; R30-F32 HydrophobicContact CB-CE2 3.58Å; R30-F32 HydrophobicContact CB-CZ 3.79Å; R30-F32 HydrophobicContact CG-CZ 4.46Å; R30-G50 WeakPolarHBondContact O-CA 3.39Å; R30-Y51 PolarHBondContact N-O 2.98Å; R30-Y51 PolarHBondContact O-N 2.71Å; R30-M122 HydrophobicContact CB-SD 4.49Å; R30-D126 IonicContact CZ-OD1 2.75Å; R30-D126 VanDerWaalsContact CZ-OD1 3.31Å; R30-D126 IonicContact NE-OD1 3.16Å; R30-D126 PolarHBondContact NE-OD1 2.95Å; R30-D126 VanDerWaalsContact NE-OD1 3.07Å; R30-D126 IonicContact NH2-OD1 2.75Å; R30-D126 PolarHBondContact NH2-OD1 2.88Å; R30-D126 IonicContact NH2-OD2 3.53Å; R30-D126 PolarHBondContact NH2-OD2 3.24Å; R30-Y137 VanDerWaalsContact CZ-CE2 3.47Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.28Å; R30-Y137 PolarHBondContact NH2-OH 3.13Å
31	Y	98.5	Very high	85.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.5	170	-74.1	-106.2	0	0	0	108.3	M29 Y33 V49 F57 V58 M122 Y123 R188	M29-Y31 HydrophobicContact CG-CD2 4.39Å; M29-Y31 HydrophobicContact CG-CE2 3.91Å; M29-Y31 HydrophobicContact SD-CE2 3.85Å; Y31-Y33 HydrophobicContact CD1-CE1 4.03Å; Y31-Y33 HydrophobicContact CG-CE1 4.5Å; Y31-V49 WeakPolarHBondContact CA-O 3.14Å; Y31-F57 HydrophobicContact CE1-CZ 4.37Å; Y31-F57 HydrophobicContact CE2-CZ 4.17Å; Y31-F57 AromaticContact CZ-CZ 3.74Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.36Å; Y31-V58 HydrophobicContact CE1-CG2 4.04Å; Y31-M122 WeakPolarHBondContact O-CA 3.48Å; Y31-Y123 AromaticContact CD2-CE2 3.96Å; Y31-Y123 HydrophobicContact CD2-CE2 3.96Å; Y31-Y123 HydrophobicContact CG-CE1 4.31Å; Y31-Y123 HydrophobicContact CG-CE2 4.13Å; Y31-Y123 AromaticContact CG-CZ 3.76Å; Y31-Y123 PolarHBondContact N-O 3.14Å; Y31-Y123 PolarHBondContact O-N 3.01Å; Y31-R188 VanDerWaalsContact CZ-NH1 3.35Å; Y31-R188 PolarHBondContact OH-NH1 3.41Å
32	F	98.8	Very high	88	Confident	90 Å²	90	56.3 Å²	56.3	40%	0.395	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	114.1	179	-55.3	-95.5	0	0	0	108.5	R30 V49 Y51 M122	R30-F32 HydrophobicContact CB-CD2 4.4Å; R30-F32 HydrophobicContact CB-CE2 3.58Å; R30-F32 HydrophobicContact CB-CZ 3.79Å; R30-F32 HydrophobicContact CG-CZ 4.46Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.33Å; F32-V49 PolarHBondContact N-O 2.94Å; F32-V49 PolarHBondContact O-N 3.33Å; F32-Y51 HydrophobicContact CD2-CD2 4.1Å; F32-Y51 HydrophobicContact CE2-CD2 4.11Å; F32-M122 HydrophobicContact CD1-CB 4.05Å; F32-M122 HydrophobicContact CD1-CG 3.51Å; F32-M122 HydrophobicContact CE1-CB 4.33Å; F32-M122 HydrophobicContact CE1-CG 3.4Å; F32-M122 HydrophobicContact CG-CG 4.33Å; F32-M122 HydrophobicContact CZ-CG 4.13Å
33	Y	98.8	Very high	90.5	Very high	10 Å²	10	56 Å²	56	4%	0.039	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.7	177.5	-63.4	-5	0	0	0	109.5	Y31 F46 I47 A48 Y91 Q94 Q120 W121 Y123	Y31-Y33 HydrophobicContact CD1-CE1 4.03Å; Y31-Y33 HydrophobicContact CG-CE1 4.5Å; Y33-F46 HydrophobicContact CD1-CZ 4.29Å; Y33-F46 HydrophobicContact CD2-CE2 4.01Å; Y33-F46 AromaticContact CD2-CZ 3.8Å; Y33-F46 HydrophobicContact CD2-CZ 3.8Å; Y33-F46 HydrophobicContact CE2-CZ 4.24Å; Y33-F46 HydrophobicContact CG-CE2 4.05Å; Y33-F46 AromaticContact CG-CZ 3.83Å; Y33-F46 HydrophobicContact CG-CZ 3.83Å; Y33-I47 CarbonylContact C-O 3.56Å; Y33-I47 WeakPolarHBondContact CA-O 3.24Å; Y33-A48 HydrophobicContact CD1-CB 3.25Å; Y33-A48 HydrophobicContact CE1-CB 3.37Å; Y33-A48 HydrophobicContact CG-CB 4.13Å; Y33-Y91 HydrophobicContact CE1-CD1 4.19Å; Y33-Y91 AromaticContact CE1-CE1 3.84Å; Y33-Y91 HydrophobicContact CE1-CE1 3.84Å; Y33-Y91 AromaticContact CZ-CE1 3.9Å; Y33-Y91 WeakPolarHBondContact OH-CE1 3.36Å; Y33-Q94 HydrophobicContact CD2-CG 3.7Å; Y33-Q94 HydrophobicContact CE2-CB 4.34Å; Y33-Q94 HydrophobicContact CE2-CG 3.8Å; Y33-Q120 WeakPolarHBondContact O-CA 3.19Å; Y33-W121 HydrophobicContact CD2-CD2 4.49Å; Y33-W121 AromaticContact CD2-CE3 3.5Å; Y33-W121 HydrophobicContact CD2-CE3 3.5Å; Y33-W121 VanDerWaalsContact CD2-CE3 3.5Å; Y33-W121 AromaticContact CD2-CZ3 3.84Å; Y33-W121 HydrophobicContact CD2-CZ3 3.84Å; Y33-W121 AromaticContact CE2-CE3 3.94Å; Y33-W121 HydrophobicContact CE2-CE3 3.94Å; Y33-W121 AromaticContact CE2-CZ3 3.78Å; Y33-W121 HydrophobicContact CE2-CZ3 3.78Å; Y33-W121 HydrophobicContact CG-CE3 4.46Å; Y33-W121 PolarHBondContact N-O 2.83Å; Y33-W121 PolarHBondContact O-N 2.85Å; Y33-Y123 HydrophobicContact CD2-CE1 4.32Å; Y33-Y123 HydrophobicContact CE1-CE1 4.24Å; Y33-Y123 AromaticContact CE2-CE1 3.72Å; Y33-Y123 HydrophobicContact CE2-CE1 3.72Å; Y33-Y123 AromaticContact CZ-CE1 3.68Å; Y33-Y123 PolarHBondContact OH-OH 3.39Å
34	T	98.9	Very high	92.8	Very high	41 Å²	41	52.8 Å²	52.8	25%	0.252	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	118.9	179.1	-59.2	0	0	0	0	109.6	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 4Å; T34-F46 WeakPolarHBondContact O-CA 3.34Å; T34-I47 PolarHBondContact N-O 3.29Å; T34-I47 PolarHBondContact O-N 2.92Å; T34-T118 HydrophobicContact CG2-CG2 4.09Å; T34-L119 CarbonylContact C-O 3.56Å; T34-L119 WeakPolarHBondContact CA-O 3.2Å; T34-Q120 HydrophobicContact CG2-CG 4.01Å
35	A	98.7	Very high	95	Very high	2 Å²	2	54.9 Å²	54.9	2%	0.017	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.2	175.3	0	0	0	0	0	110	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.49Å; A35-R45 VanDerWaalsContact CA-O 3.31Å; A35-R45 WeakPolarHBondContact CA-O 3.48Å; A35-F46 HydrophobicContact CB-CD2 4.35Å; A35-D98 HydrophobicContact CB-CB 3.63Å; A35-L102 HydrophobicContact CB-CD1 3.87Å; A35-T118 WeakPolarHBondContact O-CA 3.38Å; A35-L119 HydrophobicContact CB-CB 4.47Å; A35-L119 PolarHBondContact N-O 3.19Å; A35-L119 PolarHBondContact O-N 3.45Å
36	V	98.6	Very high	96.3	Very high	50 Å²	50	52 Å²	52	30%	0.303	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	115.2	-178.7	-173.6	0	0	0	0	109.6	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 4Å; V36-P44 CarbonylContact O-C 3.56Å; V36-P44 WeakPolarHBondContact O-CA 3.37Å; V36-P44 WeakPolarHBondContact O-CB 3.34Å; V36-R45 PolarHBondContact N-O 3Å; V36-R45 PolarHBondContact O-N 3.33Å; V36-H117 WeakPolarHBondContact CA-O 3.2Å; V36-T118 HydrophobicContact CG2-CG2 4.33Å
37	S	98.1	Very high	96.8	Very high	18 Å²	18	50.9 Å²	50.9	13%	0.126	28%	0.277	C	S	.	.			trans	-69.7	143.6	174.5	79.2	0	0	0	0	110.6	S116 H117	S37-S116 PolarHBondContact O-OG 3.28Å; S37-H117 PolarHBondContact N-O 3.32Å; S37-H117 PolarHBondContact OG-N 3.3Å; S37-H117 PolarHBondContact OG-O 3.23Å
38	R	96.3	Very high	97	Very high	74 Å²	74	49.4 Å²	49.4	28%	0.279	27%	0.269	S	S	.	.			trans	-137.4	74.9	-178.4	52.8	173.3	173	-156.8	-14.7	111.5	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 3.39Å; R38-R41 HydrophobicContact CB-CB 4.12Å; R38-R41 WeakPolarHBondContact CD-O 3.37Å; R38-R41 HydrophobicContact CG-CB 4.16Å; R38-R41 PolarHBondContact NE-O 3.42Å; R38-R41 PolarHBondContact O-N 3.45Å; R38-E43 VanDerWaalsContact CZ-O 3.28Å; R38-E43 PolarHBondContact NE-O 2.91Å; R38-E43 PolarHBondContact NH2-O 3.46Å; R38-D63 IonicContact CZ-OD1 3.71Å; R38-D63 IonicContact CZ-OD2 2.77Å; R38-D63 IonicContact NH1-OD1 3.16Å; R38-D63 PolarHBondContact NH1-OD1 3.36Å; R38-D63 IonicContact NH1-OD2 3.06Å; R38-D63 PolarHBondContact NH1-OD2 3.01Å; R38-D63 IonicContact NH2-OD1 3.48Å; R38-D63 PolarHBondContact NH2-OD1 2.94Å; R38-D63 IonicContact NH2-OD2 3.84Å
39	P	93.3	Very high	97.1	Very high	56 Å²	56	49.6 Å²	49.6	36%	0.364	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	132.8	-177.5	-28.1	35.5	0	0	0	112.9	R41 E113 G115	P39-R41 PolarHBondContact O-N 3Å; P39-E113 WeakPolarHBondContact CB-O 3.43Å; P39-E113 WeakPolarHBondContact CG-O 3.18Å; P39-G115 WeakPolarHBondContact CG-O 3.43Å
40	G	92.1	Very high	97.1	Very high	89 Å²	89	49.6 Å²	49.6	92%	0.918	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	1.1	-176.9	0	0	0	0	0	116	R38	R38-G40 PolarHBondContact O-N 3.39Å
41	R	93.3	Very high	97.1	Very high	208 Å²	208	50.6 Å²	50.6	79%	0.785	27%	0.274	S	S	*	.	S	Bend	trans	-122.7	25.2	-179.6	-57.8	-174.2	-179.1	-169.9	0.5	113.6	R38 P39	R38-R41 HydrophobicContact CB-CB 4.12Å; R38-R41 WeakPolarHBondContact CD-O 3.37Å; R38-R41 HydrophobicContact CG-CB 4.16Å; R38-R41 PolarHBondContact NE-O 3.42Å; R38-R41 PolarHBondContact O-N 3.45Å; P39-R41 PolarHBondContact O-N 3Å
42	G	92.1	Very high	97.1	Very high	56 Å²	56	50.6 Å²	50.6	58%	0.577	27%	0.274	S	S	*	.	S	Bend	trans	91.4	-161	180	0	0	0	0	0	113.6
43	E	94.8	Very high	96.9	Very high	98 Å²	98	47.6 Å²	47.6	46%	0.458	26%	0.262	S	S	.	.	S	Bend	trans	-71.3	155.3	-176.4	-63	-55.4	161.9	0	0	113.1	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.28Å; R38-E43 PolarHBondContact NE-O 2.91Å; R38-E43 PolarHBondContact NH2-O 3.46Å; E43-R45 PolarHBondContact O-N 2.82Å; E43-R99 VanDerWaalsContact CD-CZ 3.43Å; E43-R99 VanDerWaalsContact CD-NE 3.35Å; E43-R99 IonicContact OE1-CZ 2.81Å; E43-R99 IonicContact OE1-NE 3.62Å; E43-R99 IonicContact OE1-NH2 2.7Å; E43-R99 PolarHBondContact OE1-NH2 2.9Å; E43-R99 WeakPolarHBondContact OE2-CD 3.35Å; E43-R99 IonicContact OE2-CZ 3.59Å; E43-R99 IonicContact OE2-NE 3.86Å; E43-R99 PolarHBondContact OE2-NE 3.43Å; E43-R99 IonicContact OE2-NH2 2.75Å; E43-R99 PolarHBondContact OE2-NH2 3.2Å; E43-R99 VanDerWaalsContact OE2-NH2 3.14Å
44	P	97.4	Very high	96.8	Very high	26 Å²	26	50.2 Å²	50.2	17%	0.169	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-50.7	134.5	173.9	-25.8	34.7	0	0	0	111.9	V36 R99 L102	V36-P44 CarbonylContact O-C 3.56Å; V36-P44 WeakPolarHBondContact O-CA 3.37Å; V36-P44 WeakPolarHBondContact O-CB 3.34Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.2Å; P44-L102 HydrophobicContact CB-CD1 3.72Å; P44-L102 HydrophobicContact CG-CD1 3.87Å
45	R	98.4	Very high	96.6	Very high	91 Å²	91	49.6 Å²	49.6	34%	0.343	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	127	173.2	-177.4	-178.7	-176.6	-174.3	-0.8	108.3	A35 V36 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.49Å; A35-R45 VanDerWaalsContact CA-O 3.31Å; A35-R45 WeakPolarHBondContact CA-O 3.48Å; V36-R45 PolarHBondContact N-O 3Å; V36-R45 PolarHBondContact O-N 3.33Å; E43-R45 PolarHBondContact O-N 2.82Å; R45-I47 HydrophobicContact CG-CG1 4.31Å; R45-D61 IonicContact CZ-OD1 2.9Å; R45-D61 IonicContact CZ-OD2 2.65Å; R45-D61 IonicContact NE-OD1 3.19Å; R45-D61 PolarHBondContact NE-OD1 2.88Å; R45-D61 IonicContact NE-OD2 2.72Å; R45-D61 VanDerWaalsContact NH2-CG 3.34Å; R45-D61 IonicContact NH2-OD1 2.69Å; R45-D61 PolarHBondContact NH2-OD1 3.35Å; R45-D61 IonicContact NH2-OD2 3.35Å; R45-D61 PolarHBondContact NH2-OD2 3.46Å; R45-S62 WeakPolarHBondContact CA-OG 3.47Å; R45-D63 VanDerWaalsContact CD-OD2 3.3Å; R45-D63 WeakPolarHBondContact CD-OD2 3.44Å; R45-D63 HydrophobicContact CG-CB 4.41Å; R45-D63 IonicContact NE-OD2 2.69Å
46	F	98.8	Very high	96.6	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.009	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.9	175.5	174.1	-90.4	0	0	0	109.9	Y33 T34 A35 A48 F60 S62 Y91 Q94 A95 D98	Y33-F46 HydrophobicContact CD1-CZ 4.29Å; Y33-F46 HydrophobicContact CD2-CE2 4.01Å; Y33-F46 AromaticContact CD2-CZ 3.8Å; Y33-F46 HydrophobicContact CD2-CZ 3.8Å; Y33-F46 HydrophobicContact CE2-CZ 4.24Å; Y33-F46 HydrophobicContact CG-CE2 4.05Å; Y33-F46 AromaticContact CG-CZ 3.83Å; Y33-F46 HydrophobicContact CG-CZ 3.83Å; T34-F46 WeakPolarHBondContact O-CA 3.34Å; A35-F46 HydrophobicContact CB-CD2 4.35Å; F46-A48 HydrophobicContact CE1-CB 3.7Å; F46-A48 HydrophobicContact CZ-CB 3.86Å; F46-F60 AromaticContact CD1-CD1 3.7Å; F46-F60 HydrophobicContact CD1-CD1 3.7Å; F46-F60 AromaticContact CD1-CE1 3.8Å; F46-F60 HydrophobicContact CD1-CE1 3.8Å; F46-F60 AromaticContact CE1-CD1 3.87Å; F46-F60 HydrophobicContact CE1-CD1 3.87Å; F46-F60 HydrophobicContact CE1-CE1 4.25Å; F46-S62 PolarHBondContact N-OG 2.68Å; F46-S62 PolarHBondContact O-N 2.95Å; F46-S62 PolarHBondContact O-OG 3.45Å; F46-Y91 HydrophobicContact CE1-CD1 4.41Å; F46-Q94 HydrophobicContact CE2-CB 4.17Å; F46-Q94 HydrophobicContact CE2-CG 3.77Å; F46-Q94 HydrophobicContact CZ-CB 3.97Å; F46-Q94 HydrophobicContact CZ-CG 3.95Å; F46-A95 HydrophobicContact CB-CB 3.66Å; F46-A95 HydrophobicContact CD1-CB 3.87Å; F46-A95 HydrophobicContact CD2-CB 4.19Å; F46-A95 HydrophobicContact CG-CB 3.64Å; F46-D98 VanDerWaalsContact CD2-OD2 3.32Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.34Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.45Å
47	I	98.8	Very high	96.5	Very high	52 Å²	52	49.7 Å²	49.7	27%	0.267	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.2	173.2	-57.2	176	0	0	0	107.5	Y33 T34 R45 F60	Y33-I47 CarbonylContact C-O 3.56Å; Y33-I47 WeakPolarHBondContact CA-O 3.24Å; T34-I47 PolarHBondContact N-O 3.29Å; T34-I47 PolarHBondContact O-N 2.92Å; R45-I47 HydrophobicContact CG-CG1 4.31Å; I47-F60 WeakPolarHBondContact CA-O 3.39Å
48	A	98.8	Very high	96.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	138.1	170.7	0	0	0	0	0	110.1	Y33 F46 R59 F60 Y91	Y33-A48 HydrophobicContact CD1-CB 3.25Å; Y33-A48 HydrophobicContact CE1-CB 3.37Å; Y33-A48 HydrophobicContact CG-CB 4.13Å; F46-A48 HydrophobicContact CE1-CB 3.7Å; F46-A48 HydrophobicContact CZ-CB 3.86Å; A48-R59 CarbonylContact O-C 3.58Å; A48-R59 VanDerWaalsContact O-CA 3.31Å; A48-R59 WeakPolarHBondContact O-CA 3.31Å; A48-F60 HydrophobicContact CB-CB 4.25Å; A48-F60 PolarHBondContact N-O 2.93Å; A48-F60 PolarHBondContact O-N 2.93Å; A48-Y91 HydrophobicContact CB-CD1 3.7Å; A48-Y91 HydrophobicContact CB-CE1 3.75Å
49	V	98.8	Very high	96.6	Very high	30 Å²	30	49.5 Å²	49.5	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.2	171.6	-62.9	0	0	0	0	110	Y31 F32 Y51 Q56 V58 R59	Y31-V49 WeakPolarHBondContact CA-O 3.14Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.33Å; F32-V49 PolarHBondContact N-O 2.94Å; F32-V49 PolarHBondContact O-N 3.33Å; V49-Y51 HydrophobicContact CB-CE2 4.08Å; V49-Y51 HydrophobicContact CG2-CD2 4.37Å; V49-Y51 HydrophobicContact CG2-CE2 3.82Å; V49-Q56 VanDerWaalsContact CG1-NE2 3.28Å; V49-V58 WeakPolarHBondContact CA-O 3.35Å; V49-R59 HydrophobicContact CG1-CG 4.33Å
50	G	98.4	Very high	96.9	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137.8	177.1	0	0	0	0	0	110.8	R30 F57 V58	R30-G50 WeakPolarHBondContact O-CA 3.39Å; G50-F57 WeakPolarHBondContact O-CD1 3.49Å; G50-F57 PolarHBondContact O-N 3.41Å; G50-V58 PolarHBondContact N-O 2.85Å; G50-V58 PolarHBondContact O-N 3.09Å
51	Y	98.4	Very high	97.2	Very high	70 Å²	70	43.3 Å²	43.3	28%	0.275	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.3	-178.2	-75.4	-103.6	0	0	0	110.4	M29 R30 F32 V49 T55 Q56	M29-Y51 VanDerWaalsContact CA-O 3.31Å; M29-Y51 WeakPolarHBondContact CA-O 3.09Å; M29-Y51 WeakPolarHBondContact CG-O 3.46Å; R30-Y51 PolarHBondContact N-O 2.98Å; R30-Y51 PolarHBondContact O-N 2.71Å; F32-Y51 HydrophobicContact CD2-CD2 4.1Å; F32-Y51 HydrophobicContact CE2-CD2 4.11Å; V49-Y51 HydrophobicContact CB-CE2 4.08Å; V49-Y51 HydrophobicContact CG2-CD2 4.37Å; V49-Y51 HydrophobicContact CG2-CE2 3.82Å; Y51-T55 WeakPolarHBondContact CA-O 3.26Å; Y51-Q56 HydrophobicContact CD1-CB 4.04Å; Y51-Q56 HydrophobicContact CD2-CG 4.35Å; Y51-Q56 HydrophobicContact CE1-CB 3.57Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.13Å; Y51-Q56 HydrophobicContact CE2-CG 3.88Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å
52	V	97.7	Very high	97.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.9	157.2	176.5	0	0	0	0	105.5	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 WeakPolarHBondContact O-CA 3.44Å; M29-V52 HydrophobicContact CB-CG2 4.38Å; M29-V52 HydrophobicContact CG-CG2 4.17Å; M29-V52 HydrophobicContact SD-CG2 4.38Å; V52-D54 PolarHBondContact O-N 3.14Å; V52-T55 PolarHBondContact N-O 2.89Å; V52-T55 WeakPolarHBondContact O-CB 3.4Å; V52-T55 PolarHBondContact O-N 3.5Å; V52-F57 HydrophobicContact CG2-CD1 3.95Å; V52-F57 HydrophobicContact CG2-CE1 3.91Å; V52-W75 HydrophobicContact CB-CH2 4.3Å; V52-W75 HydrophobicContact CB-CZ2 4.36Å; V52-W75 HydrophobicContact CG2-CH2 3.83Å; V52-W75 HydrophobicContact CG2-CZ2 4.38Å; V52-L192 HydrophobicContact CG1-CD1 3.63Å; V52-L192 HydrophobicContact CG2-CD1 4.22Å; V52-Y195 HydrophobicContact CG2-CD2 3.92Å; V52-Y195 HydrophobicContact CG2-CG 4.48Å; V52-L196 HydrophobicContact CG1-CD2 4.09Å; V52-L203 HydrophobicContact CB-CD1 4.31Å; V52-L203 HydrophobicContact CB-CD2 4.2Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.11Å
53	D	95.3	Very high	97.7	Very high	27 Å²	27	35.8 Å²	35.8	14%	0.144	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	48	-131.3	-165.2	-51.9	-43.1	0	0	0	110.4	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.29Å; H27-D53 WeakPolarHBondContact CA-OD1 3.36Å; H27-D53 IonicContact CE1-OD2 3.13Å; H27-D53 IonicContact CG-OD2 3.64Å; H27-D53 IonicContact ND1-OD1 3.15Å; H27-D53 IonicContact ND1-OD2 3.52Å; H27-D53 PolarHBondContact ND1-OD2 3.01Å; S28-D53 PolarHBondContact N-OD1 2.72Å; S28-D53 PolarHBondContact O-N 3.15Å; S28-D53 PolarHBondContact OG-OD1 3.48Å; D53-T55 VanDerWaalsContact C-N 3.27Å; D53-T55 PolarHBondContact O-N 3.14Å
54	D	95.3	Very high	97.8	Very high	64 Å²	64	32.8 Å²	32.8	34%	0.342	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	1.3	177.3	-63.8	-58.4	0	0	0	114	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.14Å; D54-Y233 HydrophobicContact CB-CE2 4.01Å; D54-P234 VanDerWaalsContact OD2-CB 3.31Å; D54-P234 WeakPolarHBondContact OD2-CB 3.02Å; D54-A235 HydrophobicContact CB-CB 4.39Å; D54-A235 VanDerWaalsContact CG-CB 3.48Å; D54-A235 VanDerWaalsContact OD2-CB 3.32Å; D54-A235 WeakPolarHBondContact OD2-CB 3.31Å; D54-A235 PolarHBondContact OD2-N 2.94Å; D54-F265 HydrophobicContact CB-CE2 3.74Å; D54-F265 HydrophobicContact CB-CZ 3.73Å
55	T	96.1	Very high	97.8	Very high	28 Å²	28	37.1 Å²	37.1	17%	0.172	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	112.3	-175.6	-63.9	0	0	0	0	112	Y51 V52 D53 F57 A73 W75 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.26Å; V52-T55 PolarHBondContact N-O 2.89Å; V52-T55 WeakPolarHBondContact O-CB 3.4Å; V52-T55 PolarHBondContact O-N 3.5Å; D53-T55 VanDerWaalsContact C-N 3.27Å; D53-T55 PolarHBondContact O-N 3.14Å; T55-F57 PolarHBondContact O-N 3.22Å; T55-A73 HydrophobicContact CG2-CB 4.28Å; T55-W75 HydrophobicContact CG2-CZ2 4.44Å; T55-L203 HydrophobicContact CG2-CD2 4.02Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.3Å; T55-Y233 PolarHBondContact OG1-OH 3.01Å
56	Q	97.3	Very high	97.7	Very high	55 Å²	55	36.8 Å²	36.8	26%	0.257	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	126.3	171.9	-166.2	-176.5	4	0	0	110.7	V49 Y51 V58 R72	V49-Q56 VanDerWaalsContact CG1-NE2 3.28Å; Y51-Q56 HydrophobicContact CD1-CB 4.04Å; Y51-Q56 HydrophobicContact CD2-CG 4.35Å; Y51-Q56 HydrophobicContact CE1-CB 3.57Å; Y51-Q56 HydrophobicContact CE1-CG 4.25Å; Y51-Q56 HydrophobicContact CE2-CB 4.13Å; Y51-Q56 HydrophobicContact CE2-CG 3.88Å; Y51-Q56 HydrophobicContact CG-CB 4.49Å; Q56-V58 PolarHBondContact NE2-O 2.91Å; Q56-V58 VanDerWaalsContact NE2-O 3.13Å; Q56-R72 HydrophobicContact CB-CB 4.49Å; Q56-R72 HydrophobicContact CG-CB 4.1Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.56Å
57	F	97.8	Very high	97.6	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	-117.9	-22.7	-180	76.5	-82.6	0	0	0	114.6	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.33Å; M29-F57 HydrophobicContact SD-CE1 4.41Å; M29-F57 HydrophobicContact SD-CZ 4.08Å; Y31-F57 HydrophobicContact CE1-CZ 4.37Å; Y31-F57 HydrophobicContact CE2-CZ 4.17Å; Y31-F57 AromaticContact CZ-CZ 3.74Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.36Å; G50-F57 WeakPolarHBondContact O-CD1 3.49Å; G50-F57 PolarHBondContact O-N 3.41Å; V52-F57 HydrophobicContact CG2-CD1 3.95Å; V52-F57 HydrophobicContact CG2-CE1 3.91Å; T55-F57 PolarHBondContact O-N 3.22Å; F57-R72 PolarHBondContact O-N 3.42Å; F57-A73 HydrophobicContact CB-CB 4.11Å; F57-W75 HydrophobicContact CB-CH2 3.17Å; F57-W75 HydrophobicContact CB-CZ2 3.38Å; F57-W75 HydrophobicContact CB-CZ3 3.93Å; F57-W75 AromaticContact CD1-CH2 3.97Å; F57-W75 HydrophobicContact CD1-CH2 3.97Å; F57-W75 AromaticContact CD2-CH2 3.75Å; F57-W75 HydrophobicContact CD2-CH2 3.75Å; F57-W75 AromaticContact CD2-CZ3 3.97Å; F57-W75 HydrophobicContact CD2-CZ3 3.97Å; F57-W75 AromaticContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CZ2 4.07Å; F57-W75 HydrophobicContact CG-CZ3 4.07Å; F57-V76 HydrophobicContact CB-CG1 4.42Å; F57-V76 HydrophobicContact CD2-CB 4.38Å; F57-V76 HydrophobicContact CD2-CG1 4.43Å; F57-V76 HydrophobicContact CD2-CG2 4.16Å; F57-V76 VanDerWaalsContact O-CG1 3.3Å; F57-V76 WeakPolarHBondContact O-CG1 3.33Å; F57-Y195 HydrophobicContact CD2-CE2 4.4Å; F57-Y195 HydrophobicContact CE2-CD2 4.18Å; F57-Y195 AromaticContact CE2-CE2 3.52Å; F57-Y195 HydrophobicContact CE2-CE2 3.52Å; F57-Y195 AromaticContact CE2-CZ 3.72Å; F57-Y195 HydrophobicContact CZ-CD2 4.19Å; F57-Y195 AromaticContact CZ-CE2 3.63Å; F57-Y195 HydrophobicContact CZ-CE2 3.63Å
58	V	98.3	Very high	97.5	Very high	1 Å²	1	43 Å²	43	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	153	176.2	-73.8	0	0	0	0	113.5	Y31 V49 G50 Q56 E70 W84	Y31-V58 HydrophobicContact CE1-CG2 4.04Å; V49-V58 WeakPolarHBondContact CA-O 3.35Å; G50-V58 PolarHBondContact N-O 2.85Å; G50-V58 PolarHBondContact O-N 3.09Å; Q56-V58 PolarHBondContact NE2-O 2.91Å; Q56-V58 VanDerWaalsContact NE2-O 3.13Å; V58-E70 WeakPolarHBondContact CA-O 3.38Å; V58-W84 HydrophobicContact CG1-CH2 3.9Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å
59	R	98.4	Very high	97.5	Very high	86 Å²	86	43.3 Å²	43.3	33%	0.325	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	150.2	168.4	-180	173.2	169.3	-179.2	-5	111.3	A48 V49 D61 E70 R72	A48-R59 CarbonylContact O-C 3.58Å; A48-R59 VanDerWaalsContact O-CA 3.31Å; A48-R59 WeakPolarHBondContact O-CA 3.31Å; V49-R59 HydrophobicContact CG1-CG 4.33Å; R59-D61 IonicContact CZ-OD2 3.53Å; R59-D61 IonicContact NH2-OD2 3.55Å; R59-D61 PolarHBondContact NH2-OD2 2.89Å; R59-E70 PolarHBondContact N-O 3.36Å; R59-E70 PolarHBondContact O-N 3.36Å; R59-R72 HydrophobicContact CB-CG 3.96Å
60	F	98.8	Very high	97.4	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.013	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146	161.6	176.8	-81.4	0	0	0	109.1	F46 I47 A48 P67 R68 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.7Å; F46-F60 HydrophobicContact CD1-CD1 3.7Å; F46-F60 AromaticContact CD1-CE1 3.8Å; F46-F60 HydrophobicContact CD1-CE1 3.8Å; F46-F60 AromaticContact CE1-CD1 3.87Å; F46-F60 HydrophobicContact CE1-CD1 3.87Å; F46-F60 HydrophobicContact CE1-CE1 4.25Å; I47-F60 WeakPolarHBondContact CA-O 3.39Å; A48-F60 HydrophobicContact CB-CB 4.25Å; A48-F60 PolarHBondContact N-O 2.93Å; A48-F60 PolarHBondContact O-N 2.93Å; F60-P67 HydrophobicContact CE1-CB 4.43Å; F60-P67 HydrophobicContact CE2-CB 3.85Å; F60-P67 HydrophobicContact CZ-CB 3.61Å; F60-R68 VanDerWaalsContact CD2-C 3.47Å; F60-R68 WeakPolarHBondContact CD2-O 3.46Å; F60-Y91 HydrophobicContact CB-CD1 4.31Å; F60-Y91 HydrophobicContact CB-CD2 3.59Å; F60-Y91 HydrophobicContact CB-CE2 4.05Å; F60-Y91 HydrophobicContact CB-CG 3.75Å; F60-Y91 HydrophobicContact CD1-CG 4.42Å; 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 3.83Å; F60-Y91 HydrophobicContact CG-CD2 3.83Å; F60-Y91 AromaticContact CG-CG 3.79Å; F60-Y91 HydrophobicContact CG-CG 3.79Å; F60-K92 HydrophobicContact CE2-CG 4.18Å; F60-K92 HydrophobicContact CZ-CG 3.97Å
61	D	98.6	Very high	97.4	Very high	13 Å²	13	46.9 Å²	46.9	7%	0.07	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	121	177.4	-160	-32.3	0	0	0	109.1	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 2.9Å; R45-D61 IonicContact CZ-OD2 2.65Å; R45-D61 IonicContact NE-OD1 3.19Å; R45-D61 PolarHBondContact NE-OD1 2.88Å; R45-D61 IonicContact NE-OD2 2.72Å; R45-D61 VanDerWaalsContact NH2-CG 3.34Å; R45-D61 IonicContact NH2-OD1 2.69Å; R45-D61 PolarHBondContact NH2-OD1 3.35Å; R45-D61 IonicContact NH2-OD2 3.35Å; R45-D61 PolarHBondContact NH2-OD2 3.46Å; R59-D61 IonicContact CZ-OD2 3.53Å; R59-D61 IonicContact NH2-OD2 3.55Å; R59-D61 PolarHBondContact NH2-OD2 2.89Å; D61-D63 PolarHBondContact O-N 2.83Å; D61-D63 PolarHBondContact OD1-N 2.95Å; D61-A64 HydrophobicContact CB-CB 4.46Å; D61-A64 WeakPolarHBondContact O-CB 3.3Å; D61-A64 PolarHBondContact O-N 2.91Å
62	S	98.3	Very high	97.3	Very high	34 Å²	34	49.2 Å²	49.2	24%	0.238	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-22.5	-178.1	66.9	0	0	0	0	113.6	R45 F46 P67	R45-S62 WeakPolarHBondContact CA-OG 3.47Å; F46-S62 PolarHBondContact N-OG 2.68Å; F46-S62 PolarHBondContact O-N 2.95Å; F46-S62 PolarHBondContact O-OG 3.45Å; S62-P67 WeakPolarHBondContact O-CG 3.2Å
63	D	97.6	Very high	97.2	Very high	71 Å²	71	49.4 Å²	49.4	38%	0.38	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-0.3	-178.4	-74.5	11.1	0	0	0	112.7	R38 R45 D61	R38-D63 IonicContact CZ-OD1 3.71Å; R38-D63 IonicContact CZ-OD2 2.77Å; R38-D63 IonicContact NH1-OD1 3.16Å; R38-D63 PolarHBondContact NH1-OD1 3.36Å; R38-D63 IonicContact NH1-OD2 3.06Å; R38-D63 PolarHBondContact NH1-OD2 3.01Å; R38-D63 IonicContact NH2-OD1 3.48Å; R38-D63 PolarHBondContact NH2-OD1 2.94Å; R38-D63 IonicContact NH2-OD2 3.84Å; R45-D63 VanDerWaalsContact CD-OD2 3.3Å; R45-D63 WeakPolarHBondContact CD-OD2 3.44Å; R45-D63 HydrophobicContact CG-CB 4.41Å; R45-D63 IonicContact NE-OD2 2.69Å; D61-D63 PolarHBondContact O-N 2.83Å; D61-D63 PolarHBondContact OD1-N 2.95Å
64	A	97.2	Very high	97.2	Very high	35 Å²	35	53 Å²	53	29%	0.289	30%	0.297	S	S	.	.	S	Bend	trans	-63.8	147.8	171.7	0	0	0	0	0	111	D61 S66 P67	D61-A64 HydrophobicContact CB-CB 4.46Å; D61-A64 WeakPolarHBondContact O-CB 3.3Å; D61-A64 PolarHBondContact O-N 2.91Å; A64-S66 PolarHBondContact O-N 3.04Å; A64-S66 VanDerWaalsContact O-N 3.11Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.38Å; A64-P67 VanDerWaalsContact O-CG 3.3Å; A64-P67 WeakPolarHBondContact O-CG 3.47Å
65	A	96.5	Very high	97.3	Very high	117 Å²	117	50.7 Å²	50.7	97%	0.967	28%	0.283	S	S	*	.	S	Bend	trans	-60.4	-25.3	-179.1	0	0	0	0	0	113.8
66	S	95.8	Very high	97.3	Very high	84 Å²	84	49.3 Å²	49.3	59%	0.587	28%	0.275	S	S	*	.	S	Bend	trans	-139.3	90.8	168.9	-173.8	0	0	0	0	108.9	A64 R68	A64-S66 PolarHBondContact O-N 3.04Å; A64-S66 VanDerWaalsContact O-N 3.11Å; S66-R68 PolarHBondContact O-N 2.8Å; S66-R68 VanDerWaalsContact O-N 3.14Å
67	P	96.9	Very high	97.2	Very high	33 Å²	33	52.6 Å²	52.6	21%	0.214	29%	0.29	C	S	.	.			trans	-64.8	114.9	-174	-24.4	35.6	0	0	0	111.9	F60 S62 A64 K92	F60-P67 HydrophobicContact CE1-CB 4.43Å; F60-P67 HydrophobicContact CE2-CB 3.85Å; F60-P67 HydrophobicContact CZ-CB 3.61Å; S62-P67 WeakPolarHBondContact O-CG 3.2Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.38Å; A64-P67 VanDerWaalsContact O-CG 3.3Å; A64-P67 WeakPolarHBondContact O-CG 3.47Å; P67-K92 WeakPolarHBondContact O-CE 3.23Å; P67-K92 PolarHBondContact O-NZ 2.94Å
68	R	97.8	Very high	97	Very high	153 Å²	153	58.3 Å²	58.3	58%	0.577	32%	0.317	S	S	*	.			trans	-146.1	161.3	177.8	62.9	-176.8	175.1	177.6	0.2	110.2	F60 S66 E70 T88	F60-R68 VanDerWaalsContact CD2-C 3.47Å; F60-R68 WeakPolarHBondContact CD2-O 3.46Å; S66-R68 PolarHBondContact O-N 2.8Å; S66-R68 VanDerWaalsContact O-N 3.14Å; R68-E70 HydrophobicContact CG-CG 4.31Å; R68-T88 HydrophobicContact CB-CG2 4.25Å
69	G	97.4	Very high	96.9	Very high	6 Å²	6	58.8 Å²	58.8	6%	0.062	32%	0.319	C	S	.	.			trans	-66	132.5	166.3	0	0	0	0	0	109.5	T88	G69-T88 PolarHBondContact N-OG1 2.83Å
70	E	97.6	Very high	96.7	Very high	55 Å²	55	56.5 Å²	56.5	26%	0.257	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134	-179.2	-62.4	-179.9	150.6	0	0	109.9	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.38Å; R59-E70 PolarHBondContact N-O 3.36Å; R59-E70 PolarHBondContact O-N 3.36Å; R68-E70 HydrophobicContact CG-CG 4.31Å; E70-R72 IonicContact OE2-CZ 2.72Å; E70-R72 IonicContact OE2-NH2 3.82Å; E70-R72 PolarHBondContact OE2-NH2 3.41Å
71	P	97.8	Very high	96.6	Very high	50 Å²	50	61 Å²	61	33%	0.325	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	148.2	171.6	28.7	-34.6	0	0	0	110.9	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.86Å; P71-E77 HydrophobicContact CB-CG 3.71Å; P71-E77 HydrophobicContact CG-CG 3.96Å; P71-W84 HydrophobicContact CB-CH2 3.68Å; P71-W84 HydrophobicContact CB-CZ2 3.89Å; P71-W84 HydrophobicContact CG-CH2 4.31Å; P71-W84 HydrophobicContact CG-CZ2 4.36Å
72	R	97.3	Very high	96.5	Very high	118 Å²	118	68.3 Å²	68.3	45%	0.445	39%	0.385	S	S	.	.			trans	-131	-3.6	175.1	-60.8	-65.9	167	177.7	-3.7	113.4	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CB-CB 4.49Å; Q56-R72 HydrophobicContact CG-CB 4.1Å; Q56-R72 HydrophobicContact CG-CG 4.38Å; Q56-R72 CarbonylContact O-C 3.56Å; F57-R72 PolarHBondContact O-N 3.42Å; R59-R72 HydrophobicContact CB-CG 3.96Å; E70-R72 IonicContact OE2-CZ 2.72Å; E70-R72 IonicContact OE2-NH2 3.82Å; E70-R72 PolarHBondContact OE2-NH2 3.41Å
73	A	95.8	Very high	96.5	Very high	5 Å²	5	67 Å²	67	4%	0.041	38%	0.375	C	S	.	.	S	Bend	trans	-135.7	143.2	171	0	0	0	0	0	110.5	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.28Å; F57-A73 HydrophobicContact CB-CB 4.11Å; A73-W75 VanDerWaalsContact C-N 3.27Å; A73-W75 HydrophobicContact CB-CD2 4.2Å; A73-W75 HydrophobicContact CB-CG 4.35Å; A73-W75 HydrophobicContact CB-CZ2 4.12Å; A73-W75 PolarHBondContact O-N 2.65Å; A73-V76 WeakPolarHBondContact O-CG1 3.31Å; A73-V76 PolarHBondContact O-N 3.35Å
74	P	95.8	Very high	96.5	Very high	103 Å²	103	65.5 Å²	65.5	67%	0.669	36%	0.364	S	S	*	.	H	α-helix	trans	-58.2	-35.7	-176.6	-26.7	35.2	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 2.96Å; P74-V76 VanDerWaalsContact O-N 3.16Å; P74-E77 WeakPolarHBondContact O-CB 3.46Å; P74-E77 PolarHBondContact O-N 2.93Å
75	W	95.4	Very high	96.5	Very high	14 Å²	14	68.9 Å²	68.9	5%	0.053	38%	0.377	C	S	.	.	H	α-helix	trans	-68.8	-11.8	-175.8	55.1	-109.4	0	0	0	115	V52 T55 F57 A73 Q78 Y195 N198 G199 L203	V52-W75 HydrophobicContact CB-CH2 4.3Å; V52-W75 HydrophobicContact CB-CZ2 4.36Å; V52-W75 HydrophobicContact CG2-CH2 3.83Å; V52-W75 HydrophobicContact CG2-CZ2 4.38Å; T55-W75 HydrophobicContact CG2-CZ2 4.44Å; F57-W75 HydrophobicContact CB-CH2 3.17Å; F57-W75 HydrophobicContact CB-CZ2 3.38Å; F57-W75 HydrophobicContact CB-CZ3 3.93Å; F57-W75 AromaticContact CD1-CH2 3.97Å; F57-W75 HydrophobicContact CD1-CH2 3.97Å; F57-W75 AromaticContact CD2-CH2 3.75Å; F57-W75 HydrophobicContact CD2-CH2 3.75Å; F57-W75 AromaticContact CD2-CZ3 3.97Å; F57-W75 HydrophobicContact CD2-CZ3 3.97Å; F57-W75 AromaticContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CH2 3.38Å; F57-W75 HydrophobicContact CG-CZ2 4.07Å; F57-W75 HydrophobicContact CG-CZ3 4.07Å; A73-W75 VanDerWaalsContact C-N 3.27Å; A73-W75 HydrophobicContact CB-CD2 4.2Å; A73-W75 HydrophobicContact CB-CG 4.35Å; A73-W75 HydrophobicContact CB-CZ2 4.12Å; A73-W75 PolarHBondContact O-N 2.65Å; W75-Q78 WeakPolarHBondContact O-CG 3.4Å; W75-Q78 PolarHBondContact O-NE2 2.9Å; W75-Y195 HydrophobicContact CE3-CD1 4.38Å; W75-Y195 HydrophobicContact CH2-CD2 4.49Å; W75-Y195 HydrophobicContact CH2-CG 4.14Å; W75-Y195 AromaticContact CZ3-CD1 3.68Å; W75-Y195 HydrophobicContact CZ3-CD1 3.68Å; W75-Y195 HydrophobicContact CZ3-CD2 4.29Å; W75-Y195 HydrophobicContact CZ3-CE1 4.42Å; W75-Y195 AromaticContact CZ3-CG 3.61Å; W75-Y195 HydrophobicContact CZ3-CG 3.61Å; W75-N198 WeakPolarHBondContact CB-O 3.46Å; W75-G199 VanDerWaalsContact CB-CA 3.48Å; W75-G199 VanDerWaalsContact CG-CA 3.49Å; W75-L203 HydrophobicContact CD2-CD1 4.4Å; W75-L203 HydrophobicContact CH2-CD1 4.33Å; W75-L203 HydrophobicContact CZ2-CD1 3.78Å; W75-L203 HydrophobicContact CZ2-CD2 4.04Å; W75-L203 HydrophobicContact CZ2-CG 4.32Å
76	V	96.9	Very high	96.5	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-97.4	-14.3	171.1	75.7	0	0	0	0	112.6	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.42Å; F57-V76 HydrophobicContact CD2-CB 4.38Å; F57-V76 HydrophobicContact CD2-CG1 4.43Å; F57-V76 HydrophobicContact CD2-CG2 4.16Å; F57-V76 VanDerWaalsContact O-CG1 3.3Å; F57-V76 WeakPolarHBondContact O-CG1 3.33Å; P71-V76 HydrophobicContact CB-CG1 3.86Å; A73-V76 WeakPolarHBondContact O-CG1 3.31Å; A73-V76 PolarHBondContact O-N 3.35Å; P74-V76 PolarHBondContact O-N 2.96Å; P74-V76 VanDerWaalsContact O-N 3.16Å; V76-Q78 PolarHBondContact O-N 3.22Å; V76-E79 HydrophobicContact CG2-CB 4.48Å; V76-E79 HydrophobicContact CG2-CG 3.82Å; V76-E79 WeakPolarHBondContact O-CB 2.95Å; V76-E79 WeakPolarHBondContact O-CG 3.02Å; V76-E79 PolarHBondContact O-N 3.4Å; V76-Y83 HydrophobicContact CG2-CE1 4.18Å; V76-W84 HydrophobicContact CG1-CH2 3.92Å; V76-W84 HydrophobicContact CG1-CZ2 4.13Å; V76-W84 HydrophobicContact CG2-CH2 4.06Å; V76-W84 HydrophobicContact CG2-CZ2 4.03Å; V76-W84 WeakPolarHBondContact O-CZ2 3.34Å; V76-Y195 HydrophobicContact CG2-CE1 4.36Å
77	E	94.9	Very high	96.6	Very high	123 Å²	123	64.5 Å²	64.5	58%	0.575	32%	0.323	S	S	*	.	H	α-helix	trans	-63.1	-25.2	179.4	-62.8	-175.4	177.2	0	0	112.9	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.71Å; P71-E77 HydrophobicContact CG-CG 3.96Å; P74-E77 WeakPolarHBondContact O-CB 3.46Å; P74-E77 PolarHBondContact O-N 2.93Å; E77-E79 PolarHBondContact O-N 3.3Å
78	Q	93.7	Very high	96.7	Very high	121 Å²	121	63.4 Å²	63.4	57%	0.565	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-10.7	173.4	66.8	-175	-35.3	0	0	114.6	W75 V76 G80 N198	W75-Q78 WeakPolarHBondContact O-CG 3.4Å; W75-Q78 PolarHBondContact O-NE2 2.9Å; V76-Q78 PolarHBondContact O-N 3.22Å; Q78-G80 PolarHBondContact O-N 2.85Å; Q78-N198 VanDerWaalsContact NE2-CB 3.35Å
79	E	95.9	Very high	96.7	Very high	11 Å²	11	61.1 Å²	61.1	5%	0.051	31%	0.312	C	S	.	.	S	Bend	trans	-68.5	131.3	174	-67.5	-61.8	149.4	0	0	110.7	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CB 4.48Å; V76-E79 HydrophobicContact CG2-CG 3.82Å; V76-E79 WeakPolarHBondContact O-CB 2.95Å; V76-E79 WeakPolarHBondContact O-CG 3.02Å; V76-E79 PolarHBondContact O-N 3.4Å; E77-E79 PolarHBondContact O-N 3.3Å; E79-Y83 HydrophobicContact CB-CD1 3.59Å; E79-Y83 HydrophobicContact CB-CD2 4.29Å; E79-Y83 HydrophobicContact CB-CE1 4.16Å; E79-Y83 HydrophobicContact CB-CG 3.7Å; E79-Y83 HydrophobicContact CG-CD1 4.18Å; E79-Y83 HydrophobicContact CG-CD2 4.25Å; E79-Y83 HydrophobicContact CG-CE1 4.35Å; E79-Y83 HydrophobicContact CG-CE2 4.4Å; E79-Y83 HydrophobicContact CG-CG 4.15Å; E79-W84 VanDerWaalsContact O-CD1 3.25Å; E79-W84 PolarHBondContact O-NE1 2.72Å; E79-R194 IonicContact OE1-CZ 3.52Å; E79-R194 IonicContact OE1-NE 2.66Å; E79-R194 PolarHBondContact OE1-NE 2.82Å; E79-R194 IonicContact OE1-NH2 3.9Å; E79-R194 PolarHBondContact OE1-NH2 2.75Å; E79-R194 IonicContact OE2-CZ 3.85Å; E79-R194 IonicContact OE2-NE 2.93Å; E79-R194 IonicContact OE2-NH2 2.74Å; E79-R194 PolarHBondContact OE2-NH2 2.84Å; E79-N198 PolarHBondContact OE1-ND2 3.29Å
80	G	95.1	Very high	96.7	Very high	37 Å²	37	63.9 Å²	63.9	38%	0.381	32%	0.322	S	S	.	.			trans	-68.1	169.6	-173.3	0	0	0	0	0	114.8	Q78 E82 Y83 W84	Q78-G80 PolarHBondContact O-N 2.85Å; G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 3.11Å; G80-Y83 WeakPolarHBondContact O-CB 3.36Å; G80-Y83 PolarHBondContact O-N 2.95Å; G80-W84 PolarHBondContact O-N 3.18Å
81	P	96.4	Very high	96.7	Very high	99 Å²	99	61.3 Å²	61.3	64%	0.643	31%	0.31	S	S	*	.	H	α-helix	trans	-56.9	-36.4	-176.7	22.6	-33.6	0	0	0	113.2	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.25Å; P81-Y83 PolarHBondContact O-N 2.84Å; P81-W84 PolarHBondContact O-N 3.2Å; P81-W84 VanDerWaalsContact O-N 3.11Å; P81-D85 PolarHBondContact O-N 2.88Å
82	E	97.1	Very high	96.8	Very high	165 Å²	165	62.8 Å²	62.8	77%	0.771	31%	0.312	S	S	*	.	H	α-helix	trans	-59.1	-33.4	176.8	-61.1	-177.3	-179.9	0	0	113.4	G80 R86	G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 3.11Å; E82-R86 WeakPolarHBondContact O-CB 3.18Å; E82-R86 PolarHBondContact O-N 2.9Å; E82-R86 VanDerWaalsContact O-N 3.09Å
83	Y	96.8	Very high	96.8	Very high	7 Å²	7	65 Å²	65	3%	0.027	32%	0.32	C	S	.	.	H	α-helix	trans	-66.1	-52.7	173.4	169.5	-87.2	0	0	0	109.9	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.18Å; E79-Y83 HydrophobicContact CB-CD1 3.59Å; E79-Y83 HydrophobicContact CB-CD2 4.29Å; E79-Y83 HydrophobicContact CB-CE1 4.16Å; E79-Y83 HydrophobicContact CB-CG 3.7Å; E79-Y83 HydrophobicContact CG-CD1 4.18Å; E79-Y83 HydrophobicContact CG-CD2 4.25Å; E79-Y83 HydrophobicContact CG-CE1 4.35Å; E79-Y83 HydrophobicContact CG-CE2 4.4Å; E79-Y83 HydrophobicContact CG-CG 4.15Å; G80-Y83 WeakPolarHBondContact O-CB 3.36Å; G80-Y83 PolarHBondContact O-N 2.95Å; P81-Y83 VanDerWaalsContact C-N 3.25Å; P81-Y83 PolarHBondContact O-N 2.84Å; Y83-D85 PolarHBondContact O-N 3.42Å; Y83-R86 PolarHBondContact O-N 3.02Å; Y83-E87 HydrophobicContact CD1-CG 4.31Å; Y83-E87 HydrophobicContact CD2-CG 4.26Å; Y83-E87 HydrophobicContact CE1-CG 3.97Å; Y83-E87 HydrophobicContact CE2-CG 3.93Å; Y83-E87 HydrophobicContact CG-CG 4.43Å; Y83-E87 WeakPolarHBondContact O-CG 3.22Å; Y83-E87 PolarHBondContact O-N 2.9Å; Y83-W191 AromaticContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CZ2 4.35Å; Y83-W191 AromaticContact CD2-CZ3 3.82Å; Y83-W191 HydrophobicContact CD2-CZ3 3.82Å; Y83-W191 HydrophobicContact CE2-CE3 4.27Å; Y83-W191 AromaticContact CE2-CH2 3.87Å; Y83-W191 HydrophobicContact CE2-CH2 3.87Å; Y83-W191 AromaticContact CE2-CZ3 3.69Å; Y83-W191 HydrophobicContact CE2-CZ3 3.69Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.31Å; Y83-Y195 WeakPolarHBondContact CE2-OH 2.99Å; Y83-Y195 PolarHBondContact OH-OH 3.09Å
84	W	97.8	Very high	96.9	Very high	40 Å²	40	67 Å²	67	15%	0.152	33%	0.328	C	S	.	.	H	α-helix	trans	-64	-38.5	-176.9	-66.9	108.9	0	0	0	113	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.9Å; V58-W84 HydrophobicContact CG1-CZ3 3.85Å; P71-W84 HydrophobicContact CB-CH2 3.68Å; P71-W84 HydrophobicContact CB-CZ2 3.89Å; P71-W84 HydrophobicContact CG-CH2 4.31Å; P71-W84 HydrophobicContact CG-CZ2 4.36Å; V76-W84 HydrophobicContact CG1-CH2 3.92Å; V76-W84 HydrophobicContact CG1-CZ2 4.13Å; V76-W84 HydrophobicContact CG2-CH2 4.06Å; V76-W84 HydrophobicContact CG2-CZ2 4.03Å; V76-W84 WeakPolarHBondContact O-CZ2 3.34Å; E79-W84 VanDerWaalsContact O-CD1 3.25Å; E79-W84 PolarHBondContact O-NE1 2.72Å; G80-W84 PolarHBondContact O-N 3.18Å; P81-W84 PolarHBondContact O-N 3.2Å; P81-W84 VanDerWaalsContact O-N 3.11Å; W84-T88 WeakPolarHBondContact O-CB 3.41Å; W84-T88 PolarHBondContact O-N 2.79Å; W84-T88 PolarHBondContact O-OG1 3.49Å
85	D	97.9	Very high	97	Very high	105 Å²	105	63 Å²	63	56%	0.561	30%	0.304	S	S	*	.	H	α-helix	trans	-64.7	-47.7	173.4	-77.4	-27.7	0	0	0	111	P81 Y83 T88 Q89	P81-D85 PolarHBondContact O-N 2.88Å; Y83-D85 PolarHBondContact O-N 3.42Å; D85-T88 PolarHBondContact O-N 2.85Å; D85-Q89 VanDerWaalsContact O-CG 3.3Å; D85-Q89 WeakPolarHBondContact O-CG 3.15Å; D85-Q89 PolarHBondContact O-N 2.55Å
86	R	97.3	Very high	97.2	Very high	103 Å²	103	67.2 Å²	67.2	39%	0.389	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-46.3	178.9	-177.5	-176.4	64.5	-138.2	-7.1	112.4	E82 Y83 Q89 K90 W191	E82-R86 WeakPolarHBondContact O-CB 3.18Å; E82-R86 PolarHBondContact O-N 2.9Å; E82-R86 VanDerWaalsContact O-N 3.09Å; Y83-R86 PolarHBondContact O-N 3.02Å; R86-Q89 PolarHBondContact O-N 2.85Å; R86-K90 WeakPolarHBondContact O-CG 3.27Å; R86-K90 PolarHBondContact O-N 3.26Å; R86-W191 VanDerWaalsContact NH2-CZ2 3.26Å
87	E	97.1	Very high	97.2	Very high	6 Å²	6	69.3 Å²	69.3	3%	0.028	34%	0.341	C	S	.	.	H	α-helix	trans	-67.3	-40.1	177.8	-59.1	-41	112.9	0	0	111	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.31Å; Y83-E87 HydrophobicContact CD2-CG 4.26Å; Y83-E87 HydrophobicContact CE1-CG 3.97Å; Y83-E87 HydrophobicContact CE2-CG 3.93Å; Y83-E87 HydrophobicContact CG-CG 4.43Å; Y83-E87 WeakPolarHBondContact O-CG 3.22Å; Y83-E87 PolarHBondContact O-N 2.9Å; E87-Q89 VanDerWaalsContact C-N 3.32Å; E87-Q89 PolarHBondContact O-N 2.99Å; E87-K90 WeakPolarHBondContact O-CB 3.13Å; E87-K90 PolarHBondContact O-N 3.21Å; E87-K90 VanDerWaalsContact O-N 3.09Å; E87-K90 IonicContact OE1-NZ 3.85Å; E87-K90 PolarHBondContact OE1-NZ 2.83Å; E87-K90 WeakPolarHBondContact OE2-CD 3.39Å; E87-K90 IonicContact OE2-NZ 3.45Å; E87-K90 PolarHBondContact OE2-NZ 2.91Å; E87-Y91 HydrophobicContact CB-CE2 4.03Å; E87-Y91 WeakPolarHBondContact O-CD2 3.38Å; E87-Y91 PolarHBondContact O-N 2.84Å
88	T	98.3	Very high	97.4	Very high	10 Å²	10	63.7 Å²	63.7	6%	0.061	32%	0.315	C	S	.	.	H	α-helix	trans	-56.1	-43.5	171.7	-65.2	0	0	0	0	112.3	R68 G69 W84 D85 Y91 K92	R68-T88 HydrophobicContact CB-CG2 4.25Å; G69-T88 PolarHBondContact N-OG1 2.83Å; W84-T88 WeakPolarHBondContact O-CB 3.41Å; W84-T88 PolarHBondContact O-N 2.79Å; W84-T88 PolarHBondContact O-OG1 3.49Å; D85-T88 PolarHBondContact O-N 2.85Å; T88-Y91 PolarHBondContact O-N 2.96Å; T88-K92 HydrophobicContact CG2-CD 4.02Å; T88-K92 WeakPolarHBondContact O-CB 3.47Å; T88-K92 WeakPolarHBondContact O-CG 3.39Å; T88-K92 PolarHBondContact O-N 2.85Å
89	Q	98.3	Very high	97.6	Very high	105 Å²	105	61.5 Å²	61.5	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-73.4	-24.7	177.7	-65.2	-60.9	-14.8	0	0	113.3	D85 R86 E87 R93	D85-Q89 VanDerWaalsContact O-CG 3.3Å; D85-Q89 WeakPolarHBondContact O-CG 3.15Å; D85-Q89 PolarHBondContact O-N 2.55Å; R86-Q89 PolarHBondContact O-N 2.85Å; E87-Q89 VanDerWaalsContact C-N 3.32Å; E87-Q89 PolarHBondContact O-N 2.99Å; Q89-R93 WeakPolarHBondContact O-CB 3.32Å; Q89-R93 VanDerWaalsContact O-CG 3.3Å; Q89-R93 WeakPolarHBondContact O-CG 3.4Å; Q89-R93 PolarHBondContact O-N 3.28Å; Q89-R93 PolarHBondContact O-NE 3.47Å; Q89-R93 VanDerWaalsContact O-NE 3.13Å
90	K	97.3	Very high	97.6	Very high	65 Å²	65	64.4 Å²	64.4	28%	0.283	32%	0.32	S	S	.	.	H	α-helix	trans	-67.7	-52.3	167.8	-73.3	168.1	176.7	172.3	0	110.6	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.27Å; R86-K90 PolarHBondContact O-N 3.26Å; E87-K90 WeakPolarHBondContact O-CB 3.13Å; E87-K90 PolarHBondContact O-N 3.21Å; E87-K90 VanDerWaalsContact O-N 3.09Å; E87-K90 IonicContact OE1-NZ 3.85Å; E87-K90 PolarHBondContact OE1-NZ 2.83Å; E87-K90 WeakPolarHBondContact OE2-CD 3.39Å; E87-K90 IonicContact OE2-NZ 3.45Å; E87-K90 PolarHBondContact OE2-NZ 2.91Å; K90-K92 VanDerWaalsContact C-N 3.32Å; K90-K92 PolarHBondContact O-N 2.89Å; K90-R93 PolarHBondContact O-N 2.88Å; K90-R93 VanDerWaalsContact O-N 3.14Å; K90-Q94 PolarHBondContact O-N 3.14Å
91	Y	98.5	Very high	97.8	Very high	1 Å²	1	64.7 Å²	64.7	0%	0.004	32%	0.316	C	S	.	.	H	α-helix	trans	-58.3	-42.2	178.9	-60.5	-50.3	0	0	0	112.4	Y33 F46 A48 F60 E87 T88 R93 Q94 A95	Y33-Y91 HydrophobicContact CE1-CD1 4.19Å; Y33-Y91 AromaticContact CE1-CE1 3.84Å; Y33-Y91 HydrophobicContact CE1-CE1 3.84Å; Y33-Y91 AromaticContact CZ-CE1 3.9Å; Y33-Y91 WeakPolarHBondContact OH-CE1 3.36Å; F46-Y91 HydrophobicContact CE1-CD1 4.41Å; A48-Y91 HydrophobicContact CB-CD1 3.7Å; A48-Y91 HydrophobicContact CB-CE1 3.75Å; F60-Y91 HydrophobicContact CB-CD1 4.31Å; F60-Y91 HydrophobicContact CB-CD2 3.59Å; F60-Y91 HydrophobicContact CB-CE2 4.05Å; F60-Y91 HydrophobicContact CB-CG 3.75Å; F60-Y91 HydrophobicContact CD1-CG 4.42Å; 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 3.83Å; F60-Y91 HydrophobicContact CG-CD2 3.83Å; F60-Y91 AromaticContact CG-CG 3.79Å; F60-Y91 HydrophobicContact CG-CG 3.79Å; E87-Y91 HydrophobicContact CB-CE2 4.03Å; E87-Y91 WeakPolarHBondContact O-CD2 3.38Å; E87-Y91 PolarHBondContact O-N 2.84Å; T88-Y91 PolarHBondContact O-N 2.96Å; Y91-R93 PolarHBondContact O-N 2.03Å; Y91-Q94 PolarHBondContact O-N 3.19Å; Y91-A95 WeakPolarHBondContact O-CB 3.39Å; Y91-A95 PolarHBondContact O-N 2.83Å
92	K	98.3	Very high	97.9	Very high	81 Å²	81	60.3 Å²	60.3	35%	0.352	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-38.9	176.2	-75.3	175.5	179.8	169.8	0	113.3	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.18Å; F60-K92 HydrophobicContact CZ-CG 3.97Å; P67-K92 WeakPolarHBondContact O-CE 3.23Å; P67-K92 PolarHBondContact O-NZ 2.94Å; T88-K92 HydrophobicContact CG2-CD 4.02Å; T88-K92 WeakPolarHBondContact O-CB 3.47Å; T88-K92 WeakPolarHBondContact O-CG 3.39Å; T88-K92 PolarHBondContact O-N 2.85Å; K90-K92 VanDerWaalsContact C-N 3.32Å; K90-K92 PolarHBondContact O-N 2.89Å; K92-Q96 PolarHBondContact O-N 2.79Å
93	R	98.3	Very high	97.9	Very high	165 Å²	165	59.3 Å²	59.3	62%	0.623	28%	0.277	S	S	*	.	H	α-helix	trans	-67.7	-42.1	173.8	-76.8	-177	-67.6	168.1	0.4	111.5	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.32Å; Q89-R93 VanDerWaalsContact O-CG 3.3Å; Q89-R93 WeakPolarHBondContact O-CG 3.4Å; Q89-R93 PolarHBondContact O-N 3.28Å; Q89-R93 PolarHBondContact O-NE 3.47Å; Q89-R93 VanDerWaalsContact O-NE 3.13Å; K90-R93 PolarHBondContact O-N 2.88Å; K90-R93 VanDerWaalsContact O-N 3.14Å; Y91-R93 PolarHBondContact O-N 2.03Å; R93-Q96 PolarHBondContact O-N 2.46Å; R93-A97 PolarHBondContact O-N 3.02Å
94	Q	98.3	Very high	97.9	Very high	46 Å²	46	62.2 Å²	62.2	22%	0.215	29%	0.293	C	S	.	.	H	α-helix	trans	-63.4	-43.6	177.7	-167.2	63.8	35.2	0	0	112.2	Y33 F46 K90 Y91 Q96 A97 D98 W121	Y33-Q94 HydrophobicContact CD2-CG 3.7Å; Y33-Q94 HydrophobicContact CE2-CB 4.34Å; Y33-Q94 HydrophobicContact CE2-CG 3.8Å; F46-Q94 HydrophobicContact CE2-CB 4.17Å; F46-Q94 HydrophobicContact CE2-CG 3.77Å; F46-Q94 HydrophobicContact CZ-CB 3.97Å; F46-Q94 HydrophobicContact CZ-CG 3.95Å; K90-Q94 PolarHBondContact O-N 3.14Å; Y91-Q94 PolarHBondContact O-N 3.19Å; Q94-Q96 PolarHBondContact O-N 2.82Å; Q94-A97 CarbonylContact O-C 3.56Å; Q94-A97 WeakPolarHBondContact O-CA 3.31Å; Q94-A97 WeakPolarHBondContact O-CB 3.32Å; Q94-A97 PolarHBondContact O-N 3.01Å; Q94-D98 PolarHBondContact NE2-OD1 3.2Å; Q94-D98 PolarHBondContact O-N 2.82Å; Q94-W121 VanDerWaalsContact CD-CZ3 3.46Å; Q94-W121 HydrophobicContact CG-CE3 4.39Å; Q94-W121 HydrophobicContact CG-CZ3 4.19Å
95	A	98.3	Very high	97.9	Very high	18 Å²	18	60.7 Å²	60.7	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-56.4	-34.4	176	0	0	0	0	0	112.9	F46 Y91 R99	F46-A95 HydrophobicContact CB-CB 3.66Å; F46-A95 HydrophobicContact CD1-CB 3.87Å; F46-A95 HydrophobicContact CD2-CB 4.19Å; F46-A95 HydrophobicContact CG-CB 3.64Å; Y91-A95 WeakPolarHBondContact O-CB 3.39Å; Y91-A95 PolarHBondContact O-N 2.83Å; A95-R99 WeakPolarHBondContact O-CB 3.5Å; A95-R99 PolarHBondContact O-N 3.08Å
96	Q	98	Very high	97.9	Very high	104 Å²	104	58.4 Å²	58.4	49%	0.486	27%	0.271	S	S	.	.	H	α-helix	trans	-76.1	-36.1	173.1	-63.7	-57.5	-39.9	0	0	112.9	K92 R93 Q94 V100	K92-Q96 PolarHBondContact O-N 2.79Å; R93-Q96 PolarHBondContact O-N 2.46Å; Q94-Q96 PolarHBondContact O-N 2.82Å; Q96-V100 WeakPolarHBondContact O-CG2 3.46Å; Q96-V100 PolarHBondContact O-N 3.03Å
97	A	97.8	Very high	97.9	Very high	43 Å²	43	55.6 Å²	55.6	36%	0.355	27%	0.274	S	S	.	.	H	α-helix	trans	-62.5	-50.2	173.5	0	0	0	0	0	111	R93 Q94 R99 V100 S101	R93-A97 PolarHBondContact O-N 3.02Å; Q94-A97 CarbonylContact O-C 3.56Å; Q94-A97 WeakPolarHBondContact O-CA 3.31Å; Q94-A97 WeakPolarHBondContact O-CB 3.32Å; Q94-A97 PolarHBondContact O-N 3.01Å; A97-R99 VanDerWaalsContact C-N 3.31Å; A97-R99 PolarHBondContact O-N 2.79Å; A97-V100 CarbonylContact O-C 3.56Å; A97-V100 WeakPolarHBondContact O-CA 3.48Å; A97-V100 WeakPolarHBondContact O-CB 3.39Å; A97-V100 PolarHBondContact O-N 2.96Å; A97-S101 PolarHBondContact O-N 2.91Å; A97-S101 PolarHBondContact O-OG 2.91Å
98	D	98	Very high	98	Very high	6 Å²	6	58 Å²	58	3%	0.032	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-36.8	179.3	-70.7	0.5	0	0	0	112.2	A35 F46 Q94 V100 S101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.63Å; F46-D98 VanDerWaalsContact CD2-OD2 3.32Å; F46-D98 WeakPolarHBondContact CD2-OD2 3.34Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.45Å; Q94-D98 PolarHBondContact NE2-OD1 3.2Å; Q94-D98 PolarHBondContact O-N 2.82Å; D98-V100 VanDerWaalsContact C-N 3.29Å; D98-V100 PolarHBondContact O-N 2.87Å; D98-S101 PolarHBondContact O-N 3.34Å; D98-L102 WeakPolarHBondContact O-CB 3.5Å; D98-L102 VanDerWaalsContact O-CG 3.29Å; D98-L102 WeakPolarHBondContact O-CG 3.41Å; D98-L102 PolarHBondContact O-N 2.63Å; D98-L119 HydrophobicContact CB-CD2 4.15Å
99	R	97.8	Very high	97.9	Very high	75 Å²	75	60.9 Å²	60.9	28%	0.283	29%	0.293	S	S	.	.	H	α-helix	trans	-58.2	-40.4	171.2	176.4	-168.9	-177.2	-155.5	3.8	112.2	E43 P44 A95 A97 R103	E43-R99 VanDerWaalsContact CD-CZ 3.43Å; E43-R99 VanDerWaalsContact CD-NE 3.35Å; E43-R99 IonicContact OE1-CZ 2.81Å; E43-R99 IonicContact OE1-NE 3.62Å; E43-R99 IonicContact OE1-NH2 2.7Å; E43-R99 PolarHBondContact OE1-NH2 2.9Å; E43-R99 WeakPolarHBondContact OE2-CD 3.35Å; E43-R99 IonicContact OE2-CZ 3.59Å; E43-R99 IonicContact OE2-NE 3.86Å; E43-R99 PolarHBondContact OE2-NE 3.43Å; E43-R99 IonicContact OE2-NH2 2.75Å; E43-R99 PolarHBondContact OE2-NH2 3.2Å; E43-R99 VanDerWaalsContact OE2-NH2 3.14Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.2Å; A95-R99 WeakPolarHBondContact O-CB 3.5Å; A95-R99 PolarHBondContact O-N 3.08Å; A97-R99 VanDerWaalsContact C-N 3.31Å; A97-R99 PolarHBondContact O-N 2.79Å; R99-R103 PolarHBondContact O-N 2.83Å
100	V	97.7	Very high	97.9	Very high	72 Å²	72	63 Å²	63	44%	0.436	31%	0.308	S	S	.	.	H	α-helix	trans	-73	-42	175.7	173.9	0	0	0	0	110.6	Q96 A97 D98 R103 N104	Q96-V100 WeakPolarHBondContact O-CG2 3.46Å; Q96-V100 PolarHBondContact O-N 3.03Å; A97-V100 CarbonylContact O-C 3.56Å; A97-V100 WeakPolarHBondContact O-CA 3.48Å; A97-V100 WeakPolarHBondContact O-CB 3.39Å; A97-V100 PolarHBondContact O-N 2.96Å; D98-V100 VanDerWaalsContact C-N 3.29Å; D98-V100 PolarHBondContact O-N 2.87Å; V100-R103 WeakPolarHBondContact O-CB 3.48Å; V100-R103 PolarHBondContact O-N 3.5Å; V100-N104 VanDerWaalsContact O-CG 3.3Å; V100-N104 PolarHBondContact O-N 3.39Å; V100-N104 PolarHBondContact O-ND2 2.95Å
101	S	98	Very high	97.9	Very high	43 Å²	43	62.9 Å²	62.9	30%	0.301	31%	0.308	S	S	.	.	H	α-helix	trans	-58.8	-47.3	175.7	-62.7	0	0	0	0	112	A97 D98 R103 N104 L105	A97-S101 PolarHBondContact O-N 2.91Å; A97-S101 PolarHBondContact O-OG 2.91Å; D98-S101 PolarHBondContact O-N 3.34Å; S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 2.85Å; S101-N104 PolarHBondContact O-N 2.91Å; S101-L105 WeakPolarHBondContact O-CB 3.33Å; S101-L105 WeakPolarHBondContact O-CD1 3.45Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.45Å; S101-L105 PolarHBondContact O-N 2.93Å
102	L	98.4	Very high	97.8	Very high	7 Å²	7	66.8 Å²	66.8	4%	0.037	34%	0.336	C	S	.	.	H	α-helix	trans	-55.5	-39.9	174.6	-77.7	167.6	0	0	0	112.4	A35 P44 D98 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.87Å; P44-L102 HydrophobicContact CB-CD1 3.72Å; P44-L102 HydrophobicContact CG-CD1 3.87Å; D98-L102 WeakPolarHBondContact O-CB 3.5Å; D98-L102 VanDerWaalsContact O-CG 3.29Å; D98-L102 WeakPolarHBondContact O-CG 3.41Å; D98-L102 PolarHBondContact O-N 2.63Å; L102-R106 VanDerWaalsContact O-CB 3.29Å; L102-R106 WeakPolarHBondContact O-CB 3.3Å; L102-R106 PolarHBondContact O-N 2.97Å; L102-R106 VanDerWaalsContact O-N 3.15Å; L102-H117 HydrophobicContact CD2-CB 4.32Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.05Å; L102-Y142 HydrophobicContact CD2-CE2 4.01Å
103	R	97.1	Very high	97.5	Very high	144 Å²	144	69.3 Å²	69.3	54%	0.543	35%	0.349	S	S	.	.	H	α-helix	trans	-68	-41.7	175.5	-173	-174.7	-63.4	166.1	0.9	111.9	R99 V100 S101 G107	R99-R103 PolarHBondContact O-N 2.83Å; V100-R103 WeakPolarHBondContact O-CB 3.48Å; V100-R103 PolarHBondContact O-N 3.5Å; S101-R103 VanDerWaalsContact C-N 3.27Å; S101-R103 PolarHBondContact O-N 2.85Å; R103-G107 PolarHBondContact O-N 3.23Å
104	N	97.6	Very high	97.3	Very high	68 Å²	68	65.3 Å²	65.3	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-66.7	-47	179.3	-68.1	-21.8	0	0	0	111.5	V100 S101 G107 Y108	V100-N104 VanDerWaalsContact O-CG 3.3Å; V100-N104 PolarHBondContact O-N 3.39Å; V100-N104 PolarHBondContact O-ND2 2.95Å; S101-N104 PolarHBondContact O-N 2.91Å; N104-G107 CarbonylContact O-C 3.58Å; N104-G107 WeakPolarHBondContact O-CA 3.32Å; N104-G107 PolarHBondContact O-N 2.91Å; N104-G107 VanDerWaalsContact O-N 3.1Å; N104-Y108 WeakPolarHBondContact O-CD1 3.37Å; N104-Y108 PolarHBondContact O-N 2.97Å
105	L	98.3	Very high	97.1	Very high	7 Å²	7	64.3 Å²	64.3	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-58.6	-52	178.3	-70.1	163.5	0	0	0	110.9	S101 G107 Y108 Y109 L119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.33Å; S101-L105 WeakPolarHBondContact O-CD1 3.45Å; S101-L105 VanDerWaalsContact O-CG 3.23Å; S101-L105 WeakPolarHBondContact O-CG 3.45Å; S101-L105 PolarHBondContact O-N 2.93Å; L105-G107 PolarHBondContact O-N 3.24Å; L105-G107 VanDerWaalsContact O-N 3.14Å; L105-Y108 PolarHBondContact O-N 3.46Å; L105-Y109 HydrophobicContact CD2-CE2 4.27Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.3Å; L105-Y109 PolarHBondContact O-N 3.45Å; L105-L119 HydrophobicContact CD1-CD1 3.96Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å; L105-Y142 HydrophobicContact CB-CD1 4.27Å; L105-Y142 HydrophobicContact CB-CD2 4.25Å; L105-Y142 HydrophobicContact CB-CE1 3.89Å; L105-Y142 HydrophobicContact CB-CE2 3.89Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.66Å; L105-Y142 HydrophobicContact CD1-CE2 3.95Å; L105-Y142 HydrophobicContact CD1-CG 4.07Å; L105-Y142 HydrophobicContact CD2-CG 4.49Å; L105-Y142 HydrophobicContact CG-CD2 4.45Å; L105-Y147 HydrophobicContact CD2-CD1 4.29Å; L105-Y147 HydrophobicContact CD2-CD2 4.02Å; L105-Y147 HydrophobicContact CD2-CE1 3.75Å; L105-Y147 HydrophobicContact CD2-CE2 3.43Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.43Å; L105-Y147 HydrophobicContact CD2-CG 4.42Å
106	R	97.5	Very high	97.1	Very high	58 Å²	58	67.2 Å²	67.2	22%	0.219	37%	0.372	C	S	.	.	H	α-helix	trans	-52.3	-38.2	174	-171.5	-167.5	65.7	170.8	9.7	112.3	L102 N110 Q111 E113	L102-R106 VanDerWaalsContact O-CB 3.29Å; L102-R106 WeakPolarHBondContact O-CB 3.3Å; L102-R106 PolarHBondContact O-N 2.97Å; L102-R106 VanDerWaalsContact O-N 3.15Å; R106-N110 PolarHBondContact O-N 3.2Å; R106-Q111 HydrophobicContact CG-CB 3.75Å; R106-Q111 PolarHBondContact O-N 3.06Å; R106-E113 IonicContact CZ-OE1 2.84Å; R106-E113 IonicContact NH1-OE1 3.18Å; R106-E113 PolarHBondContact NH1-OE1 3.12Å; R106-E113 IonicContact NH2-OE1 3.38Å; R106-E113 PolarHBondContact NH2-OE1 2.79Å
107	G	97.4	Very high	97.1	Very high	44 Å²	44	63 Å²	63	45%	0.454	35%	0.353	S	S	.	.	H	α-helix	trans	-67.6	-48.2	173.9	0	0	0	0	0	113.5	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 3.23Å; N104-G107 CarbonylContact O-C 3.58Å; N104-G107 WeakPolarHBondContact O-CA 3.32Å; N104-G107 PolarHBondContact O-N 2.91Å; N104-G107 VanDerWaalsContact O-N 3.1Å; L105-G107 PolarHBondContact O-N 3.24Å; L105-G107 VanDerWaalsContact O-N 3.14Å; G107-Y109 VanDerWaalsContact C-N 3.29Å; G107-Y109 PolarHBondContact O-N 2.81Å; G107-N110 PolarHBondContact O-N 3.16Å; G107-N110 VanDerWaalsContact O-N 3.12Å
108	Y	97.9	Very high	97.1	Very high	57 Å²	57	62.8 Å²	62.8	22%	0.224	35%	0.347	C	S	.	.	H	α-helix	trans	-60.9	-37.2	178.8	-60.1	-20	0	0	0	112.5	N104 L105 N110 A163 I166 K170	N104-Y108 WeakPolarHBondContact O-CD1 3.37Å; N104-Y108 PolarHBondContact O-N 2.97Å; L105-Y108 PolarHBondContact O-N 3.46Å; Y108-N110 VanDerWaalsContact C-N 3.35Å; Y108-A163 HydrophobicContact CD2-CB 4.47Å; Y108-I166 HydrophobicContact CD1-CD1 4.06Å; Y108-I166 HydrophobicContact CD2-CD1 4.48Å; Y108-I166 HydrophobicContact CE1-CD1 4.39Å; Y108-I166 HydrophobicContact CE1-CG2 4.01Å; Y108-I166 HydrophobicContact CE2-CB 4.26Å; Y108-I166 HydrophobicContact CE2-CG2 4.19Å; Y108-I166 HydrophobicContact CG-CD1 4.12Å; Y108-K170 PolarHBondContact OH-NZ 2.69Å
109	Y	98.1	Very high	97.2	Very high	69 Å²	69	62.9 Å²	62.9	27%	0.271	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	2.7	177.8	-68.3	-70	0	0	0	114.3	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.27Å; L105-Y109 VanDerWaalsContact O-CD2 3.24Å; L105-Y109 WeakPolarHBondContact O-CD2 3.3Å; L105-Y109 PolarHBondContact O-N 3.45Å; G107-Y109 VanDerWaalsContact C-N 3.29Å; G107-Y109 PolarHBondContact O-N 2.81Å; Y109-Q111 PolarHBondContact O-N 2.72Å; Y109-Y142 AromaticContact CD2-CD1 3.73Å; Y109-Y142 HydrophobicContact CD2-CD1 3.73Å; Y109-Y142 AromaticContact CD2-CE1 3.5Å; Y109-Y142 HydrophobicContact CD2-CE1 3.5Å; Y109-Y142 AromaticContact CE2-CD1 3.48Å; Y109-Y142 HydrophobicContact CE2-CD1 3.48Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.48Å; Y109-Y142 AromaticContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CG-CE1 4.47Å; Y109-Y147 HydrophobicContact CE2-CD2 4.41Å; Y109-Y147 HydrophobicContact CE2-CE2 4.14Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.49Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.41Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.45Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.27Å; Y109-D161 PolarHBondContact OH-OD1 2.98Å; Y109-D161 PolarHBondContact OH-OD2 3.49Å; Y109-A163 HydrophobicContact CD1-CB 4.21Å; Y109-A163 HydrophobicContact CE1-CB 3.67Å; Y109-A163 HydrophobicContact CE2-CB 3.99Å
110	N	97.2	Very high	97.2	Very high	151 Å²	151	63.1 Å²	63.1	81%	0.807	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	36.5	-177.7	-56.1	-77.2	0	0	0	113.7	R106 G107 Y108	R106-N110 PolarHBondContact O-N 3.2Å; G107-N110 PolarHBondContact O-N 3.16Å; G107-N110 VanDerWaalsContact O-N 3.12Å; Y108-N110 VanDerWaalsContact C-N 3.35Å
111	Q	97.6	Very high	97.3	Very high	61 Å²	61	61.1 Å²	61.1	29%	0.285	34%	0.336	S	S	.	.			trans	-84.3	152.7	-176.1	-71.2	164.9	-40.4	0	0	112.4	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.75Å; R106-Q111 PolarHBondContact O-N 3.06Å; Y109-Q111 PolarHBondContact O-N 2.72Å; Q111-H117 PolarHBondContact NE2-CE1 3.19Å; Q111-H117 VanDerWaalsContact NE2-CE1 3.3Å; Q111-H117 PolarHBondContact OE1-CE1 3.35Å; Q111-Y142 PolarHBondContact OE1-OH 3.4Å; Q111-D143 PolarHBondContact NE2-OD2 2.8Å
112	S	95.8	Very high	97.3	Very high	83 Å²	83	60.1 Å²	60.1	58%	0.58	33%	0.327	S	S	*	.			trans	-67.9	145.5	-179.5	178.7	0	0	0	0	112.9	A114 G115	S112-A114 PolarHBondContact O-N 2.92Å; S112-A114 PolarHBondContact OG-N 3.36Å; S112-G115 PolarHBondContact O-N 2.63Å; S112-G115 VanDerWaalsContact O-N 3.16Å
113	E	93.1	Very high	97.3	Very high	134 Å²	134	60.3 Å²	60.3	63%	0.626	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.4	174.4	-58.5	-143.2	108.7	0	0	114.2	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.43Å; P39-E113 WeakPolarHBondContact CG-O 3.18Å; R106-E113 IonicContact CZ-OE1 2.84Å; R106-E113 IonicContact NH1-OE1 3.18Å; R106-E113 PolarHBondContact NH1-OE1 3.12Å; R106-E113 IonicContact NH2-OE1 3.38Å; R106-E113 PolarHBondContact NH2-OE1 2.79Å; E113-G115 VanDerWaalsContact C-N 3.28Å
114	A	93.6	Very high	97.3	Very high	82 Å²	82	53.5 Å²	53.5	68%	0.678	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.4	177.2	0	0	0	0	0	113.4	S112	S112-A114 PolarHBondContact O-N 2.92Å; S112-A114 PolarHBondContact OG-N 3.36Å
115	G	94.3	Very high	97.2	Very high	24 Å²	24	50.2 Å²	50.2	25%	0.247	28%	0.284	C	S	.	.			trans	-73.6	131.6	179.8	0	0	0	0	0	113.1	P39 S112 E113 H117	P39-G115 WeakPolarHBondContact CG-O 3.43Å; S112-G115 PolarHBondContact O-N 2.63Å; S112-G115 VanDerWaalsContact O-N 3.16Å; E113-G115 VanDerWaalsContact C-N 3.28Å; G115-H117 PolarHBondContact O-CD2 3.16Å
116	S	97.6	Very high	97.2	Very high	79 Å²	79	51.3 Å²	51.3	55%	0.552	29%	0.29	S	S	*	.			trans	-78.6	131	161.4	-175.3	0	0	0	0	108.1	S37	S37-S116 PolarHBondContact O-OG 3.28Å
117	H	98.4	Very high	97.1	Very high	16 Å²	16	48.7 Å²	48.7	7%	0.074	28%	0.28	C	S	.	.			trans	-134.1	149.8	-176.4	-65.9	-75.4	0	0	0	110.8	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 WeakPolarHBondContact CA-O 3.2Å; S37-H117 PolarHBondContact N-O 3.32Å; S37-H117 PolarHBondContact OG-N 3.3Å; S37-H117 PolarHBondContact OG-O 3.23Å; L102-H117 HydrophobicContact CD2-CB 4.32Å; Q111-H117 PolarHBondContact NE2-CE1 3.19Å; Q111-H117 VanDerWaalsContact NE2-CE1 3.3Å; Q111-H117 PolarHBondContact OE1-CE1 3.35Å; G115-H117 PolarHBondContact O-CD2 3.16Å; H117-Y142 HydrophobicContact CB-CE2 3.87Å; H117-Y142 WeakPolarHBondContact CB-OH 3.41Å; H117-Y142 VanDerWaalsContact CG-OH 3.27Å; H117-Y142 AromaticContact ND1-CZ 3.97Å; H117-Y142 PolarHBondContact ND1-OH 2.78Å; H117-D143 WeakPolarHBondContact CA-OD1 3.42Å; H117-D143 WeakPolarHBondContact CB-OD1 3.42Å; H117-D143 IonicContact CE1-OD2 2.72Å; H117-D143 IonicContact CG-OD1 3.45Å; H117-D143 IonicContact CG-OD2 3.96Å; H117-D143 IonicContact ND1-OD1 3.67Å; H117-D143 PolarHBondContact ND1-OD1 3.42Å; H117-D143 IonicContact ND1-OD2 3.07Å; H117-D143 PolarHBondContact ND1-OD2 3.26Å
118	T	98.8	Very high	96.8	Very high	38 Å²	38	46.8 Å²	46.8	23%	0.233	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124	-174.9	-62.7	0	0	0	0	110.2	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.09Å; A35-T118 WeakPolarHBondContact O-CA 3.38Å; V36-T118 HydrophobicContact CG2-CG2 4.33Å; T118-Q120 HydrophobicContact CG2-CG 3.93Å; T118-Y142 WeakPolarHBondContact O-CA 3.22Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.3Å; T118-D143 PolarHBondContact N-OD1 3.31Å; T118-D143 PolarHBondContact O-N 3.16Å
119	L	98.8	Very high	96.3	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.047	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.2	168	173.9	60.7	0	0	0	108	T34 A35 D98 L102 L105	T34-L119 CarbonylContact C-O 3.56Å; T34-L119 WeakPolarHBondContact CA-O 3.2Å; A35-L119 HydrophobicContact CB-CB 4.47Å; A35-L119 PolarHBondContact N-O 3.19Å; A35-L119 PolarHBondContact O-N 3.45Å; D98-L119 HydrophobicContact CB-CD2 4.15Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.05Å; L105-L119 HydrophobicContact CD1-CD1 3.96Å; L105-L119 HydrophobicContact CD1-CD2 4.27Å
120	Q	98.8	Very high	95.8	Very high	79 Å²	79	49.6 Å²	49.6	37%	0.369	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	142.8	174.9	-71.5	168.3	-86.5	0	0	109.2	Y33 T34 T118 S140 A141	Y33-Q120 WeakPolarHBondContact O-CA 3.19Å; T34-Q120 HydrophobicContact CG2-CG 4.01Å; T118-Q120 HydrophobicContact CG2-CG 3.93Å; Q120-S140 CarbonylContact O-C 3.59Å; Q120-S140 VanDerWaalsContact O-CA 3.29Å; Q120-S140 WeakPolarHBondContact O-CA 3.48Å; Q120-A141 HydrophobicContact CB-CB 4.37Å; Q120-A141 PolarHBondContact N-O 3.04Å; Q120-A141 PolarHBondContact O-N 3.14Å
121	W	98.6	Very high	95.4	Very high	31 Å²	31	43.2 Å²	43.2	12%	0.117	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	126.4	178	-179.1	37	0	0	0	109.7	Y33 Q94 Y123 D138 S140 W180	Y33-W121 HydrophobicContact CD2-CD2 4.49Å; Y33-W121 AromaticContact CD2-CE3 3.5Å; Y33-W121 HydrophobicContact CD2-CE3 3.5Å; Y33-W121 VanDerWaalsContact CD2-CE3 3.5Å; Y33-W121 AromaticContact CD2-CZ3 3.84Å; Y33-W121 HydrophobicContact CD2-CZ3 3.84Å; Y33-W121 AromaticContact CE2-CE3 3.94Å; Y33-W121 HydrophobicContact CE2-CE3 3.94Å; Y33-W121 AromaticContact CE2-CZ3 3.78Å; Y33-W121 HydrophobicContact CE2-CZ3 3.78Å; Y33-W121 HydrophobicContact CG-CE3 4.46Å; Y33-W121 PolarHBondContact N-O 2.83Å; Y33-W121 PolarHBondContact O-N 2.85Å; Q94-W121 VanDerWaalsContact CD-CZ3 3.46Å; Q94-W121 HydrophobicContact CG-CE3 4.39Å; Q94-W121 HydrophobicContact CG-CZ3 4.19Å; W121-Y123 HydrophobicContact CD2-CD1 4.03Å; W121-Y123 AromaticContact CE2-CD1 3.74Å; W121-Y123 HydrophobicContact CE3-CD1 4.25Å; W121-Y123 HydrophobicContact CE3-CE1 4.41Å; W121-Y123 AromaticContact CH2-CD1 3.85Å; W121-Y123 HydrophobicContact CH2-CD1 3.85Å; W121-Y123 HydrophobicContact CH2-CE1 4.02Å; W121-Y123 AromaticContact CZ2-CD1 3.66Å; W121-Y123 HydrophobicContact CZ2-CD1 3.66Å; W121-Y123 HydrophobicContact CZ2-CE1 4.3Å; W121-Y123 HydrophobicContact CZ2-CG 4.13Å; W121-Y123 HydrophobicContact CZ3-CD1 4.14Å; W121-Y123 HydrophobicContact CZ3-CE1 4.07Å; W121-D138 PolarHBondContact NE1-OD1 2.85Å; W121-S140 VanDerWaalsContact CD1-OG 3.31Å; W121-W180 AromaticContact CH2-CH2 3.48Å; W121-W180 HydrophobicContact CH2-CH2 3.48Å; W121-W180 VanDerWaalsContact CH2-CH2 3.48Å; W121-W180 AromaticContact CH2-CZ2 3.49Å; W121-W180 HydrophobicContact CH2-CZ2 3.49Å; W121-W180 VanDerWaalsContact CH2-CZ2 3.49Å; W121-W180 AromaticContact CZ2-CH2 3.33Å; W121-W180 HydrophobicContact CZ2-CH2 3.33Å; W121-W180 AromaticContact CZ2-CZ2 3.29Å; W121-W180 HydrophobicContact CZ2-CZ2 3.29Å; W121-W180 HydrophobicContact CZ2-CZ3 4.3Å
122	M	98.5	Very high	95.1	Very high	21 Å²	21	48.4 Å²	48.4	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.4	174.3	-170.9	-77.3	-73.9	0	0	109.1	R30 Y31 F32 Y137 Q139	R30-M122 HydrophobicContact CB-SD 4.49Å; Y31-M122 WeakPolarHBondContact O-CA 3.48Å; F32-M122 HydrophobicContact CD1-CB 4.05Å; F32-M122 HydrophobicContact CD1-CG 3.51Å; F32-M122 HydrophobicContact CE1-CB 4.33Å; F32-M122 HydrophobicContact CE1-CG 3.4Å; F32-M122 HydrophobicContact CG-CG 4.33Å; F32-M122 HydrophobicContact CZ-CG 4.13Å; M122-Y137 HydrophobicContact CE-CD1 3.97Å; M122-Y137 HydrophobicContact CE-CG 4.15Å; M122-Q139 HydrophobicContact CB-CG 4.15Å; M122-Q139 HydrophobicContact CE-CG 3.86Å; M122-Q139 PolarHBondContact N-O 2.79Å; M122-Q139 PolarHBondContact O-N 2.66Å
123	Y	97.9	Very high	95	Very high	12 Å²	12	46.7 Å²	46.7	5%	0.047	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	156.2	171.8	72.5	-90.5	0	0	0	110.6	Y31 Y33 W121 Y137 W180 Y183	Y31-Y123 AromaticContact CD2-CE2 3.96Å; Y31-Y123 HydrophobicContact CD2-CE2 3.96Å; Y31-Y123 HydrophobicContact CG-CE1 4.31Å; Y31-Y123 HydrophobicContact CG-CE2 4.13Å; Y31-Y123 AromaticContact CG-CZ 3.76Å; Y31-Y123 PolarHBondContact N-O 3.14Å; Y31-Y123 PolarHBondContact O-N 3.01Å; Y33-Y123 HydrophobicContact CD2-CE1 4.32Å; Y33-Y123 HydrophobicContact CE1-CE1 4.24Å; Y33-Y123 AromaticContact CE2-CE1 3.72Å; Y33-Y123 HydrophobicContact CE2-CE1 3.72Å; Y33-Y123 AromaticContact CZ-CE1 3.68Å; Y33-Y123 PolarHBondContact OH-OH 3.39Å; W121-Y123 HydrophobicContact CD2-CD1 4.03Å; W121-Y123 AromaticContact CE2-CD1 3.74Å; W121-Y123 HydrophobicContact CE3-CD1 4.25Å; W121-Y123 HydrophobicContact CE3-CE1 4.41Å; W121-Y123 AromaticContact CH2-CD1 3.85Å; W121-Y123 HydrophobicContact CH2-CD1 3.85Å; W121-Y123 HydrophobicContact CH2-CE1 4.02Å; W121-Y123 AromaticContact CZ2-CD1 3.66Å; W121-Y123 HydrophobicContact CZ2-CD1 3.66Å; W121-Y123 HydrophobicContact CZ2-CE1 4.3Å; W121-Y123 HydrophobicContact CZ2-CG 4.13Å; W121-Y123 HydrophobicContact CZ3-CD1 4.14Å; W121-Y123 HydrophobicContact CZ3-CE1 4.07Å; Y123-Y137 CarbonylContact C-O 3.59Å; Y123-Y137 WeakPolarHBondContact CA-O 3.15Å; Y123-Y137 VanDerWaalsContact CB-O 3.3Å; Y123-Y137 WeakPolarHBondContact CB-O 3.48Å; Y123-W180 HydrophobicContact CD2-CH2 4.35Å; Y123-W180 AromaticContact CD2-CZ3 3.99Å; Y123-W180 HydrophobicContact CD2-CZ3 3.99Å; Y123-W180 HydrophobicContact CG-CH2 4.32Å; Y123-W180 HydrophobicContact CG-CZ3 4.19Å; Y123-Y183 HydrophobicContact CD2-CE1 4.26Å; Y123-Y183 HydrophobicContact CE2-CE1 4.04Å
124	G	97.4	Very high	95.1	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.6	-170.9	-174.9	0	0	0	0	0	114.4	M29 Y137 L184	M29-G124 CarbonylContact O-C 3.56Å; M29-G124 WeakPolarHBondContact O-CA 3.07Å; G124-Y137 PolarHBondContact N-O 3.46Å; G124-Y137 PolarHBondContact O-N 3.27Å; G124-L184 VanDerWaalsContact O-CD2 3.25Å; G124-L184 WeakPolarHBondContact O-CD2 3.41Å
125	C	96.7	Very high	95.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	157.9	176.7	60.8	0	0	0	0	112.2	S28 M29 L133 R135 R188	S28-C125 CarbonylContact C-O 3.55Å; S28-C125 VanDerWaalsContact CA-O 3.31Å; S28-C125 WeakPolarHBondContact CA-O 2.91Å; M29-C125 PolarHBondContact N-O 2.88Å; M29-C125 PolarHBondContact O-N 2.85Å; C125-L133 HydrophobicContact CB-CD1 3.49Å; C125-L133 VanDerWaalsContact CB-CD1 3.49Å; C125-R135 CarbonylContact C-O 3.6Å; C125-R135 VanDerWaalsContact CA-O 3.25Å; C125-R135 WeakPolarHBondContact CA-O 3.5Å; C125-R188 HydrophobicContact CB-CG 4.35Å; C125-R188 WeakPolarHBondContact SG-CG 3.38Å
126	D	96.3	Very high	95.3	Very high	29 Å²	29	45.7 Å²	45.7	16%	0.155	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.2	169.6	-56.1	-16.7	0	0	0	109.2	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.56Å; H27-D126 WeakPolarHBondContact O-CA 3.36Å; S28-D126 WeakPolarHBondContact CB-OD1 3.4Å; R30-D126 IonicContact CZ-OD1 2.75Å; R30-D126 VanDerWaalsContact CZ-OD1 3.31Å; R30-D126 IonicContact NE-OD1 3.16Å; R30-D126 PolarHBondContact NE-OD1 2.95Å; R30-D126 VanDerWaalsContact NE-OD1 3.07Å; R30-D126 IonicContact NH2-OD1 2.75Å; R30-D126 PolarHBondContact NH2-OD1 2.88Å; R30-D126 IonicContact NH2-OD2 3.53Å; R30-D126 PolarHBondContact NH2-OD2 3.24Å; D126-L134 PolarHBondContact O-N 3.35Å; D126-R135 PolarHBondContact N-O 3.29Å; D126-R135 PolarHBondContact O-N 3.02Å; D126-Y137 VanDerWaalsContact OD2-CE2 3.31Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.35Å; D126-Y137 PolarHBondContact OD2-OH 2.99Å
127	L	95.4	Very high	95.3	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.016	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	142.2	175.3	-55.3	-175.2	0	0	0	110.7	S26 H27 R132 L133 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.47Å; S26-L127 WeakPolarHBondContact CB-O 3.4Å; H27-L127 PolarHBondContact N-O 2.73Å; H27-L127 VanDerWaalsContact N-O 3.08Å; H27-L127 PolarHBondContact O-N 2.99Å; L127-R132 CarbonylContact C-O 3.55Å; L127-R132 WeakPolarHBondContact CA-O 3.03Å; L127-L133 HydrophobicContact CD2-CD1 4.49Å; L127-V189 HydrophobicContact CD1-CG1 4.16Å; L127-V189 HydrophobicContact CD2-CB 4.3Å; L127-V189 HydrophobicContact CD2-CG1 3.85Å; L127-V189 HydrophobicContact CD2-CG2 3.96Å; L127-L192 HydrophobicContact CD1-CB 3.94Å; L127-L192 HydrophobicContact CD1-CD2 3.72Å; L127-L192 HydrophobicContact CD1-CG 3.7Å; L127-L192 HydrophobicContact CG-CD2 3.65Å; L127-L192 HydrophobicContact CG-CG 4.23Å; L127-R193 HydrophobicContact CD1-CG 4.14Å
128	G	91.8	Very high	95.2	Very high	4 Å²	4	42.9 Å²	42.9	4%	0.041	21%	0.213	C	C	.	.			trans	-76.7	177	169.7	0	0	0	0	0	112.4	D130 G131 R132	G128-D130 PolarHBondContact O-N 3.38Å; G128-G131 WeakPolarHBondContact O-CA 3.31Å; G128-G131 PolarHBondContact O-N 2.74Å; G128-R132 PolarHBondContact N-O 2.78Å
129	P	87.8	Confident	95.2	Very high	91 Å²	91	44.6 Å²	44.6	59%	0.591	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.9	178.2	-17.3	26.1	0	0	0	113.7	A24 G131	A24-P129 HydrophobicContact CB-CB 4.44Å; A24-P129 HydrophobicContact CB-CG 3.38Å; P129-G131 PolarHBondContact O-N 2.91Å
130	D	88	Confident	95.2	Very high	95 Å²	95	44.9 Å²	44.9	51%	0.508	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	5.1	173.8	75.8	-17.5	0	0	0	113.1	G128 R132	G128-D130 PolarHBondContact O-N 3.38Å; D130-R132 PolarHBondContact O-N 2.93Å; D130-R132 VanDerWaalsContact OD1-CB 3.31Å; D130-R132 WeakPolarHBondContact OD1-CB 3.11Å; D130-R132 WeakPolarHBondContact OD1-CG 3.43Å; D130-R132 PolarHBondContact OD1-N 3.39Å; D130-R132 WeakPolarHBondContact OD2-CD 3.39Å; D130-R132 VanDerWaalsContact OD2-CG 3.26Å; D130-R132 WeakPolarHBondContact OD2-CG 3.35Å; D130-R132 IonicContact OD2-CZ 3.8Å; D130-R132 IonicContact OD2-NE 3.1Å; D130-R132 PolarHBondContact OD2-NE 3.27Å; D130-R132 VanDerWaalsContact OD2-NE 3.13Å
131	G	87.7	Confident	95.2	Very high	17 Å²	17	41.9 Å²	41.9	18%	0.175	21%	0.21	C	C	.	.	S	Bend	trans	69.8	11.2	-178.7	0	0	0	0	0	114.5	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.31Å; G128-G131 PolarHBondContact O-N 2.74Å; P129-G131 PolarHBondContact O-N 2.91Å; G131-R193 VanDerWaalsContact O-CZ 3.31Å; G131-R193 PolarHBondContact O-NE 3.44Å; G131-R193 PolarHBondContact O-NH2 2.98Å
132	R	91.8	Very high	95.2	Very high	169 Å²	169	41 Å²	41	64%	0.638	21%	0.207	S	C	*	.			trans	-87.1	152.7	177.8	-62.7	-175.2	-168.4	173.5	1.3	111.6	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.55Å; L127-R132 WeakPolarHBondContact CA-O 3.03Å; G128-R132 PolarHBondContact N-O 2.78Å; D130-R132 PolarHBondContact O-N 2.93Å; D130-R132 VanDerWaalsContact OD1-CB 3.31Å; D130-R132 WeakPolarHBondContact OD1-CB 3.11Å; D130-R132 WeakPolarHBondContact OD1-CG 3.43Å; D130-R132 PolarHBondContact OD1-N 3.39Å; D130-R132 WeakPolarHBondContact OD2-CD 3.39Å; D130-R132 VanDerWaalsContact OD2-CG 3.26Å; D130-R132 WeakPolarHBondContact OD2-CG 3.35Å; D130-R132 IonicContact OD2-CZ 3.8Å; D130-R132 IonicContact OD2-NE 3.1Å; D130-R132 PolarHBondContact OD2-NE 3.27Å; D130-R132 VanDerWaalsContact OD2-NE 3.13Å; R132-L134 PolarHBondContact O-N 2.91Å
133	L	94.4	Very high	95.2	Very high	48 Å²	48	43 Å²	43	25%	0.251	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	118.7	174.8	-175.2	71.8	0	0	0	110.3	C125 L127 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.49Å; C125-L133 VanDerWaalsContact CB-CD1 3.49Å; L127-L133 HydrophobicContact CD2-CD1 4.49Å; L133-R135 VanDerWaalsContact CD1-O 3.3Å; L133-R135 WeakPolarHBondContact CD1-O 3.43Å; L133-L154 HydrophobicContact CD2-CD1 4.16Å; L133-E185 HydrophobicContact CD2-CB 4.48Å; L133-E185 HydrophobicContact CD2-CG 3.78Å; L133-V189 HydrophobicContact CB-CG2 4.21Å; L133-V189 HydrophobicContact CD1-CG2 4.44Å
134	L	94.3	Very high	95.2	Very high	118 Å²	118	45.2 Å²	45.2	62%	0.618	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	-44.5	167.3	-67.7	176.6	0	0	0	110.6	D126 R132	D126-L134 PolarHBondContact O-N 3.35Å; R132-L134 PolarHBondContact O-N 2.91Å
135	R	94.9	Very high	95.2	Very high	95 Å²	95	52.9 Å²	52.9	36%	0.358	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	139.6	-174.6	-172.2	163.8	173.3	137.6	13	111.8	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.6Å; C125-R135 VanDerWaalsContact CA-O 3.25Å; C125-R135 WeakPolarHBondContact CA-O 3.5Å; D126-R135 PolarHBondContact N-O 3.29Å; D126-R135 PolarHBondContact O-N 3.02Å; L133-R135 VanDerWaalsContact CD1-O 3.3Å; L133-R135 WeakPolarHBondContact CD1-O 3.43Å; R135-Y137 HydrophobicContact CB-CE2 4.1Å; R135-Y137 VanDerWaalsContact CD-CZ 3.47Å; R135-Y137 VanDerWaalsContact CD-OH 3.25Å; R135-Y137 WeakPolarHBondContact CD-OH 3.29Å; R135-Y137 HydrophobicContact CG-CD2 4.33Å; R135-Y137 HydrophobicContact CG-CE1 4.27Å; R135-Y137 HydrophobicContact CG-CE2 3.71Å; R135-Y137 VanDerWaalsContact NE-CE1 3.32Å; R135-Y137 PolarHBondContact NE-OH 2.94Å; R135-E152 IonicContact CZ-OE1 2.8Å; R135-E152 IonicContact NH1-OE1 2.63Å; R135-E152 PolarHBondContact NH1-OE1 3.26Å; R135-E152 IonicContact NH1-OE2 3.36Å; R135-E152 IonicContact NH2-OE1 3.07Å; R135-E152 PolarHBondContact NH2-OE1 3.33Å
136	G	96.6	Very high	95.3	Very high	6 Å²	6	58.7 Å²	58.7	6%	0.062	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	154.3	168.5	0	0	0	0	0	111.1
137	Y	97.4	Very high	95.4	Very high	34 Å²	34	57.8 Å²	57.8	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.9	-179.3	-60.3	-95.3	0	0	0	110.9	R30 M122 Y123 G124 D126 R135	R30-Y137 VanDerWaalsContact CZ-CE2 3.47Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.28Å; R30-Y137 PolarHBondContact NH2-OH 3.13Å; M122-Y137 HydrophobicContact CE-CD1 3.97Å; M122-Y137 HydrophobicContact CE-CG 4.15Å; Y123-Y137 CarbonylContact C-O 3.59Å; Y123-Y137 WeakPolarHBondContact CA-O 3.15Å; Y123-Y137 VanDerWaalsContact CB-O 3.3Å; Y123-Y137 WeakPolarHBondContact CB-O 3.48Å; G124-Y137 PolarHBondContact N-O 3.46Å; G124-Y137 PolarHBondContact O-N 3.27Å; D126-Y137 VanDerWaalsContact OD2-CE2 3.31Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.35Å; D126-Y137 PolarHBondContact OD2-OH 2.99Å; R135-Y137 HydrophobicContact CB-CE2 4.1Å; R135-Y137 VanDerWaalsContact CD-CZ 3.47Å; R135-Y137 VanDerWaalsContact CD-OH 3.25Å; R135-Y137 WeakPolarHBondContact CD-OH 3.29Å; R135-Y137 HydrophobicContact CG-CD2 4.33Å; R135-Y137 HydrophobicContact CG-CE1 4.27Å; R135-Y137 HydrophobicContact CG-CE2 3.71Å; R135-Y137 VanDerWaalsContact NE-CE1 3.32Å; R135-Y137 PolarHBondContact NE-OH 2.94Å
138	D	97.8	Very high	95.6	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.011	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	111.7	161.5	175.3	-7.6	0	0	0	106.4	W121 A149 L150 W180	W121-D138 PolarHBondContact NE1-OD1 2.85Å; D138-A149 CarbonylContact O-C 3.59Å; D138-A149 WeakPolarHBondContact O-CA 3.39Å; D138-L150 HydrophobicContact CB-CB 3.91Å; D138-L150 HydrophobicContact CB-CD2 4.17Å; D138-L150 WeakPolarHBondContact O-CB 3.43Å; D138-L150 PolarHBondContact O-N 3.29Å; D138-W180 HydrophobicContact CB-CD2 4.46Å; D138-W180 HydrophobicContact CB-CE3 4.49Å; D138-W180 VanDerWaalsContact OD2-CE2 3.23Å; D138-W180 PolarHBondContact OD2-NE1 3.11Å
139	Q	98.3	Very high	95.9	Very high	73 Å²	73	59.1 Å²	59.1	34%	0.341	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	131.8	-178.9	60	-174.3	85.1	0	0	112.1	M122 I148 A149	M122-Q139 HydrophobicContact CB-CG 4.15Å; M122-Q139 HydrophobicContact CE-CG 3.86Å; M122-Q139 PolarHBondContact N-O 2.79Å; M122-Q139 PolarHBondContact O-N 2.66Å; Q139-I148 WeakPolarHBondContact CA-O 3.49Å; Q139-A149 HydrophobicContact CB-CB 3.81Å
140	S	98.5	Very high	96.4	Very high	15 Å²	15	55.5 Å²	55.5	11%	0.105	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.4	179.2	-62.2	0	0	0	0	111.5	Q120 W121 Y147 I148	Q120-S140 CarbonylContact O-C 3.59Å; Q120-S140 VanDerWaalsContact O-CA 3.29Å; Q120-S140 WeakPolarHBondContact O-CA 3.48Å; W121-S140 VanDerWaalsContact CD1-OG 3.31Å; S140-Y147 WeakPolarHBondContact O-CA 3.32Å; S140-Y147 WeakPolarHBondContact O-CB 3.11Å; S140-Y147 PolarHBondContact O-N 2.96Å; S140-I148 PolarHBondContact N-O 3Å; S140-I148 PolarHBondContact O-N 3.2Å
141	A	98.8	Very high	96.9	Very high	17 Å²	17	53.1 Å²	53.1	14%	0.14	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.1	174.8	0	0	0	0	0	110.7	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.37Å; Q120-A141 PolarHBondContact N-O 3.04Å; Q120-A141 PolarHBondContact O-N 3.14Å; A141-K145 CarbonylContact C-O 3.56Å; A141-K145 WeakPolarHBondContact CA-O 3.24Å; A141-K145 VanDerWaalsContact CB-O 3.23Å; A141-K145 WeakPolarHBondContact CB-O 3.21Å
142	Y	98.8	Very high	97.3	Very high	11 Å²	11	58.8 Å²	58.8	4%	0.043	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	130.9	179.1	-173.4	-123	0	0	0	110.7	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.01Å; L105-Y142 HydrophobicContact CB-CD1 4.27Å; L105-Y142 HydrophobicContact CB-CD2 4.25Å; L105-Y142 HydrophobicContact CB-CE1 3.89Å; L105-Y142 HydrophobicContact CB-CE2 3.89Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.66Å; L105-Y142 HydrophobicContact CD1-CE2 3.95Å; L105-Y142 HydrophobicContact CD1-CG 4.07Å; L105-Y142 HydrophobicContact CD2-CG 4.49Å; L105-Y142 HydrophobicContact CG-CD2 4.45Å; Y109-Y142 AromaticContact CD2-CD1 3.73Å; Y109-Y142 HydrophobicContact CD2-CD1 3.73Å; Y109-Y142 AromaticContact CD2-CE1 3.5Å; Y109-Y142 HydrophobicContact CD2-CE1 3.5Å; Y109-Y142 AromaticContact CE2-CD1 3.48Å; Y109-Y142 HydrophobicContact CE2-CD1 3.48Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.48Å; Y109-Y142 AromaticContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CE2-CE1 3.78Å; Y109-Y142 HydrophobicContact CG-CE1 4.47Å; Q111-Y142 PolarHBondContact OE1-OH 3.4Å; H117-Y142 HydrophobicContact CB-CE2 3.87Å; H117-Y142 WeakPolarHBondContact CB-OH 3.41Å; H117-Y142 VanDerWaalsContact CG-OH 3.27Å; H117-Y142 AromaticContact ND1-CZ 3.97Å; H117-Y142 PolarHBondContact ND1-OH 2.78Å; T118-Y142 WeakPolarHBondContact O-CA 3.22Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.3Å; Y142-G144 PolarHBondContact O-N 2.9Å; Y142-G144 VanDerWaalsContact O-N 3.14Å; Y142-K145 PolarHBondContact N-O 3.12Å; Y142-K145 PolarHBondContact O-N 3.22Å
143	D	98.4	Very high	97.5	Very high	63 Å²	63	54.3 Å²	54.3	34%	0.337	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	39.4	-174.3	-65.7	-21.2	0	0	0	113.3	Q111 H117 T118	Q111-D143 PolarHBondContact NE2-OD2 2.8Å; H117-D143 WeakPolarHBondContact CA-OD1 3.42Å; H117-D143 WeakPolarHBondContact CB-OD1 3.42Å; H117-D143 IonicContact CE1-OD2 2.72Å; H117-D143 IonicContact CG-OD1 3.45Å; H117-D143 IonicContact CG-OD2 3.96Å; H117-D143 IonicContact ND1-OD1 3.67Å; H117-D143 PolarHBondContact ND1-OD1 3.42Å; H117-D143 IonicContact ND1-OD2 3.07Å; H117-D143 PolarHBondContact ND1-OD2 3.26Å; T118-D143 PolarHBondContact N-OD1 3.31Å; T118-D143 PolarHBondContact O-N 3.16Å
144	G	97.6	Very high	97.6	Very high	60 Å²	60	52.4 Å²	52.4	62%	0.619	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	12.2	178.4	0	0	0	0	0	115.6	Y142	Y142-G144 PolarHBondContact O-N 2.9Å; Y142-G144 VanDerWaalsContact O-N 3.14Å
145	K	98.5	Very high	97.7	Very high	161 Å²	161	54.8 Å²	54.8	70%	0.7	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	146	176.9	-60.7	178.9	-176.7	177.5	0	110.9	A141 Y142 Y147	A141-K145 CarbonylContact C-O 3.56Å; A141-K145 WeakPolarHBondContact CA-O 3.24Å; A141-K145 VanDerWaalsContact CB-O 3.23Å; A141-K145 WeakPolarHBondContact CB-O 3.21Å; Y142-K145 PolarHBondContact N-O 3.12Å; Y142-K145 PolarHBondContact O-N 3.22Å; K145-Y147 PolarHBondContact O-N 3.36Å
146	D	98.7	Very high	97.8	Very high	122 Å²	122	52.3 Å²	52.3	65%	0.652	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.5	136.9	173.8	-63	-43.4	0	0	0	111	A160	D146-A160 WeakPolarHBondContact O-CB 3.43Å
147	Y	98.8	Very high	97.9	Very high	10 Å²	10	52.5 Å²	52.5	4%	0.039	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	-61.7	179.9	179.1	-108.6	0	0	0	110.5	L105 Y109 S140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.29Å; L105-Y147 HydrophobicContact CD2-CD2 4.02Å; L105-Y147 HydrophobicContact CD2-CE1 3.75Å; L105-Y147 HydrophobicContact CD2-CE2 3.43Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.43Å; L105-Y147 HydrophobicContact CD2-CG 4.42Å; Y109-Y147 HydrophobicContact CE2-CD2 4.41Å; Y109-Y147 HydrophobicContact CE2-CE2 4.14Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.49Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.41Å; S140-Y147 WeakPolarHBondContact O-CA 3.32Å; S140-Y147 WeakPolarHBondContact O-CB 3.11Å; S140-Y147 PolarHBondContact O-N 2.96Å; K145-Y147 PolarHBondContact O-N 3.36Å; Y147-A160 WeakPolarHBondContact O-CB 3.46Å; Y147-A160 PolarHBondContact O-N 3.07Å; Y147-A163 HydrophobicContact CE2-CB 4.44Å; Y147-A163 PolarHBondContact OH-O 2.82Å; Y147-A163 VanDerWaalsContact OH-O 3.09Å; Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.49Å; Y147-A164 VanDerWaalsContact CE2-CA 3.47Å; Y147-A164 HydrophobicContact CE2-CB 3.7Å; Y147-A164 HydrophobicContact CG-CB 4.31Å; Y147-A164 VanDerWaalsContact CZ-CA 3.5Å; Y147-A164 WeakPolarHBondContact O-CB 3.29Å; Y147-T167 HydrophobicContact CE1-CG2 4.24Å; Y147-T167 PolarHBondContact OH-OG1 2.6Å
148	I	98.6	Very high	98	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.021	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	142.3	178.4	-161.5	171.5	0	0	0	110.5	Q139 S140 W157 T158 T167 Q168 W171	Q139-I148 WeakPolarHBondContact CA-O 3.49Å; S140-I148 PolarHBondContact N-O 3Å; S140-I148 PolarHBondContact O-N 3.2Å; I148-W157 HydrophobicContact CD1-CB 4.23Å; I148-W157 HydrophobicContact CD1-CD2 4.47Å; I148-W157 HydrophobicContact CD1-CE3 4.3Å; I148-W157 HydrophobicContact CD1-CG 4.46Å; I148-W157 HydrophobicContact CG1-CB 4.3Å; I148-W157 HydrophobicContact CG1-CE3 4.13Å; I148-T158 WeakPolarHBondContact CA-O 3.23Å; I148-T158 WeakPolarHBondContact CG1-O 3.11Å; I148-T167 HydrophobicContact CD1-CG2 4.16Å; I148-Q168 HydrophobicContact CD1-CB 3.94Å; I148-W171 HydrophobicContact CD1-CE3 3.94Å; I148-W171 HydrophobicContact CD1-CZ3 4.19Å; I148-W171 HydrophobicContact CG2-CE3 4.41Å; I148-W171 HydrophobicContact CG2-CH2 3.99Å; I148-W171 HydrophobicContact CG2-CZ3 3.61Å
149	A	98.7	Very high	98	Very high	31 Å²	31	55.6 Å²	55.6	26%	0.256	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142.2	177.1	0	0	0	0	0	111.7	D138 Q139 W157 T158	D138-A149 CarbonylContact O-C 3.59Å; D138-A149 WeakPolarHBondContact O-CA 3.39Å; Q139-A149 HydrophobicContact CB-CB 3.81Å; A149-W157 CarbonylContact O-C 3.53Å; A149-W157 WeakPolarHBondContact O-CA 3.28Å; A149-T158 PolarHBondContact N-O 2.9Å; A149-T158 PolarHBondContact O-N 3.43Å
150	L	98.6	Very high	98	Very high	14 Å²	14	55 Å²	55	7%	0.073	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	129.7	168	-174.9	66.2	0	0	0	108.5	D138 L154 W157 A177 W180 L184	D138-L150 HydrophobicContact CB-CB 3.91Å; D138-L150 HydrophobicContact CB-CD2 4.17Å; D138-L150 WeakPolarHBondContact O-CB 3.43Å; D138-L150 PolarHBondContact O-N 3.29Å; L150-L154 HydrophobicContact CD2-CD2 3.75Å; L150-L154 HydrophobicContact CG-CD2 4.27Å; L150-W157 HydrophobicContact CB-CE3 3.96Å; L150-W157 HydrophobicContact CB-CH2 4.05Å; L150-W157 HydrophobicContact CB-CZ3 3.61Å; L150-W157 HydrophobicContact CD1-CD2 4.17Å; L150-W157 HydrophobicContact CD1-CE3 4.28Å; L150-W157 HydrophobicContact CD1-CH2 4.04Å; L150-W157 HydrophobicContact CD1-CZ2 3.92Å; L150-W157 HydrophobicContact CD1-CZ3 4.21Å; L150-W157 HydrophobicContact CG-CZ3 4.47Å; L150-A177 HydrophobicContact CD1-CB 3.89Å; L150-W180 HydrophobicContact CD2-CB 4.06Å; L150-L184 HydrophobicContact CD2-CD1 4.2Å
151	N	98.2	Very high	98	Very high	45 Å²	45	56.9 Å²	56.9	24%	0.241	32%	0.316	C	S	.	.			trans	-74.7	163.6	-179.6	-66.2	-28.9	0	0	0	111.4	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 3.46Å; N151-L154 PolarHBondContact O-N 2.86Å; N151-S156 WeakPolarHBondContact CB-O 3.4Å; N151-S156 PolarHBondContact N-O 2.89Å; N151-S156 PolarHBondContact ND2-O 3.31Å; N151-S156 PolarHBondContact ND2-OG 2.99Å; N151-T158 PolarHBondContact ND2-OG1 2.79Å; N151-T158 WeakPolarHBondContact OD1-CB 3.44Å; N151-T158 PolarHBondContact OD1-OG1 3.46Å
152	E	95.9	Very high	98	Very high	137 Å²	137	61.2 Å²	61.2	64%	0.64	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.1	-179.4	-64.4	176.1	-164.9	0	0	113.7	R135 L154	R135-E152 IonicContact CZ-OE1 2.8Å; R135-E152 IonicContact NH1-OE1 2.63Å; R135-E152 PolarHBondContact NH1-OE1 3.26Å; R135-E152 IonicContact NH1-OE2 3.36Å; R135-E152 IonicContact NH2-OE1 3.07Å; R135-E152 PolarHBondContact NH2-OE1 3.33Å; E152-L154 PolarHBondContact O-N 3.34Å
153	D	96.1	Very high	98	Very high	74 Å²	74	61 Å²	61	40%	0.396	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-9.7	173.4	71.3	-0.9	0	0	0	114	N151 R155 S156	N151-D153 PolarHBondContact O-N 3.46Å; D153-R155 WeakPolarHBondContact O-CG 3.47Å; D153-R155 PolarHBondContact O-N 3.02Å; D153-R155 PolarHBondContact OD1-N 2.9Å; D153-S156 VanDerWaalsContact CG-OG 3.25Å; D153-S156 PolarHBondContact OD1-N 2.66Å; D153-S156 PolarHBondContact OD1-OG 2.9Å; D153-S156 WeakPolarHBondContact OD2-CB 3.46Å; D153-S156 PolarHBondContact OD2-OG 2.93Å
154	L	96.4	Very high	98	Very high	9 Å²	9	58 Å²	58	5%	0.047	33%	0.325	C	S	.	.	S	Bend	trans	51.7	32.4	-173.1	-53.6	-179.6	0	0	0	113.3	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.16Å; L150-L154 HydrophobicContact CD2-CD2 3.75Å; L150-L154 HydrophobicContact CG-CD2 4.27Å; N151-L154 PolarHBondContact O-N 2.86Å; E152-L154 PolarHBondContact O-N 3.34Å; L154-R181 HydrophobicContact CB-CB 4.02Å; L154-R181 HydrophobicContact CB-CG 3.82Å; L154-R181 HydrophobicContact CD1-CG 4.24Å; L154-R181 WeakPolarHBondContact O-CD 3.35Å; L154-L184 HydrophobicContact CD2-CD1 4.17Å; L154-E185 HydrophobicContact CD1-CG 4.42Å
155	R	96.6	Very high	98	Very high	168 Å²	168	58.5 Å²	58.5	63%	0.634	31%	0.311	S	S	*	.	S	Bend	trans	-138.6	-32.2	-174.1	-69.7	166.1	-171.7	-124.7	7.5	113.5	D153 A177	D153-R155 WeakPolarHBondContact O-CG 3.47Å; D153-R155 PolarHBondContact O-N 3.02Å; D153-R155 PolarHBondContact OD1-N 2.9Å; R155-A177 WeakPolarHBondContact O-CB 3.29Å
156	S	97.4	Very high	98	Very high	42 Å²	42	53.7 Å²	53.7	29%	0.294	29%	0.293	S	S	.	.			trans	-116.5	159.7	-177.6	62.2	0	0	0	0	112	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.4Å; N151-S156 PolarHBondContact N-O 2.89Å; N151-S156 PolarHBondContact ND2-O 3.31Å; N151-S156 PolarHBondContact ND2-OG 2.99Å; D153-S156 VanDerWaalsContact CG-OG 3.25Å; D153-S156 PolarHBondContact OD1-N 2.66Å; D153-S156 PolarHBondContact OD1-OG 2.9Å; D153-S156 WeakPolarHBondContact OD2-CB 3.46Å; D153-S156 PolarHBondContact OD2-OG 2.93Å
157	W	98.6	Very high	98	Very high	11 Å²	11	48.7 Å²	48.7	4%	0.042	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	143	-178.6	-60.8	93.6	0	0	0	110.8	I148 A149 L150 Q168 W171 E176 A177	I148-W157 HydrophobicContact CD1-CB 4.23Å; I148-W157 HydrophobicContact CD1-CD2 4.47Å; I148-W157 HydrophobicContact CD1-CE3 4.3Å; I148-W157 HydrophobicContact CD1-CG 4.46Å; I148-W157 HydrophobicContact CG1-CB 4.3Å; I148-W157 HydrophobicContact CG1-CE3 4.13Å; A149-W157 CarbonylContact O-C 3.53Å; A149-W157 WeakPolarHBondContact O-CA 3.28Å; L150-W157 HydrophobicContact CB-CE3 3.96Å; L150-W157 HydrophobicContact CB-CH2 4.05Å; L150-W157 HydrophobicContact CB-CZ3 3.61Å; L150-W157 HydrophobicContact CD1-CD2 4.17Å; L150-W157 HydrophobicContact CD1-CE3 4.28Å; L150-W157 HydrophobicContact CD1-CH2 4.04Å; L150-W157 HydrophobicContact CD1-CZ2 3.92Å; L150-W157 HydrophobicContact CD1-CZ3 4.21Å; L150-W157 HydrophobicContact CG-CZ3 4.47Å; W157-Q168 HydrophobicContact CB-CG 4.22Å; W157-Q168 PolarHBondContact O-NE2 3.15Å; W157-W171 AromaticContact CD2-CE3 3.93Å; W157-W171 HydrophobicContact CD2-CE3 3.93Å; W157-W171 HydrophobicContact CD2-CZ3 4.47Å; W157-W171 AromaticContact CE2-CE3 3.83Å; W157-W171 AromaticContact CE3-CE3 3.8Å; W157-W171 HydrophobicContact CE3-CE3 3.8Å; W157-W171 AromaticContact CE3-CZ3 3.87Å; W157-W171 HydrophobicContact CE3-CZ3 3.87Å; W157-W171 AromaticContact CH2-CE3 3.55Å; W157-W171 HydrophobicContact CH2-CE3 3.55Å; W157-W171 AromaticContact CH2-CZ3 3.56Å; W157-W171 HydrophobicContact CH2-CZ3 3.56Å; W157-W171 HydrophobicContact CZ2-CD2 4.48Å; W157-W171 AromaticContact CZ2-CE3 3.65Å; W157-W171 HydrophobicContact CZ2-CE3 3.65Å; W157-W171 HydrophobicContact CZ2-CZ3 4.17Å; W157-W171 AromaticContact CZ3-CE3 3.62Å; W157-W171 HydrophobicContact CZ3-CE3 3.62Å; W157-W171 AromaticContact CZ3-CZ3 3.39Å; W157-W171 HydrophobicContact CZ3-CZ3 3.39Å; W157-E176 HydrophobicContact CZ2-CB 4.17Å; W157-A177 HydrophobicContact CZ2-CB 4.29Å
158	T	98.6	Very high	98	Very high	77 Å²	77	50.1 Å²	50.1	47%	0.472	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	117.9	165.6	-67.2	0	0	0	0	109.1	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.23Å; I148-T158 WeakPolarHBondContact CG1-O 3.11Å; A149-T158 PolarHBondContact N-O 2.9Å; A149-T158 PolarHBondContact O-N 3.43Å; N151-T158 PolarHBondContact ND2-OG1 2.79Å; N151-T158 WeakPolarHBondContact OD1-CB 3.44Å; N151-T158 PolarHBondContact OD1-OG1 3.46Å
159	A	98.6	Very high	98	Very high	23 Å²	23	56.9 Å²	56.9	19%	0.19	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.3	175.4	0	0	0	0	0	110.4	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.67Å; A159-Q165 HydrophobicContact CB-CG 4.08Å; A159-Q168 HydrophobicContact CB-CB 4.36Å; A159-Q168 VanDerWaalsContact CB-OE1 3.32Å
160	A	98.5	Very high	97.9	Very high	62 Å²	62	60.8 Å²	60.8	51%	0.512	31%	0.31	S	S	.	.	S	Bend	trans	-72.5	-30.8	-175.9	0	0	0	0	0	113.7	D146 Y147	D146-A160 WeakPolarHBondContact O-CB 3.43Å; Y147-A160 WeakPolarHBondContact O-CB 3.46Å; Y147-A160 PolarHBondContact O-N 3.07Å
161	D	98.3	Very high	97.9	Very high	54 Å²	54	63.2 Å²	63.2	29%	0.289	32%	0.318	S	S	.	.	S	Bend	trans	-150.1	-174.7	-178.3	69.9	29.7	0	0	0	113.8	Y109 A163 A164 Q165	Y109-D161 WeakPolarHBondContact CE1-OD2 3.45Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.27Å; Y109-D161 PolarHBondContact OH-OD1 2.98Å; Y109-D161 PolarHBondContact OH-OD2 3.49Å; D161-A163 VanDerWaalsContact C-N 3.31Å; D161-A163 PolarHBondContact O-N 3.47Å; D161-A163 WeakPolarHBondContact OD1-CA 3.29Å; D161-A163 WeakPolarHBondContact OD1-CB 3.28Å; D161-A163 PolarHBondContact OD1-N 3.5Å; D161-A164 PolarHBondContact O-N 2.89Å; D161-A164 PolarHBondContact OD1-N 2.88Å; D161-Q165 WeakPolarHBondContact O-CG 3.27Å; D161-Q165 PolarHBondContact O-N 2.87Å
162	T	98.1	Very high	97.9	Very high	108 Å²	108	65.6 Å²	65.6	66%	0.663	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.7	-178.6	54.6	0	0	0	0	114.4
163	A	98.1	Very high	98	Very high	5 Å²	5	63.3 Å²	63.3	4%	0.041	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-39.3	173	0	0	0	0	0	110.6	Y108 Y109 Y147 D161 Q165 I166	Y108-A163 HydrophobicContact CD2-CB 4.47Å; Y109-A163 HydrophobicContact CD1-CB 4.21Å; Y109-A163 HydrophobicContact CE1-CB 3.67Å; Y109-A163 HydrophobicContact CE2-CB 3.99Å; Y147-A163 HydrophobicContact CE2-CB 4.44Å; Y147-A163 PolarHBondContact OH-O 2.82Å; Y147-A163 VanDerWaalsContact OH-O 3.09Å; D161-A163 VanDerWaalsContact C-N 3.31Å; D161-A163 PolarHBondContact O-N 3.47Å; D161-A163 WeakPolarHBondContact OD1-CA 3.29Å; D161-A163 WeakPolarHBondContact OD1-CB 3.28Å; D161-A163 PolarHBondContact OD1-N 3.5Å; A163-Q165 VanDerWaalsContact C-N 3.3Å; A163-Q165 PolarHBondContact O-N 2.87Å; A163-I166 VanDerWaalsContact O-CB 3.32Å; A163-I166 WeakPolarHBondContact O-CB 3.38Å; A163-I166 PolarHBondContact O-N 3.01Å; A163-I166 VanDerWaalsContact O-N 3.07Å
164	A	98.4	Very high	98.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-37.3	171.6	0	0	0	0	0	112.6	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.86Å; Y147-A164 HydrophobicContact CE1-CB 4.49Å; Y147-A164 VanDerWaalsContact CE2-CA 3.47Å; Y147-A164 HydrophobicContact CE2-CB 3.7Å; Y147-A164 HydrophobicContact CG-CB 4.31Å; Y147-A164 VanDerWaalsContact CZ-CA 3.5Å; Y147-A164 WeakPolarHBondContact O-CB 3.29Å; A159-A164 HydrophobicContact CB-CB 3.67Å; D161-A164 PolarHBondContact O-N 2.89Å; D161-A164 PolarHBondContact OD1-N 2.88Å; A164-I166 PolarHBondContact O-N 3.16Å; A164-I166 VanDerWaalsContact O-N 3.16Å; A164-T167 WeakPolarHBondContact O-CA 3.36Å; A164-T167 WeakPolarHBondContact O-CB 3.42Å; A164-T167 PolarHBondContact O-N 3.34Å; A164-Q168 PolarHBondContact O-N 3.46Å
165	Q	98.6	Very high	98.1	Very high	72 Å²	72	68.9 Å²	68.9	34%	0.336	36%	0.358	S	S	.	.	H	α-helix	trans	-59	-24.7	172.6	-72.5	175.1	14.8	0	0	113.8	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 4.08Å; D161-Q165 WeakPolarHBondContact O-CG 3.27Å; D161-Q165 PolarHBondContact O-N 2.87Å; A163-Q165 VanDerWaalsContact C-N 3.3Å; A163-Q165 PolarHBondContact O-N 2.87Å; Q165-R169 VanDerWaalsContact O-CG 3.29Å; Q165-R169 WeakPolarHBondContact O-CG 3.29Å; Q165-R169 PolarHBondContact O-N 2.86Å
166	I	98.3	Very high	98.1	Very high	60 Å²	60	63.3 Å²	63.3	31%	0.308	34%	0.339	S	S	.	.	H	α-helix	trans	-70.1	-40.6	174	-55.9	172.4	0	0	0	110	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.06Å; Y108-I166 HydrophobicContact CD2-CD1 4.48Å; Y108-I166 HydrophobicContact CE1-CD1 4.39Å; Y108-I166 HydrophobicContact CE1-CG2 4.01Å; Y108-I166 HydrophobicContact CE2-CB 4.26Å; Y108-I166 HydrophobicContact CE2-CG2 4.19Å; Y108-I166 HydrophobicContact CG-CD1 4.12Å; A163-I166 VanDerWaalsContact O-CB 3.32Å; A163-I166 WeakPolarHBondContact O-CB 3.38Å; A163-I166 PolarHBondContact O-N 3.01Å; A163-I166 VanDerWaalsContact O-N 3.07Å; A164-I166 PolarHBondContact O-N 3.16Å; A164-I166 VanDerWaalsContact O-N 3.16Å; I166-K170 WeakPolarHBondContact O-CG 3.47Å; I166-K170 PolarHBondContact O-N 3.3Å
167	T	98.1	Very high	98.1	Very high	17 Å²	17	61.7 Å²	61.7	10%	0.104	33%	0.328	C	S	.	.	H	α-helix	trans	-69.7	-45.7	175.3	-65.8	0	0	0	0	111	Y147 I148 A164 R169 K170 W171	Y147-T167 HydrophobicContact CE1-CG2 4.24Å; Y147-T167 PolarHBondContact OH-OG1 2.6Å; I148-T167 HydrophobicContact CD1-CG2 4.16Å; A164-T167 WeakPolarHBondContact O-CA 3.36Å; A164-T167 WeakPolarHBondContact O-CB 3.42Å; A164-T167 PolarHBondContact O-N 3.34Å; T167-R169 PolarHBondContact O-N 3.48Å; T167-K170 WeakPolarHBondContact O-CB 3.44Å; T167-K170 PolarHBondContact O-N 3.11Å; T167-W171 HydrophobicContact CG2-CD2 3.67Å; T167-W171 HydrophobicContact CG2-CE3 4.1Å; T167-W171 HydrophobicContact CG2-CG 4.13Å; T167-W171 HydrophobicContact CG2-CH2 4.28Å; T167-W171 HydrophobicContact CG2-CZ2 3.85Å; T167-W171 HydrophobicContact CG2-CZ3 4.38Å; T167-W171 PolarHBondContact O-N 2.89Å
168	Q	98.5	Very high	98	Very high	40 Å²	40	66.6 Å²	66.6	19%	0.187	35%	0.351	C	S	.	.	H	α-helix	trans	-49.5	-54.8	175.3	176	173.3	11.7	0	0	112.1	I148 W157 A159 A164 K170 W171 E172	I148-Q168 HydrophobicContact CD1-CB 3.94Å; W157-Q168 HydrophobicContact CB-CG 4.22Å; W157-Q168 PolarHBondContact O-NE2 3.15Å; A159-Q168 HydrophobicContact CB-CB 4.36Å; A159-Q168 VanDerWaalsContact CB-OE1 3.32Å; A164-Q168 PolarHBondContact O-N 3.46Å; Q168-K170 PolarHBondContact O-N 3.35Å; Q168-W171 PolarHBondContact O-N 2.83Å; Q168-W171 VanDerWaalsContact O-N 3.1Å; Q168-E172 VanDerWaalsContact CG-CD 3.5Å; Q168-E172 HydrophobicContact CG-CG 4.23Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.31Å; Q168-E172 PolarHBondContact NE2-OE1 3.14Å; Q168-E172 WeakPolarHBondContact O-CB 3.42Å; Q168-E172 WeakPolarHBondContact O-CG 3.43Å; Q168-E172 PolarHBondContact O-N 3.4Å
169	R	98.5	Very high	97.9	Very high	145 Å²	145	68.5 Å²	68.5	55%	0.547	36%	0.355	S	S	.	.	H	α-helix	trans	-59.6	-33.5	-179.8	-68.5	171.3	-164.6	122.2	8.5	113	Q165 T167 A173	Q165-R169 VanDerWaalsContact O-CG 3.29Å; Q165-R169 WeakPolarHBondContact O-CG 3.29Å; Q165-R169 PolarHBondContact O-N 2.86Å; T167-R169 PolarHBondContact O-N 3.48Å; R169-A173 VanDerWaalsContact O-CB 3.29Å; R169-A173 WeakPolarHBondContact O-CB 3.31Å; R169-A173 PolarHBondContact O-N 2.87Å; R169-A173 VanDerWaalsContact O-N 3.16Å
170	K	97.9	Very high	97.8	Very high	113 Å²	113	69.6 Å²	69.6	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-70.8	-44.4	175.9	-71.2	174.5	178.9	-176.1	0	111.3	Y108 I166 T167 Q168 A173 A174	Y108-K170 PolarHBondContact OH-NZ 2.69Å; I166-K170 WeakPolarHBondContact O-CG 3.47Å; I166-K170 PolarHBondContact O-N 3.3Å; T167-K170 WeakPolarHBondContact O-CB 3.44Å; T167-K170 PolarHBondContact O-N 3.11Å; Q168-K170 PolarHBondContact O-N 3.35Å; K170-A173 PolarHBondContact O-N 3.45Å; K170-A174 VanDerWaalsContact O-CB 3.32Å; K170-A174 WeakPolarHBondContact O-CB 3.41Å; K170-A174 PolarHBondContact O-N 3.23Å
171	W	97.9	Very high	97.7	Very high	65 Å²	65	70.2 Å²	70.2	25%	0.246	34%	0.343	C	S	.	.	H	α-helix	trans	-70.7	-35.2	-179.4	-72.6	-0.1	0	0	0	112.9	I148 W157 T167 Q168 A174 R175 E176	I148-W171 HydrophobicContact CD1-CE3 3.94Å; I148-W171 HydrophobicContact CD1-CZ3 4.19Å; I148-W171 HydrophobicContact CG2-CE3 4.41Å; I148-W171 HydrophobicContact CG2-CH2 3.99Å; I148-W171 HydrophobicContact CG2-CZ3 3.61Å; W157-W171 AromaticContact CD2-CE3 3.93Å; W157-W171 HydrophobicContact CD2-CE3 3.93Å; W157-W171 HydrophobicContact CD2-CZ3 4.47Å; W157-W171 AromaticContact CE2-CE3 3.83Å; W157-W171 AromaticContact CE3-CE3 3.8Å; W157-W171 HydrophobicContact CE3-CE3 3.8Å; W157-W171 AromaticContact CE3-CZ3 3.87Å; W157-W171 HydrophobicContact CE3-CZ3 3.87Å; W157-W171 AromaticContact CH2-CE3 3.55Å; W157-W171 HydrophobicContact CH2-CE3 3.55Å; W157-W171 AromaticContact CH2-CZ3 3.56Å; W157-W171 HydrophobicContact CH2-CZ3 3.56Å; W157-W171 HydrophobicContact CZ2-CD2 4.48Å; W157-W171 AromaticContact CZ2-CE3 3.65Å; W157-W171 HydrophobicContact CZ2-CE3 3.65Å; W157-W171 HydrophobicContact CZ2-CZ3 4.17Å; W157-W171 AromaticContact CZ3-CE3 3.62Å; W157-W171 HydrophobicContact CZ3-CE3 3.62Å; W157-W171 AromaticContact CZ3-CZ3 3.39Å; W157-W171 HydrophobicContact CZ3-CZ3 3.39Å; T167-W171 HydrophobicContact CG2-CD2 3.67Å; T167-W171 HydrophobicContact CG2-CE3 4.1Å; T167-W171 HydrophobicContact CG2-CG 4.13Å; T167-W171 HydrophobicContact CG2-CH2 4.28Å; T167-W171 HydrophobicContact CG2-CZ2 3.85Å; T167-W171 HydrophobicContact CG2-CZ3 4.38Å; T167-W171 PolarHBondContact O-N 2.89Å; Q168-W171 PolarHBondContact O-N 2.83Å; Q168-W171 VanDerWaalsContact O-N 3.1Å; W171-A174 CarbonylContact O-C 3.57Å; W171-A174 PolarHBondContact O-N 2.88Å; W171-R175 WeakPolarHBondContact O-CA 3.38Å; W171-R175 PolarHBondContact O-N 2.85Å; W171-E176 HydrophobicContact CB-CB 4.05Å; W171-E176 HydrophobicContact CB-CG 3.8Å; W171-E176 HydrophobicContact CG-CB 4.27Å; W171-E176 HydrophobicContact CG-CG 3.79Å; W171-E176 PolarHBondContact O-N 3.28Å
172	E	98.2	Very high	97.6	Very high	95 Å²	95	70.7 Å²	70.7	44%	0.444	36%	0.355	S	S	.	.	H	α-helix	trans	-64.7	-46.5	170.6	-72.1	169.4	170.3	0	0	111.2	Q168 A174 R175	Q168-E172 VanDerWaalsContact CG-CD 3.5Å; Q168-E172 HydrophobicContact CG-CG 4.23Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.31Å; Q168-E172 PolarHBondContact NE2-OE1 3.14Å; Q168-E172 WeakPolarHBondContact O-CB 3.42Å; Q168-E172 WeakPolarHBondContact O-CG 3.43Å; Q168-E172 PolarHBondContact O-N 3.4Å; E172-A174 VanDerWaalsContact C-N 3.31Å; E172-A174 PolarHBondContact O-N 2.97Å; E172-R175 PolarHBondContact O-N 2.66Å; E172-R175 VanDerWaalsContact O-N 3.14Å
173	A	98.1	Very high	97.4	Very high	89 Å²	89	68.1 Å²	68.1	74%	0.736	33%	0.334	S	S	*	.	H	α-helix	trans	-64.1	-33.8	176.7	0	0	0	0	0	113.1	R169 K170	R169-A173 VanDerWaalsContact O-CB 3.29Å; R169-A173 WeakPolarHBondContact O-CB 3.31Å; R169-A173 PolarHBondContact O-N 2.87Å; R169-A173 VanDerWaalsContact O-N 3.16Å; K170-A173 PolarHBondContact O-N 3.45Å
174	A	97.6	Very high	97.3	Very high	50 Å²	50	67.9 Å²	67.9	41%	0.413	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-4.1	175.3	0	0	0	0	0	114.2	K170 W171 E172 E176	K170-A174 VanDerWaalsContact O-CB 3.32Å; K170-A174 WeakPolarHBondContact O-CB 3.41Å; K170-A174 PolarHBondContact O-N 3.23Å; W171-A174 CarbonylContact O-C 3.57Å; W171-A174 PolarHBondContact O-N 2.88Å; E172-A174 VanDerWaalsContact C-N 3.31Å; E172-A174 PolarHBondContact O-N 2.97Å; A174-E176 VanDerWaalsContact C-N 3.29Å; A174-E176 HydrophobicContact CB-CG 4.1Å; A174-E176 PolarHBondContact O-N 2.88Å
175	R	97.3	Very high	97	Very high	150 Å²	150	72.1 Å²	72.1	57%	0.566	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	36.7	-177.2	-57.3	168.6	165.1	-120.8	0.8	114	W171 E172 A177 E178	W171-R175 WeakPolarHBondContact O-CA 3.38Å; W171-R175 PolarHBondContact O-N 2.85Å; E172-R175 PolarHBondContact O-N 2.66Å; E172-R175 VanDerWaalsContact O-N 3.14Å; R175-A177 PolarHBondContact O-N 2.73Å; R175-A177 VanDerWaalsContact O-N 3.16Å; R175-E178 HydrophobicContact CB-CB 4.44Å; R175-E178 HydrophobicContact CB-CG 4.22Å; R175-E178 WeakPolarHBondContact CD-OE2 3.49Å; R175-E178 IonicContact CZ-OE1 3.38Å; R175-E178 IonicContact NH1-OE1 3.14Å; R175-E178 PolarHBondContact NH1-OE1 2.88Å; R175-E178 IonicContact NH1-OE2 3.17Å; R175-E178 PolarHBondContact NH1-OE2 3.03Å; R175-E178 VanDerWaalsContact NH1-OE2 3.1Å; R175-E178 WeakPolarHBondContact O-CB 3.35Å; R175-E178 PolarHBondContact O-N 3Å
176	E	96.9	Very high	96.8	Very high	52 Å²	52	70 Å²	70	24%	0.243	35%	0.349	C	S	.	.	H	α-helix	trans	-56.4	-35.3	-177.2	-62.6	-68.8	-178.4	0	0	112.5	W157 W171 A174 E178 Q179 W180	W157-E176 HydrophobicContact CZ2-CB 4.17Å; W171-E176 HydrophobicContact CB-CB 4.05Å; W171-E176 HydrophobicContact CB-CG 3.8Å; W171-E176 HydrophobicContact CG-CB 4.27Å; W171-E176 HydrophobicContact CG-CG 3.79Å; W171-E176 PolarHBondContact O-N 3.28Å; A174-E176 VanDerWaalsContact C-N 3.29Å; A174-E176 HydrophobicContact CB-CG 4.1Å; A174-E176 PolarHBondContact O-N 2.88Å; E176-E178 VanDerWaalsContact C-N 3.28Å; E176-E178 PolarHBondContact O-N 3.44Å; E176-Q179 WeakPolarHBondContact O-CB 3.29Å; E176-Q179 PolarHBondContact O-N 2.95Å; E176-Q179 VanDerWaalsContact O-N 3.09Å; E176-Q179 PolarHBondContact OE2-NE2 2.77Å; E176-W180 PolarHBondContact O-N 3.39Å
177	A	97.4	Very high	96.6	Very high	7 Å²	7	70.1 Å²	70.1	6%	0.058	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-33.4	176.8	0	0	0	0	0	113.1	L150 R155 W157 R175 Q179 R181	L150-A177 HydrophobicContact CD1-CB 3.89Å; R155-A177 WeakPolarHBondContact O-CB 3.29Å; W157-A177 HydrophobicContact CZ2-CB 4.29Å; R175-A177 PolarHBondContact O-N 2.73Å; R175-A177 VanDerWaalsContact O-N 3.16Å; A177-Q179 VanDerWaalsContact C-N 3.33Å; A177-Q179 PolarHBondContact O-N 3.13Å; A177-R181 WeakPolarHBondContact O-CB 3.4Å; A177-R181 PolarHBondContact O-N 3.22Å
178	E	96.8	Very high	96.4	Very high	114 Å²	114	69.4 Å²	69.4	53%	0.533	35%	0.348	S	S	.	.	H	α-helix	trans	-65.8	-37.7	175.6	-64.2	-179.8	177.6	0	0	111	R175 E176 A182	R175-E178 HydrophobicContact CB-CB 4.44Å; R175-E178 HydrophobicContact CB-CG 4.22Å; R175-E178 WeakPolarHBondContact CD-OE2 3.49Å; R175-E178 IonicContact CZ-OE1 3.38Å; R175-E178 IonicContact NH1-OE1 3.14Å; R175-E178 PolarHBondContact NH1-OE1 2.88Å; R175-E178 IonicContact NH1-OE2 3.17Å; R175-E178 PolarHBondContact NH1-OE2 3.03Å; R175-E178 VanDerWaalsContact NH1-OE2 3.1Å; R175-E178 WeakPolarHBondContact O-CB 3.35Å; R175-E178 PolarHBondContact O-N 3Å; E176-E178 VanDerWaalsContact C-N 3.28Å; E176-E178 PolarHBondContact O-N 3.44Å; E178-A182 WeakPolarHBondContact O-CB 3.49Å; E178-A182 PolarHBondContact O-N 2.83Å; E178-A182 VanDerWaalsContact O-N 3.16Å
179	Q	95.4	Very high	96.2	Very high	118 Å²	118	68 Å²	68	55%	0.551	34%	0.341	S	S	*	.	H	α-helix	trans	-70.6	-46.2	176.9	-57.4	-177.2	53.7	0	0	111.5	E176 A177 A182 Y183	E176-Q179 WeakPolarHBondContact O-CB 3.29Å; E176-Q179 PolarHBondContact O-N 2.95Å; E176-Q179 VanDerWaalsContact O-N 3.09Å; E176-Q179 PolarHBondContact OE2-NE2 2.77Å; A177-Q179 VanDerWaalsContact C-N 3.33Å; A177-Q179 PolarHBondContact O-N 3.13Å; Q179-A182 PolarHBondContact O-N 3Å; Q179-Y183 PolarHBondContact O-N 3.01Å
180	W	96.2	Very high	96.1	Very high	45 Å²	45	67.1 Å²	67.1	17%	0.17	34%	0.344	C	S	.	.	H	α-helix	trans	-61.2	-44.7	177	-84.6	105.7	0	0	0	112.4	W121 Y123 D138 L150 E176 A182 Y183 L184	W121-W180 AromaticContact CH2-CH2 3.48Å; W121-W180 HydrophobicContact CH2-CH2 3.48Å; W121-W180 VanDerWaalsContact CH2-CH2 3.48Å; W121-W180 AromaticContact CH2-CZ2 3.49Å; W121-W180 HydrophobicContact CH2-CZ2 3.49Å; W121-W180 VanDerWaalsContact CH2-CZ2 3.49Å; W121-W180 AromaticContact CZ2-CH2 3.33Å; W121-W180 HydrophobicContact CZ2-CH2 3.33Å; W121-W180 AromaticContact CZ2-CZ2 3.29Å; W121-W180 HydrophobicContact CZ2-CZ2 3.29Å; W121-W180 HydrophobicContact CZ2-CZ3 4.3Å; Y123-W180 HydrophobicContact CD2-CH2 4.35Å; Y123-W180 AromaticContact CD2-CZ3 3.99Å; Y123-W180 HydrophobicContact CD2-CZ3 3.99Å; Y123-W180 HydrophobicContact CG-CH2 4.32Å; Y123-W180 HydrophobicContact CG-CZ3 4.19Å; D138-W180 HydrophobicContact CB-CD2 4.46Å; D138-W180 HydrophobicContact CB-CE3 4.49Å; D138-W180 VanDerWaalsContact OD2-CE2 3.23Å; D138-W180 PolarHBondContact OD2-NE1 3.11Å; L150-W180 HydrophobicContact CD2-CB 4.06Å; E176-W180 PolarHBondContact O-N 3.39Å; W180-A182 PolarHBondContact O-N 3.05Å; W180-Y183 AromaticContact CE3-CD1 3.9Å; W180-Y183 HydrophobicContact CE3-CD1 3.9Å; W180-Y183 HydrophobicContact CH2-CD1 4.45Å; W180-Y183 AromaticContact CZ3-CD1 3.55Å; W180-Y183 HydrophobicContact CZ3-CD1 3.55Å; W180-Y183 AromaticContact CZ3-CE1 3.8Å; W180-Y183 HydrophobicContact CZ3-CE1 3.8Å; W180-Y183 PolarHBondContact O-N 3.06Å; W180-L184 HydrophobicContact CE3-CD1 4.38Å; W180-L184 HydrophobicContact CE3-CG 4.34Å; W180-L184 VanDerWaalsContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CG 3.37Å; W180-L184 PolarHBondContact O-N 3.36Å
181	R	96.3	Very high	96	Very high	75 Å²	75	63.8 Å²	63.8	28%	0.283	33%	0.328	S	S	.	.	H	α-helix	trans	-59.6	-46.6	175.6	-173.4	169.4	176.9	-115.1	-22.3	112.2	L154 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.02Å; L154-R181 HydrophobicContact CB-CG 3.82Å; L154-R181 HydrophobicContact CD1-CG 4.24Å; L154-R181 WeakPolarHBondContact O-CD 3.35Å; A177-R181 WeakPolarHBondContact O-CB 3.4Å; A177-R181 PolarHBondContact O-N 3.22Å; R181-Y183 VanDerWaalsContact C-N 3.32Å; R181-Y183 PolarHBondContact O-N 3.14Å; R181-L184 PolarHBondContact O-N 2.85Å; R181-E185 HydrophobicContact CG-CG 4.11Å; R181-E185 IonicContact CZ-OE1 3.15Å; R181-E185 IonicContact CZ-OE2 3.73Å; R181-E185 IonicContact NE-OE1 2.9Å; R181-E185 PolarHBondContact NE-OE1 3.39Å; R181-E185 IonicContact NE-OE2 2.66Å; R181-E185 IonicContact NH2-OE1 2.91Å; R181-E185 PolarHBondContact NH2-OE1 2.9Å; R181-E185 IonicContact NH2-OE2 2.66Å; R181-E185 PolarHBondContact NH2-OE2 2.9Å; R181-E185 VanDerWaalsContact NH2-OE2 3.16Å; R181-E185 VanDerWaalsContact O-CB 3.31Å; R181-E185 WeakPolarHBondContact O-CB 3.39Å; R181-E185 WeakPolarHBondContact O-CG 3.16Å; R181-E185 PolarHBondContact O-N 2.83Å
182	A	96.7	Very high	95.9	Very high	65 Å²	65	60.7 Å²	60.7	54%	0.537	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-38.3	177.2	0	0	0	0	0	112.8	E178 Q179 W180 G186	E178-A182 WeakPolarHBondContact O-CB 3.49Å; E178-A182 PolarHBondContact O-N 2.83Å; E178-A182 VanDerWaalsContact O-N 3.16Å; Q179-A182 PolarHBondContact O-N 3Å; W180-A182 PolarHBondContact O-N 3.05Å; A182-G186 PolarHBondContact O-N 2.83Å; A182-G186 VanDerWaalsContact O-N 3.15Å
183	Y	94.8	Very high	95.8	Very high	54 Å²	54	62.1 Å²	62.1	21%	0.212	32%	0.318	C	S	.	.	H	α-helix	trans	-68.1	-45	175.5	175.2	-110.4	0	0	0	112.7	Y123 Q179 W180 R181 T187 R188	Y123-Y183 HydrophobicContact CD2-CE1 4.26Å; Y123-Y183 HydrophobicContact CE2-CE1 4.04Å; Q179-Y183 PolarHBondContact O-N 3.01Å; W180-Y183 AromaticContact CE3-CD1 3.9Å; W180-Y183 HydrophobicContact CE3-CD1 3.9Å; W180-Y183 HydrophobicContact CH2-CD1 4.45Å; W180-Y183 AromaticContact CZ3-CD1 3.55Å; W180-Y183 HydrophobicContact CZ3-CD1 3.55Å; W180-Y183 AromaticContact CZ3-CE1 3.8Å; W180-Y183 HydrophobicContact CZ3-CE1 3.8Å; W180-Y183 PolarHBondContact O-N 3.06Å; R181-Y183 VanDerWaalsContact C-N 3.32Å; R181-Y183 PolarHBondContact O-N 3.14Å; Y183-T187 HydrophobicContact CD2-CG2 4.29Å; Y183-T187 HydrophobicContact CE2-CG2 4.06Å; Y183-T187 PolarHBondContact O-N 2.88Å; Y183-R188 HydrophobicContact CE1-CB 4.42Å; Y183-R188 HydrophobicContact CE1-CG 4.47Å; Y183-R188 WeakPolarHBondContact O-CB 3.48Å; Y183-R188 PolarHBondContact O-N 3.04Å; Y183-R188 WeakPolarHBondContact OH-CD 2.97Å; Y183-R188 PolarHBondContact OH-NH1 2.82Å
184	L	94.8	Very high	95.7	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-72.5	-39.8	-177.2	-69.8	171.3	0	0	0	112.8	G124 L150 L154 W180 R181 R188 V189	G124-L184 VanDerWaalsContact O-CD2 3.25Å; G124-L184 WeakPolarHBondContact O-CD2 3.41Å; L150-L184 HydrophobicContact CD2-CD1 4.2Å; L154-L184 HydrophobicContact CD2-CD1 4.17Å; W180-L184 HydrophobicContact CE3-CD1 4.38Å; W180-L184 HydrophobicContact CE3-CG 4.34Å; W180-L184 VanDerWaalsContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CB 3.31Å; W180-L184 WeakPolarHBondContact O-CG 3.37Å; W180-L184 PolarHBondContact O-N 3.36Å; R181-L184 PolarHBondContact O-N 2.85Å; L184-R188 HydrophobicContact CD2-CB 4.47Å; L184-R188 HydrophobicContact CD2-CG 4.35Å; L184-V189 WeakPolarHBondContact O-CG2 3.3Å
185	E	93.8	Very high	95.6	Very high	89 Å²	89	61.2 Å²	61.2	42%	0.416	29%	0.285	S	S	.	.	H	α-helix	trans	-75.9	-30.3	177.3	-69	-179.4	167.1	0	0	113	L133 L154 R181 V189	L133-E185 HydrophobicContact CD2-CB 4.48Å; L133-E185 HydrophobicContact CD2-CG 3.78Å; L154-E185 HydrophobicContact CD1-CG 4.42Å; R181-E185 HydrophobicContact CG-CG 4.11Å; R181-E185 IonicContact CZ-OE1 3.15Å; R181-E185 IonicContact CZ-OE2 3.73Å; R181-E185 IonicContact NE-OE1 2.9Å; R181-E185 PolarHBondContact NE-OE1 3.39Å; R181-E185 IonicContact NE-OE2 2.66Å; R181-E185 IonicContact NH2-OE1 2.91Å; R181-E185 PolarHBondContact NH2-OE1 2.9Å; R181-E185 IonicContact NH2-OE2 2.66Å; R181-E185 PolarHBondContact NH2-OE2 2.9Å; R181-E185 VanDerWaalsContact NH2-OE2 3.16Å; R181-E185 VanDerWaalsContact O-CB 3.31Å; R181-E185 WeakPolarHBondContact O-CB 3.39Å; R181-E185 WeakPolarHBondContact O-CG 3.16Å; R181-E185 PolarHBondContact O-N 2.83Å; E185-V189 WeakPolarHBondContact O-CG2 3.4Å
186	G	93.8	Very high	95.5	Very high	27 Å²	27	54.8 Å²	54.8	28%	0.278	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-98.4	-178.1	0	0	0	0	0	113.2	A182 R188 V189 E190	A182-G186 PolarHBondContact O-N 2.83Å; A182-G186 VanDerWaalsContact O-N 3.15Å; G186-R188 PolarHBondContact O-N 3.16Å; G186-V189 PolarHBondContact O-N 3.18Å; G186-V189 VanDerWaalsContact O-N 3.09Å; G186-E190 PolarHBondContact O-N 3.21Å
187	T	93.7	Very high	95.4	Very high	62 Å²	62	58.1 Å²	58.1	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-50.6	-35.4	-171.8	-60.1	0	0	0	0	113.5	Y183 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 4.29Å; Y183-T187 HydrophobicContact CE2-CG2 4.06Å; Y183-T187 PolarHBondContact O-N 2.88Å; T187-E190 PolarHBondContact O-N 3.15Å; T187-W191 PolarHBondContact O-N 3.31Å; T187-W191 VanDerWaalsContact O-N 3.14Å
188	R	93	Very high	95.3	Very high	3 Å²	3	60.1 Å²	60.1	1%	0.011	29%	0.287	C	S	.	.	H	α-helix	trans	-69.9	-41.3	-177.1	-160.3	74.7	-72.6	-167.5	-7.6	112.7	M29 Y31 C125 Y183 L184 G186 W191 L192	M29-R188 HydrophobicContact CE-CG 3.88Å; M29-R188 WeakPolarHBondContact CE-O 3.42Å; Y31-R188 VanDerWaalsContact CZ-NH1 3.35Å; Y31-R188 PolarHBondContact OH-NH1 3.41Å; C125-R188 HydrophobicContact CB-CG 4.35Å; C125-R188 WeakPolarHBondContact SG-CG 3.38Å; Y183-R188 HydrophobicContact CE1-CB 4.42Å; Y183-R188 HydrophobicContact CE1-CG 4.47Å; Y183-R188 WeakPolarHBondContact O-CB 3.48Å; Y183-R188 PolarHBondContact O-N 3.04Å; Y183-R188 WeakPolarHBondContact OH-CD 2.97Å; Y183-R188 PolarHBondContact OH-NH1 2.82Å; L184-R188 HydrophobicContact CD2-CB 4.47Å; L184-R188 HydrophobicContact CD2-CG 4.35Å; G186-R188 PolarHBondContact O-N 3.16Å; R188-W191 PolarHBondContact O-N 3.26Å; R188-L192 PolarHBondContact O-N 3.21Å; R188-L192 VanDerWaalsContact O-N 3.11Å
189	V	94.9	Very high	95.2	Very high	9 Å²	9	54.9 Å²	54.9	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-44.9	173.5	-178.3	0	0	0	0	110.9	L127 L133 L184 E185 G186 W191 L192 R193	L127-V189 HydrophobicContact CD1-CG1 4.16Å; L127-V189 HydrophobicContact CD2-CB 4.3Å; L127-V189 HydrophobicContact CD2-CG1 3.85Å; L127-V189 HydrophobicContact CD2-CG2 3.96Å; L133-V189 HydrophobicContact CB-CG2 4.21Å; L133-V189 HydrophobicContact CD1-CG2 4.44Å; L184-V189 WeakPolarHBondContact O-CG2 3.3Å; E185-V189 WeakPolarHBondContact O-CG2 3.4Å; G186-V189 PolarHBondContact O-N 3.18Å; G186-V189 VanDerWaalsContact O-N 3.09Å; V189-W191 PolarHBondContact O-N 3.22Å; V189-L192 PolarHBondContact O-N 2.85Å; V189-R193 HydrophobicContact CG1-CG 4.49Å; V189-R193 WeakPolarHBondContact O-CG 3.41Å; V189-R193 PolarHBondContact O-N 3.14Å
190	E	95.8	Very high	95.1	Very high	128 Å²	128	54 Å²	54	60%	0.598	26%	0.257	S	S	*	.	H	α-helix	trans	-58.3	-46.2	179.1	-65.9	173.5	159	0	0	112	G186 T187 R194	G186-E190 PolarHBondContact O-N 3.21Å; T187-E190 PolarHBondContact O-N 3.15Å; E190-R194 PolarHBondContact O-N 3.02Å
191	W	96.4	Very high	94.8	Very high	42 Å²	42	60.6 Å²	60.6	16%	0.159	29%	0.29	C	S	.	.	H	α-helix	trans	-66.8	-39.6	177.4	-82	104.8	0	0	0	113.2	M29 Y83 R86 T187 R188 V189 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.2Å; Y83-W191 AromaticContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CH2 3.59Å; Y83-W191 HydrophobicContact CD2-CZ2 4.35Å; Y83-W191 AromaticContact CD2-CZ3 3.82Å; Y83-W191 HydrophobicContact CD2-CZ3 3.82Å; Y83-W191 HydrophobicContact CE2-CE3 4.27Å; Y83-W191 AromaticContact CE2-CH2 3.87Å; Y83-W191 HydrophobicContact CE2-CH2 3.87Å; Y83-W191 AromaticContact CE2-CZ3 3.69Å; Y83-W191 HydrophobicContact CE2-CZ3 3.69Å; R86-W191 VanDerWaalsContact NH2-CZ2 3.26Å; T187-W191 PolarHBondContact O-N 3.31Å; T187-W191 VanDerWaalsContact O-N 3.14Å; R188-W191 PolarHBondContact O-N 3.26Å; V189-W191 PolarHBondContact O-N 3.22Å; W191-R194 PolarHBondContact O-N 2.88Å; W191-Y195 HydrophobicContact CB-CE2 4.22Å; W191-Y195 HydrophobicContact CE3-CD1 4.39Å; W191-Y195 AromaticContact CE3-CE1 3.53Å; W191-Y195 HydrophobicContact CE3-CE1 3.53Å; W191-Y195 HydrophobicContact CE3-CE2 4.35Å; W191-Y195 AromaticContact CE3-CZ 3.5Å; W191-Y195 AromaticContact CZ3-CE1 3.92Å; W191-Y195 HydrophobicContact CZ3-CE1 3.92Å; W191-Y195 VanDerWaalsContact O-CD2 3.29Å; W191-Y195 WeakPolarHBondContact O-CD2 3.44Å; W191-Y195 VanDerWaalsContact O-CG 3.23Å; W191-Y195 PolarHBondContact O-N 3.01Å
192	L	96.7	Very high	94.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-49.2	176.9	-174.6	35.5	0	0	0	110.7	M29 V52 L127 R188 V189 R194 Y195 L196	M29-L192 HydrophobicContact CB-CD1 4.05Å; M29-L192 HydrophobicContact CB-CD2 3.92Å; M29-L192 HydrophobicContact CB-CG 4.4Å; M29-L192 HydrophobicContact CE-CB 3.83Å; V52-L192 HydrophobicContact CG1-CD1 3.63Å; V52-L192 HydrophobicContact CG2-CD1 4.22Å; L127-L192 HydrophobicContact CD1-CB 3.94Å; L127-L192 HydrophobicContact CD1-CD2 3.72Å; L127-L192 HydrophobicContact CD1-CG 3.7Å; L127-L192 HydrophobicContact CG-CD2 3.65Å; L127-L192 HydrophobicContact CG-CG 4.23Å; R188-L192 PolarHBondContact O-N 3.21Å; R188-L192 VanDerWaalsContact O-N 3.11Å; V189-L192 PolarHBondContact O-N 2.85Å; L192-R194 VanDerWaalsContact C-N 3.29Å; L192-R194 PolarHBondContact O-N 2.93Å; L192-Y195 PolarHBondContact O-N 3.1Å; L192-Y195 VanDerWaalsContact O-N 3.1Å; L192-L196 HydrophobicContact CD1-CD1 3.76Å; L192-L196 HydrophobicContact CD1-CD2 4.39Å; L192-L196 HydrophobicContact CD1-CG 3.8Å; L192-L196 HydrophobicContact CG-CD1 3.89Å; L192-L196 HydrophobicContact CG-CG 4.42Å; L192-L196 WeakPolarHBondContact O-CG 3.35Å; L192-L196 PolarHBondContact O-N 3.2Å
193	R	95.1	Very high	94.3	Very high	126 Å²	126	56.6 Å²	56.6	48%	0.475	27%	0.267	S	S	.	.	H	α-helix	trans	-57.3	-42	176.5	-68.9	175.6	-179.1	179.2	0.3	112.2	L127 G131 V189 L196 E197	L127-R193 HydrophobicContact CD1-CG 4.14Å; G131-R193 VanDerWaalsContact O-CZ 3.31Å; G131-R193 PolarHBondContact O-NE 3.44Å; G131-R193 PolarHBondContact O-NH2 2.98Å; V189-R193 HydrophobicContact CG1-CG 4.49Å; V189-R193 WeakPolarHBondContact O-CG 3.41Å; V189-R193 PolarHBondContact O-N 3.14Å; R193-L196 PolarHBondContact O-N 2.77Å; R193-E197 PolarHBondContact O-N 2.69Å; R193-E197 VanDerWaalsContact O-N 3.07Å
194	R	95.8	Very high	94	Very high	119 Å²	119	58.3 Å²	58.3	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-61.6	-45.2	174.6	178	175.1	172.1	129.9	0.5	112.1	E79 E190 W191 L192 E197 N198	E79-R194 IonicContact OE1-CZ 3.52Å; E79-R194 IonicContact OE1-NE 2.66Å; E79-R194 PolarHBondContact OE1-NE 2.82Å; E79-R194 IonicContact OE1-NH2 3.9Å; E79-R194 PolarHBondContact OE1-NH2 2.75Å; E79-R194 IonicContact OE2-CZ 3.85Å; E79-R194 IonicContact OE2-NE 2.93Å; E79-R194 IonicContact OE2-NH2 2.74Å; E79-R194 PolarHBondContact OE2-NH2 2.84Å; E190-R194 PolarHBondContact O-N 3.02Å; W191-R194 PolarHBondContact O-N 2.88Å; L192-R194 VanDerWaalsContact C-N 3.29Å; L192-R194 PolarHBondContact O-N 2.93Å; R194-E197 PolarHBondContact O-N 2.89Å; R194-N198 VanDerWaalsContact O-CB 3.25Å; R194-N198 WeakPolarHBondContact O-CB 3.41Å; R194-N198 PolarHBondContact O-N 3.17Å; R194-N198 PolarHBondContact O-OD1 3.07Å
195	Y	96.2	Very high	93.8	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.7	-37.9	178.5	-62.2	-29.9	0	0	0	112.7	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.67Å; M29-Y195 HydrophobicContact SD-CE2 3.53Å; M29-Y195 VanDerWaalsContact SD-CE2 3.53Å; V52-Y195 HydrophobicContact CG2-CD2 3.92Å; V52-Y195 HydrophobicContact CG2-CG 4.48Å; F57-Y195 HydrophobicContact CD2-CE2 4.4Å; F57-Y195 HydrophobicContact CE2-CD2 4.18Å; F57-Y195 AromaticContact CE2-CE2 3.52Å; F57-Y195 HydrophobicContact CE2-CE2 3.52Å; F57-Y195 AromaticContact CE2-CZ 3.72Å; F57-Y195 HydrophobicContact CZ-CD2 4.19Å; F57-Y195 AromaticContact CZ-CE2 3.63Å; F57-Y195 HydrophobicContact CZ-CE2 3.63Å; W75-Y195 HydrophobicContact CE3-CD1 4.38Å; W75-Y195 HydrophobicContact CH2-CD2 4.49Å; W75-Y195 HydrophobicContact CH2-CG 4.14Å; W75-Y195 AromaticContact CZ3-CD1 3.68Å; W75-Y195 HydrophobicContact CZ3-CD1 3.68Å; W75-Y195 HydrophobicContact CZ3-CD2 4.29Å; W75-Y195 HydrophobicContact CZ3-CE1 4.42Å; W75-Y195 AromaticContact CZ3-CG 3.61Å; W75-Y195 HydrophobicContact CZ3-CG 3.61Å; V76-Y195 HydrophobicContact CG2-CE1 4.36Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.31Å; Y83-Y195 WeakPolarHBondContact CE2-OH 2.99Å; Y83-Y195 PolarHBondContact OH-OH 3.09Å; W191-Y195 HydrophobicContact CB-CE2 4.22Å; W191-Y195 HydrophobicContact CE3-CD1 4.39Å; W191-Y195 AromaticContact CE3-CE1 3.53Å; W191-Y195 HydrophobicContact CE3-CE1 3.53Å; W191-Y195 HydrophobicContact CE3-CE2 4.35Å; W191-Y195 AromaticContact CE3-CZ 3.5Å; W191-Y195 AromaticContact CZ3-CE1 3.92Å; W191-Y195 HydrophobicContact CZ3-CE1 3.92Å; W191-Y195 VanDerWaalsContact O-CD2 3.29Å; W191-Y195 WeakPolarHBondContact O-CD2 3.44Å; W191-Y195 VanDerWaalsContact O-CG 3.23Å; W191-Y195 PolarHBondContact O-N 3.01Å; L192-Y195 PolarHBondContact O-N 3.1Å; L192-Y195 VanDerWaalsContact O-N 3.1Å; Y195-E197 VanDerWaalsContact C-N 3.34Å; Y195-E197 PolarHBondContact O-N 3.23Å; Y195-N198 PolarHBondContact O-N 3.42Å; Y195-G199 WeakPolarHBondContact O-CA 3.42Å; Y195-G199 PolarHBondContact O-N 3.44Å; Y195-L203 WeakPolarHBondContact O-CD1 3.32Å
196	L	95.2	Very high	93.7	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-35	175.6	-71.5	167.1	0	0	0	112.7	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.65Å; H27-L196 HydrophobicContact CB-CD2 3.94Å; H27-L196 HydrophobicContact CB-CG 4.39Å; H27-L196 VanDerWaalsContact CG-CD2 3.49Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.37Å; V52-L196 HydrophobicContact CG1-CD2 4.09Å; L192-L196 HydrophobicContact CD1-CD1 3.76Å; L192-L196 HydrophobicContact CD1-CD2 4.39Å; L192-L196 HydrophobicContact CD1-CG 3.8Å; L192-L196 HydrophobicContact CG-CD1 3.89Å; L192-L196 HydrophobicContact CG-CG 4.42Å; L192-L196 WeakPolarHBondContact O-CG 3.35Å; L192-L196 PolarHBondContact O-N 3.2Å; R193-L196 PolarHBondContact O-N 2.77Å; L196-K200 WeakPolarHBondContact O-CA 3.23Å; L196-K200 WeakPolarHBondContact O-CB 3.41Å; L196-K200 PolarHBondContact O-N 3.26Å; L196-K200 VanDerWaalsContact O-N 3.12Å; L196-L203 HydrophobicContact CD2-CB 4.13Å; L196-L203 HydrophobicContact CD2-CD1 4.27Å; L196-Q204 PolarHBondContact O-NE2 3.04Å
197	E	94.9	Very high	93.7	Very high	123 Å²	123	61.4 Å²	61.4	58%	0.575	29%	0.288	S	S	*	.	H	α-helix	trans	-74.7	-47.6	173.4	-169.4	61.6	-158	0	0	111	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 2.69Å; R193-E197 VanDerWaalsContact O-N 3.07Å; R194-E197 PolarHBondContact O-N 2.89Å; Y195-E197 VanDerWaalsContact C-N 3.34Å; Y195-E197 PolarHBondContact O-N 3.23Å; E197-G199 VanDerWaalsContact C-N 3.28Å; E197-G199 PolarHBondContact O-N 2.79Å; E197-K200 WeakPolarHBondContact O-CB 3.49Å; E197-K200 PolarHBondContact O-N 2.84Å; E197-K200 IonicContact OE2-NZ 2.78Å
198	N	95.8	Very high	93.8	Very high	49 Å²	49	63.1 Å²	63.1	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-56.7	-39.3	176.9	-78.5	8.8	0	0	0	113.2	W75 Q78 E79 R194 Y195	W75-N198 WeakPolarHBondContact CB-O 3.46Å; Q78-N198 VanDerWaalsContact NE2-CB 3.35Å; E79-N198 PolarHBondContact OE1-ND2 3.29Å; R194-N198 VanDerWaalsContact O-CB 3.25Å; R194-N198 WeakPolarHBondContact O-CB 3.41Å; R194-N198 PolarHBondContact O-N 3.17Å; R194-N198 PolarHBondContact O-OD1 3.07Å; Y195-N198 PolarHBondContact O-N 3.42Å
199	G	94.8	Very high	94	Very high	3 Å²	3	63.3 Å²	63.3	3%	0.031	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	18.6	-175.5	0	0	0	0	0	113.8	W75 Y195 E197 E201 T202 L203	W75-G199 VanDerWaalsContact CB-CA 3.48Å; W75-G199 VanDerWaalsContact CG-CA 3.49Å; Y195-G199 WeakPolarHBondContact O-CA 3.42Å; Y195-G199 PolarHBondContact O-N 3.44Å; E197-G199 VanDerWaalsContact C-N 3.28Å; E197-G199 PolarHBondContact O-N 2.79Å; G199-E201 VanDerWaalsContact C-N 3.29Å; G199-E201 PolarHBondContact O-N 3.21Å; G199-E201 VanDerWaalsContact O-N 3.15Å; G199-T202 PolarHBondContact O-N 2.88Å; G199-T202 PolarHBondContact O-OG1 3.41Å; G199-L203 WeakPolarHBondContact O-CB 3.5Å; G199-L203 PolarHBondContact O-N 2.95Å
200	K	92.9	Very high	94.2	Very high	100 Å²	100	69.9 Å²	69.9	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-48.2	-46.1	-171.5	-175.6	167.7	-167.6	165.5	0	114.4	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.23Å; L196-K200 WeakPolarHBondContact O-CB 3.41Å; L196-K200 PolarHBondContact O-N 3.26Å; L196-K200 VanDerWaalsContact O-N 3.12Å; E197-K200 WeakPolarHBondContact O-CB 3.49Å; E197-K200 PolarHBondContact O-N 2.84Å; E197-K200 IonicContact OE2-NZ 2.78Å; K200-T202 PolarHBondContact O-N 2.86Å; K200-Q204 HydrophobicContact CG-CB 4.44Å; K200-Q204 HydrophobicContact CG-CG 4.46Å; K200-Q204 WeakPolarHBondContact O-CB 3.47Å; K200-Q204 PolarHBondContact O-N 3.18Å
201	E	90.6	Very high	94.3	Very high	183 Å²	183	65.5 Å²	65.5	86%	0.855	30%	0.303	S	S	*	.	H	α-helix	trans	-64	-20.7	179.8	-60.4	-175.6	162.5	0	0	114.1	G199 R205	G199-E201 VanDerWaalsContact C-N 3.29Å; G199-E201 PolarHBondContact O-N 3.21Å; G199-E201 VanDerWaalsContact O-N 3.15Å; E201-R205 WeakPolarHBondContact O-CD 3.31Å
202	T	89.8	Confident	94.3	Very high	51 Å²	51	67.2 Å²	67.2	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-113.1	-27.4	-177	22.7	0	0	0	0	114.4	G199 K200 R205	G199-T202 PolarHBondContact O-N 2.88Å; G199-T202 PolarHBondContact O-OG1 3.41Å; K200-T202 PolarHBondContact O-N 2.86Å; T202-R205 WeakPolarHBondContact O-CG 3.37Å; T202-R205 PolarHBondContact O-NE 2.84Å; T202-R205 VanDerWaalsContact O-NE 3.14Å
203	L	91.1	Very high	94.4	Very high	5 Å²	5	68.3 Å²	68.3	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-97.6	-33.2	-177.7	-62.1	173.5	0	0	0	113	V52 T55 W75 Y195 L196 G199 R205	V52-L203 HydrophobicContact CB-CD1 4.31Å; V52-L203 HydrophobicContact CB-CD2 4.2Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.11Å; T55-L203 HydrophobicContact CG2-CD2 4.02Å; W75-L203 HydrophobicContact CD2-CD1 4.4Å; W75-L203 HydrophobicContact CH2-CD1 4.33Å; W75-L203 HydrophobicContact CZ2-CD1 3.78Å; W75-L203 HydrophobicContact CZ2-CD2 4.04Å; W75-L203 HydrophobicContact CZ2-CG 4.32Å; Y195-L203 WeakPolarHBondContact O-CD1 3.32Å; L196-L203 HydrophobicContact CD2-CB 4.13Å; L196-L203 HydrophobicContact CD2-CD1 4.27Å; G199-L203 WeakPolarHBondContact O-CB 3.5Å; G199-L203 PolarHBondContact O-N 2.95Å; L203-R205 VanDerWaalsContact C-N 3.34Å
204	Q	89.3	Confident	94.5	Very high	91 Å²	91	63.9 Å²	63.9	43%	0.425	31%	0.306	S	S	.	.	S	Bend	trans	-99.8	26	178.6	-56.9	176.6	31.6	0	0	111.9	L196 K200	L196-Q204 PolarHBondContact O-NE2 3.04Å; K200-Q204 HydrophobicContact CG-CB 4.44Å; K200-Q204 HydrophobicContact CG-CG 4.46Å; K200-Q204 WeakPolarHBondContact O-CB 3.47Å; K200-Q204 PolarHBondContact O-N 3.18Å
205	R	89.7	Confident	94.5	Very high	82 Å²	82	60.8 Å²	60.8	31%	0.309	30%	0.296	S	S	.	.			trans	-103	146.5	171.5	70.5	-176.9	175.2	146.6	18.5	109.1	E201 T202 L203 E207 Y233	E201-R205 WeakPolarHBondContact O-CD 3.31Å; T202-R205 WeakPolarHBondContact O-CG 3.37Å; T202-R205 PolarHBondContact O-NE 2.84Å; T202-R205 VanDerWaalsContact O-NE 3.14Å; L203-R205 VanDerWaalsContact C-N 3.34Å; R205-E207 IonicContact CZ-OE1 2.65Å; R205-E207 IonicContact NE-OE1 3.31Å; R205-E207 IonicContact NH1-OE1 2.97Å; R205-E207 PolarHBondContact NH1-OE1 2.65Å; R205-E207 IonicContact NH2-OE1 3.7Å; R205-E207 PolarHBondContact NH2-OE1 3.41Å; R205-Y233 HydrophobicContact CG-CD1 4.36Å; R205-Y233 WeakPolarHBondContact O-CD1 3.33Å
206	A	92.3	Very high	94.4	Very high	40 Å²	40	64.6 Å²	64.6	33%	0.331	31%	0.314	S	S	.	.			trans	-115.5	127.1	162.7	0	0	0	0	0	108.9	Y233	A206-Y233 CarbonylContact C-O 3.56Å; A206-Y233 VanDerWaalsContact CA-O 3.29Å; A206-Y233 WeakPolarHBondContact CA-O 3.19Å
207	E	94.3	Very high	94.4	Very high	58 Å²	58	68.8 Å²	68.8	27%	0.271	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-99.9	120.2	172.3	-69.7	-167.9	-148.7	0	0	108.9	R205 F232 Y233 H287	R205-E207 IonicContact CZ-OE1 2.65Å; R205-E207 IonicContact NE-OE1 3.31Å; R205-E207 IonicContact NH1-OE1 2.97Å; R205-E207 PolarHBondContact NH1-OE1 2.65Å; R205-E207 IonicContact NH2-OE1 3.7Å; R205-E207 PolarHBondContact NH2-OE1 3.41Å; E207-F232 WeakPolarHBondContact O-CA 3.18Å; E207-F232 VanDerWaalsContact O-CB 3.3Å; E207-F232 WeakPolarHBondContact O-CB 3.32Å; E207-Y233 PolarHBondContact N-O 3.34Å; E207-Y233 PolarHBondContact O-N 2.99Å; E207-Y233 VanDerWaalsContact O-N 3.12Å; E207-H287 PolarHBondContact O-CE1 3.14Å
208	H	95.6	Very high	94.2	Very high	99 Å²	99	67.4 Å²	67.4	46%	0.458	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-67.7	142.5	-178.4	-50	-101.6	0	0	0	112.1	K210 G289 L290	H208-K210 PolarHBondContact O-N 3.35Å; H208-G289 VanDerWaalsContact CE1-C 3.5Å; H208-G289 PolarHBondContact CE1-O 3.24Å; H208-G289 PolarHBondContact ND1-O 2.98Å; H208-L290 HydrophobicContact CB-CD2 4.13Å
209	P	97.8	Very high	94	Very high	7 Å²	7	67.6 Å²	67.6	5%	0.045	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-66.4	128.4	175.7	27.9	-35.3	0	0	0	112.1	T211 A229 F232 I237 V285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.99Å; P209-T211 HydrophobicContact CG-CG2 4.18Å; P209-T211 PolarHBondContact O-N 2.8Å; P209-A229 HydrophobicContact CB-CB 3.82Å; P209-F232 HydrophobicContact CB-CB 3.94Å; P209-F232 HydrophobicContact CB-CD1 3.93Å; P209-F232 HydrophobicContact CB-CG 4.2Å; P209-I237 HydrophobicContact CB-CD1 4Å; P209-I237 HydrophobicContact CG-CD1 4.13Å; P209-V285 HydrophobicContact CG-CG1 3.94Å; P209-H287 HydrophobicContact CG-CB 4.04Å; P209-L290 HydrophobicContact CG-CD1 3.94Å; P209-L290 HydrophobicContact CG-CD2 4.34Å; P209-L290 HydrophobicContact CG-CG 4.22Å
210	K	98	Very high	93.7	Very high	147 Å²	147	74.7 Å²	74.7	64%	0.639	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	101.9	165.5	-65.6	163.8	-172.7	155.9	0	107.9	H208 L230	H208-K210 PolarHBondContact O-N 3.35Å; K210-L230 WeakPolarHBondContact CB-O 3.49Å; K210-L230 PolarHBondContact N-O 3.08Å; K210-L230 PolarHBondContact O-N 3.18Å; K210-L230 VanDerWaalsContact O-N 3.14Å
211	T	98	Very high	93.7	Very high	35 Å²	35	76.7 Å²	76.7	22%	0.215	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.6	-172.8	51	0	0	0	0	113.2	P209 W228 A229 V285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.99Å; P209-T211 HydrophobicContact CG-CG2 4.18Å; P209-T211 PolarHBondContact O-N 2.8Å; T211-W228 WeakPolarHBondContact CA-O 3.48Å; T211-A229 HydrophobicContact CG2-CB 4.37Å; T211-V285 HydrophobicContact CG2-CB 4.29Å; T211-V285 HydrophobicContact CG2-CG1 4.03Å; T211-V285 HydrophobicContact CG2-CG2 3.95Å; T211-L294 HydrophobicContact CG2-CD1 4.24Å; T211-L296 HydrophobicContact CG2-CD1 4.27Å
212	H	97.3	Very high	93.9	Very high	79 Å²	79	72.5 Å²	72.5	37%	0.366	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	157.2	170.3	64.2	-72	0	0	0	111.1	W228	H212-W228 VanDerWaalsContact CE1-CB 3.47Å; H212-W228 WeakPolarHBondContact CE1-CB 3.47Å; H212-W228 AromaticContact CE1-CD1 3.85Å; H212-W228 AromaticContact CE1-CG 3.69Å; H212-W228 PolarHBondContact N-O 3.49Å; H212-W228 AromaticContact NE2-CD1 3.55Å; H212-W228 AromaticContact NE2-CG 3.85Å; H212-W228 PolarHBondContact O-N 2.88Å
213	V	98.2	Very high	94.2	Very high	22 Å²	22	70.1 Å²	70.1	13%	0.133	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	130.2	175.8	179.6	0	0	0	0	109.8	L225 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.41Å; V213-L225 HydrophobicContact CG1-CD2 4.43Å; V213-C227 HydrophobicContact CG2-CB 4.33Å; V213-W241 HydrophobicContact CG1-CH2 3.85Å; V213-W241 HydrophobicContact CG1-CZ2 4.32Å; V213-W241 HydrophobicContact CG2-CH2 4.22Å; V213-L296 HydrophobicContact CG2-CB 3.8Å; V213-W298 HydrophobicContact CB-CB 4.49Å; V213-W298 HydrophobicContact CG1-CB 3.79Å
214	T	96.8	Very high	94.5	Very high	33 Å²	33	71 Å²	71	20%	0.202	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.8	177.8	52.7	0	0	0	0	110.3	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3Å; T214-L225 WeakPolarHBondContact O-CA 3.33Å; T214-R226 PolarHBondContact N-O 2.91Å; T214-R226 PolarHBondContact O-N 3.17Å; T214-R226 PolarHBondContact OG1-O 3.31Å; T214-W228 PolarHBondContact OG1-NE1 2.85Å; T214-W228 VanDerWaalsContact OG1-NE1 3.11Å
215	H	96.1	Very high	94.9	Very high	54 Å²	54	66.6 Å²	66.6	25%	0.25	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.4	-177.6	167.4	-87.5	0	0	0	110.2	A223 L225 W298	H215-A223 VanDerWaalsContact NE2-CB 3.26Å; H215-A223 WeakPolarHBondContact NE2-CB 3.25Å; H215-L225 HydrophobicContact CB-CD2 3.95Å; H215-W298 HydrophobicContact CB-CD2 4.01Å; H215-W298 HydrophobicContact CB-CG 4.06Å; H215-W298 HydrophobicContact CB-CZ2 4.02Å; H215-W298 VanDerWaalsContact CB-NE1 3.31Å; H215-W298 AromaticContact CG-CE2 3.77Å; H215-W298 AromaticContact CG-CZ2 3.8Å; H215-W298 AromaticContact ND1-CZ2 3.99Å
216	H	94.6	Very high	95.3	Very high	81 Å²	81	65 Å²	65	38%	0.375	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	106.8	-178.2	-57.4	75.2	0	0	0	109	T214 V218 A223 T224 R226	T214-H216 PolarHBondContact OG1-CE1 3Å; H216-V218 PolarHBondContact O-N 2.76Å; H216-A223 CarbonylContact O-C 3.49Å; H216-A223 WeakPolarHBondContact O-CA 3.5Å; H216-T224 PolarHBondContact N-O 3.44Å; H216-T224 PolarHBondContact O-N 3.22Å; H216-R226 PolarHBondContact CE1-NH1 2.97Å
217	P	93.8	Very high	95.6	Very high	102 Å²	102	63 Å²	63	66%	0.662	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.1	132.9	172.4	-20.6	31.1	0	0	0	110.7
218	V	90.9	Very high	95.8	Very high	94 Å²	94	62.7 Å²	62.7	57%	0.57	32%	0.32	S	S	*	.			trans	-107	-39.8	175.6	-179.9	0	0	0	0	110.2	H216 E222 T224	H216-V218 PolarHBondContact O-N 2.76Å; V218-E222 PolarHBondContact N-O 3.07Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.31Å
219	S	91.6	Very high	96	Very high	53 Å²	53	58 Å²	58	37%	0.371	30%	0.298	S	S	.	.	S	Bend	trans	-148.7	-178.3	174.7	71.3	0	0	0	0	110.6	H221 E222	S219-H221 PolarHBondContact O-N 3.18Å; S219-H221 VanDerWaalsContact O-N 3.14Å; S219-H221 PolarHBondContact OG-N 3.02Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; S219-E222 PolarHBondContact N-O 2.89Å; S219-E222 PolarHBondContact OG-N 2.88Å; S219-E222 VanDerWaalsContact OG-N 3.14Å
220	D	89.1	Confident	96	Very high	152 Å²	152	60.3 Å²	60.3	81%	0.813	31%	0.31	S	S	*	.	S	Bend	trans	-67.7	-3.2	171.4	-63	-28.1	0	0	0	113.5
221	H	92.8	Very high	96	Very high	142 Å²	142	54 Å²	54	66%	0.657	29%	0.286	S	S	*	.	S	Bend	trans	-124.3	-16.2	-175.6	-56.1	-28.6	0	0	0	113.4	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.18Å; S219-H221 VanDerWaalsContact O-N 3.14Å; S219-H221 PolarHBondContact OG-N 3.02Å; S219-H221 VanDerWaalsContact OG-N 3.15Å; H221-P274 CarbonylContact O-C 3.6Å; H221-P274 WeakPolarHBondContact O-CA 3.4Å; H221-S275 PolarHBondContact O-N 2.97Å; H221-S275 PolarHBondContact O-OG 2.72Å
222	E	95.1	Very high	95.9	Very high	95 Å²	95	52.3 Å²	52.3	44%	0.444	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	142.7	-171.8	-66.5	-179.8	163.3	0	0	112.2	V218 S219 V272 V273 S275	V218-E222 PolarHBondContact N-O 3.07Å; S219-E222 PolarHBondContact N-O 2.89Å; S219-E222 PolarHBondContact OG-N 2.88Å; S219-E222 VanDerWaalsContact OG-N 3.14Å; E222-V272 HydrophobicContact CB-CG1 4.09Å; E222-V272 HydrophobicContact CG-CG1 4.31Å; E222-V273 WeakPolarHBondContact CA-O 3.45Å; E222-S275 PolarHBondContact N-OG 2.8Å
223	A	95.8	Very high	95.8	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	154.9	170.7	0	0	0	0	0	110.9	H215 H216 V273	H215-A223 VanDerWaalsContact NE2-CB 3.26Å; H215-A223 WeakPolarHBondContact NE2-CB 3.25Å; H216-A223 CarbonylContact O-C 3.49Å; H216-A223 WeakPolarHBondContact O-CA 3.5Å; A223-V273 HydrophobicContact CB-CG2 4.49Å; A223-V273 PolarHBondContact N-O 2.87Å; A223-V273 PolarHBondContact O-N 2.88Å
224	T	97.5	Very high	95.7	Very high	23 Å²	23	48.5 Å²	48.5	14%	0.141	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119.5	169.3	-51.2	0	0	0	0	109.8	H216 V218 A270 V271	H216-T224 PolarHBondContact N-O 3.44Å; H216-T224 PolarHBondContact O-N 3.22Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.31Å; T224-A270 HydrophobicContact CG2-CB 3.87Å; T224-V271 WeakPolarHBondContact CA-O 3.38Å
225	L	98.1	Very high	95.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	123.6	164	-63.1	-174.6	0	0	0	108.8	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.41Å; V213-L225 HydrophobicContact CG1-CD2 4.43Å; T214-L225 WeakPolarHBondContact O-CA 3.33Å; H215-L225 HydrophobicContact CB-CD2 3.95Å; L225-W241 HydrophobicContact CB-CH2 3.67Å; L225-W241 HydrophobicContact CB-CZ2 3.73Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 3.99Å; L225-W241 HydrophobicContact CD1-CZ3 4.17Å; L225-W241 HydrophobicContact CG-CH2 4.48Å; L225-A270 CarbonylContact O-C 3.57Å; L225-A270 WeakPolarHBondContact O-CA 3.37Å; L225-V271 HydrophobicContact CB-CG1 4.27Å; L225-V271 PolarHBondContact N-O 3.45Å; L225-V271 PolarHBondContact O-N 2.87Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.14Å; L225-V273 HydrophobicContact CG-CG1 4.1Å; L225-V273 HydrophobicContact CG-CG2 3.89Å; L225-E278 HydrophobicContact CD1-CB 4.12Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.34Å; L225-W298 HydrophobicContact CD1-CB 4.43Å; L225-W298 HydrophobicContact CD2-CB 3.83Å; L225-W298 HydrophobicContact CD2-CD2 4.43Å; L225-W298 HydrophobicContact CD2-CG 4.01Å
226	R	98.3	Very high	95.6	Very high	47 Å²	47	51.9 Å²	51.9	18%	0.177	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.5	174.8	-179.3	-178.8	-64.3	108	4.4	110.2	T214 H216 W228 W268 A269 A270	T214-R226 PolarHBondContact N-O 2.91Å; T214-R226 PolarHBondContact O-N 3.17Å; T214-R226 PolarHBondContact OG1-O 3.31Å; H216-R226 PolarHBondContact CE1-NH1 2.97Å; R226-W228 VanDerWaalsContact CD-CE2 3.48Å; R226-W228 VanDerWaalsContact CD-CZ2 3.44Å; R226-W228 HydrophobicContact CG-CZ2 4.45Å; R226-W268 HydrophobicContact CG-CB 3.99Å; R226-W268 HydrophobicContact CG-CD2 4.04Å; R226-W268 HydrophobicContact CG-CE3 3.8Å; R226-W268 HydrophobicContact CG-CG 4.18Å; R226-A269 WeakPolarHBondContact CA-O 3.44Å; R226-A270 HydrophobicContact CB-CB 3.95Å; R226-A270 HydrophobicContact CG-CB 4.09Å
227	C	98.4	Very high	95.7	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.7	173.9	-174.4	0	0	0	0	109.3	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.33Å; C227-W241 HydrophobicContact CB-CH2 4.42Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; C227-W268 CarbonylContact O-C 3.39Å; C227-W268 WeakPolarHBondContact O-CA 3.49Å; C227-W268 WeakPolarHBondContact O-CB 3.5Å; C227-A269 PolarHBondContact N-O 2.85Å; C227-A269 PolarHBondContact O-N 2.97Å; C227-C283 HydrophobicContact CB-CB 3.51Å; C227-C283 WeakPolarHBondContact CB-SG 3.44Å; C227-C283 WeakPolarHBondContact SG-CB 3.25Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 3.19Å
228	W	98.4	Very high	95.8	Very high	50 Å²	50	46.3 Å²	46.3	19%	0.189	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	143.7	179.4	-68.1	89.3	0	0	0	110.8	T211 H212 T214 R226 L230 W268	T211-W228 WeakPolarHBondContact CA-O 3.48Å; H212-W228 VanDerWaalsContact CE1-CB 3.47Å; H212-W228 WeakPolarHBondContact CE1-CB 3.47Å; H212-W228 AromaticContact CE1-CD1 3.85Å; H212-W228 AromaticContact CE1-CG 3.69Å; H212-W228 PolarHBondContact N-O 3.49Å; H212-W228 AromaticContact NE2-CD1 3.55Å; H212-W228 AromaticContact NE2-CG 3.85Å; H212-W228 PolarHBondContact O-N 2.88Å; T214-W228 PolarHBondContact OG1-NE1 2.85Å; T214-W228 VanDerWaalsContact OG1-NE1 3.11Å; R226-W228 VanDerWaalsContact CD-CE2 3.48Å; R226-W228 VanDerWaalsContact CD-CZ2 3.44Å; R226-W228 HydrophobicContact CG-CZ2 4.45Å; W228-L230 HydrophobicContact CB-CG 4.48Å; W228-L230 HydrophobicContact CE3-CD2 3.92Å; W228-L230 HydrophobicContact CZ3-CD2 4.47Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.43Å; W228-W268 HydrophobicContact CE3-CB 3.87Å; W228-W268 AromaticContact CE3-CD1 3.75Å; W228-W268 HydrophobicContact CE3-CG 4.1Å; W228-W268 HydrophobicContact CG-CB 4.37Å; W228-W268 AromaticContact CH2-CD1 3.71Å; W228-W268 HydrophobicContact CH2-CG 4.34Å; W228-W268 HydrophobicContact CZ3-CB 4.34Å; W228-W268 AromaticContact CZ3-CD1 3.34Å; W228-W268 HydrophobicContact CZ3-CG 4.07Å
229	A	98.5	Very high	96.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.4	160.1	0	0	0	0	0	107.9	P209 T211 F232 I237 L239 Q266 K267	P209-A229 HydrophobicContact CB-CB 3.82Å; T211-A229 HydrophobicContact CG2-CB 4.37Å; A229-F232 HydrophobicContact CB-CD1 4.03Å; A229-F232 HydrophobicContact CB-CE1 3.76Å; A229-F232 WeakPolarHBondContact O-CE1 3.3Å; A229-I237 HydrophobicContact CB-CD1 3.71Å; A229-L239 HydrophobicContact CB-CD1 4.01Å; A229-L239 HydrophobicContact CB-CD2 4.23Å; A229-Q266 WeakPolarHBondContact O-CA 3.5Å; A229-K267 PolarHBondContact N-O 3.44Å; A229-K267 PolarHBondContact O-N 3.19Å; A229-K267 VanDerWaalsContact O-O 3.04Å
230	L	98.3	Very high	96.4	Very high	56 Å²	56	41.5 Å²	41.5	29%	0.293	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	144	-175.1	-59.8	176.8	0	0	0	111	K210 W228 Q266	K210-L230 WeakPolarHBondContact CB-O 3.49Å; K210-L230 PolarHBondContact N-O 3.08Å; K210-L230 PolarHBondContact O-N 3.18Å; K210-L230 VanDerWaalsContact O-N 3.14Å; W228-L230 HydrophobicContact CB-CG 4.48Å; W228-L230 HydrophobicContact CE3-CD2 3.92Å; W228-L230 HydrophobicContact CZ3-CD2 4.47Å; L230-Q266 HydrophobicContact CD2-CB 3.59Å
231	G	97.4	Very high	96.9	Very high	14 Å²	14	34.3 Å²	34.3	14%	0.144	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	69.6	41.1	169.4	0	0	0	0	0	113.5	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.19Å; G231-F265 PolarHBondContact N-O 2.99Å
232	F	97.2	Very high	97.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	157.4	178.4	59.1	-90.9	0	0	0	112.8	E207 P209 A229 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.18Å; E207-F232 VanDerWaalsContact O-CB 3.3Å; E207-F232 WeakPolarHBondContact O-CB 3.32Å; P209-F232 HydrophobicContact CB-CB 3.94Å; P209-F232 HydrophobicContact CB-CD1 3.93Å; P209-F232 HydrophobicContact CB-CG 4.2Å; A229-F232 HydrophobicContact CB-CD1 4.03Å; A229-F232 HydrophobicContact CB-CE1 3.76Å; A229-F232 WeakPolarHBondContact O-CE1 3.3Å; F232-P234 WeakPolarHBondContact CD2-O 3.17Å; F232-I237 HydrophobicContact CD1-CD1 3.89Å; F232-I237 HydrophobicContact CD2-CB 4.32Å; F232-I237 HydrophobicContact CD2-CD1 3.95Å; F232-I237 HydrophobicContact CE1-CD1 3.79Å; F232-I237 HydrophobicContact CE1-CG2 4.46Å; F232-I237 HydrophobicContact CE2-CB 3.79Å; F232-I237 HydrophobicContact CE2-CD1 3.88Å; F232-I237 HydrophobicContact CE2-CG1 4.43Å; F232-I237 HydrophobicContact CE2-CG2 3.56Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.18Å; F232-I237 HydrophobicContact CZ-CD1 3.82Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; F232-T257 HydrophobicContact CE2-CG2 4.03Å; F232-T257 HydrophobicContact CZ-CG2 3.89Å; F232-T264 CarbonylContact O-C 3.57Å; F232-T264 WeakPolarHBondContact O-CA 3.42Å; F232-F265 WeakPolarHBondContact CD1-O 3.41Å; F232-F265 HydrophobicContact CD2-CB 3.89Å; F232-F265 HydrophobicContact CE1-CB 4.32Å; F232-F265 WeakPolarHBondContact CE1-O 3.34Å; F232-F265 HydrophobicContact CE2-CB 3.46Å; F232-F265 VanDerWaalsContact CE2-CB 3.46Å; F232-F265 HydrophobicContact CG-CB 4.47Å; F232-F265 HydrophobicContact CZ-CB 3.68Å; F232-F265 PolarHBondContact N-O 3.16Å; F232-F265 PolarHBondContact O-N 2.88Å; F232-K267 HydrophobicContact CE1-CB 4.4Å; F232-K267 HydrophobicContact CZ-CB 4.1Å; F232-H287 AromaticContact CD2-CD2 3.85Å; F232-H287 AromaticContact CD2-NE2 3.74Å
233	Y	95.4	Very high	97.2	Very high	3 Å²	3	28.5 Å²	28.5	1%	0.012	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-153.5	136.3	174.3	178.8	-83.2	0	0	0	108.7	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.01Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.3Å; T55-Y233 PolarHBondContact OG1-OH 3.01Å; R205-Y233 HydrophobicContact CG-CD1 4.36Å; R205-Y233 WeakPolarHBondContact O-CD1 3.33Å; A206-Y233 CarbonylContact C-O 3.56Å; A206-Y233 VanDerWaalsContact CA-O 3.29Å; A206-Y233 WeakPolarHBondContact CA-O 3.19Å; E207-Y233 PolarHBondContact N-O 3.34Å; E207-Y233 PolarHBondContact O-N 2.99Å; E207-Y233 VanDerWaalsContact O-N 3.12Å; Y233-G263 WeakPolarHBondContact CD2-O 3.45Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 HydrophobicContact CD2-CE2 4.05Å; Y233-F265 HydrophobicContact CE2-CE2 4.49Å; Y233-H287 PolarHBondContact O-CE1 3.44Å
234	P	94.8	Very high	97.2	Very high	18 Å²	18	33.3 Å²	33.3	12%	0.117	17%	0.169	C	C	.	.	S	Bend	cis	-70.3	179.5	1.2	30.5	-36.9	0	0	0	113.2	D54 F232 E236 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.31Å; D54-P234 WeakPolarHBondContact OD2-CB 3.02Å; F232-P234 WeakPolarHBondContact CD2-O 3.17Å; P234-E236 VanDerWaalsContact C-N 3.34Å; P234-H287 PolarHBondContact O-NE2 3.46Å; P234-E288 WeakPolarHBondContact CG-OE2 3.5Å
235	A	96.1	Very high	96.9	Very high	14 Å²	14	34.4 Å²	34.4	12%	0.116	19%	0.186	C	C	.	.	S	Bend	trans	-72.3	-22.9	-176.1	0	0	0	0	0	114.1	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.39Å; D54-A235 VanDerWaalsContact CG-CB 3.48Å; D54-A235 VanDerWaalsContact OD2-CB 3.32Å; D54-A235 WeakPolarHBondContact OD2-CB 3.31Å; D54-A235 PolarHBondContact OD2-N 2.94Å; A235-I237 PolarHBondContact O-N 3.09Å; A235-T257 HydrophobicContact CB-CG2 4.3Å; A235-T257 WeakPolarHBondContact O-CG2 3.43Å; A235-F265 HydrophobicContact CB-CD1 3.75Å; A235-F265 HydrophobicContact CB-CD2 3.7Å; A235-F265 HydrophobicContact CB-CE1 3.78Å; A235-F265 HydrophobicContact CB-CE2 3.74Å; A235-F265 HydrophobicContact CB-CG 3.73Å; A235-F265 HydrophobicContact CB-CZ 3.79Å
236	E	95.3	Very high	96.8	Very high	144 Å²	144	40.7 Å²	40.7	67%	0.673	22%	0.215	S	C	*	.			trans	-66.7	117.5	179.8	-171.9	52.6	-133.3	0	0	110.3	P234 H287	P234-E236 VanDerWaalsContact C-N 3.34Å; E236-H287 PolarHBondContact O-CD2 3.34Å; E236-H287 VanDerWaalsContact O-CD2 3.24Å
237	I	96.3	Very high	96.7	Very high	8 Å²	8	43 Å²	43	4%	0.041	23%	0.23	C	C	.	.			trans	-154.7	136.2	-176	-164.4	170.7	0	0	0	110.2	P209 A229 F232 A235 L239 K267 V285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4Å; P209-I237 HydrophobicContact CG-CD1 4.13Å; A229-I237 HydrophobicContact CB-CD1 3.71Å; F232-I237 HydrophobicContact CD1-CD1 3.89Å; F232-I237 HydrophobicContact CD2-CB 4.32Å; F232-I237 HydrophobicContact CD2-CD1 3.95Å; F232-I237 HydrophobicContact CE1-CD1 3.79Å; F232-I237 HydrophobicContact CE1-CG2 4.46Å; F232-I237 HydrophobicContact CE2-CB 3.79Å; F232-I237 HydrophobicContact CE2-CD1 3.88Å; F232-I237 HydrophobicContact CE2-CG1 4.43Å; F232-I237 HydrophobicContact CE2-CG2 3.56Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.18Å; F232-I237 HydrophobicContact CZ-CD1 3.82Å; F232-I237 HydrophobicContact CZ-CG2 3.54Å; A235-I237 PolarHBondContact O-N 3.09Å; I237-L239 HydrophobicContact CD1-CD1 3.72Å; I237-L239 HydrophobicContact CG1-CD1 3.68Å; I237-L239 HydrophobicContact CG2-CD1 4.22Å; I237-K267 HydrophobicContact CG2-CB 4.23Å; I237-K267 HydrophobicContact CG2-CD 3.54Å; I237-V285 HydrophobicContact CD1-CG1 4.06Å; I237-V285 HydrophobicContact CG1-CG1 4.38Å; I237-Q286 WeakPolarHBondContact CG1-O 3.32Å; I237-H287 HydrophobicContact CD1-CB 4.17Å; I237-H287 HydrophobicContact CG1-CB 4Å
238	T	97.3	Very high	96.5	Very high	59 Å²	59	44 Å²	44	36%	0.362	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.1	174.2	-67.9	0	0	0	0	110.3	T240 V285 Q286	T238-T240 HydrophobicContact CG2-CG2 3.99Å; T238-V285 WeakPolarHBondContact O-CA 3.39Å; T238-Q286 PolarHBondContact N-O 2.69Å; T238-Q286 PolarHBondContact O-N 2.92Å
239	L	97.8	Very high	96	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.037	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.8	171.6	-89.3	62.3	0	0	0	108	A229 I237 L254 K267 A269 H284 V285	A229-L239 HydrophobicContact CB-CD1 4.01Å; A229-L239 HydrophobicContact CB-CD2 4.23Å; I237-L239 HydrophobicContact CD1-CD1 3.72Å; I237-L239 HydrophobicContact CG1-CD1 3.68Å; I237-L239 HydrophobicContact CG2-CD1 4.22Å; L239-L254 HydrophobicContact CB-CD1 4.14Å; L239-K267 HydrophobicContact CD1-CD 4.33Å; L239-K267 HydrophobicContact CD2-CB 4.36Å; L239-K267 HydrophobicContact CD2-CG 4.42Å; L239-A269 HydrophobicContact CB-CB 4.05Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; L239-H284 WeakPolarHBondContact CA-O 3.47Å; L239-V285 HydrophobicContact CD1-CG1 4.01Å; L239-V285 HydrophobicContact CD1-CG2 4.41Å; L239-V285 HydrophobicContact CG-CG2 4.25Å
240	T	97.6	Very high	95.5	Very high	39 Å²	39	55.7 Å²	55.7	24%	0.239	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147.3	174.4	59.1	0	0	0	0	111.5	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 3.99Å; T240-C283 CarbonylContact O-C 3.52Å; T240-C283 WeakPolarHBondContact O-CA 3.3Å; T240-H284 PolarHBondContact N-O 3.14Å; T240-H284 PolarHBondContact O-N 3.13Å
241	W	98.2	Very high	95	Very high	1 Å²	1	58.4 Å²	58.4	0%	0.004	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	136.3	167.9	-83	107.5	0	0	0	109.9	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.85Å; V213-W241 HydrophobicContact CG1-CZ2 4.32Å; V213-W241 HydrophobicContact CG2-CH2 4.22Å; L225-W241 HydrophobicContact CB-CH2 3.67Å; L225-W241 HydrophobicContact CB-CZ2 3.73Å; L225-W241 HydrophobicContact CB-CZ3 4.48Å; L225-W241 HydrophobicContact CD1-CH2 3.99Å; L225-W241 HydrophobicContact CD1-CZ3 4.17Å; L225-W241 HydrophobicContact CG-CH2 4.48Å; C227-W241 HydrophobicContact CB-CH2 4.42Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; W241-Q248 HydrophobicContact CB-CB 4.27Å; W241-Q248 PolarHBondContact O-N 3.45Å; W241-A269 PolarHBondContact NE1-O 3.36Å; W241-V271 HydrophobicContact CB-CB 4.49Å; W241-V271 HydrophobicContact CB-CG1 4.3Å; W241-V271 HydrophobicContact CD2-CB 4.49Å; W241-V271 HydrophobicContact CD2-CG1 3.58Å; W241-V271 HydrophobicContact CE3-CG1 4.04Å; W241-V271 HydrophobicContact CG-CB 4.12Å; W241-V271 HydrophobicContact CG-CG1 3.7Å; W241-V271 HydrophobicContact CZ2-CG1 4.3Å; W241-T282 VanDerWaalsContact CE3-C 3.4Å; W241-C283 HydrophobicContact CD2-CB 4.15Å; W241-C283 HydrophobicContact CE3-CB 4.05Å; W241-C283 HydrophobicContact CH2-CB 3.99Å; W241-C283 HydrophobicContact CZ2-CB 4.1Å; W241-C283 HydrophobicContact CZ3-CB 3.96Å
242	Q	97.9	Very high	94.9	Very high	38 Å²	38	58.9 Å²	58.9	18%	0.178	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	143.6	171.2	-72.6	-176.1	-8.3	0	0	110.5	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.54Å; Q242-E246 VanDerWaalsContact CA-O 3.23Å; Q242-E246 WeakPolarHBondContact CA-O 3.28Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.37Å; Q242-D247 PolarHBondContact NE2-OD1 2.91Å; Q242-Y281 CarbonylContact O-C 3.52Å; Q242-Y281 VanDerWaalsContact O-CA 3.3Å; Q242-Y281 WeakPolarHBondContact O-CA 3.25Å; Q242-T282 PolarHBondContact N-O 3.34Å; Q242-T282 PolarHBondContact O-N 3.45Å; Q242-T282 PolarHBondContact O-OG1 3.11Å; Q242-H284 VanDerWaalsContact CB-NE2 3.27Å; Q242-H284 WeakPolarHBondContact CB-NE2 3.5Å; Q242-H284 PolarHBondContact OE1-NE2 3.2Å
243	R	97.4	Very high	94.9	Very high	77 Å²	77	64.3 Å²	64.3	29%	0.291	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.7	167.3	-169.2	-175.6	77.2	-173.8	-4.3	109	G245 E246 Q248 R280 Y281	R243-G245 PolarHBondContact O-N 2.75Å; R243-E246 PolarHBondContact N-O 3.42Å; R243-E246 PolarHBondContact O-N 2.8Å; R243-Q248 HydrophobicContact CB-CG 4.03Å; R243-R280 WeakPolarHBondContact CA-O 3.38Å; R243-R280 HydrophobicContact CG-CB 4.09Å; R243-Y281 HydrophobicContact CB-CD1 4.02Å; R243-Y281 HydrophobicContact CB-CE1 3.85Å; R243-Y281 WeakPolarHBondContact CD-OH 3.22Å; R243-Y281 HydrophobicContact CG-CD1 4.26Å; R243-Y281 HydrophobicContact CG-CD2 4.26Å; R243-Y281 HydrophobicContact CG-CE1 3.96Å; R243-Y281 HydrophobicContact CG-CE2 3.93Å; R243-Y281 HydrophobicContact CG-CG 4.42Å
244	D	95.4	Very high	95	Very high	101 Å²	101	68.3 Å²	68.3	54%	0.54	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	22.2	-175.1	-50.9	-52.7	0	0	0	114.9	R280	D244-R280 PolarHBondContact N-O 3.3Å; D244-R280 WeakPolarHBondContact OD1-CB 3.36Å; D244-R280 IonicContact OD1-NE 3.45Å; D244-R280 PolarHBondContact OD1-NE 2.92Å; D244-R280 IonicContact OD2-CZ 3.54Å; D244-R280 IonicContact OD2-NE 3.85Å; D244-R280 PolarHBondContact OD2-NE 2.76Å; D244-R280 IonicContact OD2-NH2 2.68Å; D244-R280 PolarHBondContact OD2-NH2 2.87Å
245	G	91.7	Very high	95	Very high	47 Å²	47	69.1 Å²	69.1	49%	0.485	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.8	-1.3	-176	0	0	0	0	0	115.8	R243	R243-G245 PolarHBondContact O-N 2.75Å
246	E	95.4	Very high	95.1	Very high	131 Å²	131	76.7 Å²	76.7	61%	0.612	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	126.2	176.1	-61.7	-175	157.8	0	0	111.4	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.54Å; Q242-E246 VanDerWaalsContact CA-O 3.23Å; Q242-E246 WeakPolarHBondContact CA-O 3.28Å; R243-E246 PolarHBondContact N-O 3.42Å; R243-E246 PolarHBondContact O-N 2.8Å; E246-Q248 PolarHBondContact O-NE2 3.12Å
247	D	95.3	Very high	95.2	Very high	95 Å²	95	72 Å²	72	51%	0.508	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	131.4	-179.8	-66.9	-34.4	0	0	0	112.5	Q242	Q242-D247 WeakPolarHBondContact CG-OD1 3.37Å; Q242-D247 PolarHBondContact NE2-OD1 2.91Å
248	Q	95.1	Very high	95.2	Very high	23 Å²	23	76.4 Å²	76.4	11%	0.107	40%	0.396	C	S	.	.			trans	-100.7	37	-176.5	-55.6	-61.1	-79	0	0	112.2	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.27Å; W241-Q248 PolarHBondContact O-N 3.45Å; R243-Q248 HydrophobicContact CB-CG 4.03Å; E246-Q248 PolarHBondContact O-NE2 3.12Å; Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.48Å; Q248-D251 PolarHBondContact O-N 3.35Å; Q248-T252 WeakPolarHBondContact O-CB 3.47Å; Q248-T252 PolarHBondContact O-N 3.07Å; Q248-T252 VanDerWaalsContact O-N 3.09Å; Q248-T252 PolarHBondContact O-OG1 2.89Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å
249	T	88.5	Confident	95.2	Very high	104 Å²	104	78 Å²	78	64%	0.638	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-31.4	-166.8	-50.1	0	0	0	0	114.6
250	Q	88.4	Confident	95.2	Very high	190 Å²	190	80.1 Å²	80.1	89%	0.888	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-31.9	179.3	-65.2	-173.6	7	0	0	112.9	Q248	Q248-Q250 VanDerWaalsContact C-N 3.3Å; Q248-Q250 PolarHBondContact O-N 3.48Å
251	D	87.4	Confident	94.9	Very high	113 Å²	113	82 Å²	82	60%	0.604	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	2.9	-178.3	-52.9	-66.6	0	0	0	112.6	Q248	Q248-D251 PolarHBondContact O-N 3.35Å
252	T	94.8	Very high	94.6	Very high	24 Å²	24	87.4 Å²	87.4	15%	0.147	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.6	179.5	-63.9	0	0	0	0	111.5	Q248 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.47Å; Q248-T252 PolarHBondContact O-N 3.07Å; Q248-T252 VanDerWaalsContact O-N 3.09Å; Q248-T252 PolarHBondContact O-OG1 2.89Å; T252-L254 HydrophobicContact CG2-CB 4.4Å; T252-L254 PolarHBondContact O-N 3.45Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; T252-A270 CarbonylContact C-O 3.44Å; T252-A270 VanDerWaalsContact CA-O 3.31Å; T252-A270 WeakPolarHBondContact CA-O 3.44Å
253	E	96.8	Very high	94.3	Very high	114 Å²	114	87.6 Å²	87.6	53%	0.533	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	102.4	163.6	-174.3	-172.6	-163	0	0	109	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.28Å; E253-W268 HydrophobicContact CG-CH2 3.99Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 VanDerWaalsContact OE2-CH2 3.31Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.42Å; E253-W268 WeakPolarHBondContact OE2-CZ3 3.48Å; E253-A269 CarbonylContact O-C 3.55Å; E253-A269 WeakPolarHBondContact O-CA 3.06Å; E253-A270 HydrophobicContact CB-CB 4.38Å; E253-A270 PolarHBondContact N-O 3.43Å; E253-A270 PolarHBondContact O-N 3.11Å
254	L	96.9	Very high	94.3	Very high	88 Å²	88	84.2 Å²	84.2	46%	0.461	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	120.1	177.2	-174.2	69.3	0	0	0	110.2	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.14Å; T252-L254 HydrophobicContact CG2-CB 4.4Å; T252-L254 PolarHBondContact O-N 3.45Å; L254-K267 HydrophobicContact CD1-CD 4.49Å; L254-A269 HydrophobicContact CD1-CB 3.71Å
255	V	96.7	Very high	94.4	Very high	34 Å²	34	80.7 Å²	80.7	21%	0.206	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-83.8	153.2	174.8	-64.5	0	0	0	0	112.5	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.45Å; V255-K267 WeakPolarHBondContact O-CE 3.29Å; V255-K267 WeakPolarHBondContact O-CG 3.29Å; V255-K267 PolarHBondContact O-NZ 3.09Å; V255-W268 HydrophobicContact CG1-CD2 4.03Å; V255-W268 VanDerWaalsContact CG1-CE2 3.48Å; V255-W268 HydrophobicContact CG1-CE3 4.33Å; V255-W268 HydrophobicContact CG1-CH2 3.72Å; V255-W268 HydrophobicContact CG1-CZ2 3.34Å; V255-W268 HydrophobicContact CG1-CZ3 4.17Å; V255-W268 HydrophobicContact CG2-CD2 3.84Å; V255-W268 HydrophobicContact CG2-CG 3.79Å; V255-W268 WeakPolarHBondContact CG2-O 3.5Å; V255-W268 PolarHBondContact N-O 3.42Å
256	E	96.8	Very high	94.7	Very high	173 Å²	173	80.4 Å²	80.4	81%	0.808	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-55.2	147.4	165.7	-67.6	-176.8	171	0	0	111.1	R258	E256-R258 PolarHBondContact O-N 2.91Å
257	T	97.8	Very high	94.8	Very high	46 Å²	46	75.2 Å²	75.2	28%	0.282	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-70	128.6	174.7	-55.4	0	0	0	0	108.5	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.03Å; F232-T257 HydrophobicContact CZ-CG2 3.89Å; A235-T257 HydrophobicContact CB-CG2 4.3Å; A235-T257 WeakPolarHBondContact O-CG2 3.43Å; T257-F265 HydrophobicContact CG2-CB 3.83Å; T257-F265 HydrophobicContact CG2-CD1 3.99Å; T257-F265 HydrophobicContact CG2-CG 4.19Å; T257-K267 WeakPolarHBondContact OG1-CD 3.32Å; T257-K267 PolarHBondContact OG1-NZ 2.66Å
258	R	97.3	Very high	95	Very high	101 Å²	101	71.8 Å²	71.8	38%	0.381	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.5	-174.2	70	-165.7	-177.4	-177.3	4	111.2	E256 Q266	E256-R258 PolarHBondContact O-N 2.91Å; R258-Q266 HydrophobicContact CG-CG 3.68Å; R258-Q266 PolarHBondContact N-O 2.98Å; R258-Q266 VanDerWaalsContact NE-OE1 3.07Å; R258-Q266 VanDerWaalsContact O-CG 3.31Å; R258-Q266 WeakPolarHBondContact O-CG 3.43Å; R258-Q266 PolarHBondContact O-N 3.36Å
259	P	97.1	Very high	95.1	Very high	91 Å²	91	70.7 Å²	70.7	59%	0.591	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	148.1	177.7	28	-34.8	0	0	0	111.3	F265 Q266	P259-F265 HydrophobicContact CB-CD1 4.43Å; P259-F265 HydrophobicContact CB-CE1 4.17Å; P259-Q266 PolarHBondContact O-NE2 3.07Å
260	A	96.2	Very high	95.6	Very high	52 Å²	52	65.9 Å²	65.9	43%	0.43	37%	0.368	S	S	.	.			trans	-88.4	-21.5	171	0	0	0	0	0	112.7	D262 T264 Q266	A260-D262 WeakPolarHBondContact CB-OD1 3.15Å; A260-T264 WeakPolarHBondContact CB-O 3.36Å; A260-T264 PolarHBondContact N-O 3.18Å; A260-Q266 HydrophobicContact CB-CG 4.47Å
261	G	92.8	Very high	96	Very high	78 Å²	78	57 Å²	57	80%	0.804	33%	0.327	S	S	*	.	S	Bend	trans	100	-6.8	178.1	0	0	0	0	0	115
262	D	92.3	Very high	96.5	Very high	115 Å²	115	55.1 Å²	55.1	62%	0.615	32%	0.32	S	S	*	.	S	Bend	trans	-101.5	8	175	58.3	4.9	0	0	0	113.3	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.15Å; D262-T264 WeakPolarHBondContact OD1-CB 3.31Å; D262-T264 PolarHBondContact OD1-N 2.87Å; D262-T264 PolarHBondContact OD1-OG1 3.19Å; D262-T264 PolarHBondContact OD2-OG1 3.16Å
263	G	90.9	Very high	96.6	Very high	42 Å²	42	54 Å²	54	43%	0.433	31%	0.313	S	S	.	.	S	Bend	trans	93.2	-4.1	-172.4	0	0	0	0	0	114.2	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.45Å
264	T	96.3	Very high	96.6	Very high	7 Å²	7	51 Å²	51	4%	0.043	30%	0.303	C	S	.	.			trans	-102.2	171.6	174.3	74.9	0	0	0	0	112.6	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.19Å; F232-T264 CarbonylContact O-C 3.57Å; F232-T264 WeakPolarHBondContact O-CA 3.42Å; A260-T264 WeakPolarHBondContact CB-O 3.36Å; A260-T264 PolarHBondContact N-O 3.18Å; D262-T264 WeakPolarHBondContact OD1-CB 3.31Å; D262-T264 PolarHBondContact OD1-N 2.87Å; D262-T264 PolarHBondContact OD1-OG1 3.19Å; D262-T264 PolarHBondContact OD2-OG1 3.16Å
265	F	98	Very high	96.4	Very high	26 Å²	26	49.6 Å²	49.6	11%	0.114	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	163.7	-177.7	-65.5	-84.6	0	0	0	112.6	D54 G231 F232 Y233 A235 T257 P259	D54-F265 HydrophobicContact CB-CE2 3.74Å; D54-F265 HydrophobicContact CB-CZ 3.73Å; G231-F265 PolarHBondContact N-O 2.99Å; F232-F265 WeakPolarHBondContact CD1-O 3.41Å; F232-F265 HydrophobicContact CD2-CB 3.89Å; F232-F265 HydrophobicContact CE1-CB 4.32Å; F232-F265 WeakPolarHBondContact CE1-O 3.34Å; F232-F265 HydrophobicContact CE2-CB 3.46Å; F232-F265 VanDerWaalsContact CE2-CB 3.46Å; F232-F265 HydrophobicContact CG-CB 4.47Å; F232-F265 HydrophobicContact CZ-CB 3.68Å; F232-F265 PolarHBondContact N-O 3.16Å; F232-F265 PolarHBondContact O-N 2.88Å; Y233-F265 HydrophobicContact CD2-CD2 4.46Å; Y233-F265 HydrophobicContact CD2-CE2 4.05Å; Y233-F265 HydrophobicContact CE2-CE2 4.49Å; A235-F265 HydrophobicContact CB-CD1 3.75Å; A235-F265 HydrophobicContact CB-CD2 3.7Å; A235-F265 HydrophobicContact CB-CE1 3.78Å; A235-F265 HydrophobicContact CB-CE2 3.74Å; A235-F265 HydrophobicContact CB-CG 3.73Å; A235-F265 HydrophobicContact CB-CZ 3.79Å; T257-F265 HydrophobicContact CG2-CB 3.83Å; T257-F265 HydrophobicContact CG2-CD1 3.99Å; T257-F265 HydrophobicContact CG2-CG 4.19Å; P259-F265 HydrophobicContact CB-CD1 4.43Å; P259-F265 HydrophobicContact CB-CE1 4.17Å
266	Q	98.3	Very high	96.1	Very high	41 Å²	41	51.2 Å²	51.2	19%	0.192	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.9	176	39.3	162.8	-24	0	0	110.1	A229 L230 R258 P259 A260	A229-Q266 WeakPolarHBondContact O-CA 3.5Å; L230-Q266 HydrophobicContact CD2-CB 3.59Å; R258-Q266 HydrophobicContact CG-CG 3.68Å; R258-Q266 PolarHBondContact N-O 2.98Å; R258-Q266 VanDerWaalsContact NE-OE1 3.07Å; R258-Q266 VanDerWaalsContact O-CG 3.31Å; R258-Q266 WeakPolarHBondContact O-CG 3.43Å; R258-Q266 PolarHBondContact O-N 3.36Å; P259-Q266 PolarHBondContact O-NE2 3.07Å; A260-Q266 HydrophobicContact CB-CG 4.47Å
267	K	98.5	Very high	96.1	Very high	22 Å²	22	45.8 Å²	45.8	10%	0.096	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	156.9	177.2	-161.3	-176	-169.7	66.5	0	109	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 3.44Å; A229-K267 PolarHBondContact O-N 3.19Å; A229-K267 VanDerWaalsContact O-O 3.04Å; F232-K267 HydrophobicContact CE1-CB 4.4Å; F232-K267 HydrophobicContact CZ-CB 4.1Å; I237-K267 HydrophobicContact CG2-CB 4.23Å; I237-K267 HydrophobicContact CG2-CD 3.54Å; L239-K267 HydrophobicContact CD1-CD 4.33Å; L239-K267 HydrophobicContact CD2-CB 4.36Å; L239-K267 HydrophobicContact CD2-CG 4.42Å; L254-K267 HydrophobicContact CD1-CD 4.49Å; V255-K267 HydrophobicContact CG2-CG 4.45Å; V255-K267 WeakPolarHBondContact O-CE 3.29Å; V255-K267 WeakPolarHBondContact O-CG 3.29Å; V255-K267 PolarHBondContact O-NZ 3.09Å; T257-K267 WeakPolarHBondContact OG1-CD 3.32Å; T257-K267 PolarHBondContact OG1-NZ 2.66Å
268	W	98.3	Very high	95.9	Very high	24 Å²	24	44.6 Å²	44.6	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.8	168.4	57.4	-97	0	0	0	111.6	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 3.99Å; R226-W268 HydrophobicContact CG-CD2 4.04Å; R226-W268 HydrophobicContact CG-CE3 3.8Å; R226-W268 HydrophobicContact CG-CG 4.18Å; C227-W268 CarbonylContact O-C 3.39Å; C227-W268 WeakPolarHBondContact O-CA 3.49Å; C227-W268 WeakPolarHBondContact O-CB 3.5Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.43Å; W228-W268 HydrophobicContact CE3-CB 3.87Å; W228-W268 AromaticContact CE3-CD1 3.75Å; W228-W268 HydrophobicContact CE3-CG 4.1Å; W228-W268 HydrophobicContact CG-CB 4.37Å; W228-W268 AromaticContact CH2-CD1 3.71Å; W228-W268 HydrophobicContact CH2-CG 4.34Å; W228-W268 HydrophobicContact CZ3-CB 4.34Å; W228-W268 AromaticContact CZ3-CD1 3.34Å; W228-W268 HydrophobicContact CZ3-CG 4.07Å; E253-W268 HydrophobicContact CB-CZ3 4.28Å; E253-W268 HydrophobicContact CG-CH2 3.99Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 VanDerWaalsContact OE2-CH2 3.31Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.42Å; E253-W268 WeakPolarHBondContact OE2-CZ3 3.48Å; V255-W268 HydrophobicContact CG1-CD2 4.03Å; V255-W268 VanDerWaalsContact CG1-CE2 3.48Å; V255-W268 HydrophobicContact CG1-CE3 4.33Å; V255-W268 HydrophobicContact CG1-CH2 3.72Å; V255-W268 HydrophobicContact CG1-CZ2 3.34Å; V255-W268 HydrophobicContact CG1-CZ3 4.17Å; V255-W268 HydrophobicContact CG2-CD2 3.84Å; V255-W268 HydrophobicContact CG2-CG 3.79Å; V255-W268 WeakPolarHBondContact CG2-O 3.5Å; V255-W268 PolarHBondContact N-O 3.42Å; W268-A270 HydrophobicContact CE3-CB 3.91Å; W268-A270 HydrophobicContact CZ3-CB 3.62Å
269	A	98.3	Very high	95.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.1	173.5	0	0	0	0	0	108.3	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.44Å; C227-A269 PolarHBondContact N-O 2.85Å; C227-A269 PolarHBondContact O-N 2.97Å; L239-A269 HydrophobicContact CB-CB 4.05Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; W241-A269 PolarHBondContact NE1-O 3.36Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; E253-A269 CarbonylContact O-C 3.55Å; E253-A269 WeakPolarHBondContact O-CA 3.06Å; L254-A269 HydrophobicContact CD1-CB 3.71Å
270	A	98	Very high	95.8	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.017	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.1	178.5	0	0	0	0	0	111.9	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.87Å; L225-A270 CarbonylContact O-C 3.57Å; L225-A270 WeakPolarHBondContact O-CA 3.37Å; R226-A270 HydrophobicContact CB-CB 3.95Å; R226-A270 HydrophobicContact CG-CB 4.09Å; T252-A270 CarbonylContact C-O 3.44Å; T252-A270 VanDerWaalsContact CA-O 3.31Å; T252-A270 WeakPolarHBondContact CA-O 3.44Å; E253-A270 HydrophobicContact CB-CB 4.38Å; E253-A270 PolarHBondContact N-O 3.43Å; E253-A270 PolarHBondContact O-N 3.11Å; W268-A270 HydrophobicContact CE3-CB 3.91Å; W268-A270 HydrophobicContact CZ3-CB 3.62Å
271	V	97.8	Very high	95.9	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142	176.7	63	0	0	0	0	109.1	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.38Å; L225-V271 HydrophobicContact CB-CG1 4.27Å; L225-V271 PolarHBondContact N-O 3.45Å; L225-V271 PolarHBondContact O-N 2.87Å; W241-V271 HydrophobicContact CB-CB 4.49Å; W241-V271 HydrophobicContact CB-CG1 4.3Å; W241-V271 HydrophobicContact CD2-CB 4.49Å; W241-V271 HydrophobicContact CD2-CG1 3.58Å; W241-V271 HydrophobicContact CE3-CG1 4.04Å; W241-V271 HydrophobicContact CG-CB 4.12Å; W241-V271 HydrophobicContact CG-CG1 3.7Å; W241-V271 HydrophobicContact CZ2-CG1 4.3Å; V271-V273 HydrophobicContact CG1-CG1 3.84Å; V271-V273 HydrophobicContact CG2-CG1 4.49Å; V271-Y281 HydrophobicContact CG1-CD1 4.09Å; V271-Y281 HydrophobicContact CG2-CD1 4.45Å; V271-Y281 HydrophobicContact CG2-CE1 4.13Å
272	V	97.4	Very high	96.1	Very high	75 Å²	75	39.1 Å²	39.1	46%	0.455	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.3	171.7	-177.8	0	0	0	0	108.3	E222	E222-V272 HydrophobicContact CB-CG1 4.09Å; E222-V272 HydrophobicContact CG-CG1 4.31Å
273	V	96.6	Very high	96.4	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.7	-175.6	-50.5	0	0	0	0	110.6	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.45Å; A223-V273 HydrophobicContact CB-CG2 4.49Å; A223-V273 PolarHBondContact N-O 2.87Å; A223-V273 PolarHBondContact O-N 2.88Å; L225-V273 HydrophobicContact CD1-CG1 4Å; L225-V273 HydrophobicContact CD1-CG2 4.14Å; L225-V273 HydrophobicContact CG-CG1 4.1Å; L225-V273 HydrophobicContact CG-CG2 3.89Å; V271-V273 HydrophobicContact CG1-CG1 3.84Å; V271-V273 HydrophobicContact CG2-CG1 4.49Å; V273-E278 HydrophobicContact CG2-CG 3.91Å; V273-Y281 HydrophobicContact CB-CD2 3.98Å; V273-Y281 HydrophobicContact CB-CE1 4.48Å; V273-Y281 HydrophobicContact CB-CE2 3.65Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.61Å; V273-Y281 HydrophobicContact CG1-CE1 3.65Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.68Å
274	P	96.3	Very high	96.8	Very high	51 Å²	51	34.1 Å²	34.1	33%	0.331	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	140.2	170	-20.2	32.4	0	0	0	111.3	H221 G276 E277	H221-P274 CarbonylContact O-C 3.6Å; H221-P274 WeakPolarHBondContact O-CA 3.4Å; P274-G276 PolarHBondContact O-N 2.91Å; P274-E277 HydrophobicContact CB-CB 4.27Å; P274-E277 HydrophobicContact CB-CG 4.08Å; P274-E277 HydrophobicContact CG-CG 4.47Å; P274-E277 WeakPolarHBondContact O-CB 3.5Å; P274-E277 PolarHBondContact O-N 3.19Å
275	S	92.8	Very high	96.8	Very high	57 Å²	57	33.8 Å²	33.8	40%	0.399	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	128.3	177.5	-62.6	0	0	0	0	111.7	H221 E222 E278	H221-S275 PolarHBondContact O-N 2.97Å; H221-S275 PolarHBondContact O-OG 2.72Å; E222-S275 PolarHBondContact N-OG 2.8Å; S275-E278 WeakPolarHBondContact CA-OE1 3.46Å
276	G	91.6	Very high	96.8	Very high	68 Å²	68	35.9 Å²	35.9	70%	0.701	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.3	-7.2	-174.1	0	0	0	0	0	114.8	P274 E278	P274-G276 PolarHBondContact O-N 2.91Å; G276-E278 WeakPolarHBondContact CA-OE2 3.36Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 3.04Å; G276-E278 PolarHBondContact N-OE2 2.87Å; G276-E278 VanDerWaalsContact N-OE2 3.09Å
277	E	95.4	Very high	96.6	Very high	60 Å²	60	34.1 Å²	34.1	28%	0.28	19%	0.189	S	C	.	.			trans	-97.5	0.9	175	-67.5	-159.2	-165.7	0	0	113.8	P274 Q279 R280 Y281	P274-E277 HydrophobicContact CB-CB 4.27Å; P274-E277 HydrophobicContact CB-CG 4.08Å; P274-E277 HydrophobicContact CG-CG 4.47Å; P274-E277 WeakPolarHBondContact O-CB 3.5Å; P274-E277 PolarHBondContact O-N 3.19Å; E277-Q279 PolarHBondContact O-N 2.71Å; E277-R280 VanDerWaalsContact O-CB 3.3Å; E277-R280 WeakPolarHBondContact O-CB 3.43Å; E277-R280 PolarHBondContact O-N 2.84Å; E277-R280 IonicContact OE1-NH1 3.82Å; E277-R280 PolarHBondContact OE1-NH1 3.44Å; E277-R280 IonicContact OE2-CZ 3.74Å; E277-R280 IonicContact OE2-NE 2.77Å; E277-R280 IonicContact OE2-NH1 3.72Å; E277-R280 PolarHBondContact OE2-NH1 3.03Å; E277-Y281 HydrophobicContact CB-CE2 4.31Å; E277-Y281 WeakPolarHBondContact O-CD2 3.46Å
278	E	94.9	Very high	96.3	Very high	20 Å²	20	36.7 Å²	36.7	9%	0.093	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-56.2	-31.9	-169.4	-55	80.4	-174.6	0	0	113.1	L225 V273 S275 G276 R280 Y281 W298	L225-E278 HydrophobicContact CD1-CB 4.12Å; L225-E278 HydrophobicContact CD2-CB 4.45Å; L225-E278 HydrophobicContact CD2-CG 4.34Å; V273-E278 HydrophobicContact CG2-CG 3.91Å; S275-E278 WeakPolarHBondContact CA-OE1 3.46Å; G276-E278 WeakPolarHBondContact CA-OE2 3.36Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 3.04Å; G276-E278 PolarHBondContact N-OE2 2.87Å; G276-E278 VanDerWaalsContact N-OE2 3.09Å; E278-R280 VanDerWaalsContact C-N 3.28Å; E278-R280 PolarHBondContact O-N 3.22Å; E278-Y281 PolarHBondContact O-N 3.25Å; E278-W298 HydrophobicContact CB-CD2 4.5Å; E278-W298 HydrophobicContact CB-CE3 3.48Å; E278-W298 VanDerWaalsContact CB-CE3 3.48Å; E278-W298 HydrophobicContact CB-CZ3 3.93Å; E278-W298 HydrophobicContact CG-CE3 3.73Å; E278-W298 HydrophobicContact CG-CZ3 3.79Å
279	Q	95.2	Very high	96	Very high	92 Å²	92	36.2 Å²	36.2	43%	0.43	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-73.6	-15	-179.7	-61.8	-57.4	-44.5	0	0	114.2	E277 Y281 R297 W298	E277-Q279 PolarHBondContact O-N 2.71Å; Q279-Y281 VanDerWaalsContact C-N 3.27Å; Q279-R297 PolarHBondContact O-NE 2.88Å; Q279-W298 PolarHBondContact NE2-O 2.87Å
280	R	96.8	Very high	95.8	Very high	98 Å²	98	36.6 Å²	36.6	37%	0.37	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-75.4	-19.6	171.5	-61.2	174.3	70.1	177.2	8	112.2	R243 D244 E277 E278	R243-R280 WeakPolarHBondContact CA-O 3.38Å; R243-R280 HydrophobicContact CG-CB 4.09Å; D244-R280 PolarHBondContact N-O 3.3Å; D244-R280 WeakPolarHBondContact OD1-CB 3.36Å; D244-R280 IonicContact OD1-NE 3.45Å; D244-R280 PolarHBondContact OD1-NE 2.92Å; D244-R280 IonicContact OD2-CZ 3.54Å; D244-R280 IonicContact OD2-NE 3.85Å; D244-R280 PolarHBondContact OD2-NE 2.76Å; D244-R280 IonicContact OD2-NH2 2.68Å; D244-R280 PolarHBondContact OD2-NH2 2.87Å; E277-R280 VanDerWaalsContact O-CB 3.3Å; E277-R280 WeakPolarHBondContact O-CB 3.43Å; E277-R280 PolarHBondContact O-N 2.84Å; E277-R280 IonicContact OE1-NH1 3.82Å; E277-R280 PolarHBondContact OE1-NH1 3.44Å; E277-R280 IonicContact OE2-CZ 3.74Å; E277-R280 IonicContact OE2-NE 2.77Å; E277-R280 IonicContact OE2-NH1 3.72Å; E277-R280 PolarHBondContact OE2-NH1 3.03Å; E278-R280 VanDerWaalsContact C-N 3.28Å; E278-R280 PolarHBondContact O-N 3.22Å
281	Y	97.6	Very high	95.5	Very high	8 Å²	8	42.2 Å²	42.2	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	132.7	-177.3	-67.2	-99.6	0	0	0	111	Q242 R243 Q248 V271 V273 E277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.52Å; Q242-Y281 VanDerWaalsContact O-CA 3.3Å; Q242-Y281 WeakPolarHBondContact O-CA 3.25Å; R243-Y281 HydrophobicContact CB-CD1 4.02Å; R243-Y281 HydrophobicContact CB-CE1 3.85Å; R243-Y281 WeakPolarHBondContact CD-OH 3.22Å; R243-Y281 HydrophobicContact CG-CD1 4.26Å; R243-Y281 HydrophobicContact CG-CD2 4.26Å; R243-Y281 HydrophobicContact CG-CE1 3.96Å; R243-Y281 HydrophobicContact CG-CE2 3.93Å; R243-Y281 HydrophobicContact CG-CG 4.42Å; Q248-Y281 HydrophobicContact CG-CE1 4.36Å; V271-Y281 HydrophobicContact CG1-CD1 4.09Å; V271-Y281 HydrophobicContact CG2-CD1 4.45Å; V271-Y281 HydrophobicContact CG2-CE1 4.13Å; V273-Y281 HydrophobicContact CB-CD2 3.98Å; V273-Y281 HydrophobicContact CB-CE1 4.48Å; V273-Y281 HydrophobicContact CB-CE2 3.65Å; V273-Y281 HydrophobicContact CG1-CD1 3.71Å; V273-Y281 HydrophobicContact CG1-CD2 3.61Å; V273-Y281 HydrophobicContact CG1-CE1 3.65Å; V273-Y281 HydrophobicContact CG1-CE2 3.57Å; V273-Y281 HydrophobicContact CG1-CG 3.68Å; E277-Y281 HydrophobicContact CB-CE2 4.31Å; E277-Y281 WeakPolarHBondContact O-CD2 3.46Å; E278-Y281 PolarHBondContact O-N 3.25Å; Q279-Y281 VanDerWaalsContact C-N 3.27Å
282	T	98	Very high	95.2	Very high	10 Å²	10	49.2 Å²	49.2	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131	177	43.7	0	0	0	0	110.1	W241 Q242 H284 T295 L296 R297	W241-T282 VanDerWaalsContact CE3-C 3.4Å; Q242-T282 PolarHBondContact N-O 3.34Å; Q242-T282 PolarHBondContact O-N 3.45Å; Q242-T282 PolarHBondContact O-OG1 3.11Å; T282-H284 WeakPolarHBondContact CB-NE2 3.35Å; T282-H284 PolarHBondContact OG1-NE2 3.4Å; T282-T295 HydrophobicContact CG2-CG2 3.87Å; T282-L296 CarbonylContact C-O 3.53Å; T282-L296 WeakPolarHBondContact CA-O 3.3Å; T282-R297 HydrophobicContact CG2-CG 3.7Å
283	C	98.2	Very high	95.1	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128.8	169.7	174.8	0	0	0	0	109.2	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.51Å; C227-C283 WeakPolarHBondContact CB-SG 3.44Å; C227-C283 WeakPolarHBondContact SG-CB 3.25Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 3.19Å; T240-C283 CarbonylContact O-C 3.52Å; T240-C283 WeakPolarHBondContact O-CA 3.3Å; W241-C283 HydrophobicContact CD2-CB 4.15Å; W241-C283 HydrophobicContact CE3-CB 4.05Å; W241-C283 HydrophobicContact CH2-CB 3.99Å; W241-C283 HydrophobicContact CZ2-CB 4.1Å; W241-C283 HydrophobicContact CZ3-CB 3.96Å; C283-T295 CarbonylContact O-C 3.49Å; C283-T295 WeakPolarHBondContact O-CA 3.21Å; C283-L296 HydrophobicContact CB-CB 4.39Å; C283-L296 PolarHBondContact N-O 3.05Å; C283-L296 PolarHBondContact O-N 2.83Å
284	H	97.9	Very high	95.1	Very high	51 Å²	51	51.9 Å²	51.9	24%	0.236	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.3	175.4	-63.2	-96.2	0	0	0	109.6	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.47Å; T240-H284 PolarHBondContact N-O 3.14Å; T240-H284 PolarHBondContact O-N 3.13Å; Q242-H284 VanDerWaalsContact CB-NE2 3.27Å; Q242-H284 WeakPolarHBondContact CB-NE2 3.5Å; Q242-H284 PolarHBondContact OE1-NE2 3.2Å; T282-H284 WeakPolarHBondContact CB-NE2 3.35Å; T282-H284 PolarHBondContact OG1-NE2 3.4Å; H284-L294 CarbonylContact C-O 3.6Å; H284-L294 WeakPolarHBondContact CA-O 3.5Å; H284-T295 VanDerWaalsContact CE1-CG2 3.4Å; H284-T295 WeakPolarHBondContact CE1-CG2 3.4Å; H284-T295 PolarHBondContact CE1-OG1 3.33Å; H284-T295 PolarHBondContact ND1-OG1 2.92Å; H284-T295 VanDerWaalsContact ND1-OG1 3.08Å
285	V	98	Very high	95.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.1	-177.4	-175.8	0	0	0	0	109.4	P209 T211 I237 T238 L239 L290 P293 L294 L296	P209-V285 HydrophobicContact CG-CG1 3.94Å; T211-V285 HydrophobicContact CG2-CB 4.29Å; T211-V285 HydrophobicContact CG2-CG1 4.03Å; T211-V285 HydrophobicContact CG2-CG2 3.95Å; I237-V285 HydrophobicContact CD1-CG1 4.06Å; I237-V285 HydrophobicContact CG1-CG1 4.38Å; T238-V285 WeakPolarHBondContact O-CA 3.39Å; L239-V285 HydrophobicContact CD1-CG1 4.01Å; L239-V285 HydrophobicContact CD1-CG2 4.41Å; L239-V285 HydrophobicContact CG-CG2 4.25Å; V285-L290 HydrophobicContact CG1-CD1 4.27Å; V285-P293 WeakPolarHBondContact O-CA 3.33Å; V285-L294 HydrophobicContact CB-CB 4.36Å; V285-L294 PolarHBondContact N-O 2.98Å; V285-L294 PolarHBondContact O-N 2.72Å; V285-L296 HydrophobicContact CG2-CD1 3.79Å
286	Q	96.9	Very high	95.4	Very high	70 Å²	70	51.9 Å²	51.9	33%	0.327	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.4	175.5	-56.1	178.1	11.1	0	0	109	I237 T238 P293	I237-Q286 WeakPolarHBondContact CG1-O 3.32Å; T238-Q286 PolarHBondContact N-O 2.69Å; T238-Q286 PolarHBondContact O-N 2.92Å; Q286-P293 HydrophobicContact CG-CB 4Å; Q286-P293 HydrophobicContact CG-CG 4.11Å
287	H	95.3	Very high	95.6	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.019	28%	0.277	C	S	.	.			trans	-158	138.6	-176.5	-177.3	-99.7	0	0	0	109.1	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 WeakPolarHBondContact CH2-O 3.42Å; E207-H287 PolarHBondContact O-CE1 3.14Å; P209-H287 HydrophobicContact CG-CB 4.04Å; F232-H287 AromaticContact CD2-CD2 3.85Å; F232-H287 AromaticContact CD2-NE2 3.74Å; Y233-H287 PolarHBondContact O-CE1 3.44Å; P234-H287 PolarHBondContact O-NE2 3.46Å; E236-H287 PolarHBondContact O-CD2 3.34Å; E236-H287 VanDerWaalsContact O-CD2 3.24Å; I237-H287 HydrophobicContact CD1-CB 4.17Å; I237-H287 HydrophobicContact CG1-CB 4Å; H287-G289 PolarHBondContact ND1-N 2.84Å; H287-G289 PolarHBondContact O-N 3.1Å; H287-L290 HydrophobicContact CB-CD1 4.03Å; H287-L290 HydrophobicContact CB-CG 4.26Å; H287-L290 WeakPolarHBondContact O-CB 3.22Å; H287-L290 PolarHBondContact O-N 3.32Å
288	E	91.2	Very high	95.6	Very high	77 Å²	77	54.9 Å²	54.9	36%	0.36	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-27.8	-177.1	-175.4	-175.3	175	0	0	114.2	W23 C25 P234	W23-E288 WeakPolarHBondContact CZ3-O 3.3Å; C25-E288 PolarHBondContact SG-OE1 3.03Å; P234-E288 WeakPolarHBondContact CG-OE2 3.5Å
289	G	91.3	Very high	95.4	Very high	14 Å²	14	61.8 Å²	61.8	14%	0.144	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-41.1	174.8	0	0	0	0	0	112.9	H208 H287	H208-G289 VanDerWaalsContact CE1-C 3.5Å; H208-G289 PolarHBondContact CE1-O 3.24Å; H208-G289 PolarHBondContact ND1-O 2.98Å; H287-G289 PolarHBondContact ND1-N 2.84Å; H287-G289 PolarHBondContact O-N 3.1Å
290	L	93.8	Very high	94.7	Very high	8 Å²	8	61 Å²	61	4%	0.042	31%	0.308	C	S	.	.			trans	-69.2	131.9	-168.1	-64.2	169.3	0	0	0	112.2	W23 H208 P209 V285 H287 E292 L294	W23-L290 WeakPolarHBondContact CH2-O 3.23Å; W23-L290 WeakPolarHBondContact CZ3-O 3.38Å; H208-L290 HydrophobicContact CB-CD2 4.13Å; P209-L290 HydrophobicContact CG-CD1 3.94Å; P209-L290 HydrophobicContact CG-CD2 4.34Å; P209-L290 HydrophobicContact CG-CG 4.22Å; V285-L290 HydrophobicContact CG1-CD1 4.27Å; H287-L290 HydrophobicContact CB-CD1 4.03Å; H287-L290 HydrophobicContact CB-CG 4.26Å; H287-L290 WeakPolarHBondContact O-CB 3.22Å; H287-L290 PolarHBondContact O-N 3.32Å; L290-E292 WeakPolarHBondContact CB-O 3.45Å; L290-E292 PolarHBondContact O-N 2.85Å; L290-L294 HydrophobicContact CD1-CD1 4.08Å; L290-L294 HydrophobicContact CD1-CG 3.92Å; L290-L294 HydrophobicContact CD2-CD1 3.65Å; L290-L294 HydrophobicContact CD2-CD2 4.49Å; L290-L294 HydrophobicContact CD2-CG 3.88Å
291	P	91.7	Very high	93.2	Very high	119 Å²	119	61.3 Å²	61.3	77%	0.773	33%	0.325	S	S	*	.	S	Bend	trans	-65.9	-28.3	176.1	27.9	-34.9	0	0	0	112.8
292	E	92.7	Very high	91	Very high	151 Å²	151	66.4 Å²	66.4	71%	0.706	36%	0.362	S	S	*	.	S	Bend	trans	-144.7	150.6	174.6	-65.1	-176.4	174.9	0	0	109	L290 L294	L290-E292 WeakPolarHBondContact CB-O 3.45Å; L290-E292 PolarHBondContact O-N 2.85Å; E292-L294 PolarHBondContact O-N 3.29Å
293	P	95.1	Very high	88.5	Confident	71 Å²	71	73.4 Å²	73.4	46%	0.461	39%	0.394	S	S	.	.			trans	-53.5	135.2	173.6	-28.3	37	0	0	0	113	V285 Q286	V285-P293 WeakPolarHBondContact O-CA 3.33Å; Q286-P293 HydrophobicContact CG-CB 4Å; Q286-P293 HydrophobicContact CG-CG 4.11Å
294	L	96.8	Very high	86	Confident	61 Å²	61	78.4 Å²	78.4	32%	0.319	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	137.5	175.8	-64.3	177.4	0	0	0	110.7	T211 H284 V285 L290 E292 L296	T211-L294 HydrophobicContact CG2-CD1 4.24Å; H284-L294 CarbonylContact C-O 3.6Å; H284-L294 WeakPolarHBondContact CA-O 3.5Å; V285-L294 HydrophobicContact CB-CB 4.36Å; V285-L294 PolarHBondContact N-O 2.98Å; V285-L294 PolarHBondContact O-N 2.72Å; L290-L294 HydrophobicContact CD1-CD1 4.08Å; L290-L294 HydrophobicContact CD1-CG 3.92Å; L290-L294 HydrophobicContact CD2-CD1 3.65Å; L290-L294 HydrophobicContact CD2-CD2 4.49Å; L290-L294 HydrophobicContact CD2-CG 3.88Å; E292-L294 PolarHBondContact O-N 3.29Å; L294-L296 HydrophobicContact CB-CD1 4.15Å
295	T	97.6	Very high	83.8	Confident	78 Å²	78	82.4 Å²	82.4	48%	0.479	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	115.1	169.9	-55.8	0	0	0	0	109.1	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 3.87Å; C283-T295 CarbonylContact O-C 3.49Å; C283-T295 WeakPolarHBondContact O-CA 3.21Å; H284-T295 VanDerWaalsContact CE1-CG2 3.4Å; H284-T295 WeakPolarHBondContact CE1-CG2 3.4Å; H284-T295 PolarHBondContact CE1-OG1 3.33Å; H284-T295 PolarHBondContact ND1-OG1 2.92Å; H284-T295 VanDerWaalsContact ND1-OG1 3.08Å
296	L	97.2	Very high	81.8	Confident	29 Å²	29	87.2 Å²	87.2	15%	0.152	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	144.7	-179.3	-60.9	104.9	0	0	0	111.5	T211 V213 T282 C283 V285 L294	T211-L296 HydrophobicContact CG2-CD1 4.27Å; V213-L296 HydrophobicContact CG2-CB 3.8Å; T282-L296 CarbonylContact C-O 3.53Å; T282-L296 WeakPolarHBondContact CA-O 3.3Å; C283-L296 HydrophobicContact CB-CB 4.39Å; C283-L296 PolarHBondContact N-O 3.05Å; C283-L296 PolarHBondContact O-N 2.83Å; V285-L296 HydrophobicContact CG2-CD1 3.79Å; L294-L296 HydrophobicContact CB-CD1 4.15Å
297	R	96.2	Very high	79.9	Confident	143 Å²	143	88 Å²	88	54%	0.54	49%	0.49	S	S	.	.			trans	-114.4	166.2	163.5	-71.7	-172.6	172.9	135.6	3.6	109.6	Q279 T282 E299	Q279-R297 PolarHBondContact O-NE 2.88Å; T282-R297 HydrophobicContact CG2-CG 3.7Å; R297-E299 PolarHBondContact O-N 2.9Å
298	W	95.9	Very high	78.3	Confident	48 Å²	48	93.4 Å²	93.4	18%	0.182	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-72.2	121.4	165.4	170.8	55.1	0	0	0	110.2	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.49Å; V213-W298 HydrophobicContact CG1-CB 3.79Å; H215-W298 HydrophobicContact CB-CD2 4.01Å; H215-W298 HydrophobicContact CB-CG 4.06Å; H215-W298 HydrophobicContact CB-CZ2 4.02Å; H215-W298 VanDerWaalsContact CB-NE1 3.31Å; H215-W298 AromaticContact CG-CE2 3.77Å; H215-W298 AromaticContact CG-CZ2 3.8Å; H215-W298 AromaticContact ND1-CZ2 3.99Å; L225-W298 HydrophobicContact CD1-CB 4.43Å; L225-W298 HydrophobicContact CD2-CB 3.83Å; L225-W298 HydrophobicContact CD2-CD2 4.43Å; L225-W298 HydrophobicContact CD2-CG 4.01Å; E278-W298 HydrophobicContact CB-CD2 4.5Å; E278-W298 HydrophobicContact CB-CE3 3.48Å; E278-W298 VanDerWaalsContact CB-CE3 3.48Å; E278-W298 HydrophobicContact CB-CZ3 3.93Å; E278-W298 HydrophobicContact CG-CE3 3.73Å; E278-W298 HydrophobicContact CG-CZ3 3.79Å; Q279-W298 PolarHBondContact NE2-O 2.87Å; W298-P300 HydrophobicContact CE3-CG 4.34Å; W298-P300 HydrophobicContact CH2-CB 4.22Å; W298-P300 HydrophobicContact CH2-CG 3.85Å; W298-P300 HydrophobicContact CZ2-CB 3.98Å; W298-P300 HydrophobicContact CZ2-CG 3.96Å; W298-P300 HydrophobicContact CZ3-CG 4.03Å
299	E	89.6	Confident	76.9	Confident	166 Å²	166	95.7 Å²	95.7	78%	0.776	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-97.5	120.7	167.9	-67.1	-173.4	170	0	0	109.5	R297 S301	R297-E299 PolarHBondContact O-N 2.9Å; E299-S301 PolarHBondContact O-N 3.33Å
300	P	81.7	Confident	75.7	Confident	76 Å²	76	97.1 Å²	97.1	49%	0.494	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-58.5	133.8	170.4	-21.9	32.6	0	0	0	110	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.34Å; W298-P300 HydrophobicContact CH2-CB 4.22Å; W298-P300 HydrophobicContact CH2-CG 3.85Å; W298-P300 HydrophobicContact CZ2-CB 3.98Å; W298-P300 HydrophobicContact CZ2-CG 3.96Å; W298-P300 HydrophobicContact CZ3-CG 4.03Å; P300-S302 PolarHBondContact O-N 3.21Å
301	S	65.7	Low	74.7	Confident	104 Å²	104	101.1 Å²	101.1	73%	0.727	57%	0.572	S	S	*	*			trans	-58.9	106.1	-178.7	-175.3	0	0	0	0	110.9	E299 Q303	E299-S301 PolarHBondContact O-N 3.33Å; S301-Q303 PolarHBondContact O-N 2.87Å
302	S	50.6	Low	73.9	Confident	114 Å²	114	99.7 Å²	99.7	80%	0.797	56%	0.561	S	S	*	*			trans	-78.3	56.9	171.2	51.2	0	0	0	0	110.3	P300 P304	P300-S302 PolarHBondContact O-N 3.21Å; S302-P304 WeakPolarHBondContact O-CD 3.4Å; S302-P304 VanDerWaalsContact O-N 3.1Å
303	Q	46.3	Very low	73.1	Confident	157 Å²	157	95 Å²	95	73%	0.734	55%	0.549	S	S	*	.			trans	-60.3	112.8	157.9	-80.4	-168.5	-8.9	0	0	107	S301 T305	S301-Q303 PolarHBondContact O-N 2.87Å; Q303-T305 PolarHBondContact O-N 3.42Å
304	P	44.5	Very low	72.5	Confident	105 Å²	105	93.3 Å²	93.3	68%	0.682	54%	0.543	S	S	*	.			trans	-62.7	118.4	169.4	27.7	-31.6	0	0	0	105.6	S302 I306	S302-P304 WeakPolarHBondContact O-CD 3.4Å; S302-P304 VanDerWaalsContact O-N 3.1Å; P304-I306 HydrophobicContact CG-CG1 4.45Å; P304-I306 PolarHBondContact O-N 3.09Å
305	T	51.7	Low	71.9	Confident	136 Å²	136	95.6 Å²	95.6	83%	0.834	56%	0.556	S	S	*	*			trans	-69.3	78.9	166.7	-52.6	0	0	0	0	106.5	Q303 P307	Q303-T305 PolarHBondContact O-N 3.42Å; T305-P307 WeakPolarHBondContact O-CD 3.17Å; T305-P307 VanDerWaalsContact O-N 3.08Å
306	I	55.7	Low	71.2	Confident	100 Å²	100	94.6 Å²	94.6	51%	0.513	56%	0.555	S	S	.	*			trans	-50.2	120.3	169.3	-62.3	175.7	0	0	0	104.3	P304 I308 I311	P304-I306 HydrophobicContact CG-CG1 4.45Å; P304-I306 PolarHBondContact O-N 3.09Å; I306-I308 HydrophobicContact CG2-CG1 4.28Å; I306-I308 PolarHBondContact O-N 2.87Å; I306-I311 HydrophobicContact CG2-CD1 3.92Å
307	P	57.2	Low	70.6	Confident	87 Å²	87	97.5 Å²	97.5	57%	0.565	57%	0.574	S	S	*	*			trans	-76	74.9	-175.1	30.2	-34.6	0	0	0	108.4	T305 V309 G310 I311	T305-P307 WeakPolarHBondContact O-CD 3.17Å; T305-P307 VanDerWaalsContact O-N 3.08Å; P307-V309 PolarHBondContact O-N 3.17Å; P307-G310 WeakPolarHBondContact O-CA 3.38Å; P307-G310 PolarHBondContact O-N 2.7Å; P307-I311 PolarHBondContact O-N 3.26Å
308	I	61	Low	70.1	Confident	117 Å²	117	96 Å²	96	60%	0.6	58%	0.576	S	S	*	*	H	α-helix	trans	-54.4	-38.3	178.8	-67	164.4	0	0	0	109	I306 G310 I311 V312	I306-I308 HydrophobicContact CG2-CG1 4.28Å; I306-I308 PolarHBondContact O-N 2.87Å; I308-G310 PolarHBondContact O-N 2.81Å; I308-I311 PolarHBondContact O-N 3.26Å; I308-V312 HydrophobicContact CG2-CG2 4.29Å; I308-V312 WeakPolarHBondContact O-CB 3.25Å; I308-V312 VanDerWaalsContact O-CG2 3.24Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 2.99Å
309	V	62.3	Low	69.5	Low	125 Å²	125	96.4 Å²	96.4	76%	0.758	59%	0.59	S	S	*	*	H	α-helix	trans	-58.1	-43.4	171.7	-178.3	0	0	0	0	112.3	P307 A313	P307-V309 PolarHBondContact O-N 3.17Å; V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.44Å; V309-A313 PolarHBondContact O-N 3.49Å
310	G	66.4	Low	69.3	Low	44 Å²	44	92.7 Å²	92.7	45%	0.454	58%	0.578	S	S	.	*	H	α-helix	trans	-68.7	-39.1	178.3	0	0	0	0	0	113.1	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.38Å; P307-G310 PolarHBondContact O-N 2.7Å; I308-G310 PolarHBondContact O-N 2.81Å; G310-G314 PolarHBondContact O-N 2.91Å
311	I	73.2	Confident	69.5	Low	92 Å²	92	94 Å²	94	47%	0.472	58%	0.58	S	S	.	*	H	α-helix	trans	-67.2	-46	175.7	-62.2	172.8	0	0	0	110.4	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 3.92Å; P307-I311 PolarHBondContact O-N 3.26Å; I308-I311 PolarHBondContact O-N 3.26Å; I311-G314 PolarHBondContact O-N 2.75Å; I311-L315 HydrophobicContact CG2-CD1 4Å; I311-L315 HydrophobicContact CG2-CG 4.5Å; I311-L315 WeakPolarHBondContact O-CB 3.18Å; I311-L315 WeakPolarHBondContact O-CG 3.34Å; I311-L315 PolarHBondContact O-N 3.35Å
312	V	75.1	Confident	70.4	Confident	90 Å²	90	92.2 Å²	92.2	55%	0.545	57%	0.572	S	S	.	*	H	α-helix	trans	-63.5	-42.7	177.5	170.7	0	0	0	0	111.3	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.29Å; I308-V312 WeakPolarHBondContact O-CB 3.25Å; I308-V312 VanDerWaalsContact O-CG2 3.24Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 2.99Å; V312-L315 PolarHBondContact O-N 3.45Å; V312-A316 WeakPolarHBondContact O-CB 3.42Å; V312-A316 PolarHBondContact O-N 2.8Å
313	A	75.4	Confident	71.9	Confident	53 Å²	53	91.2 Å²	91.2	44%	0.438	56%	0.561	S	S	.	*	H	α-helix	trans	-62.8	-44.4	174.8	0	0	0	0	0	112.1	V309 A316 V317	V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.44Å; V309-A313 PolarHBondContact O-N 3.49Å; A313-A316 PolarHBondContact O-N 2.66Å; A313-V317 WeakPolarHBondContact O-CG2 3.33Å; A313-V317 PolarHBondContact O-N 3.16Å
314	G	81.5	Confident	73.6	Confident	34 Å²	34	88.4 Å²	88.4	35%	0.351	55%	0.55	S	S	.	*	H	α-helix	trans	-61.2	-43.9	176.6	0	0	0	0	0	113	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 2.91Å; I311-G314 PolarHBondContact O-N 2.75Å; G314-V317 PolarHBondContact O-N 3.04Å; G314-L318 PolarHBondContact O-N 3.21Å
315	L	85.1	Confident	75.4	Confident	110 Å²	110	85.4 Å²	85.4	58%	0.576	54%	0.538	S	S	*	.	H	α-helix	trans	-65.8	-39.2	176	-71.7	171.9	0	0	0	112.4	I311 V312 L318 A319	I311-L315 HydrophobicContact CG2-CD1 4Å; I311-L315 HydrophobicContact CG2-CG 4.5Å; I311-L315 WeakPolarHBondContact O-CB 3.18Å; I311-L315 WeakPolarHBondContact O-CG 3.34Å; I311-L315 PolarHBondContact O-N 3.35Å; V312-L315 PolarHBondContact O-N 3.45Å; L315-L318 PolarHBondContact O-N 3.1Å; L315-A319 WeakPolarHBondContact O-CB 3.32Å; L315-A319 PolarHBondContact O-N 2.94Å
316	A	82.6	Confident	76.7	Confident	56 Å²	56	81.5 Å²	81.5	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-63.3	-43.4	175.5	0	0	0	0	0	112	V312 A313 A319 V320	V312-A316 WeakPolarHBondContact O-CB 3.42Å; V312-A316 PolarHBondContact O-N 2.8Å; A313-A316 PolarHBondContact O-N 2.66Å; A316-A319 PolarHBondContact O-N 3.42Å; A316-V320 WeakPolarHBondContact O-CG2 3.45Å; A316-V320 PolarHBondContact O-N 2.82Å
317	V	85.1	Confident	77.8	Confident	90 Å²	90	80.5 Å²	80.5	55%	0.545	52%	0.518	S	S	.	.	H	α-helix	trans	-63.1	-44.6	175.4	171.5	0	0	0	0	111.2	A313 G314 A319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.33Å; A313-V317 PolarHBondContact O-N 3.16Å; G314-V317 PolarHBondContact O-N 3.04Å; V317-A319 PolarHBondContact O-N 2.84Å; V317-V320 PolarHBondContact O-N 3.24Å; V317-L321 HydrophobicContact CG1-CD1 3.93Å; V317-L321 HydrophobicContact CG1-CG 4.39Å; V317-L321 WeakPolarHBondContact O-CG 3.45Å; V317-L321 PolarHBondContact O-N 3.16Å
318	L	84.7	Confident	78.7	Confident	112 Å²	112	82.1 Å²	82.1	59%	0.586	52%	0.519	S	S	*	.	H	α-helix	trans	-60.7	-41.7	176	-80.8	165.8	0	0	0	112.5	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.21Å; L315-L318 PolarHBondContact O-N 3.1Å; L318-L321 PolarHBondContact O-N 3.22Å; L318-A322 WeakPolarHBondContact O-CB 3.31Å; L318-A322 PolarHBondContact O-N 3.31Å
319	A	84.9	Confident	79.4	Confident	57 Å²	57	79 Å²	79	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-43.9	176.5	0	0	0	0	0	112	L315 A316 V317 A322 V323	L315-A319 WeakPolarHBondContact O-CB 3.32Å; L315-A319 PolarHBondContact O-N 2.94Å; A316-A319 PolarHBondContact O-N 3.42Å; V317-A319 PolarHBondContact O-N 2.84Å; A319-A322 PolarHBondContact O-N 2.88Å; A319-V323 WeakPolarHBondContact O-CG2 3.39Å; A319-V323 PolarHBondContact O-N 3.09Å
320	V	85.1	Confident	79.9	Confident	87 Å²	87	77 Å²	77	53%	0.527	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-44.3	175.8	171	0	0	0	0	111.3	A316 V317 A322 V323 L324	A316-V320 WeakPolarHBondContact O-CG2 3.45Å; A316-V320 PolarHBondContact O-N 2.82Å; V317-V320 PolarHBondContact O-N 3.24Å; V320-A322 PolarHBondContact O-N 3.38Å; V320-V323 PolarHBondContact O-N 2.94Å; V320-L324 HydrophobicContact CG1-CD1 3.95Å; V320-L324 HydrophobicContact CG1-CG 4.49Å; V320-L324 WeakPolarHBondContact O-CG 3.31Å; V320-L324 PolarHBondContact O-N 3.25Å
321	L	85.7	Confident	80.3	Confident	105 Å²	105	78.3 Å²	78.3	55%	0.55	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-39.2	177	-70.9	173	0	0	0	112.4	V317 L318 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.93Å; V317-L321 HydrophobicContact CG1-CG 4.39Å; V317-L321 WeakPolarHBondContact O-CG 3.45Å; V317-L321 PolarHBondContact O-N 3.16Å; L318-L321 PolarHBondContact O-N 3.22Å; L321-L324 PolarHBondContact O-N 3Å; L321-G325 PolarHBondContact O-N 2.85Å
322	A	83.6	Confident	80.3	Confident	66 Å²	66	80.3 Å²	80.3	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-42.2	175.5	0	0	0	0	0	112.1	L318 A319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.31Å; L318-A322 PolarHBondContact O-N 3.31Å; A319-A322 PolarHBondContact O-N 2.88Å; V320-A322 PolarHBondContact O-N 3.38Å; A322-G325 PolarHBondContact O-N 3.32Å; A322-A326 WeakPolarHBondContact O-CB 3.26Å; A322-A326 PolarHBondContact O-N 3.33Å
323	V	82.9	Confident	79.7	Confident	93 Å²	93	80.2 Å²	80.2	56%	0.564	51%	0.51	S	S	*	.	H	α-helix	trans	-64.1	-45	175.1	171.6	0	0	0	0	111.2	A319 V320 G325 A326 V327	A319-V323 WeakPolarHBondContact O-CG2 3.39Å; A319-V323 PolarHBondContact O-N 3.09Å; V320-V323 PolarHBondContact O-N 2.94Å; V323-G325 PolarHBondContact O-N 2.87Å; V323-A326 PolarHBondContact O-N 3.13Å; V323-V327 HydrophobicContact CG1-CG2 4.47Å; V323-V327 WeakPolarHBondContact O-CG2 3.49Å; V323-V327 PolarHBondContact O-N 3.36Å
324	L	81.8	Confident	79	Confident	98 Å²	98	86.8 Å²	86.8	51%	0.513	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-43	175.7	-72.2	169.3	0	0	0	111.8	V320 L321 V327 M328	V320-L324 HydrophobicContact CG1-CD1 3.95Å; V320-L324 HydrophobicContact CG1-CG 4.49Å; V320-L324 WeakPolarHBondContact O-CG 3.31Å; V320-L324 PolarHBondContact O-N 3.25Å; L321-L324 PolarHBondContact O-N 3Å; L324-V327 PolarHBondContact O-N 3.4Å; L324-M328 WeakPolarHBondContact O-CB 3.31Å; L324-M328 VanDerWaalsContact O-CG 3.29Å; L324-M328 WeakPolarHBondContact O-CG 3.39Å; L324-M328 PolarHBondContact O-N 3.48Å
325	G	81.7	Confident	77.9	Confident	41 Å²	41	95 Å²	95	42%	0.423	54%	0.544	S	S	.	.	H	α-helix	trans	-60.2	-44.6	174.4	0	0	0	0	0	112.8	L321 A322 V323 M328 A329	L321-G325 PolarHBondContact O-N 2.85Å; A322-G325 PolarHBondContact O-N 3.32Å; V323-G325 PolarHBondContact O-N 2.87Å; G325-M328 PolarHBondContact O-N 3.15Å; G325-A329 WeakPolarHBondContact O-CB 3.01Å; G325-A329 PolarHBondContact O-N 3.33Å
326	A	79.5	Confident	76.2	Confident	55 Å²	55	98.5 Å²	98.5	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-64.1	-42.7	176.4	0	0	0	0	0	112.4	A322 V323 A329 V330	A322-A326 WeakPolarHBondContact O-CB 3.26Å; A322-A326 PolarHBondContact O-N 3.33Å; V323-A326 PolarHBondContact O-N 3.13Å; A326-A329 PolarHBondContact O-N 3.02Å; A326-V330 WeakPolarHBondContact O-CG2 3.47Å; A326-V330 PolarHBondContact O-N 2.85Å
327	V	79.9	Confident	74.8	Confident	79 Å²	79	100.4 Å²	100.4	48%	0.479	56%	0.564	S	S	.	*	H	α-helix	trans	-62.1	-45.5	175.3	170.3	0	0	0	0	110.8	V323 L324 A329 V330 V331	V323-V327 HydrophobicContact CG1-CG2 4.47Å; V323-V327 WeakPolarHBondContact O-CG2 3.49Å; V323-V327 PolarHBondContact O-N 3.36Å; L324-V327 PolarHBondContact O-N 3.4Å; V327-A329 PolarHBondContact O-N 3.07Å; V327-V330 PolarHBondContact O-N 3.24Å; V327-V331 HydrophobicContact CG1-CG2 4.41Å; V327-V331 WeakPolarHBondContact O-CB 3.18Å; V327-V331 VanDerWaalsContact O-CG2 3.31Å; V327-V331 WeakPolarHBondContact O-CG2 3.47Å; V327-V331 PolarHBondContact O-N 3.09Å
328	M	75.9	Confident	73	Confident	120 Å²	120	101 Å²	101	59%	0.591	57%	0.572	S	S	*	*	H	α-helix	trans	-62.6	-41.3	176.9	-72	-64	-72.3	0	0	112.1	L324 G325 V331 M332	L324-M328 WeakPolarHBondContact O-CB 3.31Å; L324-M328 VanDerWaalsContact O-CG 3.29Å; L324-M328 WeakPolarHBondContact O-CG 3.39Å; L324-M328 PolarHBondContact O-N 3.48Å; G325-M328 PolarHBondContact O-N 3.15Å; M328-V331 PolarHBondContact O-N 2.74Å; M328-M332 WeakPolarHBondContact O-CB 3.29Å; M328-M332 WeakPolarHBondContact O-CG 3.45Å; M328-M332 PolarHBondContact O-N 3Å
329	A	74.6	Confident	71.1	Confident	52 Å²	52	98.8 Å²	98.8	43%	0.43	58%	0.576	S	S	.	*	H	α-helix	trans	-61.7	-45.3	174.3	0	0	0	0	0	112	G325 A326 V327 V331 M332 C333	G325-A329 WeakPolarHBondContact O-CB 3.01Å; G325-A329 PolarHBondContact O-N 3.33Å; A326-A329 PolarHBondContact O-N 3.02Å; V327-A329 PolarHBondContact O-N 3.07Å; A329-V331 PolarHBondContact O-N 3.4Å; A329-M332 PolarHBondContact O-N 2.94Å; A329-C333 WeakPolarHBondContact O-CB 3.48Å; A329-C333 PolarHBondContact O-N 3.49Å; A329-C333 PolarHBondContact O-SG 3.46Å
330	V	74.1	Confident	68.7	Low	83 Å²	83	100.2 Å²	100.2	50%	0.503	60%	0.597	S	S	.	*	H	α-helix	trans	-63.3	-40.8	176.3	170	0	0	0	0	111.7	A326 V327 C333 R334	A326-V330 WeakPolarHBondContact O-CG2 3.47Å; A326-V330 PolarHBondContact O-N 2.85Å; V327-V330 PolarHBondContact O-N 3.24Å; V330-C333 PolarHBondContact O-N 2.9Å; V330-R334 WeakPolarHBondContact O-CB 3.48Å; V330-R334 WeakPolarHBondContact O-CG 3.44Å; V330-R334 PolarHBondContact O-N 3.16Å
331	V	73.7	Confident	66.3	Low	72 Å²	72	106.5 Å²	106.5	44%	0.436	62%	0.617	S	S	.	*	H	α-helix	trans	-66	-40.7	176.2	170	0	0	0	0	111.3	V327 M328 A329 R334 R335	V327-V331 HydrophobicContact CG1-CG2 4.41Å; V327-V331 WeakPolarHBondContact O-CB 3.18Å; V327-V331 VanDerWaalsContact O-CG2 3.31Å; V327-V331 WeakPolarHBondContact O-CG2 3.47Å; V327-V331 PolarHBondContact O-N 3.09Å; M328-V331 PolarHBondContact O-N 2.74Å; A329-V331 PolarHBondContact O-N 3.4Å; V331-R334 PolarHBondContact O-N 3.48Å; V331-R335 PolarHBondContact O-N 3.14Å
332	M	72.5	Confident	63.8	Low	133 Å²	133	105.5 Å²	105.5	66%	0.655	63%	0.632	S	S	*	*	H	α-helix	trans	-66.1	-42.4	174.3	-74	-174.9	70.3	0	0	112.2	M328 A329 R334 R335 K336	M328-M332 WeakPolarHBondContact O-CB 3.29Å; M328-M332 WeakPolarHBondContact O-CG 3.45Å; M328-M332 PolarHBondContact O-N 3Å; A329-M332 PolarHBondContact O-N 2.94Å; M332-R334 VanDerWaalsContact C-N 3.33Å; M332-R334 PolarHBondContact O-N 2.92Å; M332-R335 PolarHBondContact O-N 3.37Å; M332-K336 WeakPolarHBondContact O-CB 3.47Å; M332-K336 PolarHBondContact O-N 2.97Å
333	C	63.1	Low	61.3	Low	89 Å²	89	106.5 Å²	106.5	60%	0.601	65%	0.648	S	S	*	*	H	α-helix	trans	-61.3	-39.6	173.3	-75.8	0	0	0	0	112	A329 V330 K336 S337	A329-C333 WeakPolarHBondContact O-CB 3.48Å; A329-C333 PolarHBondContact O-N 3.49Å; A329-C333 PolarHBondContact O-SG 3.46Å; V330-C333 PolarHBondContact O-N 2.9Å; C333-K336 PolarHBondContact O-N 2.75Å; C333-S337 PolarHBondContact O-N 2.75Å; C333-S337 PolarHBondContact O-OG 3.16Å; C333-S337 VanDerWaalsContact O-OG 3.05Å
334	R	61.3	Low	58.9	Low	190 Å²	190	107.2 Å²	107.2	72%	0.717	66%	0.657	S	S	*	*	H	α-helix	trans	-69.6	-35.2	174.7	-79.6	-176.1	160.5	177.1	-4.9	113.6	V330 V331 M332 K336 S337	V330-R334 WeakPolarHBondContact O-CB 3.48Å; V330-R334 WeakPolarHBondContact O-CG 3.44Å; V330-R334 PolarHBondContact O-N 3.16Å; V331-R334 PolarHBondContact O-N 3.48Å; M332-R334 VanDerWaalsContact C-N 3.33Å; M332-R334 PolarHBondContact O-N 2.92Å; R334-K336 VanDerWaalsContact C-N 3.32Å; R334-S337 PolarHBondContact O-OG 3.16Å
335	R	57.6	Low	56.4	Low	208 Å²	208	107.9 Å²	107.9	79%	0.785	67%	0.669	S	S	*	*	H	α-helix	trans	-68.2	-29.8	170.2	-95.5	-177.2	164.5	175.8	-4.2	112.9	V331 M332 S338	V331-R335 PolarHBondContact O-N 3.14Å; M332-R335 PolarHBondContact O-N 3.37Å; R335-S338 PolarHBondContact O-OG 3.1Å
336	K	50.8	Low	54.1	Low	183 Å²	183	111 Å²	111	80%	0.796	68%	0.684	S	S	*	*	H	α-helix	trans	-84.4	-17.5	179.6	-162.7	169.7	-178.4	179.3	0	113.6	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.47Å; M332-K336 PolarHBondContact O-N 2.97Å; C333-K336 PolarHBondContact O-N 2.75Å; R334-K336 VanDerWaalsContact C-N 3.32Å
337	S	51.4	Low	51.9	Low	95 Å²	95	117.6 Å²	117.6	66%	0.664	71%	0.706	S	S	*	*	S	Bend	trans	-94.5	-0.6	176.4	55.5	0	0	0	0	114.9	C333 R334 G339	C333-S337 PolarHBondContact O-N 2.75Å; C333-S337 PolarHBondContact O-OG 3.16Å; C333-S337 VanDerWaalsContact O-OG 3.05Å; R334-S337 PolarHBondContact O-OG 3.16Å; S337-G339 VanDerWaalsContact C-N 3.34Å; S337-G339 PolarHBondContact O-N 2.91Å
338	S	48.2	Very low	49.7	Very low	103 Å²	103	118.4 Å²	118.4	72%	0.72	72%	0.721	S	S	*	*	S	Bend	trans	-92.8	26.2	174.4	71.1	0	0	0	0	114.2	R335	R335-S338 PolarHBondContact O-OG 3.1Å
339	G	44.2	Very low	47.6	Very low	66 Å²	66	117 Å²	117	68%	0.68	73%	0.728	S	S	*	*	S	Bend	trans	-168	112.9	177.6	0	0	0	0	0	114	S337	S337-G339 VanDerWaalsContact C-N 3.34Å; S337-G339 PolarHBondContact O-N 2.91Å
340	G	36	Very low	45.6	Very low	87 Å²	87	119.8 Å²	119.8	90%	0.897	74%	0.744	S	S	*	*			trans	124.5	116.1	170.6	0	0	0	0	0	114
341	K	33.6	Very low	43.6	Very low	219 Å²	219	121.2 Å²	121.2	95%	0.952	76%	0.758	S	S	*	*			trans	-127.2	129.8	-178.9	178.2	176.6	-179.9	176.7	0	109.5
342	G	32.5	Very low	41.8	Very low	83 Å²	83	125.8 Å²	125.8	86%	0.856	78%	0.78	S	S	*	*			trans	123.5	136.8	164.7	0	0	0	0	0	115.5
343	G	31	Very low	40.3	Very low	87 Å²	87	125.6 Å²	125.6	90%	0.897	79%	0.792	S	S	*	*			trans	150.4	91.3	171.8	0	0	0	0	0	114.4
344	S	33	Very low	39	Very low	108 Å²	108	125.8 Å²	125.8	76%	0.755	80%	0.8	S	S	*	*			trans	-63.4	158.8	179.8	-168.8	0	0	0	0	115.8
345	C	30.3	Very low	37.8	Very low	112 Å²	112	126.1 Å²	126.1	76%	0.757	81%	0.81	S	S	*	*			trans	31	147.9	152	-66.1	0	0	0	0	121.2
346	S	33.6	Very low	36.6	Very low	106 Å²	106	119.6 Å²	119.6	74%	0.741	81%	0.807	S	S	*	*			cis	-163.5	149.8	43.7	-45.2	0	0	0	0	114
347	Q	33.4	Very low	36	Very low	195 Å²	195	115.8 Å²	115.8	91%	0.911	80%	0.803	S	S	*	*			trans	18.5	137.1	135.7	-151.9	160.8	-0.8	0	0	121.7
348	A	33.3	Very low	35.3	Very low	95 Å²	95	118.6 Å²	118.6	79%	0.785	81%	0.811	S	S	*	*			trans	-87.4	154.4	176.4	0	0	0	0	0	114.3
349	A	31.4	Very low	34.6	Very low	91 Å²	91	122.3 Å²	122.3	75%	0.752	82%	0.817	S	S	*	*			trans	-176.4	135.6	132.1	0	0	0	0	0	114.4
350	S	32.7	Very low	34.2	Very low	110 Å²	110	123.1 Å²	123.1	77%	0.769	81%	0.812	S	S	*	*			trans	42.5	122.1	144.8	63.7	0	0	0	0	123.7
351	S	32.5	Very low	34.1	Very low	114 Å²	114	127 Å²	127	80%	0.797	81%	0.811	S	S	*	*				171.5	121.4	107.1	39.2	0	0	0	0	110.1
352	N	35.4	Very low	34.3	Very low	168 Å²	168	124.5 Å²	124.5	90%	0.898	81%	0.807	S	S	*	*				60.5	101.4	81.5	-91.2	14.3	0	0	0	115.9
353	S	40	Very low	34.4	Very low	129 Å²	129	124.7 Å²	124.7	90%	0.902	80%	0.8	S	S	*	*			trans	-157.3	152.8	144.7	51.5	0	0	0	0	109.7
354	A	36.3	Very low	34.3	Very low	93 Å²	93	126 Å²	126	77%	0.769	79%	0.794	S	S	*	*			trans	-142.4	147.5	-166.6	0	0	0	0	0	112.5
355	Q	37.2	Very low	34.4	Very low	197 Å²	197	130.4 Å²	130.4	92%	0.921	80%	0.8	S	S	*	*			trans	175	132.7	155.7	-98.1	156.9	-19.4	0	0	105.3
356	G	30.8	Very low	34.6	Very low	70 Å²	70	133.3 Å²	133.3	72%	0.722	83%	0.832	S	S	*	*				95.2	123.7	60	0	0	0	0	0	107.5
357	S	39.3	Very low	34.6	Very low	104 Å²	104	134.7 Å²	134.7	73%	0.727	84%	0.837	S	S	*	*			cis	-158.6	168.2	18.8	-46.6	0	0	0	0	111.7
358	D	37.6	Very low	34.7	Very low	154 Å²	154	131.5 Å²	131.5	82%	0.824	83%	0.833	S	S	*	*			trans	43.3	147.7	144.3	-45.5	-26.3	0	0	0	120.5
359	E	33	Very low	34.8	Very low	180 Å²	180	133.6 Å²	133.6	84%	0.841	84%	0.836	S	S	*	*			cis	-156.4	167.8	-9.8	-126.5	-146	118.8	0	0	105.8
360	S	34.4	Very low	35	Very low	83 Å²	83	136.1 Å²	136.1	58%	0.58	84%	0.84	S	S	*	*			cis	-149.8	-172.6	4.8	64.4	0	0	0	0	109.8
361	L	34.5	Very low	35.1	Very low	168 Å²	168	137.7 Å²	137.7	88%	0.88	85%	0.845	S	S	*	*			trans	-139.8	123.5	169.3	-97	165.4	0	0	0	110.3
362	I	37.5	Very low	35.3	Very low	168 Å²	168	139.3 Å²	139.3	86%	0.862	85%	0.848	S	S	*	*			trans	-87.5	123.6	167.1	-68.3	175.5	0	0	0	108.6
363	A	34.3	Very low	35.3	Very low	87 Å²	87	137.2 Å²	137.2	72%	0.719	85%	0.845	S	S	*	*			trans	-107.3	124	178.9	0	0	0	0	0	112.6
364	C	30.4	Very low	34.9	Very low	114 Å²	114	137.8 Å²	137.8	77%	0.77	84%	0.84	S	S	*	*			trans	35.9	127.6	141.3	-67.2	0	0	0	0	122.7
365	K	33.9	Very low	34.8	Very low	200 Å²	200	141.6 Å²	141.6	87%	0.87	85%	0.846	S	S	*	*			trans	62.3	117.8	134.1	-72.4	-175.5	169.7	-177	0	120.2
366	A	34.8	Very low	34.6	Very low	174 Å²	174	136.5 Å²	136.5	100%	1.438	84%	0.839	S	S	*	*				-126	0	103.1	0	0	0	0	0	108.4

Retrieved 366 of 366 residues in 71.3 ms (Link to these results)

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