A0A087YM60_POEFO Loading...

Transmembrane p24 trafficking protein 7

AlphaFold DB , UniProt , Accession A0A087YM60, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 216 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	V	57.3	Low	71.5	Confident	148 Å²	148	134.5 Å²	134.5	90%	0.897	65%	0.649	S	S	*	*				0	-52.3	0	-169.6	0	0	0	0	112.9	R3 M4 F5	V1-R3 PolarHBondContact O-N 3.47Å; V1-M4 PolarHBondContact O-N 3.06Å; V1-F5 HydrophobicContact CG1-CD2 4.11Å; V1-F5 HydrophobicContact CG1-CE2 4.27Å; V1-F5 PolarHBondContact O-N 2.82Å
2	S	59.3	Low	72.6	Confident	100 Å²	100	131.2 Å²	131.2	70%	0.699	64%	0.636	S	S	*	*	H	α-helix	trans	-63.7	-37.3	-176.7	72.1	0	0	0	0	115.2	M4 F5 R6	S2-M4 VanDerWaalsContact C-N 3.35Å; S2-M4 PolarHBondContact O-N 2.92Å; S2-F5 PolarHBondContact O-N 2.8Å; S2-R6 PolarHBondContact O-N 2.82Å; S2-R6 VanDerWaalsContact O-N 3.14Å
3	R	61.8	Low	73.4	Confident	223 Å²	223	131.5 Å²	131.5	84%	0.842	64%	0.635	S	S	*	*	H	α-helix	trans	-65.5	-35.1	176.7	-70.3	-174.3	178.9	-175.1	-0.5	113	V1 R6 S7	V1-R3 PolarHBondContact O-N 3.47Å; R3-R6 PolarHBondContact O-N 2.57Å; R3-S7 PolarHBondContact O-N 2.92Å; R3-S7 VanDerWaalsContact O-N 3.13Å
4	M	67.3	Low	74.1	Confident	144 Å²	144	128.1 Å²	128.1	71%	0.709	63%	0.626	S	S	*	*	H	α-helix	trans	-71.5	-40.7	179.1	-160.6	169.5	86.7	0	0	111.5	V1 S2 R6 S7 L8	V1-M4 PolarHBondContact O-N 3.06Å; S2-M4 VanDerWaalsContact C-N 3.35Å; S2-M4 PolarHBondContact O-N 2.92Å; M4-R6 VanDerWaalsContact C-N 3.31Å; M4-R6 PolarHBondContact O-N 2.63Å; M4-S7 PolarHBondContact O-N 3.01Å; M4-L8 WeakPolarHBondContact O-CB 3.42Å; M4-L8 PolarHBondContact O-N 2.56Å
5	F	68.1	Low	74.6	Confident	125 Å²	125	126.1 Å²	126.1	55%	0.548	62%	0.619	S	S	.	*	H	α-helix	trans	-63.9	-34.1	173.3	-98.7	-89.7	0	0	0	113.1	V1 S2 R9	V1-F5 HydrophobicContact CG1-CD2 4.11Å; V1-F5 HydrophobicContact CG1-CE2 4.27Å; V1-F5 PolarHBondContact O-N 2.82Å; S2-F5 PolarHBondContact O-N 2.8Å; F5-R9 WeakPolarHBondContact O-CG 3.47Å; F5-R9 PolarHBondContact O-N 3.26Å; F5-R9 VanDerWaalsContact O-N 3.11Å
6	R	71.6	Confident	74.8	Confident	196 Å²	196	128.9 Å²	128.9	74%	0.74	62%	0.621	S	S	*	*	H	α-helix	trans	-70.5	-41.6	177.3	-138.8	176	-167.3	-148	2.9	111.8	S2 R3 M4 R9 L10	S2-R6 PolarHBondContact O-N 2.82Å; S2-R6 VanDerWaalsContact O-N 3.14Å; R3-R6 PolarHBondContact O-N 2.57Å; M4-R6 VanDerWaalsContact C-N 3.31Å; M4-R6 PolarHBondContact O-N 2.63Å; R6-R9 PolarHBondContact O-N 3.43Å; R6-L10 PolarHBondContact O-N 3.3Å; R6-L10 VanDerWaalsContact O-N 3.1Å
7	S	71.9	Confident	74.8	Confident	65 Å²	65	124.5 Å²	124.5	46%	0.455	61%	0.61	S	S	.	*	H	α-helix	trans	-65.3	-39.9	175.6	-164.6	0	0	0	0	112.2	R3 M4 L10 L11	R3-S7 PolarHBondContact O-N 2.92Å; R3-S7 VanDerWaalsContact O-N 3.13Å; M4-S7 PolarHBondContact O-N 3.01Å; S7-L10 PolarHBondContact O-N 2.8Å; S7-L11 WeakPolarHBondContact O-CG 3.31Å; S7-L11 PolarHBondContact O-N 2.88Å
8	L	79.9	Confident	74.5	Confident	99 Å²	99	125.6 Å²	125.6	52%	0.518	61%	0.614	S	S	.	*	H	α-helix	trans	-68.2	-38.8	178.6	-170.8	67	0	0	0	112.1	M4 L11 L12	M4-L8 WeakPolarHBondContact O-CB 3.42Å; M4-L8 PolarHBondContact O-N 2.56Å; L8-L11 PolarHBondContact O-N 2.63Å; L8-L12 HydrophobicContact CG-CD1 4.2Å; L8-L12 WeakPolarHBondContact O-CB 3.45Å; L8-L12 PolarHBondContact O-N 3.19Å
9	R	82.5	Confident	74.2	Confident	179 Å²	179	126.6 Å²	126.6	68%	0.675	62%	0.622	S	S	*	*	H	α-helix	trans	-64.6	-41.1	173.4	-80.8	-174.6	177	-168.5	-0.3	112.6	F5 R6 L12 Q13	F5-R9 WeakPolarHBondContact O-CG 3.47Å; F5-R9 PolarHBondContact O-N 3.26Å; F5-R9 VanDerWaalsContact O-N 3.11Å; R6-R9 PolarHBondContact O-N 3.43Å; R9-L12 PolarHBondContact O-N 2.79Å; R9-Q13 WeakPolarHBondContact O-CB 3.41Å; R9-Q13 VanDerWaalsContact O-CG 3.29Å; R9-Q13 WeakPolarHBondContact O-CG 3.3Å; R9-Q13 PolarHBondContact O-N 2.99Å
10	L	82.3	Confident	73.6	Confident	100 Å²	100	126.6 Å²	126.6	52%	0.524	62%	0.624	S	S	.	*	H	α-helix	trans	-62.7	-44.3	175.1	-86.3	155.4	0	0	0	111.5	R6 S7 Q13 V14	R6-L10 PolarHBondContact O-N 3.3Å; R6-L10 VanDerWaalsContact O-N 3.1Å; S7-L10 PolarHBondContact O-N 2.8Å; L10-Q13 PolarHBondContact O-N 3.18Å; L10-V14 VanDerWaalsContact O-CG2 3.31Å; L10-V14 WeakPolarHBondContact O-CG2 3.46Å; L10-V14 PolarHBondContact O-N 3.02Å
11	L	84.8	Confident	72.7	Confident	101 Å²	101	125.2 Å²	125.2	53%	0.529	63%	0.625	S	S	.	*	H	α-helix	trans	-62.6	-43.7	176.1	-77	164	0	0	0	112.2	S7 L8 Q13 V14 L15	S7-L11 WeakPolarHBondContact O-CG 3.31Å; S7-L11 PolarHBondContact O-N 2.88Å; L8-L11 PolarHBondContact O-N 2.63Å; L11-Q13 VanDerWaalsContact C-N 3.33Å; L11-Q13 PolarHBondContact O-N 2.82Å; L11-V14 PolarHBondContact O-N 3.38Å; L11-L15 WeakPolarHBondContact O-CB 3.25Å; L11-L15 PolarHBondContact O-N 2.04Å
12	L	84.9	Confident	72.9	Confident	94 Å²	94	120.7 Å²	120.7	49%	0.492	61%	0.608	S	S	.	*	H	α-helix	trans	-63.3	-37.6	175.3	-89	154.8	0	0	0	112.5	L8 R9 W16	L8-L12 HydrophobicContact CG-CD1 4.2Å; L8-L12 WeakPolarHBondContact O-CB 3.45Å; L8-L12 PolarHBondContact O-N 3.19Å; R9-L12 PolarHBondContact O-N 2.79Å; L12-W16 WeakPolarHBondContact O-CB 3.42Å; L12-W16 PolarHBondContact O-N 2.8Å
13	Q	82.6	Confident	72.6	Confident	135 Å²	135	127.8 Å²	127.8	63%	0.631	62%	0.62	S	S	*	*	H	α-helix	trans	-68.7	-39.4	175.8	-77.3	-179.5	-30.7	0	0	112.4	R9 L10 L11 W16 A17	R9-Q13 WeakPolarHBondContact O-CB 3.41Å; R9-Q13 VanDerWaalsContact O-CG 3.29Å; R9-Q13 WeakPolarHBondContact O-CG 3.3Å; R9-Q13 PolarHBondContact O-N 2.99Å; L10-Q13 PolarHBondContact O-N 3.18Å; L11-Q13 VanDerWaalsContact C-N 3.33Å; L11-Q13 PolarHBondContact O-N 2.82Å; Q13-W16 PolarHBondContact O-N 3.02Å; Q13-A17 WeakPolarHBondContact O-CB 3.4Å; Q13-A17 PolarHBondContact O-N 3.25Å
14	V	83.5	Confident	72.1	Confident	84 Å²	84	123.8 Å²	123.8	51%	0.509	62%	0.62	S	S	.	*	H	α-helix	trans	-67.2	-43.4	175	173	0	0	0	0	110.7	L10 L11 W16 A17 Q18	L10-V14 VanDerWaalsContact O-CG2 3.31Å; L10-V14 WeakPolarHBondContact O-CG2 3.46Å; L10-V14 PolarHBondContact O-N 3.02Å; L11-V14 PolarHBondContact O-N 3.38Å; V14-W16 PolarHBondContact O-N 2.94Å; V14-A17 PolarHBondContact O-N 2.79Å; V14-Q18 WeakPolarHBondContact O-CG 3.41Å; V14-Q18 PolarHBondContact O-N 2.82Å
15	L	80.6	Confident	71.6	Confident	98 Å²	98	125 Å²	125	51%	0.513	63%	0.626	S	S	.	*	H	α-helix	trans	-61.7	-41	174.6	-87.1	156.3	0	0	0	112.2	L11 Q18 L19	L11-L15 WeakPolarHBondContact O-CB 3.25Å; L11-L15 PolarHBondContact O-N 2.04Å; L15-Q18 PolarHBondContact O-N 3.35Å; L15-L19 PolarHBondContact O-N 2.9Å
16	W	78	Confident	71.1	Confident	171 Å²	171	121.6 Å²	121.6	65%	0.648	63%	0.627	S	S	*	*	H	α-helix	trans	-64.2	-40.6	172.8	-108.7	77.7	0	0	0	112.5	L12 Q13 V14 Q18 L19 L20	L12-W16 WeakPolarHBondContact O-CB 3.42Å; L12-W16 PolarHBondContact O-N 2.8Å; Q13-W16 PolarHBondContact O-N 3.02Å; V14-W16 PolarHBondContact O-N 2.94Å; W16-Q18 VanDerWaalsContact C-N 3.34Å; W16-L19 PolarHBondContact O-N 3.12Å; W16-L20 HydrophobicContact CE3-CD1 3.93Å; W16-L20 HydrophobicContact CE3-CG 4.25Å; W16-L20 HydrophobicContact CZ3-CD1 4.39Å; W16-L20 WeakPolarHBondContact O-CB 3.35Å; W16-L20 VanDerWaalsContact O-CG 3.29Å; W16-L20 WeakPolarHBondContact O-CG 2.99Å; W16-L20 PolarHBondContact O-N 3.11Å
17	A	75.6	Confident	71.2	Confident	54 Å²	54	115.2 Å²	115.2	45%	0.446	61%	0.612	S	S	.	*	H	α-helix	trans	-65.5	-37.2	176.5	0	0	0	0	0	112.1	Q13 V14 L20 C21	Q13-A17 WeakPolarHBondContact O-CB 3.4Å; Q13-A17 PolarHBondContact O-N 3.25Å; V14-A17 PolarHBondContact O-N 2.79Å; A17-L20 PolarHBondContact O-N 2.98Å; A17-C21 PolarHBondContact O-N 3.24Å; A17-C21 VanDerWaalsContact O-N 3.15Å
18	Q	69.3	Low	71.9	Confident	145 Å²	145	116.3 Å²	116.3	68%	0.678	61%	0.61	S	S	*	*	H	α-helix	trans	-71.1	-31.4	174.6	-69	-157.9	-51.3	0	0	113	V14 L15 W16	V14-Q18 WeakPolarHBondContact O-CG 3.41Å; V14-Q18 PolarHBondContact O-N 2.82Å; L15-Q18 PolarHBondContact O-N 3.35Å; W16-Q18 VanDerWaalsContact C-N 3.34Å
19	L	67.8	Low	72.5	Confident	145 Å²	145	115.2 Å²	115.2	76%	0.759	60%	0.604	S	S	*	*	H	α-helix	trans	-71.9	-27.9	171.6	-109	134.2	0	0	0	113.1	L15 W16	L15-L19 PolarHBondContact O-N 2.9Å; W16-L19 PolarHBondContact O-N 3.12Å
20	L	63	Low	73	Confident	126 Å²	126	110.3 Å²	110.3	66%	0.66	59%	0.594	S	S	*	*	H	α-helix	trans	-81.2	-19.4	176.4	-74.5	169.6	0	0	0	113.3	W16 A17 G22	W16-L20 HydrophobicContact CE3-CD1 3.93Å; W16-L20 HydrophobicContact CE3-CG 4.25Å; W16-L20 HydrophobicContact CZ3-CD1 4.39Å; W16-L20 WeakPolarHBondContact O-CB 3.35Å; W16-L20 VanDerWaalsContact O-CG 3.29Å; W16-L20 WeakPolarHBondContact O-CG 2.99Å; W16-L20 PolarHBondContact O-N 3.11Å; A17-L20 PolarHBondContact O-N 2.98Å; L20-G22 PolarHBondContact O-N 2.82Å
21	C	54.8	Low	73.6	Confident	97 Å²	97	106.8 Å²	106.8	66%	0.655	58%	0.575	S	S	*	*	S	Bend	trans	-73.6	76.5	163.9	-80	0	0	0	0	109	A17 W23	A17-C21 PolarHBondContact O-N 3.24Å; A17-C21 VanDerWaalsContact O-N 3.15Å; C21-W23 PolarHBondContact O-N 2.85Å
22	G	60.8	Low	74.2	Confident	53 Å²	53	108.9 Å²	108.9	55%	0.546	58%	0.582	S	S	.	*			trans	-51.8	139.9	162.9	0	0	0	0	0	109.5	L20 V24	L20-G22 PolarHBondContact O-N 2.82Å; G22-V24 PolarHBondContact O-N 2.88Å
23	W	53.8	Low	74.7	Confident	249 Å²	249	104.4 Å²	104.4	94%	0.943	56%	0.558	S	S	*	*			trans	-62.5	106.7	171	-74.4	47.7	0	0	0	107	C21 M25	C21-W23 PolarHBondContact O-N 2.85Å; W23-M25 PolarHBondContact O-N 3.11Å; W23-M25 VanDerWaalsContact O-N 3.11Å
24	V	51.3	Low	75.4	Confident	139 Å²	139	101.2 Å²	101.2	84%	0.842	55%	0.549	S	S	*	.			trans	-74.4	100.9	170.1	178.3	0	0	0	0	105.9	G22 G26	G22-V24 PolarHBondContact O-N 2.88Å; V24-G26 PolarHBondContact O-N 2.82Å
25	M	56.1	Low	75.9	Confident	169 Å²	169	101 Å²	101	83%	0.833	55%	0.545	S	S	*	.			trans	-79.5	104.8	163.5	-70.8	-100.5	51.3	0	0	106.3	W23	W23-M25 PolarHBondContact O-N 3.11Å; W23-M25 VanDerWaalsContact O-N 3.11Å
26	G	58.1	Low	76.5	Confident	55 Å²	55	101.5 Å²	101.5	57%	0.567	55%	0.549	S	S	*	.			trans	-103.5	127.7	170	0	0	0	0	0	109.2	V24 E28	V24-G26 PolarHBondContact O-N 2.82Å; G26-E28 VanDerWaalsContact C-N 3.3Å
27	S	73.4	Confident	77.4	Confident	62 Å²	62	94.6 Å²	94.6	43%	0.434	53%	0.528	S	S	.	.	S	Bend	trans	-83.6	-12.3	167.6	59.3	0	0	0	0	112.5	D117 F118	S27-D117 WeakPolarHBondContact CB-OD1 2.99Å; S27-D117 PolarHBondContact OG-OD1 2.93Å; S27-F118 PolarHBondContact O-N 2.83Å
28	E	87.8	Confident	78.4	Confident	87 Å²	87	98.3 Å²	98.3	41%	0.407	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.8	-176.8	-56.3	178.8	165.8	0	0	110.8	G26 Y115 F116 D117	G26-E28 VanDerWaalsContact C-N 3.3Å; E28-Y115 HydrophobicContact CB-CE2 4.07Å; E28-Y115 VanDerWaalsContact CG-OH 3.27Å; E28-Y115 WeakPolarHBondContact CG-OH 3.41Å; E28-Y115 PolarHBondContact OE1-OH 2.87Å; E28-Y115 PolarHBondContact OE2-OH 3.19Å; E28-F116 CarbonylContact C-O 3.57Å; E28-F116 WeakPolarHBondContact CA-O 3.28Å; E28-D117 HydrophobicContact CG-CB 3.94Å; E28-D117 WeakPolarHBondContact CG-OD1 3.24Å
29	L	91.3	Very high	79.7	Confident	76 Å²	76	95.6 Å²	95.6	40%	0.398	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	133	175.8	179.8	63.9	0	0	0	111.3	F31 F41 Y115 F116	L29-F31 HydrophobicContact CG-CB 4.45Å; L29-F41 HydrophobicContact CD2-CE1 3.67Å; L29-F41 HydrophobicContact CD2-CZ 4.06Å; L29-Y115 WeakPolarHBondContact O-CA 3.12Å; L29-F116 HydrophobicContact CB-CD1 4.37Å; L29-F116 HydrophobicContact CB-CE1 3.72Å; L29-F116 HydrophobicContact CB-CE2 4.37Å; L29-F116 HydrophobicContact CB-CZ 3.73Å; L29-F116 HydrophobicContact CD2-CE1 3.89Å; L29-F116 HydrophobicContact CD2-CZ 3.98Å; L29-F116 HydrophobicContact CG-CE1 4.11Å; L29-F116 HydrophobicContact CG-CZ 4.37Å; L29-F116 PolarHBondContact N-O 3.49Å; L29-F116 PolarHBondContact O-N 3.01Å
30	T	93.5	Very high	81.1	Confident	76 Å²	76	90 Å²	90	47%	0.466	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.9	164.4	-50.1	0	0	0	0	109	T113 V114 Y115	T30-T113 HydrophobicContact CG2-CG2 3.51Å; T30-V114 WeakPolarHBondContact CA-O 3.33Å; T30-Y115 WeakPolarHBondContact OG1-CD2 3.2Å
31	F	95.3	Very high	82.7	Confident	27 Å²	27	85.8 Å²	85.8	12%	0.118	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	157.1	179.1	75.7	-79.5	0	0	0	111.9	L29 L33 Q39 F41 F102 T113 V114 F116	L29-F31 HydrophobicContact CG-CB 4.45Å; F31-L33 HydrophobicContact CD2-CB 4.48Å; F31-L33 HydrophobicContact CE2-CB 3.81Å; F31-L33 HydrophobicContact CE2-CD1 4.12Å; F31-L33 HydrophobicContact CE2-CG 4.42Å; F31-L33 HydrophobicContact CZ-CB 4.47Å; F31-Q39 HydrophobicContact CD2-CB 4.48Å; F31-Q39 HydrophobicContact CD2-CG 4.28Å; F31-Q39 HydrophobicContact CE2-CB 3.67Å; F31-Q39 HydrophobicContact CE2-CG 3.88Å; F31-Q39 HydrophobicContact CZ-CB 4.21Å; F31-Q39 HydrophobicContact CZ-CG 4.48Å; F31-F41 HydrophobicContact CD1-CE2 4.18Å; F31-F41 AromaticContact CD1-CZ 3.9Å; F31-F41 HydrophobicContact CD1-CZ 3.9Å; F31-F41 HydrophobicContact CD2-CZ 4.37Å; F31-F41 AromaticContact CE1-CE2 3.71Å; F31-F41 HydrophobicContact CE1-CE2 3.71Å; F31-F41 AromaticContact CE1-CZ 3.91Å; F31-F41 HydrophobicContact CE1-CZ 3.91Å; F31-F41 HydrophobicContact CE2-CE2 4.36Å; F31-F41 HydrophobicContact CE2-CZ 4.38Å; F31-F41 HydrophobicContact CG-CZ 4.14Å; F31-F41 AromaticContact CZ-CE2 3.82Å; F31-F41 HydrophobicContact CZ-CE2 3.82Å; F31-F41 HydrophobicContact CZ-CZ 4.16Å; F31-F102 AromaticContact CE1-CD2 3.9Å; F31-F102 HydrophobicContact CE1-CD2 3.9Å; F31-F102 HydrophobicContact CE1-CE2 4.33Å; F31-F102 HydrophobicContact CZ-CB 4.05Å; F31-F102 AromaticContact CZ-CD2 3.78Å; F31-F102 HydrophobicContact CZ-CD2 3.78Å; F31-F102 HydrophobicContact CZ-CG 4.17Å; F31-T113 WeakPolarHBondContact O-CA 3.16Å; F31-V114 HydrophobicContact CD1-CB 4.44Å; F31-V114 WeakPolarHBondContact CD1-O 3.47Å; F31-V114 HydrophobicContact CE1-CB 3.86Å; F31-V114 HydrophobicContact CE1-CG1 4.16Å; F31-V114 HydrophobicContact CZ-CB 4.1Å; F31-V114 PolarHBondContact N-O 2.81Å; F31-V114 PolarHBondContact O-N 3.02Å; F31-F116 AromaticContact CD1-CD1 3.97Å; F31-F116 HydrophobicContact CD1-CD1 3.97Å; F31-F116 AromaticContact CD1-CE1 3.87Å; F31-F116 HydrophobicContact CD1-CE1 3.87Å; F31-F116 AromaticContact CE1-CD1 3.75Å; F31-F116 HydrophobicContact CE1-CD1 3.75Å; F31-F116 AromaticContact CE1-CE1 3.89Å; F31-F116 HydrophobicContact CE1-CE1 3.89Å
32	E	95.9	Very high	84.6	Confident	144 Å²	144	87.9 Å²	87.9	67%	0.673	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	125.1	172.6	-66	-176.9	175.7	0	0	109.7	K112	E32-K112 CarbonylContact C-O 3.6Å
33	L	96.8	Very high	86.2	Confident	0 Å²	0	89.8 Å²	89.8	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	109.8	175.7	-176.7	59.1	0	0	0	108.6	F31 Q39 V65 F102 N104 H111 K112 V114	F31-L33 HydrophobicContact CD2-CB 4.48Å; F31-L33 HydrophobicContact CE2-CB 3.81Å; F31-L33 HydrophobicContact CE2-CD1 4.12Å; F31-L33 HydrophobicContact CE2-CG 4.42Å; F31-L33 HydrophobicContact CZ-CB 4.47Å; L33-Q39 HydrophobicContact CD1-CB 3.84Å; L33-V65 HydrophobicContact CD2-CG2 3.79Å; L33-F102 HydrophobicContact CD2-CB 3.98Å; L33-N104 HydrophobicContact CD2-CB 3.63Å; L33-N104 HydrophobicContact CG-CB 3.7Å; L33-H111 WeakPolarHBondContact O-CA 3.41Å; L33-K112 PolarHBondContact N-O 3.23Å; L33-K112 PolarHBondContact O-N 2.86Å; L33-V114 HydrophobicContact CD2-CG2 4.49Å
34	P	96	Very high	88.1	Confident	68 Å²	68	83.3 Å²	83.3	44%	0.442	44%	0.444	S	S	.	.			trans	-60.7	165.1	-178.6	-23.4	33.6	0	0	0	113.3	A37 N104	P34-A37 HydrophobicContact CB-CB 3.84Å; P34-A37 HydrophobicContact CG-CB 4.23Å; P34-N104 WeakPolarHBondContact O-CB 3.46Å; P34-N104 PolarHBondContact O-ND2 3.28Å
35	D	94.2	Very high	90.2	Very high	80 Å²	80	77 Å²	77	43%	0.428	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	145.5	167.9	56.6	-62.9	0	0	0	111	A37 S107	D35-A37 PolarHBondContact O-N 2.97Å; D35-S107 WeakPolarHBondContact CB-O 3.26Å
36	N	94.3	Very high	92	Very high	109 Å²	109	74.5 Å²	74.5	58%	0.583	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	29.7	-177.8	-161.2	17.6	0	0	0	115.1	N104 S107	N36-N104 PolarHBondContact N-O 2.93Å; N36-S107 PolarHBondContact N-O 2.55Å
37	A	95.8	Very high	93.7	Very high	25 Å²	25	75.2 Å²	75.2	21%	0.207	39%	0.388	C	S	.	.			trans	-124.7	159.2	-175.1	0	0	0	0	0	112.3	P34 D35 N104	P34-A37 HydrophobicContact CB-CB 3.84Å; P34-A37 HydrophobicContact CG-CB 4.23Å; D35-A37 PolarHBondContact O-N 2.97Å; A37-N104 CarbonylContact O-C 3.6Å; A37-N104 PolarHBondContact O-N 3.32Å
38	K	96.4	Very high	94.6	Very high	132 Å²	132	74.8 Å²	74.8	57%	0.574	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	140.8	170.7	70.2	-176.3	176.7	-163.2	0	109.8	F102	K38-F102 CarbonylContact C-O 3.54Å; K38-F102 VanDerWaalsContact CA-O 3.31Å; K38-F102 WeakPolarHBondContact CA-O 3.21Å
39	Q	97.3	Very high	94.9	Very high	88 Å²	88	71.8 Å²	71.8	41%	0.411	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	132.8	176	-169.6	64.5	20.6	0	0	109	F31 L33 F41 C101 F102	F31-Q39 HydrophobicContact CD2-CB 4.48Å; F31-Q39 HydrophobicContact CD2-CG 4.28Å; F31-Q39 HydrophobicContact CE2-CB 3.67Å; F31-Q39 HydrophobicContact CE2-CG 3.88Å; F31-Q39 HydrophobicContact CZ-CB 4.21Å; F31-Q39 HydrophobicContact CZ-CG 4.48Å; L33-Q39 HydrophobicContact CD1-CB 3.84Å; Q39-F41 HydrophobicContact CB-CE2 4.42Å; Q39-F41 HydrophobicContact CG-CE1 4.49Å; Q39-F41 HydrophobicContact CG-CE2 3.79Å; Q39-F41 HydrophobicContact CG-CZ 3.7Å; Q39-C101 CarbonylContact O-C 3.48Å; Q39-C101 VanDerWaalsContact O-CA 3.25Å; Q39-C101 WeakPolarHBondContact O-CA 3.4Å; Q39-F102 PolarHBondContact N-O 3.31Å; Q39-F102 PolarHBondContact O-N 2.94Å
40	C	97	Very high	95	Very high	27 Å²	27	73.6 Å²	73.6	18%	0.182	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144.8	179.9	-61.9	0	0	0	0	110.6	Y42 F100 C101	C40-Y42 HydrophobicContact CB-CE2 4.1Å; C40-F100 CarbonylContact C-O 3.57Å; C40-F100 WeakPolarHBondContact CA-O 3.28Å; C40-C101 HydrophobicContact CB-CB 4.07Å; C40-C101 WeakPolarHBondContact CB-SG 3.42Å; C40-C101 WeakPolarHBondContact SG-CB 3.41Å; C40-C101 CovalentContact SG-SG 2.04Å; C40-C101 PolarHBondContact SG-SG 2.62Å
41	F	96.6	Very high	95	Very high	39 Å²	39	70 Å²	70	17%	0.171	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	155.1	177.7	-58.6	-86.6	0	0	0	108.9	L29 F31 Q39 K99 F100 F102 F116	L29-F41 HydrophobicContact CD2-CE1 3.67Å; L29-F41 HydrophobicContact CD2-CZ 4.06Å; F31-F41 HydrophobicContact CD1-CE2 4.18Å; F31-F41 AromaticContact CD1-CZ 3.9Å; F31-F41 HydrophobicContact CD1-CZ 3.9Å; F31-F41 HydrophobicContact CD2-CZ 4.37Å; F31-F41 AromaticContact CE1-CE2 3.71Å; F31-F41 HydrophobicContact CE1-CE2 3.71Å; F31-F41 AromaticContact CE1-CZ 3.91Å; F31-F41 HydrophobicContact CE1-CZ 3.91Å; F31-F41 HydrophobicContact CE2-CE2 4.36Å; F31-F41 HydrophobicContact CE2-CZ 4.38Å; F31-F41 HydrophobicContact CG-CZ 4.14Å; F31-F41 AromaticContact CZ-CE2 3.82Å; F31-F41 HydrophobicContact CZ-CE2 3.82Å; F31-F41 HydrophobicContact CZ-CZ 4.16Å; Q39-F41 HydrophobicContact CB-CE2 4.42Å; Q39-F41 HydrophobicContact CG-CE1 4.49Å; Q39-F41 HydrophobicContact CG-CE2 3.79Å; Q39-F41 HydrophobicContact CG-CZ 3.7Å; F41-K99 WeakPolarHBondContact O-CA 3.44Å; F41-F100 HydrophobicContact CB-CD1 4.26Å; F41-F100 HydrophobicContact CB-CD2 4Å; F41-F100 HydrophobicContact CB-CE1 3.73Å; F41-F100 HydrophobicContact CB-CE2 3.45Å; F41-F100 VanDerWaalsContact CB-CE2 3.45Å; F41-F100 HydrophobicContact CB-CG 4.38Å; F41-F100 HydrophobicContact CB-CZ 3.3Å; F41-F100 HydrophobicContact CD2-CD2 4.18Å; F41-F100 AromaticContact CD2-CE2 3.79Å; F41-F100 HydrophobicContact CD2-CE2 3.79Å; F41-F100 HydrophobicContact CD2-CZ 4.46Å; F41-F100 AromaticContact CG-CE2 3.86Å; F41-F100 HydrophobicContact CG-CE2 3.86Å; F41-F100 HydrophobicContact CG-CZ 4.08Å; F41-F100 PolarHBondContact N-O 2.83Å; F41-F100 PolarHBondContact O-N 2.92Å; F41-F102 HydrophobicContact CD2-CD2 4.31Å; F41-F102 HydrophobicContact CD2-CE2 4.4Å; F41-F102 HydrophobicContact CE2-CD2 4.1Å; F41-F102 HydrophobicContact CE2-CE2 4.41Å; F41-F116 HydrophobicContact CD1-CE1 4.32Å; F41-F116 AromaticContact CD1-CZ 3.93Å; F41-F116 HydrophobicContact CD1-CZ 3.93Å; F41-F116 AromaticContact CD2-CE1 3.9Å; F41-F116 HydrophobicContact CD2-CE1 3.9Å; F41-F116 AromaticContact CD2-CZ 3.98Å; F41-F116 HydrophobicContact CD2-CZ 3.98Å; F41-F116 AromaticContact CE1-CE1 4Å; F41-F116 HydrophobicContact CE1-CE1 4Å; F41-F116 HydrophobicContact CE1-CZ 4.01Å; F41-F116 HydrophobicContact CE2-CD1 4.36Å; F41-F116 AromaticContact CE2-CE1 3.54Å; F41-F116 HydrophobicContact CE2-CE1 3.54Å; F41-F116 HydrophobicContact CE2-CZ 4.05Å; F41-F116 HydrophobicContact CG-CE1 4.27Å; F41-F116 AromaticContact CG-CZ 3.93Å; F41-F116 HydrophobicContact CG-CZ 3.93Å; F41-F116 AromaticContact CZ-CE1 3.6Å; F41-F116 HydrophobicContact CZ-CE1 3.6Å; F41-F116 HydrophobicContact CZ-CZ 4.07Å
42	Y	95.5	Very high	95	Very high	141 Å²	141	69.8 Å²	69.8	55%	0.553	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137	133.5	-169.5	-60.6	-93.5	0	0	0	108.7	C40 T97 F98 K99	C40-Y42 HydrophobicContact CB-CE2 4.1Å; Y42-T97 HydrophobicContact CD1-CG2 4.06Å; Y42-T97 HydrophobicContact CG-CG2 4.4Å; Y42-F98 VanDerWaalsContact CA-O 3.29Å; Y42-F98 WeakPolarHBondContact CA-O 3.42Å; Y42-K99 HydrophobicContact CD1-CB 3.89Å; Y42-K99 HydrophobicContact CD1-CD 4.48Å; Y42-K99 HydrophobicContact CD1-CG 3.99Å; Y42-K99 HydrophobicContact CE1-CB 3.86Å; Y42-K99 HydrophobicContact CE1-CD 3.63Å; Y42-K99 HydrophobicContact CE1-CG 3.54Å
43	E	93.6	Very high	95	Very high	92 Å²	92	63 Å²	63	43%	0.43	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.1	179.4	-166.9	61.3	-154	0	0	109.7	I45 T97 F98 F118 V120	E43-I45 HydrophobicContact CG-CG1 4.38Å; E43-T97 CarbonylContact O-C 3.57Å; E43-T97 WeakPolarHBondContact O-CA 3.24Å; E43-F98 PolarHBondContact N-O 2.67Å; E43-F98 PolarHBondContact O-N 3.42Å; E43-F118 HydrophobicContact CB-CD1 4.03Å; E43-F118 HydrophobicContact CB-CE1 3.69Å; E43-F118 HydrophobicContact CG-CD1 4.02Å; E43-F118 HydrophobicContact CG-CE1 3.82Å; E43-V120 HydrophobicContact CG-CG2 3.8Å
44	D	94.4	Very high	94.9	Very high	114 Å²	114	64.3 Å²	64.3	61%	0.61	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.1	179.6	-73.7	-37.8	0	0	0	110.3	T97	D44-T97 VanDerWaalsContact OD1-CA 3.31Å; D44-T97 WeakPolarHBondContact OD1-CA 3.42Å; D44-T97 VanDerWaalsContact OD1-CB 3.25Å; D44-T97 WeakPolarHBondContact OD1-CB 3.26Å; D44-T97 PolarHBondContact OD1-OG1 2.89Å
45	I	94.1	Very high	94.9	Very high	5 Å²	5	61.1 Å²	61.1	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	140.2	-172.4	-48.2	177.9	0	0	0	109.8	E43 T49 F90 A92 N95 G96 F98 F118 V120	E43-I45 HydrophobicContact CG-CG1 4.38Å; I45-T49 HydrophobicContact CG2-CG2 4.26Å; I45-F90 HydrophobicContact CD1-CZ 4.43Å; I45-A92 HydrophobicContact CG2-CB 3.72Å; I45-N95 WeakPolarHBondContact O-CA 3.07Å; I45-G96 PolarHBondContact N-O 2.93Å; I45-G96 PolarHBondContact O-N 2.82Å; I45-F98 HydrophobicContact CB-CD2 3.65Å; I45-F98 HydrophobicContact CB-CE2 3.76Å; I45-F98 HydrophobicContact CD1-CB 3.85Å; I45-F98 HydrophobicContact CD1-CD1 4.41Å; I45-F98 HydrophobicContact CD1-CD2 3.54Å; I45-F98 HydrophobicContact CD1-CE2 4.2Å; I45-F98 HydrophobicContact CD1-CG 3.67Å; I45-F98 HydrophobicContact CG1-CB 4.48Å; I45-F98 HydrophobicContact CG1-CD2 3.7Å; I45-F98 HydrophobicContact CG1-CE2 4.3Å; I45-F98 HydrophobicContact CG1-CG 4.3Å; I45-F98 HydrophobicContact CG2-CE2 4.44Å; I45-F118 HydrophobicContact CD1-CE1 3.74Å; I45-F118 HydrophobicContact CD1-CZ 3.66Å; I45-V120 HydrophobicContact CD1-CG2 4.24Å; I45-V120 HydrophobicContact CG1-CG1 4.19Å; I45-V120 HydrophobicContact CG1-CG2 4.32Å; I45-V120 HydrophobicContact CG2-CG1 4.04Å
46	I	94	Very high	95	Very high	117 Å²	117	57.9 Å²	57.9	60%	0.6	30%	0.3	S	S	*	.			trans	-89.2	151.9	173	66.4	179.9	0	0	0	111.2	T49 A92 N95	I46-T49 WeakPolarHBondContact CG1-OG1 3.08Å; I46-T49 VanDerWaalsContact O-CB 3.28Å; I46-T49 WeakPolarHBondContact O-CB 3.04Å; I46-T49 PolarHBondContact O-N 2.87Å; I46-T49 PolarHBondContact O-OG1 2.89Å; I46-A92 WeakPolarHBondContact O-CB 3.46Å; I46-N95 WeakPolarHBondContact CA-OD1 3.29Å
47	T	94.4	Very high	95	Very high	71 Å²	71	52.7 Å²	52.7	44%	0.436	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	138	-177.2	-57.4	0	0	0	0	109.6	T49 A93 K94 N95	T47-T49 VanDerWaalsContact C-N 3.26Å; T47-A93 WeakPolarHBondContact CG2-O 3.34Å; T47-K94 VanDerWaalsContact OG1-CA 3.3Å; T47-K94 WeakPolarHBondContact OG1-CA 3.3Å; T47-N95 WeakPolarHBondContact CA-OD1 3.43Å; T47-N95 VanDerWaalsContact CB-OD1 3.24Å; T47-N95 WeakPolarHBondContact CB-OD1 3.18Å; T47-N95 PolarHBondContact N-OD1 2.91Å; T47-N95 VanDerWaalsContact OG1-CG 3.26Å; T47-N95 PolarHBondContact OG1-N 2.87Å; T47-N95 PolarHBondContact OG1-OD1 3.48Å
48	G	92.6	Very high	95	Very high	53 Å²	53	52.2 Å²	52.2	55%	0.546	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-6.1	-178.2	0	0	0	0	0	113.9	A92	G48-A92 PolarHBondContact N-O 2.93Å
49	T	93.5	Very high	94.8	Very high	24 Å²	24	47.5 Å²	47.5	15%	0.147	25%	0.249	C	C	.	.			trans	-75.6	129.5	175.7	-61.6	0	0	0	0	111	I45 I46 T47 A92 V120 G121	I45-T49 HydrophobicContact CG2-CG2 4.26Å; I46-T49 WeakPolarHBondContact CG1-OG1 3.08Å; I46-T49 VanDerWaalsContact O-CB 3.28Å; I46-T49 WeakPolarHBondContact O-CB 3.04Å; I46-T49 PolarHBondContact O-N 2.87Å; I46-T49 PolarHBondContact O-OG1 2.89Å; T47-T49 VanDerWaalsContact C-N 3.26Å; T49-A92 PolarHBondContact O-N 2.9Å; T49-V120 HydrophobicContact CG2-CG1 3.89Å; T49-G121 VanDerWaalsContact CG2-N 3.28Å
50	K	94.2	Very high	94.4	Very high	114 Å²	114	44.1 Å²	44.1	50%	0.496	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	131.1	172	-173.5	-176.9	175.5	-168.1	0	109.1	T89 G121	K50-T89 HydrophobicContact CD-CG2 4.26Å; K50-T89 HydrophobicContact CG-CG2 3.89Å; K50-G121 WeakPolarHBondContact O-CA 3.49Å; K50-G121 PolarHBondContact O-N 2.94Å
51	C	94.2	Very high	94	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.4	-179	-53.7	0	0	0	0	109.9	T89 F90 F118 Q119	C51-T89 CarbonylContact O-C 3.5Å; C51-T89 VanDerWaalsContact O-CA 3.3Å; C51-T89 WeakPolarHBondContact O-CA 3.43Å; C51-F90 HydrophobicContact CB-CD1 4.26Å; C51-F90 HydrophobicContact CB-CE1 3.66Å; C51-F90 HydrophobicContact CB-CE2 4.2Å; C51-F90 HydrophobicContact CB-CZ 3.64Å; C51-F90 PolarHBondContact N-O 2.97Å; C51-F90 PolarHBondContact O-N 3.49Å; C51-F90 VanDerWaalsContact O-O 3.13Å; C51-F118 HydrophobicContact CB-CZ 4.3Å; C51-Q119 CarbonylContact C-O 3.56Å; C51-Q119 WeakPolarHBondContact CA-O 3.47Å
52	T	94.3	Very high	93.7	Very high	23 Å²	23	50.2 Å²	50.2	14%	0.141	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.2	177	-58.2	0	0	0	0	109.4	F88 T89 Q119	T52-F88 WeakPolarHBondContact CA-O 3.02Å; T52-T89 WeakPolarHBondContact CG2-OG1 3.23Å; T52-T89 PolarHBondContact OG1-OG1 3.4Å; T52-Q119 PolarHBondContact N-O 2.95Å; T52-Q119 PolarHBondContact O-N 3.11Å
53	L	95.6	Very high	93.6	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	115.7	170.2	175.6	62.8	0	0	0	108.6	S87 F88 F100 F102 F118	L53-S87 WeakPolarHBondContact O-CA 2.9Å; L53-F88 PolarHBondContact N-O 3.3Å; L53-F88 PolarHBondContact O-N 3.41Å; L53-F100 HydrophobicContact CD1-CD2 4.03Å; L53-F100 HydrophobicContact CD1-CE2 4.28Å; L53-F100 HydrophobicContact CD1-CG 4.5Å; L53-F100 HydrophobicContact CD2-CB 4.16Å; L53-F102 HydrophobicContact CD1-CZ 4.39Å; L53-F118 HydrophobicContact CB-CD2 3.84Å; L53-F118 HydrophobicContact CB-CE2 4.12Å; L53-F118 HydrophobicContact CD1-CB 4.48Å; L53-F118 HydrophobicContact CD1-CD2 3.85Å; L53-F118 HydrophobicContact CG-CD2 4.39Å
54	E	95.3	Very high	93.7	Very high	28 Å²	28	42 Å²	42	13%	0.131	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	138.9	172.4	-178.3	165.5	179.2	0	0	109.6	Y85 F116 D117	E54-Y85 HydrophobicContact CG-CE2 3.87Å; E54-Y85 WeakPolarHBondContact OE1-CE2 2.82Å; E54-Y85 VanDerWaalsContact OE1-CZ 3.26Å; E54-Y85 PolarHBondContact OE1-OH 3.47Å; E54-F116 CarbonylContact O-C 3.53Å; E54-F116 WeakPolarHBondContact O-CA 3.39Å; E54-F116 WeakPolarHBondContact O-CB 3.15Å; E54-D117 PolarHBondContact N-O 3.11Å; E54-D117 PolarHBondContact O-N 3.05Å
55	F	95.9	Very high	93.8	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.4	175.9	68.7	-87.8	0	0	0	112.3	V65 C67 Y78 K83 Y85 D86 F102 Y115 F116	F55-V65 HydrophobicContact CD2-CG1 3.95Å; F55-V65 HydrophobicContact CE2-CG1 3.73Å; F55-C67 HydrophobicContact CD1-CB 4.46Å; F55-C67 HydrophobicContact CE1-CB 3.79Å; F55-C67 HydrophobicContact CE2-CB 4.47Å; F55-C67 HydrophobicContact CZ-CB 3.8Å; F55-Y78 HydrophobicContact CE1-CE1 4.3Å; F55-K83 HydrophobicContact CE2-CB 4.03Å; F55-K83 HydrophobicContact CZ-CB 3.87Å; F55-Y85 WeakPolarHBondContact O-CA 3.37Å; F55-Y85 WeakPolarHBondContact O-CD2 3.31Å; F55-D86 HydrophobicContact CD1-CB 4.48Å; F55-D86 HydrophobicContact CE1-CB 3.62Å; F55-D86 HydrophobicContact CZ-CB 3.68Å; F55-D86 PolarHBondContact N-O 2.74Å; F55-D86 PolarHBondContact O-N 3Å; F55-F102 HydrophobicContact CB-CE1 3.65Å; F55-F102 HydrophobicContact CB-CZ 3.84Å; F55-F102 AromaticContact CD1-CE1 3.99Å; F55-F102 HydrophobicContact CD1-CE1 3.99Å; F55-F102 HydrophobicContact CD2-CE1 4.03Å; F55-F102 AromaticContact CG-CE1 3.62Å; F55-F102 HydrophobicContact CG-CE1 3.62Å; F55-F102 HydrophobicContact CG-CZ 4.26Å; F55-Y115 CarbonylContact C-O 3.6Å; F55-Y115 VanDerWaalsContact CA-O 3.24Å; F55-Y115 WeakPolarHBondContact CA-O 3.4Å; F55-Y115 WeakPolarHBondContact CB-O 3.02Å; F55-F116 HydrophobicContact CB-CB 4.02Å
56	Q	96.1	Very high	94	Very high	11 Å²	11	36.9 Å²	36.9	5%	0.051	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	131.4	175.3	-169.2	170.4	0.2	0	0	110.5	V58 Y85 Y115	Q56-V58 PolarHBondContact O-N 3.03Å; Q56-Y85 HydrophobicContact CB-CD2 4.02Å; Q56-Y85 HydrophobicContact CG-CD2 4.24Å; Q56-Y115 PolarHBondContact N-O 3.1Å; Q56-Y115 PolarHBondContact O-N 3.41Å
57	V	95.3	Very high	94.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	113.2	171.1	-171.9	0	0	0	0	108.8	T59 Y63 V65 Q84 K112 V114	V57-T59 WeakPolarHBondContact CG1-O 3.48Å; V57-Y63 VanDerWaalsContact CB-O 3.26Å; V57-Y63 WeakPolarHBondContact CB-O 3.37Å; V57-Y63 WeakPolarHBondContact CG2-O 3.46Å; V57-V65 HydrophobicContact CG2-CB 3.92Å; V57-V65 HydrophobicContact CG2-CG1 3.67Å; V57-Q84 PolarHBondContact N-O 2.94Å; V57-K112 HydrophobicContact CG1-CB 4.47Å; V57-V114 HydrophobicContact CG2-CG2 4.47Å
58	V	93.9	Very high	94.3	Very high	15 Å²	15	32.1 Å²	32.1	9%	0.091	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-44.3	-175.6	-171.8	0	0	0	0	110.7	Q56 Y63 T113 L162 A165	Q56-V58 PolarHBondContact O-N 3.03Å; V58-Y63 WeakPolarHBondContact O-CE1 3.31Å; V58-T113 HydrophobicContact CB-CG2 4.4Å; V58-T113 PolarHBondContact N-O 3.49Å; V58-L162 HydrophobicContact CG2-CD2 4.08Å; V58-A165 HydrophobicContact CG1-CB 4.43Å
59	T	92.2	Very high	94.5	Very high	33 Å²	33	29.6 Å²	29.6	20%	0.202	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	162.4	-178.1	65.2	0	0	0	0	112.1	V57 K112 T113	V57-T59 WeakPolarHBondContact CG1-O 3.48Å; T59-K112 WeakPolarHBondContact O-CA 3.34Å; T59-T113 PolarHBondContact O-N 3.42Å; T59-T113 VanDerWaalsContact O-N 3.08Å; T59-T113 WeakPolarHBondContact OG1-CB 3.07Å; T59-T113 PolarHBondContact OG1-OG1 3.43Å
60	G	89.7	Confident	94.7	Very high	18 Å²	18	30.3 Å²	30.3	19%	0.186	16%	0.156	C	C	.	.	S	Bend	trans	106.2	125.5	170.2	0	0	0	0	0	115.1	H62 Y63 H111	G60-H62 PolarHBondContact O-N 2.9Å; G60-Y63 WeakPolarHBondContact O-CA 3.37Å; G60-Y63 PolarHBondContact O-N 3.05Å; G60-H111 WeakPolarHBondContact CA-O 3.33Å
61	G	88.3	Confident	94.8	Very high	43 Å²	43	25.5 Å²	25.5	44%	0.443	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	-126.6	174.1	0	0	0	0	0	113.7	Y63	G61-Y63 VanDerWaalsContact C-N 3.25Å; G61-Y63 PolarHBondContact O-N 2.89Å
62	H	90.2	Very high	94.9	Very high	150 Å²	150	27.8 Å²	27.8	69%	0.694	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	15.8	176.2	-66	-62.7	0	0	0	114	G60 D64 Q84	G60-H62 PolarHBondContact O-N 2.9Å; H62-D64 PolarHBondContact O-N 3.14Å; H62-Q84 PolarHBondContact O-NE2 2.9Å
63	Y	92.9	Very high	94.9	Very high	47 Å²	47	31.8 Å²	31.8	18%	0.184	17%	0.171	C	C	.	.	S	Bend	trans	57	32.1	-175.3	-55.1	-94.1	0	0	0	112.9	V57 V58 G60 G61 Q84 Q166	V57-Y63 VanDerWaalsContact CB-O 3.26Å; V57-Y63 WeakPolarHBondContact CB-O 3.37Å; V57-Y63 WeakPolarHBondContact CG2-O 3.46Å; V58-Y63 WeakPolarHBondContact O-CE1 3.31Å; G60-Y63 WeakPolarHBondContact O-CA 3.37Å; G60-Y63 PolarHBondContact O-N 3.05Å; G61-Y63 VanDerWaalsContact C-N 3.25Å; G61-Y63 PolarHBondContact O-N 2.89Å; Y63-Q84 WeakPolarHBondContact O-CA 3.31Å; Y63-Q84 WeakPolarHBondContact O-CB 3.47Å; Y63-Q84 WeakPolarHBondContact O-CG 3.44Å; Y63-Q166 HydrophobicContact CD1-CG 4.32Å; Y63-Q166 VanDerWaalsContact CD1-NE2 3.33Å; Y63-Q166 HydrophobicContact CE1-CG 4.04Å
64	D	95.7	Very high	94.8	Very high	14 Å²	14	33.9 Å²	33.9	8%	0.075	19%	0.193	C	C	.	.			trans	-114.4	148.7	-175.4	56.8	-12.6	0	0	0	112.7	H62 K82 K83 F106 K112	H62-D64 PolarHBondContact O-N 3.14Å; D64-K82 HydrophobicContact CB-CB 4.02Å; D64-K83 CarbonylContact C-O 3.58Å; D64-K83 WeakPolarHBondContact CA-O 3.43Å; D64-F106 HydrophobicContact CB-CZ 4.44Å; D64-F106 WeakPolarHBondContact O-CZ 3.48Å; D64-F106 WeakPolarHBondContact OD1-CE2 3.46Å; D64-K112 WeakPolarHBondContact O-CD 3.23Å; D64-K112 WeakPolarHBondContact O-CE 3.32Å; D64-K112 PolarHBondContact O-NZ 3.4Å; D64-K112 IonicContact OD1-NZ 2.8Å; D64-K112 PolarHBondContact OD1-NZ 3.38Å
65	V	97.1	Very high	94.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	152.9	173.7	72.1	0	0	0	0	110.3	L33 F55 V57 K82 K83 F102 S103 V114	L33-V65 HydrophobicContact CD2-CG2 3.79Å; F55-V65 HydrophobicContact CD2-CG1 3.95Å; F55-V65 HydrophobicContact CE2-CG1 3.73Å; V57-V65 HydrophobicContact CG2-CB 3.92Å; V57-V65 HydrophobicContact CG2-CG1 3.67Å; V65-K82 PolarHBondContact O-N 3.02Å; V65-K83 PolarHBondContact N-O 3.2Å; V65-K83 PolarHBondContact O-N 2.9Å; V65-F102 HydrophobicContact CG1-CD1 4.12Å; V65-F102 HydrophobicContact CG2-CB 4.01Å; V65-F102 HydrophobicContact CG2-CD1 4.4Å; V65-S103 VanDerWaalsContact CG2-O 3.32Å; V65-S103 WeakPolarHBondContact CG2-O 3.43Å; V65-V114 HydrophobicContact CG2-CG2 4.4Å
66	D	97.6	Very high	94.9	Very high	12 Å²	12	39.8 Å²	39.8	6%	0.064	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.6	170	-63.6	-21.8	0	0	0	109.1	E80 M81 K82 F102 S103	D66-E80 WeakPolarHBondContact CA-O 3.33Å; D66-M81 HydrophobicContact CB-CE 4.16Å; D66-M81 HydrophobicContact CB-SD 3.96Å; D66-M81 WeakPolarHBondContact OD1-CA 3.43Å; D66-M81 WeakPolarHBondContact OD1-CE 3.48Å; D66-M81 WeakPolarHBondContact OD2-CE 3.25Å; D66-K82 PolarHBondContact OD1-N 3.35Å; D66-F102 CarbonylContact O-C 3.5Å; D66-F102 WeakPolarHBondContact O-CA 3.41Å; D66-S103 PolarHBondContact N-O 2.92Å; D66-S103 VanDerWaalsContact N-O 3.11Å; D66-S103 PolarHBondContact O-N 2.6Å
67	C	97.8	Very high	94.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	134.6	-179.8	-175	0	0	0	0	110.4	F55 Y78 K79 E80 C101 F102	F55-C67 HydrophobicContact CD1-CB 4.46Å; F55-C67 HydrophobicContact CE1-CB 3.79Å; F55-C67 HydrophobicContact CE2-CB 4.47Å; F55-C67 HydrophobicContact CZ-CB 3.8Å; C67-Y78 HydrophobicContact CB-CE1 4.02Å; C67-K79 WeakPolarHBondContact O-CA 3.48Å; C67-E80 PolarHBondContact N-O 3.29Å; C67-E80 PolarHBondContact O-N 3.27Å; C67-C101 WeakPolarHBondContact CA-O 3.46Å; C67-F102 HydrophobicContact CB-CD1 4.24Å; C67-F102 HydrophobicContact CB-CE1 4.22Å
68	R	97.9	Very high	94.9	Very high	88 Å²	88	43.5 Å²	43.5	33%	0.332	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	133.1	176.6	-63.7	-175.4	-172.2	166.9	7.3	110.4	Y78 K79 F100 C101	R68-Y78 CarbonylContact C-O 3.53Å; R68-Y78 WeakPolarHBondContact CA-O 3.32Å; R68-K79 HydrophobicContact CG-CB 4.36Å; R68-K79 HydrophobicContact CG-CD 4.45Å; R68-K79 HydrophobicContact CG-CG 4.03Å; R68-F100 CarbonylContact O-C 3.55Å; R68-F100 VanDerWaalsContact O-CA 3.23Å; R68-F100 WeakPolarHBondContact O-CA 3.39Å; R68-C101 PolarHBondContact N-O 3.19Å; R68-C101 PolarHBondContact O-N 2.71Å
69	L	97.4	Very high	95.1	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130	173.8	174.9	70.1	0	0	0	109.1	T76 L77 Y78 F88 F90 K99 F100	L69-T76 CarbonylContact O-C 3.53Å; L69-T76 WeakPolarHBondContact O-CA 3.22Å; L69-L77 HydrophobicContact CD2-CB 4.14Å; L69-L77 HydrophobicContact CD2-CD1 4.47Å; L69-L77 HydrophobicContact CG-CB 4.29Å; L69-L77 PolarHBondContact O-N 3.17Å; L69-Y78 PolarHBondContact N-O 2.69Å; L69-Y78 PolarHBondContact O-N 2.86Å; L69-F88 HydrophobicContact CD2-CD1 4.03Å; L69-F88 HydrophobicContact CD2-CE1 3.99Å; L69-F90 HydrophobicContact CD1-CE1 4.45Å; L69-F90 HydrophobicContact CD1-CZ 4.4Å; L69-F90 HydrophobicContact CD2-CD1 3.63Å; L69-F90 HydrophobicContact CD2-CE1 3.33Å; L69-F90 HydrophobicContact CD2-CE2 4.48Å; L69-F90 HydrophobicContact CD2-CG 4.35Å; L69-F90 HydrophobicContact CD2-CZ 3.8Å; L69-F90 HydrophobicContact CG-CE1 4.48Å; L69-K99 CarbonylContact C-O 3.59Å; L69-K99 WeakPolarHBondContact CA-O 3.49Å; L69-F100 HydrophobicContact CD1-CB 3.84Å
70	E	97.4	Very high	95.3	Very high	39 Å²	39	49.9 Å²	49.9	18%	0.182	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.5	-177.7	-66.3	168.5	-177.3	0	0	110	T75 K99	E70-T75 WeakPolarHBondContact CA-O 2.97Å; E70-K99 HydrophobicContact CB-CB 4.5Å; E70-K99 PolarHBondContact N-O 2.93Å; E70-K99 PolarHBondContact O-N 3.34Å; E70-K99 IonicContact OE2-NZ 2.57Å; E70-K99 PolarHBondContact OE2-NZ 3.41Å
71	D	95.8	Very high	95.7	Very high	13 Å²	13	53.1 Å²	53.1	7%	0.07	29%	0.286	C	S	.	.			trans	-69.4	165.8	169.5	-160.2	40.3	0	0	0	110.2	D73 G74 T75 L77 F98	D71-D73 PolarHBondContact O-N 2.83Å; D71-G74 WeakPolarHBondContact O-CA 3.34Å; D71-G74 PolarHBondContact O-N 2.89Å; D71-T75 PolarHBondContact N-O 2.69Å; D71-L77 HydrophobicContact CB-CD1 4.05Å; D71-L77 HydrophobicContact CB-CD2 4.29Å; D71-L77 HydrophobicContact CB-CG 4.12Å; D71-F98 HydrophobicContact CB-CE1 4.36Å; D71-F98 WeakPolarHBondContact OD1-CE1 3.37Å; D71-F98 WeakPolarHBondContact OD1-CZ 3.5Å
72	P	96.1	Very high	96	Very high	48 Å²	48	57 Å²	57	31%	0.312	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.1	179.6	-25.3	35.5	0	0	0	114.5	G74 G96 T97 F98	P72-G74 VanDerWaalsContact C-N 3.26Å; P72-G74 PolarHBondContact O-N 3.07Å; P72-G96 VanDerWaalsContact CG-C 3.48Å; P72-T97 WeakPolarHBondContact CA-O 3.42Å; P72-F98 HydrophobicContact CG-CD2 4.06Å; P72-F98 HydrophobicContact CG-CE2 3.91Å; P72-F98 HydrophobicContact CG-CZ 4.41Å
73	D	95.1	Very high	96.3	Very high	106 Å²	106	53.5 Å²	53.5	57%	0.567	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	1	174.5	-68.4	-29	0	0	0	113.5	D71 T75 K94	D71-D73 PolarHBondContact O-N 2.83Å; D73-T75 VanDerWaalsContact C-N 3.31Å; D73-K94 WeakPolarHBondContact OD2-CD 3.17Å; D73-K94 IonicContact OD2-NZ 3.17Å; D73-K94 PolarHBondContact OD2-NZ 2.91Å
74	G	93.6	Very high	96.4	Very high	46 Å²	46	56.3 Å²	56.3	47%	0.474	29%	0.289	S	S	.	.	S	Bend	trans	78.2	10.9	-175.9	0	0	0	0	0	114.3	D71 P72	D71-G74 WeakPolarHBondContact O-CA 3.34Å; D71-G74 PolarHBondContact O-N 2.89Å; P72-G74 VanDerWaalsContact C-N 3.26Å; P72-G74 PolarHBondContact O-N 3.07Å
75	T	95.7	Very high	96.3	Very high	83 Å²	83	60.4 Å²	60.4	51%	0.509	30%	0.304	S	S	.	.			trans	-75.4	125.7	174.7	-59.3	0	0	0	0	109.5	E70 D71 D73 L77	E70-T75 WeakPolarHBondContact CA-O 2.97Å; D71-T75 PolarHBondContact N-O 2.69Å; D73-T75 VanDerWaalsContact C-N 3.31Å; T75-L77 PolarHBondContact O-N 2.93Å
76	T	96.3	Very high	96.3	Very high	70 Å²	70	62.4 Å²	62.4	43%	0.429	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	117.4	177.8	-52.2	0	0	0	0	110.7	L69 Y78 K79	L69-T76 CarbonylContact O-C 3.53Å; L69-T76 WeakPolarHBondContact O-CA 3.22Å; T76-Y78 WeakPolarHBondContact CG2-O 3.3Å; T76-K79 HydrophobicContact CG2-CB 3.74Å
77	L	96.1	Very high	96.2	Very high	69 Å²	69	64.2 Å²	64.2	36%	0.361	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-35	177.3	-61.1	-180	0	0	0	112	L69 D71 T75 F90 F98	L69-L77 HydrophobicContact CD2-CB 4.14Å; L69-L77 HydrophobicContact CD2-CD1 4.47Å; L69-L77 HydrophobicContact CG-CB 4.29Å; L69-L77 PolarHBondContact O-N 3.17Å; D71-L77 HydrophobicContact CB-CD1 4.05Å; D71-L77 HydrophobicContact CB-CD2 4.29Å; D71-L77 HydrophobicContact CB-CG 4.12Å; T75-L77 PolarHBondContact O-N 2.93Å; L77-F90 HydrophobicContact CD1-CD2 4.07Å; L77-F90 HydrophobicContact CD1-CE2 4.11Å; L77-F98 HydrophobicContact CD1-CD1 4.07Å; L77-F98 HydrophobicContact CD1-CE1 3.66Å
78	Y	97.1	Very high	96.1	Very high	19 Å²	19	66.9 Å²	66.9	8%	0.075	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	137.9	178.6	169.8	-93.7	0	0	0	109.9	F55 C67 R68 L69 T76 E80 D86 F88	F55-Y78 HydrophobicContact CE1-CE1 4.3Å; C67-Y78 HydrophobicContact CB-CE1 4.02Å; R68-Y78 CarbonylContact C-O 3.53Å; R68-Y78 WeakPolarHBondContact CA-O 3.32Å; L69-Y78 PolarHBondContact N-O 2.69Å; L69-Y78 PolarHBondContact O-N 2.86Å; T76-Y78 WeakPolarHBondContact CG2-O 3.3Å; Y78-E80 HydrophobicContact CD2-CG 4.27Å; Y78-E80 HydrophobicContact CE1-CB 4.14Å; Y78-E80 HydrophobicContact CE1-CG 4.16Å; Y78-E80 HydrophobicContact CE2-CB 4.26Å; Y78-E80 HydrophobicContact CE2-CG 3.4Å; Y78-E80 WeakPolarHBondContact OH-CB 3.24Å; Y78-E80 VanDerWaalsContact OH-CG 3.24Å; Y78-E80 WeakPolarHBondContact OH-CG 3.37Å; Y78-D86 VanDerWaalsContact OH-CB 3.3Å; Y78-D86 WeakPolarHBondContact OH-CB 3.3Å; Y78-D86 PolarHBondContact OH-OD2 2.97Å; Y78-F88 HydrophobicContact CD2-CB 3.9Å; Y78-F88 HydrophobicContact CD2-CD1 4.03Å; Y78-F88 AromaticContact CD2-CD2 3.55Å; Y78-F88 HydrophobicContact CD2-CD2 3.55Å; Y78-F88 HydrophobicContact CD2-CE1 4.47Å; Y78-F88 HydrophobicContact CD2-CE2 4.05Å; Y78-F88 AromaticContact CD2-CG 3.53Å; Y78-F88 HydrophobicContact CD2-CG 3.53Å; Y78-F88 HydrophobicContact CD2-CZ 4.48Å; Y78-F88 HydrophobicContact CE2-CB 3.96Å; Y78-F88 HydrophobicContact CE2-CD2 4.11Å; Y78-F88 HydrophobicContact CE2-CG 4.09Å; Y78-F88 HydrophobicContact CG-CB 4.22Å; Y78-F88 AromaticContact CG-CD1 3.88Å; Y78-F88 HydrophobicContact CG-CD1 3.88Å; Y78-F88 HydrophobicContact CG-CD2 4.24Å; Y78-F88 HydrophobicContact CG-CE1 4.3Å; Y78-F88 AromaticContact CG-CG 3.84Å; Y78-F88 HydrophobicContact CG-CG 3.84Å
79	K	97.1	Very high	96	Very high	111 Å²	111	66 Å²	66	48%	0.483	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	111.6	178.5	172.4	173.8	178.7	-173.9	0	109.2	C67 R68 T76	C67-K79 WeakPolarHBondContact O-CA 3.48Å; R68-K79 HydrophobicContact CG-CB 4.36Å; R68-K79 HydrophobicContact CG-CD 4.45Å; R68-K79 HydrophobicContact CG-CG 4.03Å; T76-K79 HydrophobicContact CG2-CB 3.74Å
80	E	97.4	Very high	95.9	Very high	71 Å²	71	67.1 Å²	67.1	33%	0.332	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.8	175.4	-74.1	-65.1	153.6	0	0	109.8	D66 C67 Y78 K83	D66-E80 WeakPolarHBondContact CA-O 3.33Å; C67-E80 PolarHBondContact N-O 3.29Å; C67-E80 PolarHBondContact O-N 3.27Å; Y78-E80 HydrophobicContact CD2-CG 4.27Å; Y78-E80 HydrophobicContact CE1-CB 4.14Å; Y78-E80 HydrophobicContact CE1-CG 4.16Å; Y78-E80 HydrophobicContact CE2-CB 4.26Å; Y78-E80 HydrophobicContact CE2-CG 3.4Å; Y78-E80 WeakPolarHBondContact OH-CB 3.24Å; Y78-E80 VanDerWaalsContact OH-CG 3.24Å; Y78-E80 WeakPolarHBondContact OH-CG 3.37Å; E80-K83 HydrophobicContact CB-CG 3.7Å; E80-K83 HydrophobicContact CG-CG 4.48Å; E80-K83 WeakPolarHBondContact OE2-CE 2.9Å; E80-K83 IonicContact OE2-NZ 2.67Å; E80-K83 PolarHBondContact OE2-NZ 2.84Å
81	M	96.6	Very high	95.8	Very high	86 Å²	86	69.6 Å²	69.6	42%	0.424	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	140	-173.9	-56	-69.1	-66	0	0	109.3	D66 K83	D66-M81 HydrophobicContact CB-CE 4.16Å; D66-M81 HydrophobicContact CB-SD 3.96Å; D66-M81 WeakPolarHBondContact OD1-CA 3.43Å; D66-M81 WeakPolarHBondContact OD1-CE 3.48Å; D66-M81 WeakPolarHBondContact OD2-CE 3.25Å; M81-K83 VanDerWaalsContact C-N 3.3Å; M81-K83 PolarHBondContact O-N 3.48Å
82	K	95.1	Very high	95.8	Very high	126 Å²	126	69 Å²	69	55%	0.548	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49	44.4	177.4	-58.8	-172.8	174.8	-170.9	0	114.6	D64 V65 D66 F106	D64-K82 HydrophobicContact CB-CB 4.02Å; V65-K82 PolarHBondContact O-N 3.02Å; D66-K82 PolarHBondContact OD1-N 3.35Å; K82-F106 HydrophobicContact CG-CZ 4.39Å
83	K	96.6	Very high	95.6	Very high	75 Å²	75	70.4 Å²	70.4	33%	0.326	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	143.1	175.3	-67.6	-67.9	-176.6	157.1	0	110.8	F55 D64 V65 E80 M81	F55-K83 HydrophobicContact CE2-CB 4.03Å; F55-K83 HydrophobicContact CZ-CB 3.87Å; D64-K83 CarbonylContact C-O 3.58Å; D64-K83 WeakPolarHBondContact CA-O 3.43Å; V65-K83 PolarHBondContact N-O 3.2Å; V65-K83 PolarHBondContact O-N 2.9Å; E80-K83 HydrophobicContact CB-CG 3.7Å; E80-K83 HydrophobicContact CG-CG 4.48Å; E80-K83 WeakPolarHBondContact OE2-CE 2.9Å; E80-K83 IonicContact OE2-NZ 2.67Å; E80-K83 PolarHBondContact OE2-NZ 2.84Å; M81-K83 VanDerWaalsContact C-N 3.3Å; M81-K83 PolarHBondContact O-N 3.48Å
84	Q	94.8	Very high	95.5	Very high	107 Å²	107	69.9 Å²	69.9	50%	0.5	37%	0.372	S	S	.	.	S	Bend	trans	-88.8	-34.8	174.3	-49.2	-169.3	-28	0	0	112.9	V57 H62 Y63	V57-Q84 PolarHBondContact N-O 2.94Å; H62-Q84 PolarHBondContact O-NE2 2.9Å; Y63-Q84 WeakPolarHBondContact O-CA 3.31Å; Y63-Q84 WeakPolarHBondContact O-CB 3.47Å; Y63-Q84 WeakPolarHBondContact O-CG 3.44Å
85	Y	94.8	Very high	95.6	Very high	99 Å²	99	72.9 Å²	72.9	39%	0.388	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	138.2	179.7	170.4	-95.3	0	0	0	107.6	E54 F55 Q56	E54-Y85 HydrophobicContact CG-CE2 3.87Å; E54-Y85 WeakPolarHBondContact OE1-CE2 2.82Å; E54-Y85 VanDerWaalsContact OE1-CZ 3.26Å; E54-Y85 PolarHBondContact OE1-OH 3.47Å; F55-Y85 WeakPolarHBondContact O-CA 3.37Å; F55-Y85 WeakPolarHBondContact O-CD2 3.31Å; Q56-Y85 HydrophobicContact CB-CD2 4.02Å; Q56-Y85 HydrophobicContact CG-CD2 4.24Å
86	D	96.1	Very high	95.6	Very high	43 Å²	43	70 Å²	70	23%	0.23	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	157.9	166.2	-150.9	-3.6	0	0	0	110.3	F55 Y78	F55-D86 HydrophobicContact CD1-CB 4.48Å; F55-D86 HydrophobicContact CE1-CB 3.62Å; F55-D86 HydrophobicContact CZ-CB 3.68Å; F55-D86 PolarHBondContact N-O 2.74Å; F55-D86 PolarHBondContact O-N 3Å; Y78-D86 VanDerWaalsContact OH-CB 3.3Å; Y78-D86 WeakPolarHBondContact OH-CB 3.3Å; Y78-D86 PolarHBondContact OH-OD2 2.97Å
87	S	95.3	Very high	95.6	Very high	49 Å²	49	69.9 Å²	69.9	34%	0.343	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	121.8	174.5	-176.5	0	0	0	0	109.2	L53	L53-S87 WeakPolarHBondContact O-CA 2.9Å
88	F	96.4	Very high	95.6	Very high	57 Å²	57	66.6 Å²	66.6	25%	0.25	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.3	-176.3	-179	-106.6	0	0	0	110.9	T52 L53 L69 Y78 F90	T52-F88 WeakPolarHBondContact CA-O 3.02Å; L53-F88 PolarHBondContact N-O 3.3Å; L53-F88 PolarHBondContact O-N 3.41Å; L69-F88 HydrophobicContact CD2-CD1 4.03Å; L69-F88 HydrophobicContact CD2-CE1 3.99Å; Y78-F88 HydrophobicContact CD2-CB 3.9Å; Y78-F88 HydrophobicContact CD2-CD1 4.03Å; Y78-F88 AromaticContact CD2-CD2 3.55Å; Y78-F88 HydrophobicContact CD2-CD2 3.55Å; Y78-F88 HydrophobicContact CD2-CE1 4.47Å; Y78-F88 HydrophobicContact CD2-CE2 4.05Å; Y78-F88 AromaticContact CD2-CG 3.53Å; Y78-F88 HydrophobicContact CD2-CG 3.53Å; Y78-F88 HydrophobicContact CD2-CZ 4.48Å; Y78-F88 HydrophobicContact CE2-CB 3.96Å; Y78-F88 HydrophobicContact CE2-CD2 4.11Å; Y78-F88 HydrophobicContact CE2-CG 4.09Å; Y78-F88 HydrophobicContact CG-CB 4.22Å; Y78-F88 AromaticContact CG-CD1 3.88Å; Y78-F88 HydrophobicContact CG-CD1 3.88Å; Y78-F88 HydrophobicContact CG-CD2 4.24Å; Y78-F88 HydrophobicContact CG-CE1 4.3Å; Y78-F88 AromaticContact CG-CG 3.84Å; Y78-F88 HydrophobicContact CG-CG 3.84Å; F88-F90 HydrophobicContact CD1-CB 4.49Å; F88-F90 AromaticContact CD1-CD1 3.98Å; F88-F90 HydrophobicContact CD1-CD1 3.98Å; F88-F90 HydrophobicContact CE1-CB 3.72Å; F88-F90 AromaticContact CE1-CD1 3.84Å; F88-F90 HydrophobicContact CE1-CD1 3.84Å; F88-F90 HydrophobicContact CE1-CG 4.06Å; F88-F90 HydrophobicContact CZ-CB 4.12Å
89	T	95.5	Very high	95.6	Very high	69 Å²	69	68.5 Å²	68.5	42%	0.423	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.1	176.3	-58.1	0	0	0	0	110.6	K50 C51 T52	K50-T89 HydrophobicContact CD-CG2 4.26Å; K50-T89 HydrophobicContact CG-CG2 3.89Å; C51-T89 CarbonylContact O-C 3.5Å; C51-T89 VanDerWaalsContact O-CA 3.3Å; C51-T89 WeakPolarHBondContact O-CA 3.43Å; T52-T89 WeakPolarHBondContact CG2-OG1 3.23Å; T52-T89 PolarHBondContact OG1-OG1 3.4Å
90	F	94.9	Very high	95.5	Very high	23 Å²	23	63.5 Å²	63.5	10%	0.101	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	164.7	175.7	69.3	-78.6	0	0	0	111.2	I45 C51 L69 L77 F88 F98 F118	I45-F90 HydrophobicContact CD1-CZ 4.43Å; C51-F90 HydrophobicContact CB-CD1 4.26Å; C51-F90 HydrophobicContact CB-CE1 3.66Å; C51-F90 HydrophobicContact CB-CE2 4.2Å; C51-F90 HydrophobicContact CB-CZ 3.64Å; C51-F90 PolarHBondContact N-O 2.97Å; C51-F90 PolarHBondContact O-N 3.49Å; C51-F90 VanDerWaalsContact O-O 3.13Å; L69-F90 HydrophobicContact CD1-CE1 4.45Å; L69-F90 HydrophobicContact CD1-CZ 4.4Å; L69-F90 HydrophobicContact CD2-CD1 3.63Å; L69-F90 HydrophobicContact CD2-CE1 3.33Å; L69-F90 HydrophobicContact CD2-CE2 4.48Å; L69-F90 HydrophobicContact CD2-CG 4.35Å; L69-F90 HydrophobicContact CD2-CZ 3.8Å; L69-F90 HydrophobicContact CG-CE1 4.48Å; L77-F90 HydrophobicContact CD1-CD2 4.07Å; L77-F90 HydrophobicContact CD1-CE2 4.11Å; F88-F90 HydrophobicContact CD1-CB 4.49Å; F88-F90 AromaticContact CD1-CD1 3.98Å; F88-F90 HydrophobicContact CD1-CD1 3.98Å; F88-F90 HydrophobicContact CE1-CB 3.72Å; F88-F90 AromaticContact CE1-CD1 3.84Å; F88-F90 HydrophobicContact CE1-CD1 3.84Å; F88-F90 HydrophobicContact CE1-CG 4.06Å; F88-F90 HydrophobicContact CZ-CB 4.12Å; F90-F98 HydrophobicContact CD2-CE1 4.48Å; F90-F98 AromaticContact CE2-CD1 3.83Å; F90-F98 HydrophobicContact CE2-CD1 3.83Å; F90-F98 AromaticContact CE2-CE1 3.57Å; F90-F98 HydrophobicContact CE2-CE1 3.57Å; F90-F98 HydrophobicContact CE2-CZ 4.31Å; F90-F98 HydrophobicContact CZ-CD1 4.04Å; F90-F98 HydrophobicContact CZ-CE1 4.25Å; F90-F118 HydrophobicContact CE1-CE2 4.13Å; F90-F118 HydrophobicContact CE1-CZ 4.39Å; F90-F118 HydrophobicContact CZ-CE2 4.39Å; F90-F118 HydrophobicContact CZ-CZ 4.2Å
91	T	95.6	Very high	95.5	Very high	91 Å²	91	60.8 Å²	60.8	56%	0.558	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	129	171.8	-56.1	0	0	0	0	108.7	A93	T91-A93 PolarHBondContact O-N 3.08Å
92	A	95.1	Very high	95.6	Very high	2 Å²	2	56.7 Å²	56.7	2%	0.017	30%	0.302	C	S	.	.			trans	-62.8	116.4	-179.7	0	0	0	0	0	110.7	I45 I46 G48 T49 K94 F98	I45-A92 HydrophobicContact CG2-CB 3.72Å; I46-A92 WeakPolarHBondContact O-CB 3.46Å; G48-A92 PolarHBondContact N-O 2.93Å; T49-A92 PolarHBondContact O-N 2.9Å; A92-K94 VanDerWaalsContact C-N 3.31Å; A92-F98 HydrophobicContact CB-CE2 4.13Å; A92-F98 HydrophobicContact CB-CZ 3.81Å
93	A	93.4	Very high	95.7	Very high	77 Å²	77	51.2 Å²	51.2	64%	0.636	28%	0.28	S	S	*	.	S	Bend	trans	-78.4	-20	178.5	0	0	0	0	0	112.6	T47 T91	T47-A93 WeakPolarHBondContact CG2-O 3.34Å; T91-A93 PolarHBondContact O-N 3.08Å
94	K	92.3	Very high	95.7	Very high	94 Å²	94	47.7 Å²	47.7	41%	0.409	26%	0.264	S	S	.	.	S	Bend	trans	-143.6	159	-173.6	-66.5	177.2	-177.5	166.2	0	110.9	T47 D73 A92	T47-K94 VanDerWaalsContact OG1-CA 3.3Å; T47-K94 WeakPolarHBondContact OG1-CA 3.3Å; D73-K94 WeakPolarHBondContact OD2-CD 3.17Å; D73-K94 IonicContact OD2-NZ 3.17Å; D73-K94 PolarHBondContact OD2-NZ 2.91Å; A92-K94 VanDerWaalsContact C-N 3.31Å
95	N	95.5	Very high	95.7	Very high	110 Å²	110	46.9 Å²	46.9	59%	0.588	26%	0.261	S	S	*	.	S	Bend	trans	-81.7	134.7	171.5	-67.5	-17.2	0	0	0	109.1	I45 I46 T47	I45-N95 WeakPolarHBondContact O-CA 3.07Å; I46-N95 WeakPolarHBondContact CA-OD1 3.29Å; T47-N95 WeakPolarHBondContact CA-OD1 3.43Å; T47-N95 VanDerWaalsContact CB-OD1 3.24Å; T47-N95 WeakPolarHBondContact CB-OD1 3.18Å; T47-N95 PolarHBondContact N-OD1 2.91Å; T47-N95 VanDerWaalsContact OG1-CG 3.26Å; T47-N95 PolarHBondContact OG1-N 2.87Å; T47-N95 PolarHBondContact OG1-OD1 3.48Å
96	G	95.1	Very high	95.6	Very high	23 Å²	23	45.2 Å²	45.2	24%	0.237	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.9	-168.2	167.3	0	0	0	0	0	113.2	I45 P72 F98	I45-G96 PolarHBondContact N-O 2.93Å; I45-G96 PolarHBondContact O-N 2.82Å; P72-G96 VanDerWaalsContact CG-C 3.48Å; G96-F98 WeakPolarHBondContact O-CD2 3.48Å; G96-F98 PolarHBondContact O-N 3.22Å
97	T	96.6	Very high	95.4	Very high	66 Å²	66	43.8 Å²	43.8	41%	0.405	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	110.3	-178.6	-42.9	0	0	0	0	110.8	Y42 E43 D44 P72	Y42-T97 HydrophobicContact CD1-CG2 4.06Å; Y42-T97 HydrophobicContact CG-CG2 4.4Å; E43-T97 CarbonylContact O-C 3.57Å; E43-T97 WeakPolarHBondContact O-CA 3.24Å; D44-T97 VanDerWaalsContact OD1-CA 3.31Å; D44-T97 WeakPolarHBondContact OD1-CA 3.42Å; D44-T97 VanDerWaalsContact OD1-CB 3.25Å; D44-T97 WeakPolarHBondContact OD1-CB 3.26Å; D44-T97 PolarHBondContact OD1-OG1 2.89Å; P72-T97 WeakPolarHBondContact CA-O 3.42Å
98	F	96.5	Very high	95	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	147	170.3	-74.2	-106.3	0	0	0	109.4	Y42 E43 I45 D71 P72 L77 F90 A92 G96	Y42-F98 VanDerWaalsContact CA-O 3.29Å; Y42-F98 WeakPolarHBondContact CA-O 3.42Å; E43-F98 PolarHBondContact N-O 2.67Å; E43-F98 PolarHBondContact O-N 3.42Å; I45-F98 HydrophobicContact CB-CD2 3.65Å; I45-F98 HydrophobicContact CB-CE2 3.76Å; I45-F98 HydrophobicContact CD1-CB 3.85Å; I45-F98 HydrophobicContact CD1-CD1 4.41Å; I45-F98 HydrophobicContact CD1-CD2 3.54Å; I45-F98 HydrophobicContact CD1-CE2 4.2Å; I45-F98 HydrophobicContact CD1-CG 3.67Å; I45-F98 HydrophobicContact CG1-CB 4.48Å; I45-F98 HydrophobicContact CG1-CD2 3.7Å; I45-F98 HydrophobicContact CG1-CE2 4.3Å; I45-F98 HydrophobicContact CG1-CG 4.3Å; I45-F98 HydrophobicContact CG2-CE2 4.44Å; D71-F98 HydrophobicContact CB-CE1 4.36Å; D71-F98 WeakPolarHBondContact OD1-CE1 3.37Å; D71-F98 WeakPolarHBondContact OD1-CZ 3.5Å; P72-F98 HydrophobicContact CG-CD2 4.06Å; P72-F98 HydrophobicContact CG-CE2 3.91Å; P72-F98 HydrophobicContact CG-CZ 4.41Å; L77-F98 HydrophobicContact CD1-CD1 4.07Å; L77-F98 HydrophobicContact CD1-CE1 3.66Å; F90-F98 HydrophobicContact CD2-CE1 4.48Å; F90-F98 AromaticContact CE2-CD1 3.83Å; F90-F98 HydrophobicContact CE2-CD1 3.83Å; F90-F98 AromaticContact CE2-CE1 3.57Å; F90-F98 HydrophobicContact CE2-CE1 3.57Å; F90-F98 HydrophobicContact CE2-CZ 4.31Å; F90-F98 HydrophobicContact CZ-CD1 4.04Å; F90-F98 HydrophobicContact CZ-CE1 4.25Å; A92-F98 HydrophobicContact CB-CE2 4.13Å; A92-F98 HydrophobicContact CB-CZ 3.81Å; G96-F98 WeakPolarHBondContact O-CD2 3.48Å; G96-F98 PolarHBondContact O-N 3.22Å
99	K	96.5	Very high	94.6	Very high	59 Å²	59	52 Å²	52	26%	0.257	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	123.9	-177	173.5	-171.4	165.5	-146.7	0	109.4	F41 Y42 L69 E70 C101	F41-K99 WeakPolarHBondContact O-CA 3.44Å; Y42-K99 HydrophobicContact CD1-CB 3.89Å; Y42-K99 HydrophobicContact CD1-CD 4.48Å; Y42-K99 HydrophobicContact CD1-CG 3.99Å; Y42-K99 HydrophobicContact CE1-CB 3.86Å; Y42-K99 HydrophobicContact CE1-CD 3.63Å; Y42-K99 HydrophobicContact CE1-CG 3.54Å; L69-K99 CarbonylContact C-O 3.59Å; L69-K99 WeakPolarHBondContact CA-O 3.49Å; E70-K99 HydrophobicContact CB-CB 4.5Å; E70-K99 PolarHBondContact N-O 2.93Å; E70-K99 PolarHBondContact O-N 3.34Å; E70-K99 IonicContact OE2-NZ 2.57Å; E70-K99 PolarHBondContact OE2-NZ 3.41Å; K99-C101 WeakPolarHBondContact CE-SG 3.42Å
100	F	96.3	Very high	94.3	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137	172.5	58.7	-81.9	0	0	0	110.6	C40 F41 L53 R68 L69 F102 F116 F118	C40-F100 CarbonylContact C-O 3.57Å; C40-F100 WeakPolarHBondContact CA-O 3.28Å; F41-F100 HydrophobicContact CB-CD1 4.26Å; F41-F100 HydrophobicContact CB-CD2 4Å; F41-F100 HydrophobicContact CB-CE1 3.73Å; F41-F100 HydrophobicContact CB-CE2 3.45Å; F41-F100 VanDerWaalsContact CB-CE2 3.45Å; F41-F100 HydrophobicContact CB-CG 4.38Å; F41-F100 HydrophobicContact CB-CZ 3.3Å; F41-F100 HydrophobicContact CD2-CD2 4.18Å; F41-F100 AromaticContact CD2-CE2 3.79Å; F41-F100 HydrophobicContact CD2-CE2 3.79Å; F41-F100 HydrophobicContact CD2-CZ 4.46Å; F41-F100 AromaticContact CG-CE2 3.86Å; F41-F100 HydrophobicContact CG-CE2 3.86Å; F41-F100 HydrophobicContact CG-CZ 4.08Å; F41-F100 PolarHBondContact N-O 2.83Å; F41-F100 PolarHBondContact O-N 2.92Å; L53-F100 HydrophobicContact CD1-CD2 4.03Å; L53-F100 HydrophobicContact CD1-CE2 4.28Å; L53-F100 HydrophobicContact CD1-CG 4.5Å; L53-F100 HydrophobicContact CD2-CB 4.16Å; R68-F100 CarbonylContact O-C 3.55Å; R68-F100 VanDerWaalsContact O-CA 3.23Å; R68-F100 WeakPolarHBondContact O-CA 3.39Å; L69-F100 HydrophobicContact CD1-CB 3.84Å; F100-F102 AromaticContact CD2-CE2 3.95Å; F100-F102 HydrophobicContact CD2-CE2 3.95Å; F100-F102 HydrophobicContact CD2-CZ 4.47Å; F100-F102 HydrophobicContact CE2-CE2 4.23Å; F100-F116 AromaticContact CE2-CD2 3.73Å; F100-F116 HydrophobicContact CE2-CD2 3.73Å; F100-F116 HydrophobicContact CE2-CE1 4.47Å; F100-F116 AromaticContact CE2-CE2 3.48Å; F100-F116 HydrophobicContact CE2-CE2 3.48Å; F100-F116 VanDerWaalsContact CE2-CE2 3.48Å; F100-F116 HydrophobicContact CE2-CG 4.35Å; F100-F116 AromaticContact CE2-CZ 3.87Å; F100-F116 HydrophobicContact CE2-CZ 3.87Å; F100-F116 HydrophobicContact CZ-CD2 4.21Å; F100-F116 AromaticContact CZ-CE2 3.66Å; F100-F116 HydrophobicContact CZ-CE2 3.66Å; F100-F116 HydrophobicContact CZ-CZ 4.18Å; F100-F118 HydrophobicContact CD1-CD2 4.35Å; F100-F118 HydrophobicContact CD1-CE2 4.39Å; F100-F118 HydrophobicContact CD1-CG 4.48Å; F100-F118 HydrophobicContact CE1-CB 4.3Å; F100-F118 AromaticContact CE1-CD1 3.94Å; F100-F118 HydrophobicContact CE1-CD1 3.94Å; F100-F118 HydrophobicContact CE1-CD2 4.17Å; F100-F118 HydrophobicContact CE1-CE1 4.3Å; F100-F118 AromaticContact CE1-CG 3.86Å; F100-F118 HydrophobicContact CE1-CG 3.86Å; F100-F118 HydrophobicContact CZ-CB 3.96Å; F100-F118 HydrophobicContact CZ-CD1 4.41Å; F100-F118 HydrophobicContact CZ-CD2 4.48Å; F100-F118 HydrophobicContact CZ-CG 4.03Å
101	C	97.6	Very high	94.3	Very high	15 Å²	15	55.2 Å²	55.2	10%	0.101	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141.6	-174.2	-57	0	0	0	0	111.4	Q39 C40 C67 R68 K99	Q39-C101 CarbonylContact O-C 3.48Å; Q39-C101 VanDerWaalsContact O-CA 3.25Å; Q39-C101 WeakPolarHBondContact O-CA 3.4Å; C40-C101 HydrophobicContact CB-CB 4.07Å; C40-C101 WeakPolarHBondContact CB-SG 3.42Å; C40-C101 WeakPolarHBondContact SG-CB 3.41Å; C40-C101 CovalentContact SG-SG 2.04Å; C40-C101 PolarHBondContact SG-SG 2.62Å; C67-C101 WeakPolarHBondContact CA-O 3.46Å; R68-C101 PolarHBondContact N-O 3.19Å; R68-C101 PolarHBondContact O-N 2.71Å; K99-C101 WeakPolarHBondContact CE-SG 3.42Å
102	F	98.1	Very high	94.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.1	168.5	-60.7	-77.6	0	0	0	108.9	F31 L33 K38 Q39 F41 L53 F55 V65 D66 C67 F100 V114 F116	F31-F102 AromaticContact CE1-CD2 3.9Å; F31-F102 HydrophobicContact CE1-CD2 3.9Å; F31-F102 HydrophobicContact CE1-CE2 4.33Å; F31-F102 HydrophobicContact CZ-CB 4.05Å; F31-F102 AromaticContact CZ-CD2 3.78Å; F31-F102 HydrophobicContact CZ-CD2 3.78Å; F31-F102 HydrophobicContact CZ-CG 4.17Å; L33-F102 HydrophobicContact CD2-CB 3.98Å; K38-F102 CarbonylContact C-O 3.54Å; K38-F102 VanDerWaalsContact CA-O 3.31Å; K38-F102 WeakPolarHBondContact CA-O 3.21Å; Q39-F102 PolarHBondContact N-O 3.31Å; Q39-F102 PolarHBondContact O-N 2.94Å; F41-F102 HydrophobicContact CD2-CD2 4.31Å; F41-F102 HydrophobicContact CD2-CE2 4.4Å; F41-F102 HydrophobicContact CE2-CD2 4.1Å; F41-F102 HydrophobicContact CE2-CE2 4.41Å; L53-F102 HydrophobicContact CD1-CZ 4.39Å; F55-F102 HydrophobicContact CB-CE1 3.65Å; F55-F102 HydrophobicContact CB-CZ 3.84Å; F55-F102 AromaticContact CD1-CE1 3.99Å; F55-F102 HydrophobicContact CD1-CE1 3.99Å; F55-F102 HydrophobicContact CD2-CE1 4.03Å; F55-F102 AromaticContact CG-CE1 3.62Å; F55-F102 HydrophobicContact CG-CE1 3.62Å; F55-F102 HydrophobicContact CG-CZ 4.26Å; V65-F102 HydrophobicContact CG1-CD1 4.12Å; V65-F102 HydrophobicContact CG2-CB 4.01Å; V65-F102 HydrophobicContact CG2-CD1 4.4Å; D66-F102 CarbonylContact O-C 3.5Å; D66-F102 WeakPolarHBondContact O-CA 3.41Å; C67-F102 HydrophobicContact CB-CD1 4.24Å; C67-F102 HydrophobicContact CB-CE1 4.22Å; F100-F102 AromaticContact CD2-CE2 3.95Å; F100-F102 HydrophobicContact CD2-CE2 3.95Å; F100-F102 HydrophobicContact CD2-CZ 4.47Å; F100-F102 HydrophobicContact CE2-CE2 4.23Å; F102-V114 HydrophobicContact CD1-CG1 4.17Å; F102-V114 HydrophobicContact CE1-CG1 4.26Å; F102-V114 HydrophobicContact CG-CG1 4.4Å; F102-F116 HydrophobicContact CE2-CB 3.99Å; F102-F116 AromaticContact CE2-CD1 3.76Å; F102-F116 HydrophobicContact CE2-CD1 3.76Å; F102-F116 HydrophobicContact CE2-CE1 4.4Å; F102-F116 AromaticContact CE2-CG 3.9Å; F102-F116 HydrophobicContact CE2-CG 3.9Å; F102-F116 HydrophobicContact CZ-CB 3.71Å; F102-F116 HydrophobicContact CZ-CD1 4.36Å; F102-F116 HydrophobicContact CZ-CG 4.13Å
103	S	97.6	Very high	94.3	Very high	11 Å²	11	51.9 Å²	51.9	8%	0.077	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	134	179	-179.2	0	0	0	0	111.8	V65 D66 E105	V65-S103 VanDerWaalsContact CG2-O 3.32Å; V65-S103 WeakPolarHBondContact CG2-O 3.43Å; D66-S103 PolarHBondContact N-O 2.92Å; D66-S103 VanDerWaalsContact N-O 3.11Å; D66-S103 PolarHBondContact O-N 2.6Å; S103-E105 WeakPolarHBondContact OG-CB 3.27Å; S103-E105 VanDerWaalsContact OG-CG 3.31Å; S103-E105 WeakPolarHBondContact OG-CG 3.42Å; S103-E105 PolarHBondContact OG-N 3.24Å; S103-E105 PolarHBondContact OG-OE2 3.41Å
104	N	96.3	Very high	94.5	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.			trans	-119.1	25.7	171.7	-170.9	30.4	0	0	0	111	L33 P34 N36 A37 F106 S107 T110 K112	L33-N104 HydrophobicContact CD2-CB 3.63Å; L33-N104 HydrophobicContact CG-CB 3.7Å; P34-N104 WeakPolarHBondContact O-CB 3.46Å; P34-N104 PolarHBondContact O-ND2 3.28Å; N36-N104 PolarHBondContact N-O 2.93Å; A37-N104 CarbonylContact O-C 3.6Å; A37-N104 PolarHBondContact O-N 3.32Å; N104-F106 PolarHBondContact O-N 3.11Å; N104-F106 VanDerWaalsContact O-N 3.11Å; N104-S107 PolarHBondContact O-N 2.82Å; N104-S107 VanDerWaalsContact O-N 3.12Å; N104-S107 WeakPolarHBondContact OD1-CB 3.44Å; N104-S107 PolarHBondContact OD1-OG 3.13Å; N104-T110 PolarHBondContact ND2-O 3.48Å; N104-K112 HydrophobicContact CB-CD 4.24Å; N104-K112 VanDerWaalsContact OD1-CD 3.3Å; N104-K112 WeakPolarHBondContact OD1-CD 3.37Å; N104-K112 WeakPolarHBondContact OD1-CE 3.46Å
105	E	94.6	Very high	94.6	Very high	91 Å²	91	44.5 Å²	44.5	43%	0.425	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.1	178.2	-73.6	171.1	164.4	0	0	112.7	S103	S103-E105 WeakPolarHBondContact OG-CB 3.27Å; S103-E105 VanDerWaalsContact OG-CG 3.31Å; S103-E105 WeakPolarHBondContact OG-CG 3.42Å; S103-E105 PolarHBondContact OG-N 3.24Å; S103-E105 PolarHBondContact OG-OE2 3.41Å
106	F	92.9	Very high	94.6	Very high	63 Å²	63	39.8 Å²	39.8	28%	0.276	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-15	179.1	66.5	-94.5	0	0	0	114.7	D64 K82 N104	D64-F106 HydrophobicContact CB-CZ 4.44Å; D64-F106 WeakPolarHBondContact O-CZ 3.48Å; D64-F106 WeakPolarHBondContact OD1-CE2 3.46Å; K82-F106 HydrophobicContact CG-CZ 4.39Å; N104-F106 PolarHBondContact O-N 3.11Å; N104-F106 VanDerWaalsContact O-N 3.11Å
107	S	90.5	Very high	94.6	Very high	13 Å²	13	38.9 Å²	38.9	9%	0.091	20%	0.197	C	C	.	.			trans	-102	119.5	177.2	-49.4	0	0	0	0	109.9	D35 N36 N104 K112	D35-S107 WeakPolarHBondContact CB-O 3.26Å; N36-S107 PolarHBondContact N-O 2.55Å; N104-S107 PolarHBondContact O-N 2.82Å; N104-S107 VanDerWaalsContact O-N 3.12Å; N104-S107 WeakPolarHBondContact OD1-CB 3.44Å; N104-S107 PolarHBondContact OD1-OG 3.13Å; S107-K112 VanDerWaalsContact OG-CE 3.31Å; S107-K112 WeakPolarHBondContact OG-CE 3.17Å
108	T	86.9	Confident	94.4	Very high	87 Å²	87	36.3 Å²	36.3	53%	0.534	18%	0.18	S	C	.	.	S	Bend	trans	-93.8	-9.8	-176.1	49.8	0	0	0	0	114.4
109	F	87.9	Confident	94.2	Very high	192 Å²	192	39.1 Å²	39.1	84%	0.842	19%	0.193	S	C	*	.	S	Bend	trans	-138.2	-7.3	-171.5	-65.5	-70	0	0	0	114.5
110	T	91.1	Very high	94	Very high	56 Å²	56	39 Å²	39	34%	0.344	20%	0.197	S	C	.	.			trans	-130.1	119.3	-174	58.2	0	0	0	0	110.3	N104	N104-T110 PolarHBondContact ND2-O 3.48Å
111	H	94.1	Very high	93.4	Very high	103 Å²	103	39.9 Å²	39.9	48%	0.477	21%	0.208	S	C	.	.			trans	-68.7	161.5	164.3	64.6	-90.1	0	0	0	110.1	L33 G60	L33-H111 WeakPolarHBondContact O-CA 3.41Å; G60-H111 WeakPolarHBondContact CA-O 3.33Å
112	K	95.6	Very high	92.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144.7	179.6	-65.1	175	-178.5	-78.3	0	109.6	E32 L33 V57 T59 D64 N104 S107 V114	E32-K112 CarbonylContact C-O 3.6Å; L33-K112 PolarHBondContact N-O 3.23Å; L33-K112 PolarHBondContact O-N 2.86Å; V57-K112 HydrophobicContact CG1-CB 4.47Å; T59-K112 WeakPolarHBondContact O-CA 3.34Å; D64-K112 WeakPolarHBondContact O-CD 3.23Å; D64-K112 WeakPolarHBondContact O-CE 3.32Å; D64-K112 PolarHBondContact O-NZ 3.4Å; D64-K112 IonicContact OD1-NZ 2.8Å; D64-K112 PolarHBondContact OD1-NZ 3.38Å; N104-K112 HydrophobicContact CB-CD 4.24Å; N104-K112 VanDerWaalsContact OD1-CD 3.3Å; N104-K112 WeakPolarHBondContact OD1-CD 3.37Å; N104-K112 WeakPolarHBondContact OD1-CE 3.46Å; S107-K112 VanDerWaalsContact OG-CE 3.31Å; S107-K112 WeakPolarHBondContact OG-CE 3.17Å; K112-V114 HydrophobicContact CB-CG2 4.42Å
113	T	95.6	Very high	91.2	Very high	23 Å²	23	49.8 Å²	49.8	14%	0.141	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.5	169	-56.3	0	0	0	0	108.1	T30 F31 V58 T59	T30-T113 HydrophobicContact CG2-CG2 3.51Å; F31-T113 WeakPolarHBondContact O-CA 3.16Å; V58-T113 HydrophobicContact CB-CG2 4.4Å; V58-T113 PolarHBondContact N-O 3.49Å; T59-T113 PolarHBondContact O-N 3.42Å; T59-T113 VanDerWaalsContact O-N 3.08Å; T59-T113 WeakPolarHBondContact OG1-CB 3.07Å; T59-T113 PolarHBondContact OG1-OG1 3.43Å
114	V	96.5	Very high	89.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.1	-176.2	-176.2	0	0	0	0	108.7	T30 F31 L33 V57 V65 F102 K112	T30-V114 WeakPolarHBondContact CA-O 3.33Å; F31-V114 HydrophobicContact CD1-CB 4.44Å; F31-V114 WeakPolarHBondContact CD1-O 3.47Å; F31-V114 HydrophobicContact CE1-CB 3.86Å; F31-V114 HydrophobicContact CE1-CG1 4.16Å; F31-V114 HydrophobicContact CZ-CB 4.1Å; F31-V114 PolarHBondContact N-O 2.81Å; F31-V114 PolarHBondContact O-N 3.02Å; L33-V114 HydrophobicContact CD2-CG2 4.49Å; V57-V114 HydrophobicContact CG2-CG2 4.47Å; V65-V114 HydrophobicContact CG2-CG2 4.4Å; F102-V114 HydrophobicContact CD1-CG1 4.17Å; F102-V114 HydrophobicContact CE1-CG1 4.26Å; F102-V114 HydrophobicContact CG-CG1 4.4Å; K112-V114 HydrophobicContact CB-CG2 4.42Å
115	Y	95.8	Very high	88.3	Confident	16 Å²	16	59.4 Å²	59.4	6%	0.063	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	135.9	164.8	171.2	-89.3	0	0	0	108.4	E28 L29 T30 F55 Q56 D117 T158 L162	E28-Y115 HydrophobicContact CB-CE2 4.07Å; E28-Y115 VanDerWaalsContact CG-OH 3.27Å; E28-Y115 WeakPolarHBondContact CG-OH 3.41Å; E28-Y115 PolarHBondContact OE1-OH 2.87Å; E28-Y115 PolarHBondContact OE2-OH 3.19Å; L29-Y115 WeakPolarHBondContact O-CA 3.12Å; T30-Y115 WeakPolarHBondContact OG1-CD2 3.2Å; F55-Y115 CarbonylContact C-O 3.6Å; F55-Y115 VanDerWaalsContact CA-O 3.24Å; F55-Y115 WeakPolarHBondContact CA-O 3.4Å; F55-Y115 WeakPolarHBondContact CB-O 3.02Å; Q56-Y115 PolarHBondContact N-O 3.1Å; Q56-Y115 PolarHBondContact O-N 3.41Å; Y115-D117 HydrophobicContact CE1-CB 4.28Å; Y115-T158 HydrophobicContact CE2-CG2 4.36Å; Y115-T158 WeakPolarHBondContact OH-CG2 3.47Å; Y115-L162 HydrophobicContact CD1-CD1 3.4Å; Y115-L162 HydrophobicContact CD1-CD2 4.3Å; Y115-L162 HydrophobicContact CD1-CG 4.5Å; Y115-L162 HydrophobicContact CD2-CD1 4.13Å; Y115-L162 HydrophobicContact CD2-CD2 3.83Å; Y115-L162 HydrophobicContact CE1-CD1 3.55Å; Y115-L162 HydrophobicContact CE2-CD1 4.25Å; Y115-L162 HydrophobicContact CE2-CD2 4.47Å; Y115-L162 HydrophobicContact CG-CD1 3.71Å; Y115-L162 HydrophobicContact CG-CD2 3.72Å; Y115-L162 HydrophobicContact CG-CG 4.38Å
116	F	95.7	Very high	87	Confident	11 Å²	11	58.6 Å²	58.6	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	155.4	165.2	73.9	-91.9	0	0	0	111.1	E28 L29 F31 F41 E54 F55 F100 F102 F118	E28-F116 CarbonylContact C-O 3.57Å; E28-F116 WeakPolarHBondContact CA-O 3.28Å; L29-F116 HydrophobicContact CB-CD1 4.37Å; L29-F116 HydrophobicContact CB-CE1 3.72Å; L29-F116 HydrophobicContact CB-CE2 4.37Å; L29-F116 HydrophobicContact CB-CZ 3.73Å; L29-F116 HydrophobicContact CD2-CE1 3.89Å; L29-F116 HydrophobicContact CD2-CZ 3.98Å; L29-F116 HydrophobicContact CG-CE1 4.11Å; L29-F116 HydrophobicContact CG-CZ 4.37Å; L29-F116 PolarHBondContact N-O 3.49Å; L29-F116 PolarHBondContact O-N 3.01Å; F31-F116 AromaticContact CD1-CD1 3.97Å; F31-F116 HydrophobicContact CD1-CD1 3.97Å; F31-F116 AromaticContact CD1-CE1 3.87Å; F31-F116 HydrophobicContact CD1-CE1 3.87Å; F31-F116 AromaticContact CE1-CD1 3.75Å; F31-F116 HydrophobicContact CE1-CD1 3.75Å; F31-F116 AromaticContact CE1-CE1 3.89Å; F31-F116 HydrophobicContact CE1-CE1 3.89Å; F41-F116 HydrophobicContact CD1-CE1 4.32Å; F41-F116 AromaticContact CD1-CZ 3.93Å; F41-F116 HydrophobicContact CD1-CZ 3.93Å; F41-F116 AromaticContact CD2-CE1 3.9Å; F41-F116 HydrophobicContact CD2-CE1 3.9Å; F41-F116 AromaticContact CD2-CZ 3.98Å; F41-F116 HydrophobicContact CD2-CZ 3.98Å; F41-F116 AromaticContact CE1-CE1 4Å; F41-F116 HydrophobicContact CE1-CE1 4Å; F41-F116 HydrophobicContact CE1-CZ 4.01Å; F41-F116 HydrophobicContact CE2-CD1 4.36Å; F41-F116 AromaticContact CE2-CE1 3.54Å; F41-F116 HydrophobicContact CE2-CE1 3.54Å; F41-F116 HydrophobicContact CE2-CZ 4.05Å; F41-F116 HydrophobicContact CG-CE1 4.27Å; F41-F116 AromaticContact CG-CZ 3.93Å; F41-F116 HydrophobicContact CG-CZ 3.93Å; F41-F116 AromaticContact CZ-CE1 3.6Å; F41-F116 HydrophobicContact CZ-CE1 3.6Å; F41-F116 HydrophobicContact CZ-CZ 4.07Å; E54-F116 CarbonylContact O-C 3.53Å; E54-F116 WeakPolarHBondContact O-CA 3.39Å; E54-F116 WeakPolarHBondContact O-CB 3.15Å; F55-F116 HydrophobicContact CB-CB 4.02Å; F100-F116 AromaticContact CE2-CD2 3.73Å; F100-F116 HydrophobicContact CE2-CD2 3.73Å; F100-F116 HydrophobicContact CE2-CE1 4.47Å; F100-F116 AromaticContact CE2-CE2 3.48Å; F100-F116 HydrophobicContact CE2-CE2 3.48Å; F100-F116 VanDerWaalsContact CE2-CE2 3.48Å; F100-F116 HydrophobicContact CE2-CG 4.35Å; F100-F116 AromaticContact CE2-CZ 3.87Å; F100-F116 HydrophobicContact CE2-CZ 3.87Å; F100-F116 HydrophobicContact CZ-CD2 4.21Å; F100-F116 AromaticContact CZ-CE2 3.66Å; F100-F116 HydrophobicContact CZ-CE2 3.66Å; F100-F116 HydrophobicContact CZ-CZ 4.18Å; F102-F116 HydrophobicContact CE2-CB 3.99Å; F102-F116 AromaticContact CE2-CD1 3.76Å; F102-F116 HydrophobicContact CE2-CD1 3.76Å; F102-F116 HydrophobicContact CE2-CE1 4.4Å; F102-F116 AromaticContact CE2-CG 3.9Å; F102-F116 HydrophobicContact CE2-CG 3.9Å; F102-F116 HydrophobicContact CZ-CB 3.71Å; F102-F116 HydrophobicContact CZ-CD1 4.36Å; F102-F116 HydrophobicContact CZ-CG 4.13Å; F116-F118 HydrophobicContact CD2-CB 4.37Å; F116-F118 HydrophobicContact CE2-CB 4.43Å
117	D	93.6	Very high	86	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.027	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126.8	168	-178.4	27	0	0	0	108.5	S27 E28 E54 Y115 Q119	S27-D117 WeakPolarHBondContact CB-OD1 2.99Å; S27-D117 PolarHBondContact OG-OD1 2.93Å; E28-D117 HydrophobicContact CG-CB 3.94Å; E28-D117 WeakPolarHBondContact CG-OD1 3.24Å; E54-D117 PolarHBondContact N-O 3.11Å; E54-D117 PolarHBondContact O-N 3.05Å; Y115-D117 HydrophobicContact CE1-CB 4.28Å; D117-Q119 VanDerWaalsContact OD2-CG 3.26Å; D117-Q119 WeakPolarHBondContact OD2-CG 3.43Å; D117-Q119 PolarHBondContact OD2-NE2 3.43Å
118	F	93.9	Very high	84.7	Confident	12 Å²	12	64.1 Å²	64.1	5%	0.053	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	96.2	177.7	-169.2	-108.5	0	0	0	109.8	S27 E43 I45 C51 L53 F90 F100 F116 V120	S27-F118 PolarHBondContact O-N 2.83Å; E43-F118 HydrophobicContact CB-CD1 4.03Å; E43-F118 HydrophobicContact CB-CE1 3.69Å; E43-F118 HydrophobicContact CG-CD1 4.02Å; E43-F118 HydrophobicContact CG-CE1 3.82Å; I45-F118 HydrophobicContact CD1-CE1 3.74Å; I45-F118 HydrophobicContact CD1-CZ 3.66Å; C51-F118 HydrophobicContact CB-CZ 4.3Å; L53-F118 HydrophobicContact CB-CD2 3.84Å; L53-F118 HydrophobicContact CB-CE2 4.12Å; L53-F118 HydrophobicContact CD1-CB 4.48Å; L53-F118 HydrophobicContact CD1-CD2 3.85Å; L53-F118 HydrophobicContact CG-CD2 4.39Å; F90-F118 HydrophobicContact CE1-CE2 4.13Å; F90-F118 HydrophobicContact CE1-CZ 4.39Å; F90-F118 HydrophobicContact CZ-CE2 4.39Å; F90-F118 HydrophobicContact CZ-CZ 4.2Å; F100-F118 HydrophobicContact CD1-CD2 4.35Å; F100-F118 HydrophobicContact CD1-CE2 4.39Å; F100-F118 HydrophobicContact CD1-CG 4.48Å; F100-F118 HydrophobicContact CE1-CB 4.3Å; F100-F118 AromaticContact CE1-CD1 3.94Å; F100-F118 HydrophobicContact CE1-CD1 3.94Å; F100-F118 HydrophobicContact CE1-CD2 4.17Å; F100-F118 HydrophobicContact CE1-CE1 4.3Å; F100-F118 AromaticContact CE1-CG 3.86Å; F100-F118 HydrophobicContact CE1-CG 3.86Å; F100-F118 HydrophobicContact CZ-CB 3.96Å; F100-F118 HydrophobicContact CZ-CD1 4.41Å; F100-F118 HydrophobicContact CZ-CD2 4.48Å; F100-F118 HydrophobicContact CZ-CG 4.03Å; F116-F118 HydrophobicContact CD2-CB 4.37Å; F116-F118 HydrophobicContact CE2-CB 4.43Å; F118-V120 HydrophobicContact CD1-CG2 3.59Å; F118-V120 HydrophobicContact CE1-CG2 3.31Å; F118-V120 HydrophobicContact CZ-CG2 4.25Å
119	Q	91.4	Very high	83.4	Confident	59 Å²	59	66.6 Å²	66.6	28%	0.276	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	121	-178.3	-59.5	178.9	19	0	0	109.6	C51 T52 D117	C51-Q119 CarbonylContact C-O 3.56Å; C51-Q119 WeakPolarHBondContact CA-O 3.47Å; T52-Q119 PolarHBondContact N-O 2.95Å; T52-Q119 PolarHBondContact O-N 3.11Å; D117-Q119 VanDerWaalsContact OD2-CG 3.26Å; D117-Q119 WeakPolarHBondContact OD2-CG 3.43Å; D117-Q119 PolarHBondContact OD2-NE2 3.43Å
120	V	91.3	Very high	81.8	Confident	56 Å²	56	66.5 Å²	66.5	34%	0.339	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	113	177.1	-178.9	0	0	0	0	110	E43 I45 T49 F118	E43-V120 HydrophobicContact CG-CG2 3.8Å; I45-V120 HydrophobicContact CD1-CG2 4.24Å; I45-V120 HydrophobicContact CG1-CG1 4.19Å; I45-V120 HydrophobicContact CG1-CG2 4.32Å; I45-V120 HydrophobicContact CG2-CG1 4.04Å; T49-V120 HydrophobicContact CG2-CG1 3.89Å; F118-V120 HydrophobicContact CD1-CG2 3.59Å; F118-V120 HydrophobicContact CE1-CG2 3.31Å; F118-V120 HydrophobicContact CZ-CG2 4.25Å
121	G	85.7	Confident	80.1	Confident	24 Å²	24	71.7 Å²	71.7	25%	0.247	39%	0.392	C	S	.	.	S	Bend	trans	75.3	-177.2	-179.9	0	0	0	0	0	113.5	T49 K50	T49-G121 VanDerWaalsContact CG2-N 3.28Å; K50-G121 WeakPolarHBondContact O-CA 3.49Å; K50-G121 PolarHBondContact O-N 2.94Å
122	D	77.8	Confident	78.1	Confident	142 Å²	142	77 Å²	77	76%	0.759	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-90.5	153.2	173.3	-61.2	-48.5	0	0	0	109.4
123	D	70.9	Confident	76	Confident	81 Å²	81	83.5 Å²	83.5	43%	0.433	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-58.3	144	176	-65.3	-25.9	0	0	0	110.2	K151	D123-K151 IonicContact OD1-NZ 2.62Å; D123-K151 PolarHBondContact OD1-NZ 3.28Å; D123-K151 VanDerWaalsContact OD1-NZ 3.17Å; D123-K151 VanDerWaalsContact OD2-CD 3.23Å; D123-K151 WeakPolarHBondContact OD2-CD 3.38Å; D123-K151 WeakPolarHBondContact OD2-CE 3.42Å; D123-K151 IonicContact OD2-NZ 3.48Å; D123-K151 PolarHBondContact OD2-NZ 3.22Å
124	P	66.8	Low	74	Confident	110 Å²	110	86 Å²	86	71%	0.714	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-55.9	137.1	175.9	21.8	-31.4	0	0	0	110.2	L126	P124-L126 PolarHBondContact O-N 2.92Å
125	P	65.8	Low	71.9	Confident	104 Å²	104	90.6 Å²	90.6	68%	0.675	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-61	136.1	-178.8	24.2	-32.9	0	0	0	110.3	F127	P125-F127 PolarHBondContact O-N 3.42Å; P125-F127 VanDerWaalsContact O-N 3.14Å
126	L	67.2	Low	69.9	Low	73 Å²	73	94.7 Å²	94.7	38%	0.382	52%	0.523	S	S	.	.	S	Bend	trans	-59	-27.9	-178.8	-66	175	0	0	0	113.2	P124 V144 H147	P124-L126 PolarHBondContact O-N 2.92Å; L126-V144 HydrophobicContact CD1-CG2 4.33Å; L126-H147 HydrophobicContact CD1-CB 3.56Å
127	F	71.9	Confident	68.4	Low	77 Å²	77	97.3 Å²	97.3	34%	0.338	54%	0.54	S	S	.	.			trans	-122.8	112.3	-178	-57.1	-71.3	0	0	0	109.7	P125 N129 E140 C143 V144	P125-F127 PolarHBondContact O-N 3.42Å; P125-F127 VanDerWaalsContact O-N 3.14Å; F127-N129 PolarHBondContact O-N 2.9Å; F127-E140 HydrophobicContact CD1-CG 4.29Å; F127-E140 HydrophobicContact CD2-CB 4.08Å; F127-E140 HydrophobicContact CD2-CG 4.09Å; F127-E140 HydrophobicContact CE1-CG 4.17Å; F127-E140 HydrophobicContact CE2-CB 3.9Å; F127-E140 HydrophobicContact CE2-CG 3.97Å; F127-E140 HydrophobicContact CG-CG 4.25Å; F127-E140 HydrophobicContact CZ-CB 4.36Å; F127-E140 HydrophobicContact CZ-CG 4.02Å; F127-C143 HydrophobicContact CE2-CB 4.1Å; F127-C143 HydrophobicContact CZ-CB 4.05Å; F127-V144 HydrophobicContact CD2-CG2 4.2Å; F127-V144 HydrophobicContact CE2-CG2 4.16Å
128	P	63.2	Low	67.3	Low	115 Å²	115	104.9 Å²	104.9	75%	0.747	58%	0.575	S	S	*	*	S	Bend	trans	-71.5	-5.6	-175.5	-19.7	30.8	0	0	0	116.2
129	N	59.6	Low	66.5	Low	140 Å²	140	111.5 Å²	111.5	75%	0.749	61%	0.608	S	S	*	*			trans	-131.8	80.4	-166.2	-74.2	-35.1	0	0	0	112.8	F127 N131	F127-N129 PolarHBondContact O-N 2.9Å; N129-N131 PolarHBondContact O-N 3.46Å
130	E	55.3	Low	65.9	Low	190 Å²	190	111.5 Å²	111.5	89%	0.888	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	5.3	177.7	-75.8	-169.8	130.5	0	0	115.6
131	N	54.3	Low	65.3	Low	165 Å²	165	112.7 Å²	112.7	88%	0.882	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	16.2	-171.4	-82	-18.9	0	0	0	116	N129	N129-N131 PolarHBondContact O-N 3.46Å
132	R	53.2	Low	65.3	Low	213 Å²	213	113.9 Å²	113.9	80%	0.804	63%	0.626	S	S	*	*			trans	-130.2	92.9	177.2	-80.9	-177.1	157.5	175.7	-5.1	112.4	T134	R132-T134 PolarHBondContact O-N 2.91Å
133	V	49.8	Very low	65.7	Low	138 Å²	138	109.8 Å²	109.8	84%	0.836	61%	0.608	S	S	*	*			trans	-68.6	93.8	169.8	-171.8	0	0	0	0	109.3
134	T	53.9	Low	66.3	Low	75 Å²	75	108.4 Å²	108.4	46%	0.46	60%	0.603	S	S	.	*	S	Bend	trans	-134.1	168.2	169.1	53.5	0	0	0	0	109	R132 L136 T137	R132-T134 PolarHBondContact O-N 2.91Å; T134-L136 PolarHBondContact O-N 3.34Å; T134-T137 VanDerWaalsContact O-CG2 3.28Å; T134-T137 WeakPolarHBondContact O-CG2 3.31Å; T134-T137 PolarHBondContact O-N 3.01Å; T134-T137 PolarHBondContact O-OG1 3.21Å; T134-T137 VanDerWaalsContact O-OG1 3.11Å
135	A	52.2	Low	67.2	Low	96 Å²	96	106.6 Å²	106.6	79%	0.793	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-9.7	-176.8	0	0	0	0	0	115.9	T137	A135-T137 PolarHBondContact O-N 3.45Å
136	L	53.7	Low	68.3	Low	103 Å²	103	106.5 Å²	106.5	54%	0.539	59%	0.586	S	S	.	*	H	α-helix	trans	-57.2	-25.2	165.8	-82.4	147.2	0	0	0	113.4	T134 Q138 M139 E140	T134-L136 PolarHBondContact O-N 3.34Å; L136-Q138 VanDerWaalsContact C-N 3.3Å; L136-Q138 PolarHBondContact O-N 2.97Å; L136-M139 PolarHBondContact O-N 3.15Å; L136-E140 WeakPolarHBondContact O-CB 3.42Å; L136-E140 WeakPolarHBondContact O-CG 3.29Å; L136-E140 PolarHBondContact O-N 3.17Å
137	T	64.4	Low	69.3	Low	65 Å²	65	106.4 Å²	106.4	40%	0.399	58%	0.583	S	S	.	*	H	α-helix	trans	-60.5	-31.9	-177.3	52.1	0	0	0	0	114.2	T134 A135 S141	T134-T137 VanDerWaalsContact O-CG2 3.28Å; T134-T137 WeakPolarHBondContact O-CG2 3.31Å; T134-T137 PolarHBondContact O-N 3.01Å; T134-T137 PolarHBondContact O-OG1 3.21Å; T134-T137 VanDerWaalsContact O-OG1 3.11Å; A135-T137 PolarHBondContact O-N 3.45Å; T137-S141 WeakPolarHBondContact O-CB 3.37Å; T137-S141 PolarHBondContact O-N 2.97Å
138	Q	71.3	Confident	69.9	Low	164 Å²	164	108.7 Å²	108.7	77%	0.766	60%	0.595	S	S	*	*	H	α-helix	trans	-73.9	-38.2	178.7	-168.8	174	42.2	0	0	111.8	L136 A142	L136-Q138 VanDerWaalsContact C-N 3.3Å; L136-Q138 PolarHBondContact O-N 2.97Å; Q138-A142 WeakPolarHBondContact O-CB 3.35Å; Q138-A142 PolarHBondContact O-N 2.88Å
139	M	77.8	Confident	71.1	Confident	151 Å²	151	105.8 Å²	105.8	74%	0.744	58%	0.58	S	S	*	*	H	α-helix	trans	-72.4	-40.5	175.3	-110.7	174.2	74.3	0	0	111.4	L136 A142 C143	L136-M139 PolarHBondContact O-N 3.15Å; M139-A142 PolarHBondContact O-N 3.36Å; M139-C143 VanDerWaalsContact O-CB 3.3Å; M139-C143 WeakPolarHBondContact O-CB 3.39Å; M139-C143 PolarHBondContact O-N 2.96Å
140	E	77.6	Confident	72.6	Confident	59 Å²	59	103.8 Å²	103.8	28%	0.276	57%	0.569	S	S	.	*	H	α-helix	trans	-61.8	-47.2	175	-72.8	170.1	170.6	0	0	111	F127 L136 A142 C143 V144	F127-E140 HydrophobicContact CD1-CG 4.29Å; F127-E140 HydrophobicContact CD2-CB 4.08Å; F127-E140 HydrophobicContact CD2-CG 4.09Å; F127-E140 HydrophobicContact CE1-CG 4.17Å; F127-E140 HydrophobicContact CE2-CB 3.9Å; F127-E140 HydrophobicContact CE2-CG 3.97Å; F127-E140 HydrophobicContact CG-CG 4.25Å; F127-E140 HydrophobicContact CZ-CB 4.36Å; F127-E140 HydrophobicContact CZ-CG 4.02Å; L136-E140 WeakPolarHBondContact O-CB 3.42Å; L136-E140 WeakPolarHBondContact O-CG 3.29Å; L136-E140 PolarHBondContact O-N 3.17Å; E140-A142 PolarHBondContact O-N 3.22Å; E140-C143 WeakPolarHBondContact O-CB 3.41Å; E140-C143 PolarHBondContact O-N 3.39Å; E140-C143 VanDerWaalsContact O-N 3.16Å; E140-V144 WeakPolarHBondContact O-CG2 3.5Å; E140-V144 PolarHBondContact O-N 3.43Å
141	S	80.1	Confident	74	Confident	82 Å²	82	98.6 Å²	98.6	57%	0.573	54%	0.544	S	S	*	.	H	α-helix	trans	-61.7	-43.4	176.1	177.5	0	0	0	0	112.5	T137 C143 V144 S145	T137-S141 WeakPolarHBondContact O-CB 3.37Å; T137-S141 PolarHBondContact O-N 2.97Å; S141-C143 VanDerWaalsContact C-N 3.3Å; S141-C143 PolarHBondContact O-N 3.02Å; S141-V144 PolarHBondContact O-N 3.19Å; S141-S145 WeakPolarHBondContact O-CB 3.32Å; S141-S145 PolarHBondContact O-N 2.9Å
142	A	84.9	Confident	75.5	Confident	48 Å²	48	93.2 Å²	93.2	40%	0.397	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-38.5	174.5	0	0	0	0	0	111.9	Q138 M139 E140 S145 I146	Q138-A142 WeakPolarHBondContact O-CB 3.35Å; Q138-A142 PolarHBondContact O-N 2.88Å; M139-A142 PolarHBondContact O-N 3.36Å; E140-A142 PolarHBondContact O-N 3.22Å; A142-S145 PolarHBondContact O-N 3.47Å; A142-I146 WeakPolarHBondContact O-CB 3.48Å; A142-I146 WeakPolarHBondContact O-CD1 3.38Å; A142-I146 VanDerWaalsContact O-CG1 3.22Å; A142-I146 WeakPolarHBondContact O-CG1 3.29Å; A142-I146 PolarHBondContact O-N 3.41Å
143	C	85.4	Confident	77.3	Confident	56 Å²	56	86.4 Å²	86.4	38%	0.378	50%	0.501	S	S	.	.	H	α-helix	trans	-66.2	-44.3	177.4	-174.3	0	0	0	0	112.1	F127 M139 E140 S141 I146 H147	F127-C143 HydrophobicContact CE2-CB 4.1Å; F127-C143 HydrophobicContact CZ-CB 4.05Å; M139-C143 VanDerWaalsContact O-CB 3.3Å; M139-C143 WeakPolarHBondContact O-CB 3.39Å; M139-C143 PolarHBondContact O-N 2.96Å; E140-C143 WeakPolarHBondContact O-CB 3.41Å; E140-C143 PolarHBondContact O-N 3.39Å; E140-C143 VanDerWaalsContact O-N 3.16Å; S141-C143 VanDerWaalsContact C-N 3.3Å; S141-C143 PolarHBondContact O-N 3.02Å; C143-I146 PolarHBondContact O-N 3.05Å; C143-H147 WeakPolarHBondContact O-CB 3.39Å; C143-H147 PolarHBondContact O-N 2.83Å
144	V	84.1	Confident	79.2	Confident	52 Å²	52	84.7 Å²	84.7	32%	0.315	49%	0.486	S	S	.	.	H	α-helix	trans	-60.2	-47.2	174	172.4	0	0	0	0	110.5	L126 F127 E140 S141 I146 H147 E148	L126-V144 HydrophobicContact CD1-CG2 4.33Å; F127-V144 HydrophobicContact CD2-CG2 4.2Å; F127-V144 HydrophobicContact CE2-CG2 4.16Å; E140-V144 WeakPolarHBondContact O-CG2 3.5Å; E140-V144 PolarHBondContact O-N 3.43Å; S141-V144 PolarHBondContact O-N 3.19Å; V144-I146 VanDerWaalsContact C-N 3.35Å; V144-I146 PolarHBondContact O-N 3.37Å; V144-H147 WeakPolarHBondContact O-CB 3.46Å; V144-H147 PolarHBondContact O-N 3.17Å; V144-H147 VanDerWaalsContact O-N 3.12Å; V144-E148 WeakPolarHBondContact O-CG 3.3Å; V144-E148 PolarHBondContact O-N 3.45Å
145	S	85.8	Confident	80.7	Confident	72 Å²	72	84.3 Å²	84.3	50%	0.503	48%	0.481	S	S	.	.	H	α-helix	trans	-61.4	-41.3	178.3	178.8	0	0	0	0	112.7	S141 A142 A149	S141-S145 WeakPolarHBondContact O-CB 3.32Å; S141-S145 PolarHBondContact O-N 2.9Å; A142-S145 PolarHBondContact O-N 3.47Å; S145-A149 WeakPolarHBondContact O-CB 3.45Å; S145-A149 PolarHBondContact O-N 2.9Å
146	I	89.3	Confident	82.3	Confident	103 Å²	103	87.1 Å²	87.1	53%	0.528	47%	0.472	S	S	.	.	H	α-helix	trans	-65.5	-40.2	174.9	-70.8	165	0	0	0	110.8	A142 C143 V144 A149 L150	A142-I146 WeakPolarHBondContact O-CB 3.48Å; A142-I146 WeakPolarHBondContact O-CD1 3.38Å; A142-I146 VanDerWaalsContact O-CG1 3.22Å; A142-I146 WeakPolarHBondContact O-CG1 3.29Å; A142-I146 PolarHBondContact O-N 3.41Å; C143-I146 PolarHBondContact O-N 3.05Å; V144-I146 VanDerWaalsContact C-N 3.35Å; V144-I146 PolarHBondContact O-N 3.37Å; I146-A149 PolarHBondContact O-N 3.12Å; I146-L150 HydrophobicContact CG2-CD1 3.87Å; I146-L150 HydrophobicContact CG2-CG 4.24Å; I146-L150 WeakPolarHBondContact O-CB 3.07Å; I146-L150 VanDerWaalsContact O-CG 3.3Å; I146-L150 WeakPolarHBondContact O-CG 3.31Å; I146-L150 PolarHBondContact O-N 3.36Å
147	H	86.7	Confident	84.1	Confident	70 Å²	70	86.7 Å²	86.7	32%	0.324	47%	0.468	S	S	.	.	H	α-helix	trans	-64.4	-45.7	178.8	179.6	78.6	0	0	0	112.1	L126 C143 V144 A149 L150 K151	L126-H147 HydrophobicContact CD1-CB 3.56Å; C143-H147 WeakPolarHBondContact O-CB 3.39Å; C143-H147 PolarHBondContact O-N 2.83Å; V144-H147 WeakPolarHBondContact O-CB 3.46Å; V144-H147 PolarHBondContact O-N 3.17Å; V144-H147 VanDerWaalsContact O-N 3.12Å; H147-A149 VanDerWaalsContact C-N 3.32Å; H147-A149 PolarHBondContact O-N 3.48Å; H147-L150 PolarHBondContact O-N 3.24Å; H147-K151 WeakPolarHBondContact O-CB 3.34Å; H147-K151 PolarHBondContact O-N 2.9Å
148	E	85.4	Confident	85.1	Confident	125 Å²	125	84.7 Å²	84.7	58%	0.584	46%	0.455	S	S	*	.	H	α-helix	trans	-59.5	-43.6	173.7	-71.7	175.6	178.8	0	0	111.5	V144 K151 S152	V144-E148 WeakPolarHBondContact O-CG 3.3Å; V144-E148 PolarHBondContact O-N 3.45Å; E148-K151 PolarHBondContact O-N 3.18Å; E148-S152 PolarHBondContact O-N 3.21Å
149	A	88.6	Confident	85.9	Confident	54 Å²	54	79.4 Å²	79.4	45%	0.446	43%	0.43	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176	0	0	0	0	0	112.1	S145 I146 H147 S152 V153	S145-A149 WeakPolarHBondContact O-CB 3.45Å; S145-A149 PolarHBondContact O-N 2.9Å; I146-A149 PolarHBondContact O-N 3.12Å; H147-A149 VanDerWaalsContact C-N 3.32Å; H147-A149 PolarHBondContact O-N 3.48Å; A149-S152 PolarHBondContact O-N 3.01Å; A149-V153 WeakPolarHBondContact O-CG2 3.44Å; A149-V153 PolarHBondContact O-N 2.97Å
150	L	90.1	Very high	86.5	Confident	98 Å²	98	78.9 Å²	78.9	51%	0.513	42%	0.424	S	S	.	.	H	α-helix	trans	-66.1	-40.6	176.6	-75.7	173.7	0	0	0	111.9	I146 H147 S152 V153 I154	I146-L150 HydrophobicContact CG2-CD1 3.87Å; I146-L150 HydrophobicContact CG2-CG 4.24Å; I146-L150 WeakPolarHBondContact O-CB 3.07Å; I146-L150 VanDerWaalsContact O-CG 3.3Å; I146-L150 WeakPolarHBondContact O-CG 3.31Å; I146-L150 PolarHBondContact O-N 3.36Å; H147-L150 PolarHBondContact O-N 3.24Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 2.89Å; L150-V153 PolarHBondContact O-N 3.42Å; L150-V153 VanDerWaalsContact O-N 3.17Å; L150-I154 WeakPolarHBondContact O-CG1 3.35Å; L150-I154 PolarHBondContact O-N 2.99Å
151	K	85.2	Confident	87.1	Confident	81 Å²	81	83.5 Å²	83.5	35%	0.352	44%	0.439	S	S	.	.	H	α-helix	trans	-58.1	-47.3	174	179.7	171.5	-176.9	165.7	0	110.7	D123 H147 E148 V153 I154 D155	D123-K151 IonicContact OD1-NZ 2.62Å; D123-K151 PolarHBondContact OD1-NZ 3.28Å; D123-K151 VanDerWaalsContact OD1-NZ 3.17Å; D123-K151 VanDerWaalsContact OD2-CD 3.23Å; D123-K151 WeakPolarHBondContact OD2-CD 3.38Å; D123-K151 WeakPolarHBondContact OD2-CE 3.42Å; D123-K151 IonicContact OD2-NZ 3.48Å; D123-K151 PolarHBondContact OD2-NZ 3.22Å; H147-K151 WeakPolarHBondContact O-CB 3.34Å; H147-K151 PolarHBondContact O-N 2.9Å; E148-K151 PolarHBondContact O-N 3.18Å; K151-V153 VanDerWaalsContact C-N 3.32Å; K151-V153 PolarHBondContact O-N 3.24Å; K151-I154 PolarHBondContact O-N 2.83Å; K151-D155 PolarHBondContact O-N 3.4Å
152	S	86.3	Confident	87.5	Confident	53 Å²	53	80.7 Å²	80.7	37%	0.371	42%	0.418	S	S	.	.	H	α-helix	trans	-60	-41.7	175.3	-179.4	0	0	0	0	112.1	E148 A149 L150 I154 D155 Y156	E148-S152 PolarHBondContact O-N 3.21Å; A149-S152 PolarHBondContact O-N 3.01Å; L150-S152 VanDerWaalsContact C-N 3.32Å; L150-S152 PolarHBondContact O-N 2.89Å; S152-I154 VanDerWaalsContact C-N 3.35Å; S152-I154 PolarHBondContact O-N 3.35Å; S152-D155 PolarHBondContact O-N 2.93Å; S152-Y156 WeakPolarHBondContact O-CD2 3.35Å; S152-Y156 PolarHBondContact O-N 3.46Å; S152-Y156 VanDerWaalsContact OG-CE2 3.31Å; S152-Y156 WeakPolarHBondContact OG-CE2 3.47Å
153	V	91.4	Very high	87.6	Confident	69 Å²	69	85.7 Å²	85.7	42%	0.418	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-39.6	176.4	169.9	0	0	0	0	112	A149 L150 K151 Y156 Q157	A149-V153 WeakPolarHBondContact O-CG2 3.44Å; A149-V153 PolarHBondContact O-N 2.97Å; L150-V153 PolarHBondContact O-N 3.42Å; L150-V153 VanDerWaalsContact O-N 3.17Å; K151-V153 VanDerWaalsContact C-N 3.32Å; K151-V153 PolarHBondContact O-N 3.24Å; V153-Y156 PolarHBondContact O-N 3.39Å; V153-Q157 HydrophobicContact CG1-CG 4.46Å; V153-Q157 WeakPolarHBondContact O-CG 3.47Å; V153-Q157 PolarHBondContact O-N 2.94Å
154	I	88.6	Confident	88	Confident	102 Å²	102	88.4 Å²	88.4	52%	0.523	43%	0.433	S	S	.	.	H	α-helix	trans	-62.5	-47.9	177.2	-69.8	164.5	0	0	0	110.1	L150 K151 S152 Y156 Q157 T158	L150-I154 WeakPolarHBondContact O-CG1 3.35Å; L150-I154 PolarHBondContact O-N 2.99Å; K151-I154 PolarHBondContact O-N 2.83Å; S152-I154 VanDerWaalsContact C-N 3.35Å; S152-I154 PolarHBondContact O-N 3.35Å; I154-Y156 PolarHBondContact O-N 3.02Å; I154-Q157 WeakPolarHBondContact O-CA 3.22Å; I154-Q157 WeakPolarHBondContact O-CB 3.46Å; I154-Q157 PolarHBondContact O-N 2.91Å; I154-T158 PolarHBondContact O-N 3.44Å; I154-T158 PolarHBondContact O-OG1 3.08Å
155	D	85.4	Confident	88.2	Confident	67 Å²	67	88.2 Å²	88.2	36%	0.358	44%	0.437	S	S	.	.	H	α-helix	trans	-55.7	-49	176.4	-180	57.2	0	0	0	111.8	K151 S152 Q157 T158 H159	K151-D155 PolarHBondContact O-N 3.4Å; S152-D155 PolarHBondContact O-N 2.93Å; D155-Q157 VanDerWaalsContact C-N 3.31Å; D155-Q157 PolarHBondContact O-N 3.4Å; D155-T158 PolarHBondContact O-N 3.16Å; D155-H159 PolarHBondContact O-N 3.4Å
156	Y	86.9	Confident	88.4	Confident	156 Å²	156	86.8 Å²	86.8	61%	0.612	42%	0.422	S	S	*	.	H	α-helix	trans	-59.3	-39.5	174.2	-80	-61.7	0	0	0	113.1	S152 V153 I154 F160	S152-Y156 WeakPolarHBondContact O-CD2 3.35Å; S152-Y156 PolarHBondContact O-N 3.46Å; S152-Y156 VanDerWaalsContact OG-CE2 3.31Å; S152-Y156 WeakPolarHBondContact OG-CE2 3.47Å; V153-Y156 PolarHBondContact O-N 3.39Å; I154-Y156 PolarHBondContact O-N 3.02Å; Y156-F160 VanDerWaalsContact O-CB 3.29Å; Y156-F160 WeakPolarHBondContact O-CB 3.4Å; Y156-F160 PolarHBondContact O-N 3.43Å
157	Q	91	Very high	88.4	Confident	94 Å²	94	83.7 Å²	83.7	44%	0.439	42%	0.416	S	S	.	.	H	α-helix	trans	-66	-42	176.9	-76.6	-177.3	21.5	0	0	111.6	V153 I154 D155 F160 R161	V153-Q157 HydrophobicContact CG1-CG 4.46Å; V153-Q157 WeakPolarHBondContact O-CG 3.47Å; V153-Q157 PolarHBondContact O-N 2.94Å; I154-Q157 WeakPolarHBondContact O-CA 3.22Å; I154-Q157 WeakPolarHBondContact O-CB 3.46Å; I154-Q157 PolarHBondContact O-N 2.91Å; D155-Q157 VanDerWaalsContact C-N 3.31Å; D155-Q157 PolarHBondContact O-N 3.4Å; Q157-F160 PolarHBondContact O-N 2.89Å; Q157-R161 WeakPolarHBondContact O-CB 3.4Å; Q157-R161 VanDerWaalsContact O-CG 3.23Å; Q157-R161 WeakPolarHBondContact O-CG 3.32Å; Q157-R161 PolarHBondContact O-N 3.32Å
158	T	86.4	Confident	88.7	Confident	22 Å²	22	87.9 Å²	87.9	14%	0.135	43%	0.429	C	S	.	.	H	α-helix	trans	-62.2	-49.8	177.7	-60.4	0	0	0	0	110.4	Y115 I154 D155 F160 R161 L162	Y115-T158 HydrophobicContact CE2-CG2 4.36Å; Y115-T158 WeakPolarHBondContact OH-CG2 3.47Å; I154-T158 PolarHBondContact O-N 3.44Å; I154-T158 PolarHBondContact O-OG1 3.08Å; D155-T158 PolarHBondContact O-N 3.16Å; T158-F160 VanDerWaalsContact C-N 3.32Å; T158-F160 PolarHBondContact O-N 3.48Å; T158-R161 PolarHBondContact O-N 3.05Å; T158-L162 HydrophobicContact CG2-CD1 4.28Å; T158-L162 WeakPolarHBondContact O-CG 3.3Å; T158-L162 PolarHBondContact O-N 3.14Å
159	H	86.4	Confident	88.9	Confident	53 Å²	53	83.4 Å²	83.4	25%	0.245	41%	0.412	C	S	.	.	H	α-helix	trans	-60.2	-40.5	175.8	175.5	-96.7	0	0	0	112.5	D155 L162 R163	D155-H159 PolarHBondContact O-N 3.4Å; H159-L162 PolarHBondContact O-N 3.39Å; H159-R163 PolarHBondContact CE1-NE 3.49Å; H159-R163 PolarHBondContact NE2-NE 3.24Å; H159-R163 PolarHBondContact O-N 3.45Å
160	F	90.4	Very high	88.9	Confident	141 Å²	141	88.7 Å²	88.7	62%	0.618	42%	0.42	S	S	*	.	H	α-helix	trans	-64.4	-44	176.3	-171.1	-91.7	0	0	0	112	Y156 Q157 T158 L162 R163 E164	Y156-F160 VanDerWaalsContact O-CB 3.29Å; Y156-F160 WeakPolarHBondContact O-CB 3.4Å; Y156-F160 PolarHBondContact O-N 3.43Å; Q157-F160 PolarHBondContact O-N 2.89Å; T158-F160 VanDerWaalsContact C-N 3.32Å; T158-F160 PolarHBondContact O-N 3.48Å; F160-L162 VanDerWaalsContact C-N 3.34Å; F160-L162 PolarHBondContact O-N 3.11Å; F160-R163 PolarHBondContact O-N 3Å; F160-E164 WeakPolarHBondContact O-CB 3.23Å; F160-E164 PolarHBondContact O-N 2.84Å
161	R	90.9	Very high	89	Confident	156 Å²	156	86.6 Å²	86.6	59%	0.589	42%	0.417	S	S	*	.	H	α-helix	trans	-61.1	-41.5	176.8	-74.9	173.3	-173.5	172.1	8	111.8	Q157 T158 E164 A165	Q157-R161 WeakPolarHBondContact O-CB 3.4Å; Q157-R161 VanDerWaalsContact O-CG 3.23Å; Q157-R161 WeakPolarHBondContact O-CG 3.32Å; Q157-R161 PolarHBondContact O-N 3.32Å; T158-R161 PolarHBondContact O-N 3.05Å; R161-E164 PolarHBondContact O-N 3.48Å; R161-A165 WeakPolarHBondContact O-CB 3.4Å; R161-A165 PolarHBondContact O-N 2.95Å
162	L	87.9	Confident	89.4	Confident	23 Å²	23	87.4 Å²	87.4	12%	0.12	42%	0.422	C	S	.	.	H	α-helix	trans	-63.2	-46	176.4	-70.8	169.1	0	0	0	111.6	V58 Y115 T158 H159 F160 A165 Q166	V58-L162 HydrophobicContact CG2-CD2 4.08Å; Y115-L162 HydrophobicContact CD1-CD1 3.4Å; Y115-L162 HydrophobicContact CD1-CD2 4.3Å; Y115-L162 HydrophobicContact CD1-CG 4.5Å; Y115-L162 HydrophobicContact CD2-CD1 4.13Å; Y115-L162 HydrophobicContact CD2-CD2 3.83Å; Y115-L162 HydrophobicContact CE1-CD1 3.55Å; Y115-L162 HydrophobicContact CE2-CD1 4.25Å; Y115-L162 HydrophobicContact CE2-CD2 4.47Å; Y115-L162 HydrophobicContact CG-CD1 3.71Å; Y115-L162 HydrophobicContact CG-CD2 3.72Å; Y115-L162 HydrophobicContact CG-CG 4.38Å; T158-L162 HydrophobicContact CG2-CD1 4.28Å; T158-L162 WeakPolarHBondContact O-CG 3.3Å; T158-L162 PolarHBondContact O-N 3.14Å; H159-L162 PolarHBondContact O-N 3.39Å; F160-L162 VanDerWaalsContact C-N 3.34Å; F160-L162 PolarHBondContact O-N 3.11Å; L162-A165 PolarHBondContact O-N 3.38Å; L162-Q166 WeakPolarHBondContact O-CB 3.29Å; L162-Q166 PolarHBondContact O-N 2.9Å
163	R	88.4	Confident	89.5	Confident	153 Å²	153	89 Å²	89	58%	0.577	43%	0.427	S	S	*	.	H	α-helix	trans	-65.1	-38.8	176.2	-78.2	-163.8	172.1	-165.1	-2.3	113.1	H159 F160 G167	H159-R163 PolarHBondContact CE1-NE 3.49Å; H159-R163 PolarHBondContact NE2-NE 3.24Å; H159-R163 PolarHBondContact O-N 3.45Å; F160-R163 PolarHBondContact O-N 3Å; R163-G167 PolarHBondContact O-N 3.31Å
164	E	92.9	Very high	89.5	Confident	112 Å²	112	90 Å²	90	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-62.7	-46.8	174.5	-174.6	-172.3	173.5	0	0	110.5	F160 R161 Q166 G167 R168	F160-E164 WeakPolarHBondContact O-CB 3.23Å; F160-E164 PolarHBondContact O-N 2.84Å; R161-E164 PolarHBondContact O-N 3.48Å; E164-Q166 PolarHBondContact O-N 3.41Å; E164-G167 PolarHBondContact O-N 3.05Å; E164-R168 VanDerWaalsContact O-CB 3.24Å; E164-R168 WeakPolarHBondContact O-CB 3.47Å; E164-R168 PolarHBondContact O-N 3.46Å
165	A	89.3	Confident	89.9	Confident	48 Å²	48	90.5 Å²	90.5	40%	0.397	43%	0.433	S	S	.	.	H	α-helix	trans	-59.6	-46.9	177.8	0	0	0	0	0	111.8	V58 R161 L162 R168 S169	V58-A165 HydrophobicContact CG1-CB 4.43Å; R161-A165 WeakPolarHBondContact O-CB 3.4Å; R161-A165 PolarHBondContact O-N 2.95Å; L162-A165 PolarHBondContact O-N 3.38Å; A165-R168 PolarHBondContact O-N 3.34Å; A165-S169 PolarHBondContact O-N 3.44Å
166	Q	88.6	Confident	90.3	Very high	42 Å²	42	90.7 Å²	90.7	20%	0.196	44%	0.437	C	S	.	.	H	α-helix	trans	-61.1	-45.6	174.8	-175.6	178.1	19.8	0	0	111.7	Y63 L162 E164 R168 S169 R170	Y63-Q166 HydrophobicContact CD1-CG 4.32Å; Y63-Q166 VanDerWaalsContact CD1-NE2 3.33Å; Y63-Q166 HydrophobicContact CE1-CG 4.04Å; L162-Q166 WeakPolarHBondContact O-CB 3.29Å; L162-Q166 PolarHBondContact O-N 2.9Å; E164-Q166 PolarHBondContact O-N 3.41Å; Q166-R168 PolarHBondContact O-N 2.84Å; Q166-S169 PolarHBondContact O-N 2.86Å; Q166-R170 PolarHBondContact O-N 3.45Å; Q166-R170 VanDerWaalsContact O-N 3.08Å
167	G	90.1	Very high	90.6	Very high	39 Å²	39	91.7 Å²	91.7	40%	0.402	44%	0.439	S	S	.	.	H	α-helix	trans	-63.4	-39.8	178.3	0	0	0	0	0	112.7	R163 E164 R170 A171	R163-G167 PolarHBondContact O-N 3.31Å; E164-G167 PolarHBondContact O-N 3.05Å; G167-R170 PolarHBondContact O-N 2.91Å; G167-A171 WeakPolarHBondContact O-CB 3.48Å; G167-A171 PolarHBondContact O-N 3.21Å
168	R	93.3	Very high	90.9	Very high	157 Å²	157	91.2 Å²	91.2	59%	0.592	44%	0.443	S	S	*	.	H	α-helix	trans	-64.8	-47.5	177	-174.9	179.6	-179.9	100.2	10.7	111.4	E164 A165 Q166 R170 A171 E172	E164-R168 VanDerWaalsContact O-CB 3.24Å; E164-R168 WeakPolarHBondContact O-CB 3.47Å; E164-R168 PolarHBondContact O-N 3.46Å; A165-R168 PolarHBondContact O-N 3.34Å; Q166-R168 PolarHBondContact O-N 2.84Å; R168-R170 VanDerWaalsContact C-N 3.31Å; R168-R170 PolarHBondContact O-N 2.79Å; R168-A171 WeakPolarHBondContact O-CB 3.17Å; R168-A171 PolarHBondContact O-N 2.98Å; R168-A171 VanDerWaalsContact O-N 3.12Å; R168-E172 IonicContact CZ-OE1 3.5Å; R168-E172 IonicContact NE-OE1 2.98Å; R168-E172 PolarHBondContact NE-OE1 3.44Å; R168-E172 IonicContact NH2-OE1 3.21Å; R168-E172 PolarHBondContact NH2-OE1 3.04Å; R168-E172 PolarHBondContact O-N 3.16Å
169	S	88.8	Confident	91.4	Very high	32 Å²	32	92.2 Å²	92.2	22%	0.224	45%	0.454	C	S	.	.	H	α-helix	trans	-56.9	-46.3	175.9	172.9	0	0	0	0	111.1	A165 Q166 A171 E172 D173	A165-S169 PolarHBondContact O-N 3.44Å; Q166-S169 PolarHBondContact O-N 2.86Å; S169-A171 VanDerWaalsContact C-N 3.33Å; S169-A171 PolarHBondContact O-N 3.34Å; S169-E172 PolarHBondContact O-N 2.93Å; S169-D173 PolarHBondContact O-N 3.32Å; S169-D173 VanDerWaalsContact O-N 3.11Å
170	R	87.6	Confident	91.8	Very high	164 Å²	164	96.6 Å²	96.6	62%	0.619	47%	0.472	S	S	*	.	H	α-helix	trans	-61.4	-40.1	175.9	-175.1	178.8	-178.4	179.4	1.3	112.8	Q166 G167 R168 L174	Q166-R170 PolarHBondContact O-N 3.45Å; Q166-R170 VanDerWaalsContact O-N 3.08Å; G167-R170 PolarHBondContact O-N 2.91Å; R168-R170 VanDerWaalsContact C-N 3.31Å; R168-R170 PolarHBondContact O-N 2.79Å; R170-L174 HydrophobicContact CG-CD1 4.01Å; R170-L174 HydrophobicContact CG-CG 4.49Å; R170-L174 WeakPolarHBondContact O-CB 3.41Å; R170-L174 VanDerWaalsContact O-CG 3.29Å; R170-L174 WeakPolarHBondContact O-CG 3.33Å; R170-L174 PolarHBondContact O-N 3.48Å
171	A	92.9	Very high	92.2	Very high	55 Å²	55	99.9 Å²	99.9	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-65.8	-42	179.3	0	0	0	0	0	111.7	G167 R168 S169 L174 N175	G167-A171 WeakPolarHBondContact O-CB 3.48Å; G167-A171 PolarHBondContact O-N 3.21Å; R168-A171 WeakPolarHBondContact O-CB 3.17Å; R168-A171 PolarHBondContact O-N 2.98Å; R168-A171 VanDerWaalsContact O-N 3.12Å; S169-A171 VanDerWaalsContact C-N 3.33Å; S169-A171 PolarHBondContact O-N 3.34Å; A171-L174 PolarHBondContact O-N 3.05Å; A171-N175 WeakPolarHBondContact O-CB 3.29Å; A171-N175 PolarHBondContact O-N 3.26Å
172	E	92.9	Very high	92.5	Very high	97 Å²	97	95.4 Å²	95.4	45%	0.453	47%	0.473	S	S	.	.	H	α-helix	trans	-64.2	-42.8	177.8	-72.1	175	-176.5	0	0	111.5	R168 S169 N175 T176	R168-E172 IonicContact CZ-OE1 3.5Å; R168-E172 IonicContact NE-OE1 2.98Å; R168-E172 PolarHBondContact NE-OE1 3.44Å; R168-E172 IonicContact NH2-OE1 3.21Å; R168-E172 PolarHBondContact NH2-OE1 3.04Å; R168-E172 PolarHBondContact O-N 3.16Å; S169-E172 PolarHBondContact O-N 2.93Å; E172-N175 PolarHBondContact O-N 2.9Å; E172-T176 WeakPolarHBondContact O-CB 3.41Å; E172-T176 PolarHBondContact O-N 3.36Å; E172-T176 PolarHBondContact O-OG1 3.12Å
173	D	89.2	Confident	93	Very high	87 Å²	87	99 Å²	99	47%	0.465	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-46.4	175.3	-81.4	-16.8	0	0	0	112.6	S169 R177	S169-D173 PolarHBondContact O-N 3.32Å; S169-D173 VanDerWaalsContact O-N 3.11Å; D173-R177 WeakPolarHBondContact O-CG 3.24Å; D173-R177 PolarHBondContact O-N 2.93Å; D173-R177 VanDerWaalsContact O-N 3.16Å
174	L	92.1	Very high	93.4	Very high	90 Å²	90	93.1 Å²	93.1	47%	0.471	48%	0.479	S	S	.	.	H	α-helix	trans	-64.9	-46.4	178.4	-75.7	171.7	0	0	0	111.3	R170 A171 T176 R177 V178	R170-L174 HydrophobicContact CG-CD1 4.01Å; R170-L174 HydrophobicContact CG-CG 4.49Å; R170-L174 WeakPolarHBondContact O-CB 3.41Å; R170-L174 VanDerWaalsContact O-CG 3.29Å; R170-L174 WeakPolarHBondContact O-CG 3.33Å; R170-L174 PolarHBondContact O-N 3.48Å; A171-L174 PolarHBondContact O-N 3.05Å; L174-T176 VanDerWaalsContact C-N 3.28Å; L174-T176 PolarHBondContact O-N 2.86Å; L174-R177 PolarHBondContact O-N 2.76Å; L174-V178 WeakPolarHBondContact O-CB 3.42Å; L174-V178 WeakPolarHBondContact O-CG2 3.48Å; L174-V178 PolarHBondContact O-N 2.96Å
175	N	95.5	Very high	93.6	Very high	113 Å²	113	93.7 Å²	93.7	60%	0.604	48%	0.481	S	S	*	.	H	α-helix	trans	-56.6	-45.3	179.1	178.9	56	0	0	0	111.1	A171 E172 V178 A179	A171-N175 WeakPolarHBondContact O-CB 3.29Å; A171-N175 PolarHBondContact O-N 3.26Å; E172-N175 PolarHBondContact O-N 2.9Å; N175-V178 PolarHBondContact O-N 3.13Å; N175-A179 VanDerWaalsContact O-CB 3.3Å; N175-A179 WeakPolarHBondContact O-CB 3.3Å; N175-A179 PolarHBondContact O-N 3.09Å
176	T	93.8	Very high	94	Very high	71 Å²	71	93.9 Å²	93.9	44%	0.436	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-46	-180	-54.5	0	0	0	0	111.6	E172 L174 A179 F180	E172-T176 WeakPolarHBondContact O-CB 3.41Å; E172-T176 PolarHBondContact O-N 3.36Å; E172-T176 PolarHBondContact O-OG1 3.12Å; L174-T176 VanDerWaalsContact C-N 3.28Å; L174-T176 PolarHBondContact O-N 2.86Å; T176-A179 PolarHBondContact O-N 3.33Å; T176-F180 HydrophobicContact CG2-CD2 4.03Å; T176-F180 HydrophobicContact CG2-CE2 3.62Å; T176-F180 WeakPolarHBondContact O-CD2 3.5Å; T176-F180 PolarHBondContact O-N 3.34Å; T176-F180 VanDerWaalsContact O-N 3.15Å
177	R	95	Very high	94.5	Very high	176 Å²	176	96.4 Å²	96.4	66%	0.664	50%	0.497	S	S	*	.	H	α-helix	trans	-62.5	-46.2	177.2	-71.3	175.6	-170.4	-109.2	1.8	112.1	D173 L174 A179 F180 W181	D173-R177 WeakPolarHBondContact O-CG 3.24Å; D173-R177 PolarHBondContact O-N 2.93Å; D173-R177 VanDerWaalsContact O-N 3.16Å; L174-R177 PolarHBondContact O-N 2.76Å; R177-A179 VanDerWaalsContact C-N 3.35Å; R177-F180 PolarHBondContact O-N 3.15Å; R177-W181 VanDerWaalsContact O-CD1 3.26Å; R177-W181 PolarHBondContact O-N 3.08Å; R177-W181 VanDerWaalsContact O-N 3.13Å
178	V	96.9	Very high	94.8	Very high	84 Å²	84	99.8 Å²	99.8	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-44.1	178.7	171.3	0	0	0	0	110.3	L174 N175 F180 W181 S182	L174-V178 WeakPolarHBondContact O-CB 3.42Å; L174-V178 WeakPolarHBondContact O-CG2 3.48Å; L174-V178 PolarHBondContact O-N 2.96Å; N175-V178 PolarHBondContact O-N 3.13Å; V178-F180 VanDerWaalsContact C-N 3.31Å; V178-F180 PolarHBondContact O-N 3.41Å; V178-W181 PolarHBondContact O-N 3.43Å; V178-W181 VanDerWaalsContact O-N 3.14Å; V178-S182 WeakPolarHBondContact O-CB 3.11Å; V178-S182 PolarHBondContact O-N 3.14Å; V178-S182 PolarHBondContact O-OG 3.44Å; V178-S182 VanDerWaalsContact O-OG 3.08Å
179	A	96.4	Very high	95	Very high	44 Å²	44	97.2 Å²	97.2	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-57	-43.6	177.2	0	0	0	0	0	112.3	N175 T176 R177 S182 I183	N175-A179 VanDerWaalsContact O-CB 3.3Å; N175-A179 WeakPolarHBondContact O-CB 3.3Å; N175-A179 PolarHBondContact O-N 3.09Å; T176-A179 PolarHBondContact O-N 3.33Å; R177-A179 VanDerWaalsContact C-N 3.35Å; A179-S182 PolarHBondContact O-N 3.16Å; A179-I183 VanDerWaalsContact O-CG1 3.26Å; A179-I183 WeakPolarHBondContact O-CG1 3.26Å; A179-I183 PolarHBondContact O-N 3.11Å
180	F	95.6	Very high	95.5	Very high	144 Å²	144	101 Å²	101	63%	0.632	52%	0.519	S	S	*	.	H	α-helix	trans	-62.6	-43.9	175.6	-78.2	-61.6	0	0	0	112.9	T176 R177 V178 I183 G184	T176-F180 HydrophobicContact CG2-CD2 4.03Å; T176-F180 HydrophobicContact CG2-CE2 3.62Å; T176-F180 WeakPolarHBondContact O-CD2 3.5Å; T176-F180 PolarHBondContact O-N 3.34Å; T176-F180 VanDerWaalsContact O-N 3.15Å; R177-F180 PolarHBondContact O-N 3.15Å; V178-F180 VanDerWaalsContact C-N 3.31Å; V178-F180 PolarHBondContact O-N 3.41Å; F180-I183 PolarHBondContact O-N 2.89Å; F180-G184 PolarHBondContact O-N 2.84Å; F180-G184 VanDerWaalsContact O-N 3.09Å
181	W	97.6	Very high	95.9	Very high	210 Å²	210	97.2 Å²	97.2	80%	0.795	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-42.3	175.6	-81.4	108.4	0	0	0	112.2	R177 V178 G184 E185	R177-W181 VanDerWaalsContact O-CD1 3.26Å; R177-W181 PolarHBondContact O-N 3.08Å; R177-W181 VanDerWaalsContact O-N 3.13Å; V178-W181 PolarHBondContact O-N 3.43Å; V178-W181 VanDerWaalsContact O-N 3.14Å; W181-G184 PolarHBondContact O-N 3.35Å; W181-E185 PolarHBondContact O-N 3.4Å
182	S	97.1	Very high	96.2	Very high	63 Å²	63	97.7 Å²	97.7	44%	0.441	51%	0.511	S	S	.	.	H	α-helix	trans	-64.6	-39.4	177.6	-61.6	0	0	0	0	112.8	V178 A179 G184 E185 A186	V178-S182 WeakPolarHBondContact O-CB 3.11Å; V178-S182 PolarHBondContact O-N 3.14Å; V178-S182 PolarHBondContact O-OG 3.44Å; V178-S182 VanDerWaalsContact O-OG 3.08Å; A179-S182 PolarHBondContact O-N 3.16Å; S182-G184 VanDerWaalsContact C-N 3.32Å; S182-E185 PolarHBondContact O-N 2.96Å; S182-A186 WeakPolarHBondContact O-CB 3.36Å; S182-A186 PolarHBondContact O-N 3.3Å
183	I	98.1	Very high	96.3	Very high	99 Å²	99	95.9 Å²	95.9	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-62.3	-43.3	173.7	-70.2	164.6	0	0	0	110.3	A179 F180 A186 I187	A179-I183 VanDerWaalsContact O-CG1 3.26Å; A179-I183 WeakPolarHBondContact O-CG1 3.26Å; A179-I183 PolarHBondContact O-N 3.11Å; F180-I183 PolarHBondContact O-N 2.89Å; I183-A186 PolarHBondContact O-N 3.21Å; I183-I187 HydrophobicContact CG2-CD1 4.07Å; I183-I187 WeakPolarHBondContact O-CG1 3.33Å; I183-I187 PolarHBondContact O-N 3.5Å; I183-I187 VanDerWaalsContact O-N 3.1Å
184	G	97.3	Very high	96.7	Very high	29 Å²	29	97 Å²	97	30%	0.299	51%	0.514	S	S	.	.	H	α-helix	trans	-59.3	-46.7	176.2	0	0	0	0	0	112.7	F180 W181 S182 A186 I187 I188	F180-G184 PolarHBondContact O-N 2.84Å; F180-G184 VanDerWaalsContact O-N 3.09Å; W181-G184 PolarHBondContact O-N 3.35Å; S182-G184 VanDerWaalsContact C-N 3.32Å; G184-A186 PolarHBondContact O-N 3.1Å; G184-I187 PolarHBondContact O-N 2.97Å; G184-I188 WeakPolarHBondContact O-CG1 3.42Å; G184-I188 PolarHBondContact O-N 3.44Å; G184-I188 VanDerWaalsContact O-N 3.11Å
185	E	97.4	Very high	96.8	Very high	123 Å²	123	95.5 Å²	95.5	58%	0.575	51%	0.511	S	S	*	.	H	α-helix	trans	-61.9	-43.4	176.9	-173	177.3	178.4	0	0	112.1	W181 S182 I187 I188 L189	W181-E185 PolarHBondContact O-N 3.4Å; S182-E185 PolarHBondContact O-N 2.96Å; E185-I187 VanDerWaalsContact C-N 3.3Å; E185-I187 PolarHBondContact O-N 3.37Å; E185-I188 PolarHBondContact O-N 2.74Å; E185-I188 VanDerWaalsContact O-N 3.16Å; E185-L189 HydrophobicContact CG-CD1 4.37Å; E185-L189 WeakPolarHBondContact O-CG 3.4Å; E185-L189 PolarHBondContact O-N 3.02Å
186	A	97.9	Very high	96.7	Very high	52 Å²	52	95.4 Å²	95.4	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-59.4	-40.4	177.2	0	0	0	0	0	112.3	S182 I183 G184 L189 L190	S182-A186 WeakPolarHBondContact O-CB 3.36Å; S182-A186 PolarHBondContact O-N 3.3Å; I183-A186 PolarHBondContact O-N 3.21Å; G184-A186 PolarHBondContact O-N 3.1Å; A186-L189 PolarHBondContact O-N 2.95Å; A186-L190 WeakPolarHBondContact O-CG 3.44Å; A186-L190 PolarHBondContact O-N 3.48Å
187	I	98.2	Very high	96.8	Very high	96 Å²	96	95.8 Å²	95.8	49%	0.492	51%	0.509	S	S	.	.	H	α-helix	trans	-64.4	-44.3	176	-67.4	166.4	0	0	0	110.8	I183 G184 E185 L189 L190 V191	I183-I187 HydrophobicContact CG2-CD1 4.07Å; I183-I187 WeakPolarHBondContact O-CG1 3.33Å; I183-I187 PolarHBondContact O-N 3.5Å; I183-I187 VanDerWaalsContact O-N 3.1Å; G184-I187 PolarHBondContact O-N 2.97Å; E185-I187 VanDerWaalsContact C-N 3.3Å; E185-I187 PolarHBondContact O-N 3.37Å; I187-L189 VanDerWaalsContact C-N 3.35Å; I187-L189 PolarHBondContact O-N 2.94Å; I187-L190 PolarHBondContact O-N 3.23Å; I187-V191 WeakPolarHBondContact O-CG2 3.37Å; I187-V191 PolarHBondContact O-N 3.47Å
188	I	97.8	Very high	96.6	Very high	110 Å²	110	91.7 Å²	91.7	56%	0.564	50%	0.503	S	S	*	.	H	α-helix	trans	-60.9	-45.7	178.5	-68.1	168.2	0	0	0	110.6	G184 E185 L190 V191 V192	G184-I188 WeakPolarHBondContact O-CG1 3.42Å; G184-I188 PolarHBondContact O-N 3.44Å; G184-I188 VanDerWaalsContact O-N 3.11Å; E185-I188 PolarHBondContact O-N 2.74Å; E185-I188 VanDerWaalsContact O-N 3.16Å; I188-L190 VanDerWaalsContact C-N 3.34Å; I188-L190 PolarHBondContact O-N 3.28Å; I188-V191 PolarHBondContact O-N 3.35Å; I188-V192 HydrophobicContact CG2-CG2 4.43Å; I188-V192 WeakPolarHBondContact O-CG2 3.44Å; I188-V192 PolarHBondContact O-N 3.24Å
189	L	97.8	Very high	96.3	Very high	102 Å²	102	92.7 Å²	92.7	53%	0.534	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-43.3	177.5	-70.5	175.4	0	0	0	111.7	E185 A186 I187 V191 V192 S193	E185-L189 HydrophobicContact CG-CD1 4.37Å; E185-L189 WeakPolarHBondContact O-CG 3.4Å; E185-L189 PolarHBondContact O-N 3.02Å; A186-L189 PolarHBondContact O-N 2.95Å; I187-L189 VanDerWaalsContact C-N 3.35Å; I187-L189 PolarHBondContact O-N 2.94Å; L189-V191 PolarHBondContact O-N 3.47Å; L189-V192 PolarHBondContact O-N 3.16Å; L189-S193 PolarHBondContact O-N 3.4Å; L189-S193 PolarHBondContact O-OG 3.45Å; L189-S193 VanDerWaalsContact O-OG 3.05Å
190	L	97.7	Very high	96	Very high	113 Å²	113	95.7 Å²	95.7	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-60.2	-44.9	175.5	-74.4	174.1	0	0	0	112.4	A186 I187 I188 V192 S193 I194	A186-L190 WeakPolarHBondContact O-CG 3.44Å; A186-L190 PolarHBondContact O-N 3.48Å; I187-L190 PolarHBondContact O-N 3.23Å; I188-L190 VanDerWaalsContact C-N 3.34Å; I188-L190 PolarHBondContact O-N 3.28Å; L190-V192 PolarHBondContact O-N 3.43Å; L190-S193 PolarHBondContact O-N 3.07Å; L190-I194 WeakPolarHBondContact O-CG1 3.32Å; L190-I194 PolarHBondContact O-N 3Å
191	V	97.6	Very high	95.6	Very high	83 Å²	83	97.9 Å²	97.9	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-62.2	-43.8	178.1	171.4	0	0	0	0	111.1	I187 I188 L189 I194 S195	I187-V191 WeakPolarHBondContact O-CG2 3.37Å; I187-V191 PolarHBondContact O-N 3.47Å; I188-V191 PolarHBondContact O-N 3.35Å; L189-V191 PolarHBondContact O-N 3.47Å; V191-I194 PolarHBondContact O-N 2.96Å; V191-S195 WeakPolarHBondContact O-CB 3.39Å; V191-S195 PolarHBondContact O-N 3.33Å; V191-S195 PolarHBondContact O-OG 2.95Å
192	V	97.6	Very high	94.9	Very high	65 Å²	65	92.1 Å²	92.1	39%	0.394	51%	0.51	S	S	.	.	H	α-helix	trans	-62.6	-45.6	176.9	172	0	0	0	0	110.7	I188 L189 L190 I194 S195 Q196	I188-V192 HydrophobicContact CG2-CG2 4.43Å; I188-V192 WeakPolarHBondContact O-CG2 3.44Å; I188-V192 PolarHBondContact O-N 3.24Å; L189-V192 PolarHBondContact O-N 3.16Å; L190-V192 PolarHBondContact O-N 3.43Å; V192-I194 PolarHBondContact O-N 3.33Å; V192-S195 PolarHBondContact O-N 3.46Å; V192-Q196 HydrophobicContact CG1-CG 4.31Å; V192-Q196 WeakPolarHBondContact O-CB 3.44Å; V192-Q196 VanDerWaalsContact O-CG 3.27Å; V192-Q196 WeakPolarHBondContact O-CG 3.44Å; V192-Q196 PolarHBondContact O-N 3.05Å
193	S	96.6	Very high	94.2	Very high	60 Å²	60	97.1 Å²	97.1	42%	0.42	52%	0.524	S	S	.	.	H	α-helix	trans	-60.3	-43.7	177.9	-62.9	0	0	0	0	112.6	L189 L190 Q196 V197	L189-S193 PolarHBondContact O-N 3.4Å; L189-S193 PolarHBondContact O-OG 3.45Å; L189-S193 VanDerWaalsContact O-OG 3.05Å; L190-S193 PolarHBondContact O-N 3.07Å; S193-Q196 PolarHBondContact O-N 2.91Å; S193-V197 WeakPolarHBondContact O-CG2 3.36Å; S193-V197 PolarHBondContact O-N 2.99Å
194	I	96.1	Very high	93.4	Very high	110 Å²	110	100.4 Å²	100.4	56%	0.564	54%	0.535	S	S	*	.	H	α-helix	trans	-64	-45.7	176	-66.7	167	0	0	0	110.4	L190 V191 V192 Q196 V197 V198	L190-I194 WeakPolarHBondContact O-CG1 3.32Å; L190-I194 PolarHBondContact O-N 3Å; V191-I194 PolarHBondContact O-N 2.96Å; V192-I194 PolarHBondContact O-N 3.33Å; I194-Q196 VanDerWaalsContact C-N 3.32Å; I194-Q196 PolarHBondContact O-N 3.49Å; I194-V197 PolarHBondContact O-N 2.93Å; I194-V197 VanDerWaalsContact O-N 3.16Å; I194-V198 HydrophobicContact CG2-CG2 4.37Å; I194-V198 WeakPolarHBondContact O-CG2 3.42Å; I194-V198 PolarHBondContact O-N 3.34Å
195	S	94.8	Very high	91.9	Very high	58 Å²	58	103.3 Å²	103.3	41%	0.406	55%	0.551	S	S	.	*	H	α-helix	trans	-59.8	-42.7	179.9	-58.7	0	0	0	0	111.6	V191 V192 V197 V198 L199	V191-S195 WeakPolarHBondContact O-CB 3.39Å; V191-S195 PolarHBondContact O-N 3.33Å; V191-S195 PolarHBondContact O-OG 2.95Å; V192-S195 PolarHBondContact O-N 3.46Å; S195-V197 PolarHBondContact O-N 3.47Å; S195-V198 PolarHBondContact O-N 2.87Å; S195-L199 WeakPolarHBondContact O-CB 3.27Å; S195-L199 WeakPolarHBondContact O-CG 3.48Å; S195-L199 PolarHBondContact O-N 3.21Å
196	Q	94.4	Very high	90.1	Very high	111 Å²	111	104.5 Å²	104.5	52%	0.519	56%	0.561	S	S	.	*	H	α-helix	trans	-58.2	-45.6	175	-75.3	172.6	-12.8	0	0	111.8	V192 S193 I194 L199 L200	V192-Q196 HydrophobicContact CG1-CG 4.31Å; V192-Q196 WeakPolarHBondContact O-CB 3.44Å; V192-Q196 VanDerWaalsContact O-CG 3.27Å; V192-Q196 WeakPolarHBondContact O-CG 3.44Å; V192-Q196 PolarHBondContact O-N 3.05Å; S193-Q196 PolarHBondContact O-N 2.91Å; I194-Q196 VanDerWaalsContact C-N 3.32Å; I194-Q196 PolarHBondContact O-N 3.49Å; Q196-L199 PolarHBondContact O-N 3.03Å; Q196-L200 WeakPolarHBondContact O-CB 3.21Å; Q196-L200 WeakPolarHBondContact O-CG 3.48Å; Q196-L200 PolarHBondContact O-N 3.12Å
197	V	94.7	Very high	88.3	Confident	80 Å²	80	111.2 Å²	111.2	49%	0.485	58%	0.581	S	S	.	*	H	α-helix	trans	-65.6	-42	179.1	175.2	0	0	0	0	111.7	S193 I194 S195 R201	S193-V197 WeakPolarHBondContact O-CG2 3.36Å; S193-V197 PolarHBondContact O-N 2.99Å; I194-V197 PolarHBondContact O-N 2.93Å; I194-V197 VanDerWaalsContact O-N 3.16Å; S195-V197 PolarHBondContact O-N 3.47Å; V197-R201 WeakPolarHBondContact O-CB 3.33Å; V197-R201 WeakPolarHBondContact O-CG 3.27Å; V197-R201 PolarHBondContact O-N 3.38Å
198	V	91.8	Very high	86.3	Confident	90 Å²	90	116.1 Å²	116.1	55%	0.545	60%	0.599	S	S	.	*	H	α-helix	trans	-64.7	-45.5	178.4	172.5	0	0	0	0	111.2	I194 S195 R201 S202	I194-V198 HydrophobicContact CG2-CG2 4.37Å; I194-V198 WeakPolarHBondContact O-CG2 3.42Å; I194-V198 PolarHBondContact O-N 3.34Å; S195-V198 PolarHBondContact O-N 2.87Å; V198-R201 PolarHBondContact O-N 2.89Å; V198-S202 WeakPolarHBondContact O-CB 3.41Å; V198-S202 PolarHBondContact O-N 3.42Å
199	L	90	Very high	84	Confident	105 Å²	105	116.3 Å²	116.3	55%	0.55	61%	0.605	S	S	.	*	H	α-helix	trans	-59.6	-49.2	177.1	-74.1	174.6	0	0	0	111.1	S195 Q196 R201 S202 F203	S195-L199 WeakPolarHBondContact O-CB 3.27Å; S195-L199 WeakPolarHBondContact O-CG 3.48Å; S195-L199 PolarHBondContact O-N 3.21Å; Q196-L199 PolarHBondContact O-N 3.03Å; L199-R201 PolarHBondContact O-N 3.22Å; L199-S202 WeakPolarHBondContact O-CB 3.46Å; L199-S202 PolarHBondContact O-N 3.32Å; L199-S202 VanDerWaalsContact O-N 3.12Å; L199-F203 WeakPolarHBondContact O-CD2 3.44Å; L199-F203 PolarHBondContact O-N 3.03Å
200	L	90.6	Very high	81.9	Confident	106 Å²	106	117.2 Å²	117.2	56%	0.555	62%	0.615	S	S	*	*	H	α-helix	trans	-59.6	-44.7	177.4	-71.6	174.5	0	0	0	111.8	Q196 S202 F203 F204	Q196-L200 WeakPolarHBondContact O-CB 3.21Å; Q196-L200 WeakPolarHBondContact O-CG 3.48Å; Q196-L200 PolarHBondContact O-N 3.12Å; L200-S202 VanDerWaalsContact C-N 3.3Å; L200-S202 PolarHBondContact O-N 2.95Å; L200-F203 PolarHBondContact O-N 3.5Å; L200-F204 WeakPolarHBondContact O-CD2 3.49Å; L200-F204 PolarHBondContact O-N 2.98Å
201	R	87.1	Confident	79.8	Confident	190 Å²	190	119.7 Å²	119.7	72%	0.717	63%	0.625	S	S	*	*	H	α-helix	trans	-61.4	-37.1	175.2	-76.9	-170.7	176	-159.1	0.4	112.6	V197 V198 L199 F203 F204 S205	V197-R201 WeakPolarHBondContact O-CB 3.33Å; V197-R201 WeakPolarHBondContact O-CG 3.27Å; V197-R201 PolarHBondContact O-N 3.38Å; V198-R201 PolarHBondContact O-N 2.89Å; L199-R201 PolarHBondContact O-N 3.22Å; R201-F203 VanDerWaalsContact C-N 3.35Å; R201-F204 PolarHBondContact O-N 3.04Å; R201-S205 VanDerWaalsContact O-CB 3.27Å; R201-S205 WeakPolarHBondContact O-CB 3.11Å; R201-S205 PolarHBondContact O-N 2.87Å
202	S	81.9	Confident	77.7	Confident	89 Å²	89	121.4 Å²	121.4	62%	0.622	64%	0.636	S	S	*	*	H	α-helix	trans	-67.4	-33.3	176.9	-173.6	0	0	0	0	112.8	V198 L199 L200	V198-S202 WeakPolarHBondContact O-CB 3.41Å; V198-S202 PolarHBondContact O-N 3.42Å; L199-S202 WeakPolarHBondContact O-CB 3.46Å; L199-S202 PolarHBondContact O-N 3.32Å; L199-S202 VanDerWaalsContact O-N 3.12Å; L200-S202 VanDerWaalsContact C-N 3.3Å; L200-S202 PolarHBondContact O-N 2.95Å
203	F	82.5	Confident	75.5	Confident	168 Å²	168	129.8 Å²	129.8	74%	0.737	66%	0.661	S	S	*	*	H	α-helix	trans	-70.4	-32.3	175.5	-83.6	-72.6	0	0	0	112.8	L199 L200 R201	L199-F203 WeakPolarHBondContact O-CD2 3.44Å; L199-F203 PolarHBondContact O-N 3.03Å; L200-F203 PolarHBondContact O-N 3.5Å; R201-F203 VanDerWaalsContact C-N 3.35Å
204	F	80.7	Confident	73.4	Confident	169 Å²	169	133.4 Å²	133.4	74%	0.741	68%	0.68	S	S	*	*	H	α-helix	trans	-95.5	-7.1	-179.3	-65.5	-64.8	0	0	0	114.6	L200 R201 D206	L200-F204 WeakPolarHBondContact O-CD2 3.49Å; L200-F204 PolarHBondContact O-N 2.98Å; R201-F204 PolarHBondContact O-N 3.04Å; F204-D206 PolarHBondContact O-N 3.42Å
205	S	67.7	Low	71.7	Confident	89 Å²	89	131.1 Å²	131.1	62%	0.622	68%	0.684	S	S	*	*			trans	-90.6	88.3	177	-162.2	0	0	0	0	110.2	R201 K207	R201-S205 VanDerWaalsContact O-CB 3.27Å; R201-S205 WeakPolarHBondContact O-CB 3.11Å; R201-S205 PolarHBondContact O-N 2.87Å; S205-K207 PolarHBondContact O-N 3.31Å
206	D	58.9	Low	69.2	Low	149 Å²	149	137.4 Å²	137.4	80%	0.797	73%	0.727	S	S	*	*			trans	-61.4	129.4	170.4	-84.2	-43.6	0	0	0	110.9	F204 K208	F204-D206 PolarHBondContact O-N 3.42Å; D206-K208 PolarHBondContact O-N 3.38Å
207	K	59.4	Low	68	Low	193 Å²	193	138.7 Å²	138.7	84%	0.839	74%	0.738	S	S	*	*			trans	-65	107.5	176.1	-65.2	-178.1	-178.7	-178.2	0	108.9	S205 T209	S205-K207 PolarHBondContact O-N 3.31Å; K207-T209 VanDerWaalsContact C-N 3.33Å; K207-T209 PolarHBondContact O-N 2.99Å
208	K	56.8	Low	66.5	Low	199 Å²	199	141.8 Å²	141.8	87%	0.865	75%	0.751	S	S	*	*			trans	-62.6	98.7	164.3	-74.5	-175.9	-179.9	177.9	0	108.1	D206 T210	D206-K208 PolarHBondContact O-N 3.38Å; K208-T210 PolarHBondContact O-N 3.25Å
209	T	50.4	Low	65.1	Low	113 Å²	113	144.7 Å²	144.7	69%	0.693	76%	0.763	S	S	*	*			trans	-65.9	98.7	168.5	-55.7	0	0	0	0	106.5	K207 M211	K207-T209 VanDerWaalsContact C-N 3.33Å; K207-T209 PolarHBondContact O-N 2.99Å; T209-M211 VanDerWaalsContact C-N 3.28Å; T209-M211 PolarHBondContact O-N 2.97Å
210	T	52.3	Low	63.7	Low	121 Å²	121	147 Å²	147	74%	0.742	78%	0.775	S	S	*	*			trans	-64.4	94.5	167.8	-64.1	0	0	0	0	107	K208 T212	K208-T210 PolarHBondContact O-N 3.25Å; T210-T212 PolarHBondContact O-N 3.08Å
211	M	54.4	Low	62	Low	166 Å²	166	149.6 Å²	149.6	82%	0.818	79%	0.789	S	S	*	*			trans	-61.9	98.2	165.6	-84	-75.3	-175.5	0	0	107.9	T209 R213	T209-M211 VanDerWaalsContact C-N 3.28Å; T209-M211 PolarHBondContact O-N 2.97Å; M211-R213 PolarHBondContact O-N 2.98Å; M211-R213 VanDerWaalsContact O-N 3.08Å
212	T	52.6	Low	60.3	Low	118 Å²	118	146.9 Å²	146.9	72%	0.724	79%	0.794	S	S	*	*			trans	-61.2	107.9	163.9	37.1	0	0	0	0	108.2	T210 V214	T210-T212 PolarHBondContact O-N 3.08Å; T212-V214 PolarHBondContact O-N 2.89Å
213	R	51.1	Low	58.8	Low	241 Å²	241	151 Å²	151	91%	0.909	81%	0.806	S	S	*	*			trans	-54.6	99.8	171.7	-178.5	179.8	177.5	136.8	-0.3	109.5	M211	M211-R213 PolarHBondContact O-N 2.98Å; M211-R213 VanDerWaalsContact O-N 3.08Å
214	V	53.8	Low	57	Low	136 Å²	136	149.7 Å²	149.7	82%	0.824	81%	0.811	S	S	*	*			trans	-71.2	125.9	162.2	175.3	0	0	0	0	106.7	T212	T212-V214 PolarHBondContact O-N 2.89Å
215	G	60.4	Low	55	Low	63 Å²	63	148.1 Å²	148.1	65%	0.649	82%	0.817	S	S	*	*			trans	-64.8	151.1	-177.5	0	0	0	0	0	113.4
216	S	41.9	Very low	53.8	Low	189 Å²	189	153.5 Å²	153.5	100%	1.322	84%	0.835	S	S	*	*				-161.7	0	124.1	-168.4	0	0	0	0	109.2

Retrieved 216 of 216 residues in 206.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).