Q6MGA2_RAT Loading...

RT1 class II, DO beta

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

AlphaFold DB , UniProt , Accession Q6MGA2, Species RAT (Rattus norvegicus, Rat), Gene RT1-DOb, Length 272 aa.

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(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	M	35.1	Very low	46.7	Very low	254 Å²	254	128.7 Å²	128.7	100%	1.251	77%	0.769	S	S	*	*				0	130.3	0	-81.5	167.4	156.8	0	0	107.8
2	G	39.8	Very low	46.7	Very low	77 Å²	77	128.8 Å²	128.8	79%	0.794	76%	0.761	S	S	*	*			trans	125.7	49.8	-179.1	0	0	0	0	0	114	G4	G2-G4 VanDerWaalsContact C-N 3.32Å; G2-G4 PolarHBondContact O-N 3.12Å
3	A	43.5	Very low	46.8	Very low	102 Å²	102	128.2 Å²	128.2	84%	0.843	75%	0.751	S	S	*	*			trans	-66.8	96.1	163.5	0	0	0	0	0	107.9	R5	A3-R5 PolarHBondContact O-N 2.97Å; A3-R5 VanDerWaalsContact O-N 3.12Å
4	G	45.2	Very low	47.2	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	74%	0.743	S	S	*	*			trans	-65.2	107.3	176.8	0	0	0	0	0	109.8	G2 A6	G2-G4 VanDerWaalsContact C-N 3.32Å; G2-G4 PolarHBondContact O-N 3.12Å; G4-A6 PolarHBondContact O-N 3.03Å
5	R	49	Very low	46.7	Very low	238 Å²	238	127.1 Å²	127.1	90%	0.898	74%	0.742	S	S	*	*			trans	-62.6	98.9	165.4	-70.5	-178.4	-176.5	-166.9	0.6	107.4	A3 P7	A3-R5 PolarHBondContact O-N 2.97Å; A3-R5 VanDerWaalsContact O-N 3.12Å; R5-P7 VanDerWaalsContact O-CD 3.28Å; R5-P7 WeakPolarHBondContact O-CD 3.48Å; R5-P7 VanDerWaalsContact O-N 3.16Å
6	A	48.9	Very low	46.7	Very low	88 Å²	88	128.3 Å²	128.3	73%	0.727	74%	0.743	S	S	*	*			trans	-61.1	112.9	163.5	0	0	0	0	0	107	G4	G4-A6 PolarHBondContact O-N 3.03Å
7	P	47.4	Very low	46.6	Very low	90 Å²	90	130.2 Å²	130.2	58%	0.584	75%	0.746	S	S	*	*			trans	-75.3	150.3	-167.3	29.6	-31.2	0	0	0	110	R5 V9	R5-P7 VanDerWaalsContact O-CD 3.28Å; R5-P7 WeakPolarHBondContact O-CD 3.48Å; R5-P7 VanDerWaalsContact O-N 3.16Å; P7-V9 HydrophobicContact CB-CG2 4.47Å; P7-V9 PolarHBondContact O-N 3.39Å
8	W	48.6	Very low	46.7	Very low	231 Å²	231	134.4 Å²	134.4	88%	0.875	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	4.8	-173	-63.1	-3.2	0	0	0	116.6	V10 A11	W8-V10 VanDerWaalsContact C-N 3.3Å; W8-V10 PolarHBondContact O-N 2.87Å; W8-A11 PolarHBondContact O-N 3.32Å
9	V	51.5	Low	46.7	Very low	94 Å²	94	133.3 Å²	133.3	57%	0.57	75%	0.747	S	S	*	*	H	α-helix	trans	-63.4	-33.6	178.5	-175.1	0	0	0	0	112	P7 A11 L12	P7-V9 HydrophobicContact CB-CG2 4.47Å; P7-V9 PolarHBondContact O-N 3.39Å; V9-A11 VanDerWaalsContact C-N 3.33Å; V9-A11 PolarHBondContact O-N 3.5Å; V9-L12 PolarHBondContact O-N 3.39Å
10	V	52.1	Low	46.7	Very low	108 Å²	108	132.5 Å²	132.5	66%	0.655	74%	0.741	S	S	*	*	H	α-helix	trans	-70.8	-30.4	179.1	-174.3	0	0	0	0	111.8	W8 L12 L13	W8-V10 VanDerWaalsContact C-N 3.3Å; W8-V10 PolarHBondContact O-N 2.87Å; V10-L12 VanDerWaalsContact C-N 3.3Å; V10-L12 PolarHBondContact O-N 3.03Å; V10-L13 PolarHBondContact O-N 2.89Å
11	A	52.2	Low	46.5	Very low	61 Å²	61	130 Å²	130	50%	0.504	73%	0.733	S	S	.	*	H	α-helix	trans	-72.2	-23.3	177.3	0	0	0	0	0	113.1	W8 V9 N15	W8-A11 PolarHBondContact O-N 3.32Å; V9-A11 VanDerWaalsContact C-N 3.33Å; V9-A11 PolarHBondContact O-N 3.5Å; A11-N15 PolarHBondContact O-ND2 2.92Å
12	L	47.5	Very low	47.1	Very low	130 Å²	130	127.3 Å²	127.3	68%	0.681	71%	0.714	S	S	*	*	H	α-helix	trans	-79	-28.9	176.5	-95.6	145.1	0	0	0	113	V9 V10	V9-L12 PolarHBondContact O-N 3.39Å; V10-L12 VanDerWaalsContact C-N 3.3Å; V10-L12 PolarHBondContact O-N 3.03Å
13	L	48.1	Very low	47.4	Very low	121 Å²	121	131.3 Å²	131.3	63%	0.634	71%	0.714	S	S	*	*	H	α-helix	trans	-77.7	-26.7	177.3	-71.9	169	0	0	0	113.1	V10 N15	V10-L13 PolarHBondContact O-N 2.89Å; L13-N15 VanDerWaalsContact C-N 3.29Å; L13-N15 PolarHBondContact O-N 3.16Å
14	V	51.7	Low	47.8	Very low	105 Å²	105	131.7 Å²	131.7	64%	0.636	71%	0.706	S	S	*	*	H	α-helix	trans	-73.5	-21.8	177.2	-180	0	0	0	0	112.1
15	N	39.6	Very low	48.1	Very low	135 Å²	135	136.1 Å²	136.1	72%	0.722	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-0.8	179.1	-76.6	-69.7	0	0	0	114.9	A11 L13	A11-N15 PolarHBondContact O-ND2 2.92Å; L13-N15 VanDerWaalsContact C-N 3.29Å; L13-N15 PolarHBondContact O-N 3.16Å
16	L	46.7	Very low	48.3	Very low	145 Å²	145	127.4 Å²	127.4	76%	0.759	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-2.8	172.1	-76.2	163.3	0	0	0	113.3
17	M	45.7	Very low	48.5	Very low	161 Å²	161	134 Å²	134	79%	0.793	70%	0.697	S	S	*	*			trans	-106.8	32.3	176.9	-68.4	-94	-80.8	0	0	111.6	P19	M17-P19 WeakPolarHBondContact O-CD 3.38Å
18	R	47.8	Very low	49	Very low	207 Å²	207	137 Å²	137	78%	0.781	71%	0.709	S	S	*	*			trans	-94.7	86.1	154	-143.3	-179.6	-165.9	165.1	0.4	105.5	D20	R18-D20 PolarHBondContact O-N 3.46Å
19	P	46.3	Very low	49.5	Very low	113 Å²	113	130.4 Å²	130.4	73%	0.734	70%	0.697	S	S	*	*			trans	-62.7	94	155.4	27.7	-26.6	0	0	0	103.2	M17 S21	M17-P19 WeakPolarHBondContact O-CD 3.38Å; P19-S21 PolarHBondContact O-N 3.09Å
20	D	46.6	Very low	49.8	Very low	116 Å²	116	130.6 Å²	130.6	62%	0.62	70%	0.701	S	S	*	*			trans	-50.3	100.5	156.3	-77.6	-32.2	0	0	0	103.7	R18 F22	R18-D20 PolarHBondContact O-N 3.46Å; D20-F22 VanDerWaalsContact C-N 3.27Å; D20-F22 PolarHBondContact O-N 3.44Å
21	S	43.7	Very low	51	Low	82 Å²	82	134.6 Å²	134.6	57%	0.573	71%	0.712	S	S	*	*			trans	24	75	137.1	48.6	0	0	0	0	111.1	P19 M23	P19-S21 PolarHBondContact O-N 3.09Å; S21-M23 PolarHBondContact O-N 3.3Å
22	F	47.7	Very low	52.7	Low	196 Å²	196	138.4 Å²	138.4	86%	0.86	72%	0.724	S	S	*	*				-59.9	66.6	127.2	-98.1	-96.5	0	0	0	105.8	D20 V24	D20-F22 VanDerWaalsContact C-N 3.27Å; D20-F22 PolarHBondContact O-N 3.44Å; F22-V24 HydrophobicContact CD1-CG2 4.02Å; F22-V24 PolarHBondContact O-N 3.06Å
23	M	46.1	Very low	54.6	Low	161 Å²	161	138.4 Å²	138.4	79%	0.793	72%	0.719	S	S	*	*			trans	-56.1	82.1	130.3	-76.5	173.2	163.6	0	0	102.4	S21 E25	S21-M23 PolarHBondContact O-N 3.3Å; M23-E25 PolarHBondContact O-N 2.99Å
24	V	51.8	Low	56.8	Low	110 Å²	110	136.1 Å²	136.1	67%	0.667	71%	0.709	S	S	*	*			trans	-46.8	98.8	134	176.2	0	0	0	0	100.7	F22 G26	F22-V24 HydrophobicContact CD1-CG2 4.02Å; F22-V24 PolarHBondContact O-N 3.06Å; V24-G26 PolarHBondContact O-N 3.29Å
25	E	50.7	Low	58.8	Low	166 Å²	166	136 Å²	136	78%	0.776	70%	0.704	S	S	*	*			trans	-42.9	98.6	156.4	-166.4	97.3	-167.6	0	0	101.4	M23 R27	M23-E25 PolarHBondContact O-N 2.99Å; E25-R27 PolarHBondContact O-N 3.31Å
26	G	53.3	Low	61.6	Low	55 Å²	55	133.4 Å²	133.4	57%	0.567	69%	0.688	S	S	*	*			trans	-60.8	91	165.5	0	0	0	0	0	100.1	V24 D28	V24-G26 PolarHBondContact O-N 3.29Å; G26-D28 PolarHBondContact O-N 3.45Å
27	R	53.7	Low	64	Low	227 Å²	227	130 Å²	130	86%	0.857	68%	0.68	S	S	*	*			trans	-49.2	103.4	153	-100.6	-179.5	-177.6	169.9	1.8	100.3	E25 S29	E25-R27 PolarHBondContact O-N 3.31Å; R27-S29 PolarHBondContact O-N 3.45Å
28	D	57.9	Low	66.4	Low	154 Å²	154	127.4 Å²	127.4	82%	0.824	67%	0.665	S	S	*	*			trans	-44.2	95.8	154.9	-73.5	-30.7	0	0	0	102.1	G26 P30	G26-D28 PolarHBondContact O-N 3.45Å; D28-P30 WeakPolarHBondContact O-CD 3.47Å; D28-P30 VanDerWaalsContact O-N 3.14Å
29	S	57.8	Low	68.8	Low	91 Å²	91	120.9 Å²	120.9	64%	0.636	66%	0.655	S	S	*	*			trans	-54.5	125.6	168.9	43.1	0	0	0	0	102	R27 E31	R27-S29 PolarHBondContact O-N 3.45Å; S29-E31 PolarHBondContact O-N 3.2Å
30	P	59.6	Low	71.2	Confident	99 Å²	99	118 Å²	118	64%	0.643	63%	0.632	S	S	*	*			trans	-43.1	126.3	173.7	-24.8	31.7	0	0	0	107	D28 D32	D28-P30 WeakPolarHBondContact O-CD 3.47Å; D28-P30 VanDerWaalsContact O-N 3.14Å; P30-D32 PolarHBondContact O-N 3.46Å
31	E	76.7	Confident	73.6	Confident	191 Å²	191	114.4 Å²	114.4	89%	0.893	62%	0.615	S	S	*	*			trans	-64.7	89.8	176.7	-70.8	-174	168.3	0	0	106.3	S29 F33	S29-E31 PolarHBondContact O-N 3.2Å; E31-F33 PolarHBondContact O-N 3.48Å
32	D	87.3	Confident	76.1	Confident	141 Å²	141	115 Å²	115	75%	0.754	61%	0.605	S	S	*	*			trans	-64.4	132.2	-179.2	-73.7	-24.8	0	0	0	107.6	P30	P30-D32 PolarHBondContact O-N 3.46Å
33	F	88.7	Confident	78.4	Confident	131 Å²	131	109.1 Å²	109.1	58%	0.575	58%	0.579	S	S	*	*			trans	-110.9	149.3	172.9	69	-89.4	0	0	0	110.1	E31 I35 F58 N59	E31-F33 PolarHBondContact O-N 3.48Å; F33-I35 HydrophobicContact CD2-CD1 4.24Å; F33-I35 HydrophobicContact CD2-CG1 3.96Å; F33-I35 HydrophobicContact CE2-CD1 3.85Å; F33-I35 HydrophobicContact CE2-CG1 4.02Å; F33-F58 HydrophobicContact CB-CE2 4.21Å; F33-F58 HydrophobicContact CB-CZ 3.95Å; F33-F58 AromaticContact CD2-CE2 3.86Å; F33-F58 HydrophobicContact CD2-CE2 3.86Å; F33-F58 HydrophobicContact CD2-CZ 4.39Å; F33-F58 HydrophobicContact CG-CE2 4.29Å; F33-F58 HydrophobicContact CG-CZ 4.37Å; F33-N59 VanDerWaalsContact CA-OD1 3.25Å; F33-N59 WeakPolarHBondContact CA-OD1 3.33Å
34	V	94.1	Very high	80.6	Confident	72 Å²	72	106.2 Å²	106.2	44%	0.436	57%	0.571	S	S	.	*			trans	-122.4	122.5	-178.8	175.2	0	0	0	0	108.9	Q36 N59	V34-Q36 HydrophobicContact CG1-CG 3.83Å; V34-N59 PolarHBondContact N-OD1 2.93Å; V34-N59 PolarHBondContact O-N 2.66Å
35	I	93.9	Very high	82.5	Confident	103 Å²	103	105.6 Å²	105.6	53%	0.528	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.7	127.2	169.4	-54.4	-179.4	0	0	0	108.1	F33 I57 F58	F33-I35 HydrophobicContact CD2-CD1 4.24Å; F33-I35 HydrophobicContact CD2-CG1 3.96Å; F33-I35 HydrophobicContact CE2-CD1 3.85Å; F33-I35 HydrophobicContact CE2-CG1 4.02Å; I35-I57 WeakPolarHBondContact CA-O 3.38Å; I35-F58 HydrophobicContact CD1-CD2 4.44Å; I35-F58 HydrophobicContact CG1-CD2 3.92Å; I35-F58 HydrophobicContact CG1-CE2 4.23Å
36	Q	97.4	Very high	84.4	Confident	81 Å²	81	99 Å²	99	38%	0.379	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.4	176.4	-72.1	175	-23.5	0	0	109.9	V34 I57	V34-Q36 HydrophobicContact CG1-CG 3.83Å; Q36-I57 HydrophobicContact CB-CB 4.2Å; Q36-I57 PolarHBondContact N-O 2.98Å; Q36-I57 PolarHBondContact O-N 3.48Å
37	A	96.8	Very high	86.3	Confident	72 Å²	72	98.9 Å²	98.9	60%	0.595	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.8	166.6	0	0	0	0	0	108.8	R55 F56	A37-R55 CarbonylContact C-O 3.56Å; A37-R55 VanDerWaalsContact CA-O 3.32Å; A37-R55 WeakPolarHBondContact CA-O 3.15Å; A37-F56 HydrophobicContact CB-CD1 4.17Å; A37-F56 HydrophobicContact CB-CE1 4.19Å
38	K	97.4	Very high	88.3	Confident	107 Å²	107	95.2 Å²	95.2	47%	0.465	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116.7	178.6	-78.6	-175.4	160.1	-177.9	0	110.1	V54 R55 I57	K38-V54 CarbonylContact O-C 3.53Å; K38-V54 VanDerWaalsContact O-CA 3.32Å; K38-V54 WeakPolarHBondContact O-CA 3.4Å; K38-R55 HydrophobicContact CB-CB 4.45Å; K38-R55 PolarHBondContact N-O 3.39Å; K38-R55 PolarHBondContact O-N 3.36Å; K38-I57 HydrophobicContact CD-CD1 3.95Å; K38-I57 HydrophobicContact CG-CD1 4.35Å
39	A	96.5	Very high	90	Very high	70 Å²	70	94.5 Å²	94.5	58%	0.579	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.4	172.4	0	0	0	0	0	109.8	F52 L53 V54	A39-F52 HydrophobicContact CB-CE2 4.01Å; A39-F52 HydrophobicContact CB-CZ 4.33Å; A39-L53 CarbonylContact C-O 3.53Å; A39-L53 WeakPolarHBondContact CA-O 3.36Å; A39-V54 HydrophobicContact CB-CG2 4.24Å
40	E	96.9	Very high	91.9	Very high	54 Å²	54	90.7 Å²	90.7	25%	0.252	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.3	-177.4	-58.7	-178.8	145.6	0	0	109.6	Y42 F52 L53 R55	E40-Y42 HydrophobicContact CB-CD2 4.34Å; E40-Y42 HydrophobicContact CB-CE2 3.63Å; E40-Y42 PolarHBondContact OE2-OH 3.5Å; E40-F52 WeakPolarHBondContact O-CD2 3.17Å; E40-L53 HydrophobicContact CB-CB 4.47Å; E40-L53 PolarHBondContact N-O 3.25Å; E40-L53 PolarHBondContact O-N 2.97Å; E40-R55 IonicContact OE2-CZ 2.7Å; E40-R55 IonicContact OE2-NE 3.83Å; E40-R55 PolarHBondContact OE2-NE 3.45Å; E40-R55 IonicContact OE2-NH2 2.75Å
41	C	97	Very high	93.7	Very high	39 Å²	39	90.4 Å²	90.4	26%	0.264	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	116.5	174.9	-65.7	0	0	0	0	108.9	F43 C105	C41-F43 HydrophobicContact CB-CD2 4.39Å; C41-F43 HydrophobicContact CB-CE1 4.4Å; C41-F43 HydrophobicContact CB-CE2 3.49Å; C41-F43 VanDerWaalsContact CB-CE2 3.49Å; C41-F43 HydrophobicContact CB-CZ 3.5Å; C41-F43 VanDerWaalsContact CB-CZ 3.5Å; C41-F43 WeakPolarHBondContact O-CD2 3.33Å; C41-F43 WeakPolarHBondContact O-CE2 3.26Å; C41-C105 HydrophobicContact CB-CB 3.63Å; C41-C105 WeakPolarHBondContact CB-SG 3.25Å; C41-C105 WeakPolarHBondContact SG-CA 3.45Å; C41-C105 WeakPolarHBondContact SG-CB 3.33Å; C41-C105 CovalentContact SG-SG 2.03Å; C41-C105 PolarHBondContact SG-SG 2.02Å
42	Y	96.6	Very high	94.7	Very high	95 Å²	95	81.9 Å²	81.9	37%	0.373	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	111.7	178.3	-64	-92.6	0	0	0	109.6	E40 V50 R51 L53	E40-Y42 HydrophobicContact CB-CD2 4.34Å; E40-Y42 HydrophobicContact CB-CE2 3.63Å; E40-Y42 PolarHBondContact OE2-OH 3.5Å; Y42-V50 WeakPolarHBondContact O-CA 3.24Å; Y42-R51 PolarHBondContact N-O 3.45Å; Y42-R51 PolarHBondContact O-N 2.85Å; Y42-L53 HydrophobicContact CE2-CB 4.31Å; Y42-L53 HydrophobicContact CE2-CD2 4.39Å
43	F	95.8	Very high	95.2	Very high	72 Å²	72	75.2 Å²	75.2	32%	0.316	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	106.3	179.5	-55.6	-81.6	0	0	0	109.4	C41 G46 V50 C105 Y109	C41-F43 HydrophobicContact CB-CD2 4.39Å; C41-F43 HydrophobicContact CB-CE1 4.4Å; C41-F43 HydrophobicContact CB-CE2 3.49Å; C41-F43 VanDerWaalsContact CB-CE2 3.49Å; C41-F43 HydrophobicContact CB-CZ 3.5Å; C41-F43 VanDerWaalsContact CB-CZ 3.5Å; C41-F43 WeakPolarHBondContact O-CD2 3.33Å; C41-F43 WeakPolarHBondContact O-CE2 3.26Å; F43-G46 WeakPolarHBondContact CB-O 3.41Å; F43-V50 HydrophobicContact CD1-CB 4.48Å; F43-V50 HydrophobicContact CD1-CG1 4.01Å; F43-V50 HydrophobicContact CD1-CG2 3.8Å; F43-V50 HydrophobicContact CE1-CG1 3.81Å; F43-V50 HydrophobicContact CE1-CG2 4.08Å; F43-C105 HydrophobicContact CE1-CB 4Å; F43-C105 WeakPolarHBondContact CE1-O 3.39Å; F43-C105 HydrophobicContact CZ-CB 3.93Å; F43-C105 VanDerWaalsContact CZ-O 3.31Å; F43-C105 WeakPolarHBondContact CZ-O 3.48Å; F43-Y109 HydrophobicContact CB-CD2 4.34Å; F43-Y109 HydrophobicContact CB-CE2 4.14Å; F43-Y109 AromaticContact CD1-CD2 3.47Å; F43-Y109 HydrophobicContact CD1-CD2 3.47Å; F43-Y109 VanDerWaalsContact CD1-CD2 3.47Å; F43-Y109 HydrophobicContact CD1-CE2 4.06Å; F43-Y109 HydrophobicContact CD1-CG 4.19Å; F43-Y109 AromaticContact CD2-CD2 3.85Å; F43-Y109 HydrophobicContact CD2-CD2 3.85Å; F43-Y109 HydrophobicContact CD2-CE2 4.32Å; F43-Y109 AromaticContact CE1-CD2 3.61Å; F43-Y109 HydrophobicContact CE1-CD2 3.61Å; F43-Y109 AromaticContact CE1-CG 3.99Å; F43-Y109 HydrophobicContact CE1-CG 3.99Å; F43-Y109 AromaticContact CE2-CD2 3.95Å; F43-Y109 HydrophobicContact CE2-CD2 3.95Å; F43-Y109 AromaticContact CG-CD2 3.61Å; F43-Y109 HydrophobicContact CG-CD2 3.61Å; F43-Y109 AromaticContact CG-CE2 3.91Å; F43-Y109 HydrophobicContact CG-CE2 3.91Å; F43-Y109 AromaticContact CZ-CD2 3.83Å; F43-Y109 HydrophobicContact CZ-CD2 3.83Å; F43-Y109 HydrophobicContact CZ-CG 4.31Å
44	T	92.7	Very high	95.7	Very high	101 Å²	101	70.1 Å²	70.1	62%	0.62	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	-23.5	-175.8	51.4	0	0	0	0	113.7	K49	T44-K49 PolarHBondContact N-O 3.42Å; T44-K49 VanDerWaalsContact N-O 3.14Å; T44-K49 WeakPolarHBondContact OG1-CB 3.45Å; T44-K49 WeakPolarHBondContact OG1-CD 3.35Å; T44-K49 VanDerWaalsContact OG1-CG 3.31Å; T44-K49 WeakPolarHBondContact OG1-CG 3.42Å; T44-K49 PolarHBondContact OG1-O 2.89Å
45	N	92.3	Very high	95.9	Very high	97 Å²	97	69.8 Å²	69.8	52%	0.519	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	69.6	171.8	-169.1	25.5	0	0	0	108.9	T47 E48 K49	N45-T47 PolarHBondContact O-N 3.3Å; N45-E48 PolarHBondContact ND2-OE2 2.72Å; N45-E48 WeakPolarHBondContact O-CB 2.96Å; N45-E48 PolarHBondContact O-N 2.87Å; N45-E48 VanDerWaalsContact O-N 3.11Å; N45-K49 HydrophobicContact CB-CB 4.38Å
46	G	89.8	Confident	96.1	Very high	27 Å²	27	66.7 Å²	66.7	28%	0.278	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	-126.7	-171.1	0	0	0	0	0	111.8	F43	F43-G46 WeakPolarHBondContact CB-O 3.41Å
47	T	94.3	Very high	96.1	Very high	52 Å²	52	63.7 Å²	63.7	32%	0.319	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-0.4	178.8	60.3	0	0	0	0	114.3	N45 V50 R106 Y109	N45-T47 PolarHBondContact O-N 3.3Å; T47-V50 WeakPolarHBondContact O-CG2 3.45Å; T47-R106 PolarHBondContact O-NE 3.5Å; T47-R106 PolarHBondContact O-NH2 3.11Å; T47-Y109 HydrophobicContact CG2-CD1 3.27Å; T47-Y109 HydrophobicContact CG2-CD2 4.33Å; T47-Y109 HydrophobicContact CG2-CE1 3.76Å; T47-Y109 HydrophobicContact CG2-CG 3.59Å
48	E	93.7	Very high	96	Very high	150 Å²	150	63.6 Å²	63.6	70%	0.701	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-52.8	178.8	-63.6	-176.7	172	0	0	110.3	N45 R106	N45-E48 PolarHBondContact ND2-OE2 2.72Å; N45-E48 WeakPolarHBondContact O-CB 2.96Å; N45-E48 PolarHBondContact O-N 2.87Å; N45-E48 VanDerWaalsContact O-N 3.11Å; E48-R106 PolarHBondContact O-NH2 2.98Å
49	K	95.3	Very high	95.9	Very high	139 Å²	139	62.3 Å²	62.3	60%	0.604	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	104	179.1	-169.9	175.8	178	-177.5	0	111	T44 N45	T44-K49 PolarHBondContact N-O 3.42Å; T44-K49 VanDerWaalsContact N-O 3.14Å; T44-K49 WeakPolarHBondContact OG1-CB 3.45Å; T44-K49 WeakPolarHBondContact OG1-CD 3.35Å; T44-K49 VanDerWaalsContact OG1-CG 3.31Å; T44-K49 WeakPolarHBondContact OG1-CG 3.42Å; T44-K49 PolarHBondContact OG1-O 2.89Å; N45-K49 HydrophobicContact CB-CB 4.38Å
50	V	97.4	Very high	95.7	Very high	12 Å²	12	66.3 Å²	66.3	7%	0.073	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	125.5	-175.3	-173.8	0	0	0	0	109.3	Y42 F43 T47 V101 C105 R106	Y42-V50 WeakPolarHBondContact O-CA 3.24Å; F43-V50 HydrophobicContact CD1-CB 4.48Å; F43-V50 HydrophobicContact CD1-CG1 4.01Å; F43-V50 HydrophobicContact CD1-CG2 3.8Å; F43-V50 HydrophobicContact CE1-CG1 3.81Å; F43-V50 HydrophobicContact CE1-CG2 4.08Å; T47-V50 WeakPolarHBondContact O-CG2 3.45Å; V50-V101 HydrophobicContact CB-CG1 3.75Å; V50-V101 HydrophobicContact CG1-CG1 3.86Å; V50-C105 HydrophobicContact CG1-CB 3.49Å; V50-C105 VanDerWaalsContact CG1-CB 3.49Å; V50-R106 HydrophobicContact CG2-CG 4.2Å
51	R	97.3	Very high	95.8	Very high	92 Å²	92	69.9 Å²	69.9	35%	0.347	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.3	170.4	-179.3	-175.7	-178	-164.5	1.5	108.9	Y42 D67 S68 D69	Y42-R51 PolarHBondContact N-O 3.45Å; Y42-R51 PolarHBondContact O-N 2.85Å; R51-D67 IonicContact CZ-OD1 3.93Å; R51-D67 IonicContact CZ-OD2 3.19Å; R51-D67 IonicContact NE-OD1 2.81Å; R51-D67 PolarHBondContact NE-OD1 3.3Å; R51-D67 IonicContact NE-OD2 2.77Å; R51-D67 PolarHBondContact NE-OD2 3.32Å; R51-D67 IonicContact NH2-OD1 3.83Å; R51-D67 IonicContact NH2-OD2 3.5Å; R51-D67 PolarHBondContact NH2-OD2 3.47Å; R51-S68 WeakPolarHBondContact CA-OG 3.31Å; R51-D69 VanDerWaalsContact CD-OD2 3.31Å; R51-D69 WeakPolarHBondContact CD-OD2 3.44Å; R51-D69 IonicContact NE-OD2 2.95Å
52	F	98	Very high	95.8	Very high	12 Å²	12	69.8 Å²	69.8	5%	0.053	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132.7	174	177.7	-116.5	0	0	0	109.7	A39 E40 V54 F66 S68 A100 V101 C105	A39-F52 HydrophobicContact CB-CE2 4.01Å; A39-F52 HydrophobicContact CB-CZ 4.33Å; E40-F52 WeakPolarHBondContact O-CD2 3.17Å; F52-V54 HydrophobicContact CD1-CG2 4.22Å; F52-V54 HydrophobicContact CE1-CG2 3.27Å; F52-V54 HydrophobicContact CE2-CG2 3.9Å; F52-V54 HydrophobicContact CZ-CG2 3.1Å; F52-F66 HydrophobicContact CD1-CD1 4.07Å; F52-F66 HydrophobicContact CD1-CE1 4.17Å; F52-F66 HydrophobicContact CE1-CD1 4.42Å; F52-S68 PolarHBondContact N-OG 2.95Å; F52-S68 WeakPolarHBondContact O-CB 3.4Å; F52-S68 PolarHBondContact O-N 3.48Å; F52-S68 PolarHBondContact O-OG 3.09Å; F52-A100 HydrophobicContact CD1-CB 3.44Å; F52-A100 VanDerWaalsContact CD1-CB 3.44Å; F52-A100 HydrophobicContact CE1-CB 3.18Å; F52-A100 HydrophobicContact CE2-CB 4.37Å; F52-A100 HydrophobicContact CG-CB 4.12Å; F52-A100 HydrophobicContact CZ-CB 3.68Å; F52-V101 HydrophobicContact CB-CG2 3.81Å; F52-C105 WeakPolarHBondContact CD2-SG 3.44Å
53	L	97.9	Very high	95.9	Very high	2 Å²	2	66.3 Å²	66.3	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.4	179.2	-168.5	77.1	0	0	0	109.4	A39 E40 Y42 R55 H65 F66 D67	A39-L53 CarbonylContact C-O 3.53Å; A39-L53 WeakPolarHBondContact CA-O 3.36Å; E40-L53 HydrophobicContact CB-CB 4.47Å; E40-L53 PolarHBondContact N-O 3.25Å; E40-L53 PolarHBondContact O-N 2.97Å; Y42-L53 HydrophobicContact CE2-CB 4.31Å; Y42-L53 HydrophobicContact CE2-CD2 4.39Å; L53-R55 HydrophobicContact CD2-CG 3.89Å; L53-R55 VanDerWaalsContact CD2-NE 3.27Å; L53-R55 HydrophobicContact CG-CG 4.16Å; L53-H65 HydrophobicContact CD1-CB 4.26Å; L53-F66 WeakPolarHBondContact CA-O 3.22Å; L53-F66 WeakPolarHBondContact CD1-O 3.48Å; L53-D67 HydrophobicContact CD1-CB 3.9Å
54	V	97.9	Very high	96	Very high	23 Å²	23	62.9 Å²	62.9	14%	0.139	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	113.1	169.7	-176.7	0	0	0	0	108.5	K38 A39 F52 F56 H65 F66	K38-V54 CarbonylContact O-C 3.53Å; K38-V54 VanDerWaalsContact O-CA 3.32Å; K38-V54 WeakPolarHBondContact O-CA 3.4Å; A39-V54 HydrophobicContact CB-CG2 4.24Å; F52-V54 HydrophobicContact CD1-CG2 4.22Å; F52-V54 HydrophobicContact CE1-CG2 3.27Å; F52-V54 HydrophobicContact CE2-CG2 3.9Å; F52-V54 HydrophobicContact CZ-CG2 3.1Å; V54-F56 HydrophobicContact CB-CE2 4.28Å; V54-F56 HydrophobicContact CG1-CD2 4.41Å; V54-F56 HydrophobicContact CG1-CE1 4.43Å; V54-F56 HydrophobicContact CG1-CE2 3.69Å; V54-F56 HydrophobicContact CG1-CZ 3.71Å; V54-H65 CarbonylContact O-C 3.46Å; V54-H65 WeakPolarHBondContact O-CA 3.42Å; V54-H65 WeakPolarHBondContact O-CB 3.48Å; V54-F66 HydrophobicContact CB-CB 4.5Å; V54-F66 PolarHBondContact N-O 2.92Å; V54-F66 PolarHBondContact O-N 3.07Å
55	R	98.1	Very high	96.3	Very high	65 Å²	65	59.2 Å²	59.2	25%	0.245	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	132.6	179.2	-58.1	175.8	-177.5	-82	1.8	110	A37 K38 E40 L53 I57 E62 H65	A37-R55 CarbonylContact C-O 3.56Å; A37-R55 VanDerWaalsContact CA-O 3.32Å; A37-R55 WeakPolarHBondContact CA-O 3.15Å; K38-R55 HydrophobicContact CB-CB 4.45Å; K38-R55 PolarHBondContact N-O 3.39Å; K38-R55 PolarHBondContact O-N 3.36Å; E40-R55 IonicContact OE2-CZ 2.7Å; E40-R55 IonicContact OE2-NE 3.83Å; E40-R55 PolarHBondContact OE2-NE 3.45Å; E40-R55 IonicContact OE2-NH2 2.75Å; L53-R55 HydrophobicContact CD2-CG 3.89Å; L53-R55 VanDerWaalsContact CD2-NE 3.27Å; L53-R55 HydrophobicContact CG-CG 4.16Å; R55-I57 HydrophobicContact CB-CD1 4.48Å; R55-I57 HydrophobicContact CB-CG1 4.41Å; R55-E62 HydrophobicContact CB-CG 4.16Å; R55-E62 VanDerWaalsContact CD-OE2 3.3Å; R55-E62 WeakPolarHBondContact CD-OE2 3.35Å; R55-E62 IonicContact CZ-OE2 2.95Å; R55-E62 IonicContact NE-OE2 3.65Å; R55-E62 VanDerWaalsContact NH1-CD 3.3Å; R55-E62 IonicContact NH1-OE1 2.61Å; R55-E62 PolarHBondContact NH1-OE1 3.36Å; R55-E62 VanDerWaalsContact NH1-OE1 3.12Å; R55-E62 IonicContact NH1-OE2 2.83Å; R55-E62 PolarHBondContact NH1-OE2 2.98Å; R55-H65 HydrophobicContact CG-CB 4.3Å
56	F	98.1	Very high	96.6	Very high	38 Å²	38	54.6 Å²	54.6	17%	0.167	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.3	171.8	-60.3	-92.7	0	0	0	108.5	A37 V54 E62 Y63 L64 F73 W87	A37-F56 HydrophobicContact CB-CD1 4.17Å; A37-F56 HydrophobicContact CB-CE1 4.19Å; V54-F56 HydrophobicContact CB-CE2 4.28Å; V54-F56 HydrophobicContact CG1-CD2 4.41Å; V54-F56 HydrophobicContact CG1-CE1 4.43Å; V54-F56 HydrophobicContact CG1-CE2 3.69Å; V54-F56 HydrophobicContact CG1-CZ 3.71Å; F56-E62 WeakPolarHBondContact O-CA 3.48Å; F56-Y63 HydrophobicContact CB-CD1 4.13Å; F56-Y63 HydrophobicContact CB-CE1 3.42Å; F56-Y63 VanDerWaalsContact CB-CE1 3.42Å; F56-Y63 HydrophobicContact CB-CE2 4.45Å; F56-Y63 WeakPolarHBondContact O-CD1 3.1Å; F56-Y63 PolarHBondContact O-N 2.89Å; F56-L64 HydrophobicContact CB-CB 4.39Å; F56-L64 HydrophobicContact CB-CD2 4.42Å; F56-L64 HydrophobicContact CD2-CD2 3.78Å; F56-L64 HydrophobicContact CD2-CG 4.23Å; F56-L64 HydrophobicContact CE2-CD2 4.35Å; F56-L64 HydrophobicContact CG-CD2 4.2Å; F56-L64 PolarHBondContact N-O 2.92Å; F56-F73 HydrophobicContact CE2-CD1 4.43Å; F56-F73 HydrophobicContact CE2-CE1 4.04Å; F56-W87 HydrophobicContact CD1-CH2 4.12Å; F56-W87 HydrophobicContact CD1-CZ3 4.35Å; F56-W87 HydrophobicContact CD2-CH2 4.47Å; F56-W87 AromaticContact CD2-CZ3 3.98Å; F56-W87 HydrophobicContact CD2-CZ3 3.98Å; F56-W87 AromaticContact CE1-CH2 3.9Å; F56-W87 HydrophobicContact CE1-CH2 3.9Å; F56-W87 AromaticContact CE1-CZ3 3.96Å; F56-W87 HydrophobicContact CE1-CZ3 3.96Å; F56-W87 HydrophobicContact CE2-CH2 4.3Å; F56-W87 AromaticContact CE2-CZ3 3.58Å; F56-W87 HydrophobicContact CE2-CZ3 3.58Å; F56-W87 HydrophobicContact CG-CH2 4.39Å; F56-W87 HydrophobicContact CG-CZ3 4.35Å; F56-W87 AromaticContact CZ-CH2 4Å; F56-W87 HydrophobicContact CZ-CH2 4Å; F56-W87 AromaticContact CZ-CZ3 3.56Å; F56-W87 HydrophobicContact CZ-CZ3 3.56Å
57	I	98	Very high	96.9	Very high	19 Å²	19	53.8 Å²	53.8	10%	0.097	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.1	-167.8	-57.7	164.9	0	0	0	108	I35 Q36 K38 R55 E61 E62	I35-I57 WeakPolarHBondContact CA-O 3.38Å; Q36-I57 HydrophobicContact CB-CB 4.2Å; Q36-I57 PolarHBondContact N-O 2.98Å; Q36-I57 PolarHBondContact O-N 3.48Å; K38-I57 HydrophobicContact CD-CD1 3.95Å; K38-I57 HydrophobicContact CG-CD1 4.35Å; R55-I57 HydrophobicContact CB-CD1 4.48Å; R55-I57 HydrophobicContact CB-CG1 4.41Å; I57-E61 CarbonylContact C-O 3.52Å; I57-E61 WeakPolarHBondContact CA-O 3.45Å; I57-E62 HydrophobicContact CG1-CB 4.17Å; I57-E62 HydrophobicContact CG1-CG 4.33Å
58	F	95.6	Very high	97.1	Very high	70 Å²	70	52.5 Å²	52.5	31%	0.307	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.2	177	-173.9	-91.4	0	0	0	108.5	F33 I35 L60 E61 Y63 L79	F33-F58 HydrophobicContact CB-CE2 4.21Å; F33-F58 HydrophobicContact CB-CZ 3.95Å; F33-F58 AromaticContact CD2-CE2 3.86Å; F33-F58 HydrophobicContact CD2-CE2 3.86Å; F33-F58 HydrophobicContact CD2-CZ 4.39Å; F33-F58 HydrophobicContact CG-CE2 4.29Å; F33-F58 HydrophobicContact CG-CZ 4.37Å; I35-F58 HydrophobicContact CD1-CD2 4.44Å; I35-F58 HydrophobicContact CG1-CD2 3.92Å; I35-F58 HydrophobicContact CG1-CE2 4.23Å; F58-L60 VanDerWaalsContact C-N 3.28Å; F58-L60 PolarHBondContact O-N 3.44Å; F58-E61 PolarHBondContact N-O 2.91Å; F58-E61 PolarHBondContact O-N 2.86Å; F58-Y63 HydrophobicContact CB-CD1 3.8Å; F58-Y63 HydrophobicContact CB-CE1 4.26Å; F58-L79 HydrophobicContact CB-CD2 4.35Å; F58-L79 HydrophobicContact CD1-CD2 4.36Å; F58-L79 HydrophobicContact CG-CD2 4.17Å
59	N	93.7	Very high	97.2	Very high	79 Å²	79	50.2 Å²	50.2	42%	0.422	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	47.7	-179.3	-70.7	-9.8	0	0	0	113.9	F33 V34 E61	F33-N59 VanDerWaalsContact CA-OD1 3.25Å; F33-N59 WeakPolarHBondContact CA-OD1 3.33Å; V34-N59 PolarHBondContact N-OD1 2.93Å; V34-N59 PolarHBondContact O-N 2.66Å; N59-E61 PolarHBondContact O-N 3.32Å
60	L	94.3	Very high	97.3	Very high	154 Å²	154	48 Å²	48	81%	0.806	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.7	-2.8	-178.9	-48.1	173	0	0	0	115.7	F58	F58-L60 VanDerWaalsContact C-N 3.28Å; F58-L60 PolarHBondContact O-N 3.44Å
61	E	97.1	Very high	97.3	Very high	129 Å²	129	47.8 Å²	47.8	60%	0.603	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	124.1	173.7	-173.2	171.6	-161.9	0	0	110.5	I57 F58 N59 Y63 T77	I57-E61 CarbonylContact C-O 3.52Å; I57-E61 WeakPolarHBondContact CA-O 3.45Å; F58-E61 PolarHBondContact N-O 2.91Å; F58-E61 PolarHBondContact O-N 2.86Å; N59-E61 PolarHBondContact O-N 3.32Å; E61-Y63 PolarHBondContact O-N 2.84Å; E61-T77 HydrophobicContact CG-CG2 4.38Å
62	E	98	Very high	97.3	Very high	38 Å²	38	47.7 Å²	47.7	18%	0.178	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	118.2	172.4	-172	-175.8	149.6	0	0	109.5	R55 F56 I57 H65 L76	R55-E62 HydrophobicContact CB-CG 4.16Å; R55-E62 VanDerWaalsContact CD-OE2 3.3Å; R55-E62 WeakPolarHBondContact CD-OE2 3.35Å; R55-E62 IonicContact CZ-OE2 2.95Å; R55-E62 IonicContact NE-OE2 3.65Å; R55-E62 VanDerWaalsContact NH1-CD 3.3Å; R55-E62 IonicContact NH1-OE1 2.61Å; R55-E62 PolarHBondContact NH1-OE1 3.36Å; R55-E62 VanDerWaalsContact NH1-OE1 3.12Å; R55-E62 IonicContact NH1-OE2 2.83Å; R55-E62 PolarHBondContact NH1-OE2 2.98Å; F56-E62 WeakPolarHBondContact O-CA 3.48Å; I57-E62 HydrophobicContact CG1-CB 4.17Å; I57-E62 HydrophobicContact CG1-CG 4.33Å; E62-H65 WeakPolarHBondContact OE1-CB 3.49Å; E62-H65 IonicContact OE1-CE1 3.69Å; E62-H65 IonicContact OE1-CG 2.68Å; E62-H65 IonicContact OE1-ND1 3.12Å; E62-H65 PolarHBondContact OE1-ND1 3.07Å; E62-L76 HydrophobicContact CB-CD1 4.09Å; E62-L76 HydrophobicContact CG-CD1 3.73Å; E62-L76 WeakPolarHBondContact OE1-CD1 3.2Å
63	Y	98	Very high	97.4	Very high	22 Å²	22	47.6 Å²	47.6	9%	0.086	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-21.1	-174.8	75.2	-90	0	0	0	112.8	F56 F58 E61 L76 T77 L79 D83	F56-Y63 HydrophobicContact CB-CD1 4.13Å; F56-Y63 HydrophobicContact CB-CE1 3.42Å; F56-Y63 VanDerWaalsContact CB-CE1 3.42Å; F56-Y63 HydrophobicContact CB-CE2 4.45Å; F56-Y63 WeakPolarHBondContact O-CD1 3.1Å; F56-Y63 PolarHBondContact O-N 2.89Å; F58-Y63 HydrophobicContact CB-CD1 3.8Å; F58-Y63 HydrophobicContact CB-CE1 4.26Å; E61-Y63 PolarHBondContact O-N 2.84Å; Y63-L76 PolarHBondContact O-N 2.85Å; Y63-T77 WeakPolarHBondContact CB-OG1 3.43Å; Y63-T77 PolarHBondContact O-N 2.82Å; Y63-L79 HydrophobicContact CD2-CD2 4.47Å; Y63-L79 HydrophobicContact CD2-CG 4.33Å; Y63-L79 HydrophobicContact CG-CD2 4.41Å; Y63-D83 WeakPolarHBondContact CE2-OD2 3.26Å; Y63-D83 PolarHBondContact OH-OD2 3.27Å
64	L	98.4	Very high	97.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	147.1	-174.6	170.2	89.1	0	0	0	110.1	F56 F73 V74 D83 A84 W87	F56-L64 HydrophobicContact CB-CB 4.39Å; F56-L64 HydrophobicContact CB-CD2 4.42Å; F56-L64 HydrophobicContact CD2-CD2 3.78Å; F56-L64 HydrophobicContact CD2-CG 4.23Å; F56-L64 HydrophobicContact CE2-CD2 4.35Å; F56-L64 HydrophobicContact CG-CD2 4.2Å; F56-L64 PolarHBondContact N-O 2.92Å; L64-F73 HydrophobicContact CD1-CB 4.01Å; L64-F73 HydrophobicContact CD2-CD1 4.46Å; L64-V74 CarbonylContact C-O 3.56Å; L64-V74 WeakPolarHBondContact CA-O 3.48Å; L64-D83 HydrophobicContact CD2-CB 4.09Å; L64-A84 HydrophobicContact CD1-CB 3.53Å; L64-W87 HydrophobicContact CD2-CD2 4.44Å; L64-W87 HydrophobicContact CD2-CE3 3.63Å; L64-W87 HydrophobicContact CD2-CH2 3.68Å; L64-W87 HydrophobicContact CD2-CZ2 4.47Å; L64-W87 HydrophobicContact CD2-CZ3 3.2Å
65	H	98.4	Very high	97.4	Very high	23 Å²	23	49.8 Å²	49.8	11%	0.106	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	157.6	163.6	61.2	-111.1	0	0	0	114	L53 V54 R55 E62 F73 V74	L53-H65 HydrophobicContact CD1-CB 4.26Å; V54-H65 CarbonylContact O-C 3.46Å; V54-H65 WeakPolarHBondContact O-CA 3.42Å; V54-H65 WeakPolarHBondContact O-CB 3.48Å; R55-H65 HydrophobicContact CG-CB 4.3Å; E62-H65 WeakPolarHBondContact OE1-CB 3.49Å; E62-H65 IonicContact OE1-CE1 3.69Å; E62-H65 IonicContact OE1-CG 2.68Å; E62-H65 IonicContact OE1-ND1 3.12Å; E62-H65 PolarHBondContact OE1-ND1 3.07Å; H65-F73 CarbonylContact O-C 3.52Å; H65-F73 VanDerWaalsContact O-CA 3.26Å; H65-F73 WeakPolarHBondContact O-CA 3.31Å; H65-V74 PolarHBondContact N-O 3.26Å; H65-V74 PolarHBondContact O-N 3.32Å
66	F	98.5	Very high	97.4	Very high	1 Å²	1	51.1 Å²	51.1	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.7	160.1	177.5	-97.2	0	0	0	109.9	F52 L53 V54 F73 L94 S97 R98	F52-F66 HydrophobicContact CD1-CD1 4.07Å; F52-F66 HydrophobicContact CD1-CE1 4.17Å; F52-F66 HydrophobicContact CE1-CD1 4.42Å; L53-F66 WeakPolarHBondContact CA-O 3.22Å; L53-F66 WeakPolarHBondContact CD1-O 3.48Å; V54-F66 HydrophobicContact CB-CB 4.5Å; V54-F66 PolarHBondContact N-O 2.92Å; V54-F66 PolarHBondContact O-N 3.07Å; F66-F73 HydrophobicContact CB-CD1 3.65Å; F66-F73 HydrophobicContact CB-CE1 3.6Å; F66-F73 HydrophobicContact CB-CG 4.29Å; F66-F73 HydrophobicContact CB-CZ 4.19Å; F66-F73 HydrophobicContact CD2-CD1 4.39Å; F66-F73 HydrophobicContact CD2-CD2 4.11Å; F66-F73 HydrophobicContact CD2-CE1 4.35Å; F66-F73 HydrophobicContact CD2-CE2 4.06Å; F66-F73 HydrophobicContact CD2-CG 4.27Å; F66-F73 HydrophobicContact CD2-CZ 4.18Å; F66-F73 HydrophobicContact CG-CE1 4.36Å; F66-F73 HydrophobicContact CG-CZ 4.5Å; F66-L94 HydrophobicContact CE2-CD2 4.39Å; F66-S97 VanDerWaalsContact CE1-O 3.24Å; F66-S97 WeakPolarHBondContact CE1-O 2.98Å; F66-S97 VanDerWaalsContact CE2-CB 3.47Å; F66-S97 VanDerWaalsContact CZ-C 3.49Å; F66-R98 HydrophobicContact CE2-CG 4.48Å; F66-R98 HydrophobicContact CZ-CG 3.94Å
67	D	98	Very high	97.4	Very high	9 Å²	9	50.9 Å²	50.9	5%	0.048	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	120.4	173.5	-172.3	-10.3	0	0	0	110.5	R51 L53 D69 L70 G71 F72	R51-D67 IonicContact CZ-OD1 3.93Å; R51-D67 IonicContact CZ-OD2 3.19Å; R51-D67 IonicContact NE-OD1 2.81Å; R51-D67 PolarHBondContact NE-OD1 3.3Å; R51-D67 IonicContact NE-OD2 2.77Å; R51-D67 PolarHBondContact NE-OD2 3.32Å; R51-D67 IonicContact NH2-OD1 3.83Å; R51-D67 IonicContact NH2-OD2 3.5Å; R51-D67 PolarHBondContact NH2-OD2 3.47Å; L53-D67 HydrophobicContact CD1-CB 3.9Å; D67-D69 PolarHBondContact O-N 2.9Å; D67-D69 PolarHBondContact OD1-N 3.18Å; D67-L70 HydrophobicContact CB-CB 4.26Å; D67-L70 HydrophobicContact CB-CD1 4.09Å; D67-L70 HydrophobicContact CB-CG 4.13Å; D67-L70 PolarHBondContact O-N 2.93Å; D67-G71 PolarHBondContact O-N 3.09Å; D67-F72 PolarHBondContact N-O 2.74Å
68	S	97.4	Very high	97.3	Very high	25 Å²	25	57.9 Å²	57.9	18%	0.175	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.4	-179.8	67.6	0	0	0	0	114	R51 F52 L70	R51-S68 WeakPolarHBondContact CA-OG 3.31Å; F52-S68 PolarHBondContact N-OG 2.95Å; F52-S68 WeakPolarHBondContact O-CB 3.4Å; F52-S68 PolarHBondContact O-N 3.48Å; F52-S68 PolarHBondContact O-OG 3.09Å; S68-L70 VanDerWaalsContact C-N 3.29Å
69	D	96.3	Very high	97.2	Very high	103 Å²	103	59.1 Å²	59.1	55%	0.551	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-29.3	178	-72.6	-3.4	0	0	0	111	R51 D67	R51-D69 VanDerWaalsContact CD-OD2 3.31Å; R51-D69 WeakPolarHBondContact CD-OD2 3.44Å; R51-D69 IonicContact NE-OD2 2.95Å; D67-D69 PolarHBondContact O-N 2.9Å; D67-D69 PolarHBondContact OD1-N 3.18Å
70	L	97.5	Very high	97.4	Very high	91 Å²	91	55.3 Å²	55.3	48%	0.476	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-34.5	172.7	-59.2	179.4	0	0	0	111.7	D67 S68 F72 V74	D67-L70 HydrophobicContact CB-CB 4.26Å; D67-L70 HydrophobicContact CB-CD1 4.09Å; D67-L70 HydrophobicContact CB-CG 4.13Å; D67-L70 PolarHBondContact O-N 2.93Å; S68-L70 VanDerWaalsContact C-N 3.29Å; L70-F72 HydrophobicContact CB-CD1 4.09Å; L70-F72 HydrophobicContact CB-CE1 3.79Å; L70-F72 HydrophobicContact CB-CZ 4.08Å; L70-F72 HydrophobicContact CD1-CZ 4.45Å; L70-F72 WeakPolarHBondContact O-CD1 3.46Å; L70-F72 WeakPolarHBondContact O-CE1 3.19Å; L70-V74 HydrophobicContact CD1-CG2 3.54Å
71	G	97.2	Very high	97.6	Very high	9 Å²	9	54 Å²	54	9%	0.093	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	79	19.3	-178.6	0	0	0	0	0	114.3	D67 R98	D67-G71 PolarHBondContact O-N 3.09Å; G71-R98 VanDerWaalsContact O-CZ 3.26Å; G71-R98 PolarHBondContact O-NE 2.76Å; G71-R98 PolarHBondContact O-NH2 2.95Å
72	F	97.9	Very high	97.6	Very high	89 Å²	89	52.8 Å²	52.8	39%	0.39	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	171.8	178	60.6	-93.8	0	0	0	111.9	D67 L70 V74 N88 L94	D67-F72 PolarHBondContact N-O 2.74Å; L70-F72 HydrophobicContact CB-CD1 4.09Å; L70-F72 HydrophobicContact CB-CE1 3.79Å; L70-F72 HydrophobicContact CB-CZ 4.08Å; L70-F72 HydrophobicContact CD1-CZ 4.45Å; L70-F72 WeakPolarHBondContact O-CD1 3.46Å; L70-F72 WeakPolarHBondContact O-CE1 3.19Å; F72-V74 HydrophobicContact CD2-CG2 4.31Å; F72-V74 HydrophobicContact CE2-CG2 4Å; F72-N88 WeakPolarHBondContact CB-OD1 3.47Å; F72-L94 HydrophobicContact CB-CD2 3.95Å
73	F	98.4	Very high	97.5	Very high	11 Å²	11	52.9 Å²	52.9	5%	0.048	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	134.5	179.3	-63.3	-94.1	0	0	0	111.7	F56 L64 H65 F66 W87 N88 L94	F56-F73 HydrophobicContact CE2-CD1 4.43Å; F56-F73 HydrophobicContact CE2-CE1 4.04Å; L64-F73 HydrophobicContact CD1-CB 4.01Å; L64-F73 HydrophobicContact CD2-CD1 4.46Å; H65-F73 CarbonylContact O-C 3.52Å; H65-F73 VanDerWaalsContact O-CA 3.26Å; H65-F73 WeakPolarHBondContact O-CA 3.31Å; F66-F73 HydrophobicContact CB-CD1 3.65Å; F66-F73 HydrophobicContact CB-CE1 3.6Å; F66-F73 HydrophobicContact CB-CG 4.29Å; F66-F73 HydrophobicContact CB-CZ 4.19Å; F66-F73 HydrophobicContact CD2-CD1 4.39Å; F66-F73 HydrophobicContact CD2-CD2 4.11Å; F66-F73 HydrophobicContact CD2-CE1 4.35Å; F66-F73 HydrophobicContact CD2-CE2 4.06Å; F66-F73 HydrophobicContact CD2-CG 4.27Å; F66-F73 HydrophobicContact CD2-CZ 4.18Å; F66-F73 HydrophobicContact CG-CE1 4.36Å; F66-F73 HydrophobicContact CG-CZ 4.5Å; F73-W87 AromaticContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CZ3 4.11Å; F73-W87 HydrophobicContact CD2-CB 3.88Å; F73-W87 AromaticContact CE1-CE3 3.45Å; F73-W87 HydrophobicContact CE1-CE3 3.45Å; F73-W87 VanDerWaalsContact CE1-CE3 3.45Å; F73-W87 AromaticContact CE1-CZ3 3.87Å; F73-W87 HydrophobicContact CE1-CZ3 3.87Å; F73-W87 HydrophobicContact CE2-CB 4.07Å; F73-W87 HydrophobicContact CE2-CE3 4.43Å; F73-W87 HydrophobicContact CG-CB 4.29Å; F73-W87 HydrophobicContact CG-CE3 4.15Å; F73-W87 AromaticContact CZ-CE3 3.91Å; F73-W87 HydrophobicContact CZ-CE3 3.91Å; F73-N88 WeakPolarHBondContact CB-OD1 3.38Å; F73-N88 WeakPolarHBondContact CD2-OD1 3.48Å; F73-N88 PolarHBondContact N-OD1 3.33Å; F73-N88 PolarHBondContact O-ND2 3.42Å; F73-L94 HydrophobicContact CD2-CD2 3.91Å; F73-L94 HydrophobicContact CE2-CD2 4.07Å
74	V	98.4	Very high	97.5	Very high	38 Å²	38	52.2 Å²	52.2	23%	0.23	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123	-179.5	-178.7	0	0	0	0	108.9	L64 H65 L70 F72	L64-V74 CarbonylContact C-O 3.56Å; L64-V74 WeakPolarHBondContact CA-O 3.48Å; H65-V74 PolarHBondContact N-O 3.26Å; H65-V74 PolarHBondContact O-N 3.32Å; L70-V74 HydrophobicContact CD1-CG2 3.54Å; F72-V74 HydrophobicContact CD2-CG2 4.31Å; F72-V74 HydrophobicContact CE2-CG2 4Å
75	A	98.2	Very high	97.5	Very high	33 Å²	33	56.5 Å²	56.5	27%	0.273	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	139	171	0	0	0	0	0	110.5	G80 E81 A84	A75-G80 VanDerWaalsContact CB-C 3.44Å; A75-E81 HydrophobicContact CB-CB 4.43Å; A75-E81 HydrophobicContact CB-CG 3.95Å; A75-A84 HydrophobicContact CB-CB 3.9Å
76	L	97.8	Very high	97.4	Very high	92 Å²	92	60.9 Å²	60.9	48%	0.482	32%	0.322	S	S	.	.	S	Bend	trans	-108.3	-19.2	173.1	-62.3	-176.5	0	0	0	112.6	E62 Y63	E62-L76 HydrophobicContact CB-CD1 4.09Å; E62-L76 HydrophobicContact CG-CD1 3.73Å; E62-L76 WeakPolarHBondContact OE1-CD1 3.2Å; Y63-L76 PolarHBondContact O-N 2.85Å
77	T	97.6	Very high	97.4	Very high	33 Å²	33	63.2 Å²	63.2	20%	0.202	33%	0.331	C	S	.	.	S	Bend	trans	-137.4	166.1	177.9	70.8	0	0	0	0	110.9	E61 Y63 L79 G80 E81	E61-T77 HydrophobicContact CG-CG2 4.38Å; Y63-T77 WeakPolarHBondContact CB-OG1 3.43Å; Y63-T77 PolarHBondContact O-N 2.82Å; T77-L79 PolarHBondContact O-N 3.31Å; T77-G80 WeakPolarHBondContact O-CA 3.18Å; T77-G80 PolarHBondContact O-N 3.36Å; T77-E81 PolarHBondContact O-N 2.79Å
78	E	96.5	Very high	97.4	Very high	166 Å²	166	65 Å²	65	78%	0.776	34%	0.341	S	S	*	.	H	α-helix	trans	-55.4	-36	176.8	-64.8	-177.2	175.2	0	0	112.4	G80 E81	E78-G80 VanDerWaalsContact C-N 3.28Å; E78-G80 PolarHBondContact O-N 3.02Å; E78-E81 PolarHBondContact O-N 3.06Å
79	L	94.1	Very high	97.5	Very high	96 Å²	96	70.4 Å²	70.4	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-59.8	-41	174.9	179.9	64.4	0	0	0	111.3	F58 Y63 T77	F58-L79 HydrophobicContact CB-CD2 4.35Å; F58-L79 HydrophobicContact CD1-CD2 4.36Å; F58-L79 HydrophobicContact CG-CD2 4.17Å; Y63-L79 HydrophobicContact CD2-CD2 4.47Å; Y63-L79 HydrophobicContact CD2-CG 4.33Å; Y63-L79 HydrophobicContact CG-CD2 4.41Å; T77-L79 PolarHBondContact O-N 3.31Å
80	G	97.7	Very high	97.5	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-76	-18.6	-180	0	0	0	0	0	114.8	A75 T77 E78 V82 D83 A84	A75-G80 VanDerWaalsContact CB-C 3.44Å; T77-G80 WeakPolarHBondContact O-CA 3.18Å; T77-G80 PolarHBondContact O-N 3.36Å; E78-G80 VanDerWaalsContact C-N 3.28Å; E78-G80 PolarHBondContact O-N 3.02Å; G80-V82 VanDerWaalsContact C-N 3.33Å; G80-V82 PolarHBondContact O-N 3.11Å; G80-D83 PolarHBondContact O-N 3.13Å; G80-A84 VanDerWaalsContact O-CB 3.25Å; G80-A84 WeakPolarHBondContact O-CB 3.44Å; G80-A84 PolarHBondContact O-N 3.38Å
81	E	98.2	Very high	97.5	Very high	125 Å²	125	72 Å²	72	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-62.4	-41.7	-179.6	-68.4	-172.7	171.1	0	0	111.8	A75 T77 E78 A84 D85	A75-E81 HydrophobicContact CB-CB 4.43Å; A75-E81 HydrophobicContact CB-CG 3.95Å; T77-E81 PolarHBondContact O-N 2.79Å; E78-E81 PolarHBondContact O-N 3.06Å; E81-A84 PolarHBondContact O-N 2.97Å; E81-D85 WeakPolarHBondContact O-CB 3.28Å; E81-D85 PolarHBondContact O-N 3.06Å
82	V	96.9	Very high	97.5	Very high	105 Å²	105	75.4 Å²	75.4	64%	0.636	38%	0.377	S	S	*	.	H	α-helix	trans	-62.5	-46.9	178.7	-179.7	0	0	0	0	110.7	G80 Q86	G80-V82 VanDerWaalsContact C-N 3.33Å; G80-V82 PolarHBondContact O-N 3.11Å; V82-Q86 WeakPolarHBondContact O-CB 3.46Å; V82-Q86 PolarHBondContact O-N 3.41Å; V82-Q86 VanDerWaalsContact O-N 3.15Å
83	D	96.7	Very high	97.4	Very high	40 Å²	40	73.3 Å²	73.3	21%	0.214	37%	0.37	C	S	.	.	H	α-helix	trans	-67.6	-45.8	178.9	-77	-10.1	0	0	0	111.3	Y63 L64 G80 D85 Q86 W87	Y63-D83 WeakPolarHBondContact CE2-OD2 3.26Å; Y63-D83 PolarHBondContact OH-OD2 3.27Å; L64-D83 HydrophobicContact CD2-CB 4.09Å; G80-D83 PolarHBondContact O-N 3.13Å; D83-D85 PolarHBondContact O-N 3.29Å; D83-Q86 PolarHBondContact O-N 2.84Å; D83-W87 HydrophobicContact CB-CD2 4.46Å; D83-W87 HydrophobicContact CB-CZ2 4.18Å; D83-W87 VanDerWaalsContact O-CB 3.27Å; D83-W87 WeakPolarHBondContact O-CB 3.44Å; D83-W87 PolarHBondContact O-N 3.12Å
84	A	98.1	Very high	97.4	Very high	7 Å²	7	73.2 Å²	73.2	6%	0.058	37%	0.369	C	S	.	.	H	α-helix	trans	-59.4	-47.1	178.8	0	0	0	0	0	111.8	L64 A75 G80 E81 Q86 W87 N88	L64-A84 HydrophobicContact CD1-CB 3.53Å; A75-A84 HydrophobicContact CB-CB 3.9Å; G80-A84 VanDerWaalsContact O-CB 3.25Å; G80-A84 WeakPolarHBondContact O-CB 3.44Å; G80-A84 PolarHBondContact O-N 3.38Å; E81-A84 PolarHBondContact O-N 2.97Å; A84-Q86 VanDerWaalsContact C-N 3.34Å; A84-Q86 PolarHBondContact O-N 3.44Å; A84-W87 PolarHBondContact O-N 3.35Å; A84-N88 WeakPolarHBondContact O-CB 3.26Å; A84-N88 PolarHBondContact O-N 3.46Å; A84-N88 PolarHBondContact O-ND2 2.91Å
85	D	97.4	Very high	97.3	Very high	90 Å²	90	77.4 Å²	77.4	48%	0.481	39%	0.387	S	S	.	.	H	α-helix	trans	-61.6	-42.5	178.4	179.4	61.2	0	0	0	111.4	E81 D83 K89	E81-D85 WeakPolarHBondContact O-CB 3.28Å; E81-D85 PolarHBondContact O-N 3.06Å; D83-D85 PolarHBondContact O-N 3.29Å; D85-K89 VanDerWaalsContact O-CD 3.3Å; D85-K89 WeakPolarHBondContact O-CD 3.48Å; D85-K89 VanDerWaalsContact O-CG 3.27Å; D85-K89 WeakPolarHBondContact O-CG 3.28Å; D85-K89 PolarHBondContact O-N 2.92Å; D85-K89 WeakPolarHBondContact OD1-CE 3.39Å; D85-K89 IonicContact OD1-NZ 2.96Å; D85-K89 PolarHBondContact OD1-NZ 2.72Å; D85-K89 IonicContact OD2-NZ 3.75Å; D85-K89 PolarHBondContact OD2-NZ 3.06Å
86	Q	97.7	Very high	97.2	Very high	116 Å²	116	79.8 Å²	79.8	54%	0.542	40%	0.398	S	S	.	.	H	α-helix	trans	-69	-45.3	177.8	-170.6	-177.4	46.5	0	0	112.3	V82 D83 A84 K89	V82-Q86 WeakPolarHBondContact O-CB 3.46Å; V82-Q86 PolarHBondContact O-N 3.41Å; V82-Q86 VanDerWaalsContact O-N 3.15Å; D83-Q86 PolarHBondContact O-N 2.84Å; A84-Q86 VanDerWaalsContact C-N 3.34Å; A84-Q86 PolarHBondContact O-N 3.44Å; Q86-K89 PolarHBondContact O-N 3Å
87	W	98	Very high	97.2	Very high	49 Å²	49	76.5 Å²	76.5	19%	0.186	38%	0.383	C	S	.	.	H	α-helix	trans	-75.2	-32.9	-173.7	-63.3	9.4	0	0	0	111.6	F56 L64 F73 D83 A84 K89 R90 L93	F56-W87 HydrophobicContact CD1-CH2 4.12Å; F56-W87 HydrophobicContact CD1-CZ3 4.35Å; F56-W87 HydrophobicContact CD2-CH2 4.47Å; F56-W87 AromaticContact CD2-CZ3 3.98Å; F56-W87 HydrophobicContact CD2-CZ3 3.98Å; F56-W87 AromaticContact CE1-CH2 3.9Å; F56-W87 HydrophobicContact CE1-CH2 3.9Å; F56-W87 AromaticContact CE1-CZ3 3.96Å; F56-W87 HydrophobicContact CE1-CZ3 3.96Å; F56-W87 HydrophobicContact CE2-CH2 4.3Å; F56-W87 AromaticContact CE2-CZ3 3.58Å; F56-W87 HydrophobicContact CE2-CZ3 3.58Å; F56-W87 HydrophobicContact CG-CH2 4.39Å; F56-W87 HydrophobicContact CG-CZ3 4.35Å; F56-W87 AromaticContact CZ-CH2 4Å; F56-W87 HydrophobicContact CZ-CH2 4Å; F56-W87 AromaticContact CZ-CZ3 3.56Å; F56-W87 HydrophobicContact CZ-CZ3 3.56Å; L64-W87 HydrophobicContact CD2-CD2 4.44Å; L64-W87 HydrophobicContact CD2-CE3 3.63Å; L64-W87 HydrophobicContact CD2-CH2 3.68Å; L64-W87 HydrophobicContact CD2-CZ2 4.47Å; L64-W87 HydrophobicContact CD2-CZ3 3.2Å; F73-W87 AromaticContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CE3 3.6Å; F73-W87 HydrophobicContact CD1-CZ3 4.11Å; F73-W87 HydrophobicContact CD2-CB 3.88Å; F73-W87 AromaticContact CE1-CE3 3.45Å; F73-W87 HydrophobicContact CE1-CE3 3.45Å; F73-W87 VanDerWaalsContact CE1-CE3 3.45Å; F73-W87 AromaticContact CE1-CZ3 3.87Å; F73-W87 HydrophobicContact CE1-CZ3 3.87Å; F73-W87 HydrophobicContact CE2-CB 4.07Å; F73-W87 HydrophobicContact CE2-CE3 4.43Å; F73-W87 HydrophobicContact CG-CB 4.29Å; F73-W87 HydrophobicContact CG-CE3 4.15Å; F73-W87 AromaticContact CZ-CE3 3.91Å; F73-W87 HydrophobicContact CZ-CE3 3.91Å; D83-W87 HydrophobicContact CB-CD2 4.46Å; D83-W87 HydrophobicContact CB-CZ2 4.18Å; D83-W87 VanDerWaalsContact O-CB 3.27Å; D83-W87 WeakPolarHBondContact O-CB 3.44Å; D83-W87 PolarHBondContact O-N 3.12Å; A84-W87 PolarHBondContact O-N 3.35Å; W87-K89 PolarHBondContact O-N 3.07Å; W87-R90 WeakPolarHBondContact O-CB 3.24Å; W87-R90 PolarHBondContact O-N 3.43Å; W87-R90 VanDerWaalsContact O-N 3.11Å; W87-L93 HydrophobicContact CB-CD1 4.42Å; W87-L93 HydrophobicContact CG-CD1 4.38Å
88	N	98.3	Very high	97.2	Very high	47 Å²	47	80.3 Å²	80.3	25%	0.251	39%	0.393	S	S	.	.	H	α-helix	trans	-69.5	-18.7	173.2	-71.5	-29.1	0	0	0	113.5	F72 F73 A84 R90 L94	F72-N88 WeakPolarHBondContact CB-OD1 3.47Å; F73-N88 WeakPolarHBondContact CB-OD1 3.38Å; F73-N88 WeakPolarHBondContact CD2-OD1 3.48Å; F73-N88 PolarHBondContact N-OD1 3.33Å; F73-N88 PolarHBondContact O-ND2 3.42Å; A84-N88 WeakPolarHBondContact O-CB 3.26Å; A84-N88 PolarHBondContact O-N 3.46Å; A84-N88 PolarHBondContact O-ND2 2.91Å; N88-R90 VanDerWaalsContact C-N 3.35Å; N88-L94 VanDerWaalsContact O-CD1 3.23Å; N88-L94 WeakPolarHBondContact O-CD1 3.3Å
89	K	98.1	Very high	97.3	Very high	138 Å²	138	74.4 Å²	74.4	60%	0.6	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.9	171.8	-70.9	167.4	-172.6	166.6	0	112.9	D85 Q86 W87 L91	D85-K89 VanDerWaalsContact O-CD 3.3Å; D85-K89 WeakPolarHBondContact O-CD 3.48Å; D85-K89 VanDerWaalsContact O-CG 3.27Å; D85-K89 WeakPolarHBondContact O-CG 3.28Å; D85-K89 PolarHBondContact O-N 2.92Å; D85-K89 WeakPolarHBondContact OD1-CE 3.39Å; D85-K89 IonicContact OD1-NZ 2.96Å; D85-K89 PolarHBondContact OD1-NZ 2.72Å; D85-K89 IonicContact OD2-NZ 3.75Å; D85-K89 PolarHBondContact OD2-NZ 3.06Å; Q86-K89 PolarHBondContact O-N 3Å; W87-K89 PolarHBondContact O-N 3.07Å; K89-L91 PolarHBondContact O-N 2.77Å
90	R	97.6	Very high	97.4	Very high	112 Å²	112	70.1 Å²	70.1	42%	0.423	35%	0.351	S	S	.	.			trans	-90.3	96.5	178.5	-75.7	-168.6	61.6	-174.6	-2.3	110.9	W87 N88 D92 L93 L94	W87-R90 WeakPolarHBondContact O-CB 3.24Å; W87-R90 PolarHBondContact O-N 3.43Å; W87-R90 VanDerWaalsContact O-N 3.11Å; N88-R90 VanDerWaalsContact C-N 3.35Å; R90-D92 VanDerWaalsContact C-N 3.27Å; R90-D92 WeakPolarHBondContact CB-OD1 3.36Å; R90-D92 IonicContact CZ-OD2 3.62Å; R90-D92 IonicContact NE-OD1 3.38Å; R90-D92 PolarHBondContact NE-OD1 3.35Å; R90-D92 IonicContact NE-OD2 3.67Å; R90-D92 IonicContact NH2-OD1 3.85Å; R90-D92 IonicContact NH2-OD2 2.73Å; R90-D92 PolarHBondContact NH2-OD2 2.8Å; R90-D92 PolarHBondContact O-N 2.81Å; R90-L93 HydrophobicContact CB-CB 3.97Å; R90-L93 HydrophobicContact CB-CD1 3.87Å; R90-L93 HydrophobicContact CB-CG 3.86Å; R90-L93 HydrophobicContact CG-CD1 4.33Å; R90-L93 PolarHBondContact O-N 2.82Å; R90-L94 PolarHBondContact O-N 2.85Å
91	L	96.6	Very high	97.4	Very high	117 Å²	117	70.9 Å²	70.9	61%	0.613	36%	0.356	S	S	*	.	H	α-helix	trans	-58.7	-38.1	-179.9	-65.6	179.1	0	0	0	112.6	K89 L93 L94 E95	K89-L91 PolarHBondContact O-N 2.77Å; L91-L93 PolarHBondContact O-N 2.9Å; L91-L94 PolarHBondContact O-N 2.82Å; L91-E95 WeakPolarHBondContact O-CB 3.37Å; L91-E95 VanDerWaalsContact O-CG 3.3Å; L91-E95 WeakPolarHBondContact O-CG 3.44Å; L91-E95 PolarHBondContact O-N 2.77Å
92	D	97.1	Very high	97.4	Very high	79 Å²	79	69.7 Å²	69.7	42%	0.422	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-42.1	177.1	62.6	-46.3	0	0	0	112.4	R90 T96	R90-D92 VanDerWaalsContact C-N 3.27Å; R90-D92 WeakPolarHBondContact CB-OD1 3.36Å; R90-D92 IonicContact CZ-OD2 3.62Å; R90-D92 IonicContact NE-OD1 3.38Å; R90-D92 PolarHBondContact NE-OD1 3.35Å; R90-D92 IonicContact NE-OD2 3.67Å; R90-D92 IonicContact NH2-OD1 3.85Å; R90-D92 IonicContact NH2-OD2 2.73Å; R90-D92 PolarHBondContact NH2-OD2 2.8Å; R90-D92 PolarHBondContact O-N 2.81Å; D92-T96 WeakPolarHBondContact O-CB 3.41Å; D92-T96 PolarHBondContact O-N 3.21Å; D92-T96 VanDerWaalsContact O-N 3.09Å; D92-T96 PolarHBondContact O-OG1 2.99Å
93	L	96.5	Very high	97.3	Very high	46 Å²	46	69.4 Å²	69.4	24%	0.241	35%	0.346	C	S	.	.	H	α-helix	trans	-67.7	-47.7	175.5	-68	-173.9	0	0	0	111.2	W87 R90 L91 E95 T96 S97	W87-L93 HydrophobicContact CB-CD1 4.42Å; W87-L93 HydrophobicContact CG-CD1 4.38Å; R90-L93 HydrophobicContact CB-CB 3.97Å; R90-L93 HydrophobicContact CB-CD1 3.87Å; R90-L93 HydrophobicContact CB-CG 3.86Å; R90-L93 HydrophobicContact CG-CD1 4.33Å; R90-L93 PolarHBondContact O-N 2.82Å; L91-L93 PolarHBondContact O-N 2.9Å; L93-E95 PolarHBondContact O-N 2.92Å; L93-T96 PolarHBondContact O-N 3.46Å; L93-S97 WeakPolarHBondContact O-CB 3.37Å; L93-S97 PolarHBondContact O-N 2.85Å; L93-S97 PolarHBondContact O-OG 2.92Å; L93-S97 VanDerWaalsContact O-OG 3.07Å
94	L	97.3	Very high	97.2	Very high	8 Å²	8	70 Å²	70	4%	0.042	35%	0.351	C	S	.	.	H	α-helix	trans	-60.4	-43.7	179.1	-75.1	178.9	0	0	0	112.4	F66 F72 F73 N88 R90 L91 S97 R98	F66-L94 HydrophobicContact CE2-CD2 4.39Å; F72-L94 HydrophobicContact CB-CD2 3.95Å; F73-L94 HydrophobicContact CD2-CD2 3.91Å; F73-L94 HydrophobicContact CE2-CD2 4.07Å; N88-L94 VanDerWaalsContact O-CD1 3.23Å; N88-L94 WeakPolarHBondContact O-CD1 3.3Å; R90-L94 PolarHBondContact O-N 2.85Å; L91-L94 PolarHBondContact O-N 2.82Å; L94-S97 PolarHBondContact O-N 3.08Å; L94-R98 WeakPolarHBondContact O-CB 3Å; L94-R98 WeakPolarHBondContact O-CD 3.27Å; L94-R98 WeakPolarHBondContact O-CG 3.49Å; L94-R98 PolarHBondContact O-N 2.7Å
95	E	97.6	Very high	97.2	Very high	127 Å²	127	69.6 Å²	69.6	59%	0.593	35%	0.348	S	S	*	.	H	α-helix	trans	-62.5	-45.8	177.1	-75.7	177.3	-176	0	0	111.5	L91 L93 R98 A99	L91-E95 WeakPolarHBondContact O-CB 3.37Å; L91-E95 VanDerWaalsContact O-CG 3.3Å; L91-E95 WeakPolarHBondContact O-CG 3.44Å; L91-E95 PolarHBondContact O-N 2.77Å; L93-E95 PolarHBondContact O-N 2.92Å; E95-R98 PolarHBondContact O-N 3.48Å; E95-A99 VanDerWaalsContact O-CB 3.31Å; E95-A99 WeakPolarHBondContact O-CB 3.35Å; E95-A99 PolarHBondContact O-N 2.82Å
96	T	96.6	Very high	97.1	Very high	83 Å²	83	68.3 Å²	68.3	51%	0.509	34%	0.336	S	S	.	.	H	α-helix	trans	-63.4	-43.9	177.3	-55.4	0	0	0	0	111.4	D92 L93 R98 A99 A100	D92-T96 WeakPolarHBondContact O-CB 3.41Å; D92-T96 PolarHBondContact O-N 3.21Å; D92-T96 VanDerWaalsContact O-N 3.09Å; D92-T96 PolarHBondContact O-OG1 2.99Å; L93-T96 PolarHBondContact O-N 3.46Å; T96-R98 PolarHBondContact O-N 2.94Å; T96-A99 PolarHBondContact O-N 2.75Å; T96-A100 PolarHBondContact O-N 3.15Å
97	S	97.2	Very high	97	Very high	23 Å²	23	68 Å²	68	16%	0.161	34%	0.335	C	S	.	.	H	α-helix	trans	-64.7	-38.6	177.5	-67.1	0	0	0	0	112.6	F66 L93 L94 A100	F66-S97 VanDerWaalsContact CE1-O 3.24Å; F66-S97 WeakPolarHBondContact CE1-O 2.98Å; F66-S97 VanDerWaalsContact CE2-CB 3.47Å; F66-S97 VanDerWaalsContact CZ-C 3.49Å; L93-S97 WeakPolarHBondContact O-CB 3.37Å; L93-S97 PolarHBondContact O-N 2.85Å; L93-S97 PolarHBondContact O-OG 2.92Å; L93-S97 VanDerWaalsContact O-OG 3.07Å; L94-S97 PolarHBondContact O-N 3.08Å; S97-A100 WeakPolarHBondContact O-CB 3.42Å; S97-A100 PolarHBondContact O-N 2.83Å
98	R	97.5	Very high	96.9	Very high	113 Å²	113	70.7 Å²	70.7	43%	0.426	35%	0.35	S	S	.	.	H	α-helix	trans	-67.2	-39.2	172.9	-70.5	165.5	-170.7	157.5	2	111.6	F66 G71 L94 E95 T96 A100	F66-R98 HydrophobicContact CE2-CG 4.48Å; F66-R98 HydrophobicContact CZ-CG 3.94Å; G71-R98 VanDerWaalsContact O-CZ 3.26Å; G71-R98 PolarHBondContact O-NE 2.76Å; G71-R98 PolarHBondContact O-NH2 2.95Å; L94-R98 WeakPolarHBondContact O-CB 3Å; L94-R98 WeakPolarHBondContact O-CD 3.27Å; L94-R98 WeakPolarHBondContact O-CG 3.49Å; L94-R98 PolarHBondContact O-N 2.7Å; E95-R98 PolarHBondContact O-N 3.48Å; T96-R98 PolarHBondContact O-N 2.94Å; R98-A100 PolarHBondContact O-N 2.88Å
99	A	97.6	Very high	96.8	Very high	41 Å²	41	70.9 Å²	70.9	34%	0.339	35%	0.347	S	S	.	.	H	α-helix	trans	-66.3	-24.3	177.8	0	0	0	0	0	112.9	E95 T96 V101 N102 M103	E95-A99 VanDerWaalsContact O-CB 3.31Å; E95-A99 WeakPolarHBondContact O-CB 3.35Å; E95-A99 PolarHBondContact O-N 2.82Å; T96-A99 PolarHBondContact O-N 2.75Å; A99-V101 PolarHBondContact O-N 2.9Å; A99-V101 VanDerWaalsContact O-N 3.11Å; A99-N102 PolarHBondContact O-N 2.89Å; A99-M103 HydrophobicContact CB-SD 3.95Å; A99-M103 WeakPolarHBondContact O-CG 3.46Å; A99-M103 PolarHBondContact O-N 3.46Å
100	A	97.2	Very high	96.6	Very high	6 Å²	6	71.9 Å²	71.9	5%	0.05	35%	0.352	C	S	.	.	H	α-helix	trans	-53	-30.3	178.8	0	0	0	0	0	114.2	F52 T96 S97 R98 N102 V104 C105	F52-A100 HydrophobicContact CD1-CB 3.44Å; F52-A100 VanDerWaalsContact CD1-CB 3.44Å; F52-A100 HydrophobicContact CE1-CB 3.18Å; F52-A100 HydrophobicContact CE2-CB 4.37Å; F52-A100 HydrophobicContact CG-CB 4.12Å; F52-A100 HydrophobicContact CZ-CB 3.68Å; T96-A100 PolarHBondContact O-N 3.15Å; S97-A100 WeakPolarHBondContact O-CB 3.42Å; S97-A100 PolarHBondContact O-N 2.83Å; R98-A100 PolarHBondContact O-N 2.88Å; A100-N102 PolarHBondContact O-N 2.8Å; A100-V104 HydrophobicContact CB-CG2 4.19Å; A100-V104 WeakPolarHBondContact O-CA 3.35Å; A100-V104 VanDerWaalsContact O-CB 3.26Å; A100-V104 WeakPolarHBondContact O-CB 3.42Å; A100-V104 PolarHBondContact O-N 2.82Å; A100-C105 PolarHBondContact O-N 2.79Å; A100-C105 VanDerWaalsContact O-N 3.11Å
101	V	97.9	Very high	96.5	Very high	17 Å²	17	71.2 Å²	71.2	10%	0.103	36%	0.356	C	S	.	.	I	π-helix	trans	-56	-42.2	173.7	-174.1	0	0	0	0	111.2	V50 F52 A99 C105 R106	V50-V101 HydrophobicContact CB-CG1 3.75Å; V50-V101 HydrophobicContact CG1-CG1 3.86Å; F52-V101 HydrophobicContact CB-CG2 3.81Å; A99-V101 PolarHBondContact O-N 2.9Å; A99-V101 VanDerWaalsContact O-N 3.11Å; V101-C105 WeakPolarHBondContact O-CB 3.39Å; V101-R106 PolarHBondContact O-N 2.87Å
102	N	96.9	Very high	96.4	Very high	99 Å²	99	66.3 Å²	66.3	53%	0.529	33%	0.334	S	S	.	.	I	π-helix	trans	-83.1	-53.7	178.7	-75.4	-45.1	0	0	0	112.2	A99 A100 R106 Q107	A99-N102 PolarHBondContact O-N 2.89Å; A100-N102 PolarHBondContact O-N 2.8Å; N102-R106 WeakPolarHBondContact OD1-CD 3.33Å; N102-R106 PolarHBondContact OD1-NH1 3Å; N102-Q107 PolarHBondContact O-N 2.95Å
103	M	95	Very high	96.3	Very high	100 Å²	100	62.7 Å²	62.7	49%	0.493	32%	0.315	S	S	.	.	I	π-helix	trans	-75.2	-26.5	-170.2	66.3	-169.5	-78.1	0	0	113.4	A99 Q107	A99-M103 HydrophobicContact CB-SD 3.95Å; A99-M103 WeakPolarHBondContact O-CG 3.46Å; A99-M103 PolarHBondContact O-N 3.46Å; M103-Q107 WeakPolarHBondContact O-CB 3.16Å; M103-Q107 PolarHBondContact O-OE1 3.04Å
104	V	95.4	Very high	96.2	Very high	51 Å²	51	64 Å²	64	31%	0.309	33%	0.326	S	S	.	.	I	π-helix	trans	-103.6	-70.9	175.8	-174.3	0	0	0	0	108.9	A100 R106 Q107 E108	A100-V104 HydrophobicContact CB-CG2 4.19Å; A100-V104 WeakPolarHBondContact O-CA 3.35Å; A100-V104 VanDerWaalsContact O-CB 3.26Å; A100-V104 WeakPolarHBondContact O-CB 3.42Å; A100-V104 PolarHBondContact O-N 2.82Å; V104-R106 PolarHBondContact O-N 2.84Å; V104-Q107 PolarHBondContact O-N 2.88Å; V104-E108 HydrophobicContact CG1-CG 4.25Å; V104-E108 WeakPolarHBondContact O-CB 3.43Å; V104-E108 VanDerWaalsContact O-CG 3.31Å; V104-E108 WeakPolarHBondContact O-CG 3.38Å; V104-E108 PolarHBondContact O-N 2.93Å
105	C	97.4	Very high	95.9	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.35	C	S	.	.	I	π-helix	trans	-62.5	-50.4	-166.5	-61.5	0	0	0	0	113.8	C41 F43 V50 F52 A100 V101 Q107 E108 Y109	C41-C105 HydrophobicContact CB-CB 3.63Å; C41-C105 WeakPolarHBondContact CB-SG 3.25Å; C41-C105 WeakPolarHBondContact SG-CA 3.45Å; C41-C105 WeakPolarHBondContact SG-CB 3.33Å; C41-C105 CovalentContact SG-SG 2.03Å; C41-C105 PolarHBondContact SG-SG 2.02Å; F43-C105 HydrophobicContact CE1-CB 4Å; F43-C105 WeakPolarHBondContact CE1-O 3.39Å; F43-C105 HydrophobicContact CZ-CB 3.93Å; F43-C105 VanDerWaalsContact CZ-O 3.31Å; F43-C105 WeakPolarHBondContact CZ-O 3.48Å; V50-C105 HydrophobicContact CG1-CB 3.49Å; V50-C105 VanDerWaalsContact CG1-CB 3.49Å; F52-C105 WeakPolarHBondContact CD2-SG 3.44Å; A100-C105 PolarHBondContact O-N 2.79Å; A100-C105 VanDerWaalsContact O-N 3.11Å; V101-C105 WeakPolarHBondContact O-CB 3.39Å; C105-Q107 VanDerWaalsContact C-N 3.31Å; C105-Q107 PolarHBondContact O-N 3.41Å; C105-E108 PolarHBondContact O-N 2.98Å; C105-Y109 WeakPolarHBondContact O-CB 3.34Å; C105-Y109 PolarHBondContact O-N 2.87Å
106	R	96.8	Very high	95.7	Very high	62 Å²	62	65.4 Å²	65.4	23%	0.234	33%	0.333	C	S	.	.	I	π-helix	trans	-68.7	-31.5	-179.7	-69.3	-175.6	176.2	97.3	5.8	112.6	T47 E48 V50 V101 N102 V104 K110	T47-R106 PolarHBondContact O-NE 3.5Å; T47-R106 PolarHBondContact O-NH2 3.11Å; E48-R106 PolarHBondContact O-NH2 2.98Å; V50-R106 HydrophobicContact CG2-CG 4.2Å; V101-R106 PolarHBondContact O-N 2.87Å; N102-R106 WeakPolarHBondContact OD1-CD 3.33Å; N102-R106 PolarHBondContact OD1-NH1 3Å; V104-R106 PolarHBondContact O-N 2.84Å; R106-K110 WeakPolarHBondContact O-CG 3.23Å; R106-K110 PolarHBondContact O-N 2.92Å
107	Q	94.9	Very high	95.5	Very high	109 Å²	109	65.7 Å²	65.7	51%	0.509	34%	0.335	S	S	.	.	H	α-helix	trans	-69.8	-48.6	175.7	-177	169	-33.5	0	0	111.1	N102 M103 V104 C105 Y109 K110 L111	N102-Q107 PolarHBondContact O-N 2.95Å; M103-Q107 WeakPolarHBondContact O-CB 3.16Å; M103-Q107 PolarHBondContact O-OE1 3.04Å; V104-Q107 PolarHBondContact O-N 2.88Å; C105-Q107 VanDerWaalsContact C-N 3.31Å; C105-Q107 PolarHBondContact O-N 3.41Å; Q107-Y109 VanDerWaalsContact C-N 3.32Å; Q107-Y109 PolarHBondContact O-N 3.4Å; Q107-K110 PolarHBondContact O-N 2.94Å; Q107-L111 PolarHBondContact O-N 2.95Å
108	E	94.8	Very high	95.3	Very high	107 Å²	107	70.3 Å²	70.3	50%	0.5	35%	0.354	S	S	.	.	H	α-helix	trans	-63.9	-36.1	176.5	-71	-56.5	144.8	0	0	112.1	V104 C105 K110 L111 G112	V104-E108 HydrophobicContact CG1-CG 4.25Å; V104-E108 WeakPolarHBondContact O-CB 3.43Å; V104-E108 VanDerWaalsContact O-CG 3.31Å; V104-E108 WeakPolarHBondContact O-CG 3.38Å; V104-E108 PolarHBondContact O-N 2.93Å; C105-E108 PolarHBondContact O-N 2.98Å; E108-K110 VanDerWaalsContact C-N 3.34Å; E108-K110 PolarHBondContact O-N 3.42Å; E108-L111 PolarHBondContact O-N 3.02Å; E108-G112 WeakPolarHBondContact O-CA 3.28Å; E108-G112 PolarHBondContact O-N 2.74Å
109	Y	96.5	Very high	95.2	Very high	50 Å²	50	67.8 Å²	67.8	20%	0.196	34%	0.344	C	S	.	.	H	α-helix	trans	-60	-44.3	173.7	-171.4	-84.3	0	0	0	111.7	F43 T47 C105 Q107 L111 G112 A113 V117	F43-Y109 HydrophobicContact CB-CD2 4.34Å; F43-Y109 HydrophobicContact CB-CE2 4.14Å; F43-Y109 AromaticContact CD1-CD2 3.47Å; F43-Y109 HydrophobicContact CD1-CD2 3.47Å; F43-Y109 VanDerWaalsContact CD1-CD2 3.47Å; F43-Y109 HydrophobicContact CD1-CE2 4.06Å; F43-Y109 HydrophobicContact CD1-CG 4.19Å; F43-Y109 AromaticContact CD2-CD2 3.85Å; F43-Y109 HydrophobicContact CD2-CD2 3.85Å; F43-Y109 HydrophobicContact CD2-CE2 4.32Å; F43-Y109 AromaticContact CE1-CD2 3.61Å; F43-Y109 HydrophobicContact CE1-CD2 3.61Å; F43-Y109 AromaticContact CE1-CG 3.99Å; F43-Y109 HydrophobicContact CE1-CG 3.99Å; F43-Y109 AromaticContact CE2-CD2 3.95Å; F43-Y109 HydrophobicContact CE2-CD2 3.95Å; F43-Y109 AromaticContact CG-CD2 3.61Å; F43-Y109 HydrophobicContact CG-CD2 3.61Å; F43-Y109 AromaticContact CG-CE2 3.91Å; F43-Y109 HydrophobicContact CG-CE2 3.91Å; F43-Y109 AromaticContact CZ-CD2 3.83Å; F43-Y109 HydrophobicContact CZ-CD2 3.83Å; F43-Y109 HydrophobicContact CZ-CG 4.31Å; T47-Y109 HydrophobicContact CG2-CD1 3.27Å; T47-Y109 HydrophobicContact CG2-CD2 4.33Å; T47-Y109 HydrophobicContact CG2-CE1 3.76Å; T47-Y109 HydrophobicContact CG2-CG 3.59Å; C105-Y109 WeakPolarHBondContact O-CB 3.34Å; C105-Y109 PolarHBondContact O-N 2.87Å; Q107-Y109 VanDerWaalsContact C-N 3.32Å; Q107-Y109 PolarHBondContact O-N 3.4Å; Y109-L111 VanDerWaalsContact C-N 3.3Å; Y109-L111 PolarHBondContact O-N 3.35Å; Y109-G112 PolarHBondContact O-N 2.86Å; Y109-A113 HydrophobicContact CD1-CB 4.12Å; Y109-A113 HydrophobicContact CE1-CB 3.94Å; Y109-A113 WeakPolarHBondContact O-CA 3.46Å; Y109-A113 WeakPolarHBondContact O-CB 3.29Å; Y109-A113 PolarHBondContact O-N 2.95Å; Y109-V117 HydrophobicContact CE2-CG2 3.98Å
110	K	94.5	Very high	95.2	Very high	160 Å²	160	69.8 Å²	69.8	70%	0.696	35%	0.349	S	S	*	.	H	α-helix	trans	-62.8	-38.7	178.7	-72.1	173.9	-176.3	-178	0	112.3	R106 Q107 E108	R106-K110 WeakPolarHBondContact O-CG 3.23Å; R106-K110 PolarHBondContact O-N 2.92Å; Q107-K110 PolarHBondContact O-N 2.94Å; E108-K110 VanDerWaalsContact C-N 3.34Å; E108-K110 PolarHBondContact O-N 3.42Å
111	L	95.2	Very high	95.2	Very high	97 Å²	97	71.4 Å²	71.4	51%	0.508	36%	0.359	S	S	.	.	H	α-helix	trans	-71.5	-46.7	176.8	-64.2	174.6	0	0	0	110.1	Q107 E108 Y109 P114 F115	Q107-L111 PolarHBondContact O-N 2.95Å; E108-L111 PolarHBondContact O-N 3.02Å; Y109-L111 VanDerWaalsContact C-N 3.3Å; Y109-L111 PolarHBondContact O-N 3.35Å; L111-P114 WeakPolarHBondContact O-CD 3.14Å; L111-F115 WeakPolarHBondContact O-CE1 3.4Å; L111-F115 WeakPolarHBondContact O-CE2 3.42Å; L111-F115 WeakPolarHBondContact O-CZ 3.48Å
112	G	94.4	Very high	95.2	Very high	14 Å²	14	73.9 Å²	73.9	14%	0.144	38%	0.375	C	S	.	.	H	α-helix	trans	-75.9	-30.8	-172.3	0	0	0	0	0	116.5	E108 Y109 F115 T116	E108-G112 WeakPolarHBondContact O-CA 3.28Å; E108-G112 PolarHBondContact O-N 2.74Å; Y109-G112 PolarHBondContact O-N 2.86Å; G112-F115 VanDerWaalsContact CA-CE2 3.41Å; G112-F115 WeakPolarHBondContact O-CD2 3.33Å; G112-F115 PolarHBondContact O-N 3Å; G112-T116 WeakPolarHBondContact O-CB 3.22Å; G112-T116 WeakPolarHBondContact O-CG2 2.99Å; G112-T116 PolarHBondContact O-N 2.95Å; G112-T116 PolarHBondContact O-OG1 2.93Å
113	A	94.9	Very high	95.2	Very high	3 Å²	3	70 Å²	70	3%	0.025	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-56.2	-45.5	-169.7	0	0	0	0	0	113.8	Y109 F115 T116 V117 E118	Y109-A113 HydrophobicContact CD1-CB 4.12Å; Y109-A113 HydrophobicContact CE1-CB 3.94Å; Y109-A113 WeakPolarHBondContact O-CA 3.46Å; Y109-A113 WeakPolarHBondContact O-CB 3.29Å; Y109-A113 PolarHBondContact O-N 2.95Å; A113-F115 PolarHBondContact O-N 3.29Å; A113-F115 VanDerWaalsContact O-N 3.08Å; A113-T116 CarbonylContact O-C 3.58Å; A113-T116 PolarHBondContact O-N 2.77Å; A113-T116 VanDerWaalsContact O-N 3.09Å; A113-V117 HydrophobicContact CB-CG2 3.74Å; A113-V117 PolarHBondContact O-N 3.39Å; A113-E118 HydrophobicContact CB-CG 4.14Å; A113-E118 WeakPolarHBondContact O-CB 3.39Å; A113-E118 PolarHBondContact O-N 3.14Å
114	P	94.2	Very high	95.4	Very high	74 Å²	74	71.3 Å²	71.3	48%	0.481	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-59.5	-24.6	-178.9	-26.9	36.8	0	0	0	115	L111	L111-P114 WeakPolarHBondContact O-CD 3.14Å
115	F	91.9	Very high	95.5	Very high	124 Å²	124	69.9 Å²	69.9	54%	0.544	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-111.8	2.4	-179.8	26.1	-91.5	0	0	0	113.7	L111 G112 A113 R119	L111-F115 WeakPolarHBondContact O-CE1 3.4Å; L111-F115 WeakPolarHBondContact O-CE2 3.42Å; L111-F115 WeakPolarHBondContact O-CZ 3.48Å; G112-F115 VanDerWaalsContact CA-CE2 3.41Å; G112-F115 WeakPolarHBondContact O-CD2 3.33Å; G112-F115 PolarHBondContact O-N 3Å; A113-F115 PolarHBondContact O-N 3.29Å; A113-F115 VanDerWaalsContact O-N 3.08Å; F115-R119 VanDerWaalsContact O-CD 3.29Å; F115-R119 WeakPolarHBondContact O-CD 3.47Å
116	T	93.2	Very high	95.6	Very high	40 Å²	40	73 Å²	73	25%	0.245	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-96.1	177.7	61.1	0	0	0	0	110.8	G112 A113 E118 R119 Y149 W179	G112-T116 WeakPolarHBondContact O-CB 3.22Å; G112-T116 WeakPolarHBondContact O-CG2 2.99Å; G112-T116 PolarHBondContact O-N 2.95Å; G112-T116 PolarHBondContact O-OG1 2.93Å; A113-T116 CarbonylContact O-C 3.58Å; A113-T116 PolarHBondContact O-N 2.77Å; A113-T116 VanDerWaalsContact O-N 3.09Å; T116-E118 VanDerWaalsContact C-N 3.33Å; T116-E118 PolarHBondContact O-N 3.47Å; T116-R119 WeakPolarHBondContact O-CB 3.19Å; T116-R119 PolarHBondContact O-N 2.92Å; T116-R119 VanDerWaalsContact O-N 3.17Å; T116-Y149 VanDerWaalsContact O-CE1 3.26Å; T116-Y149 WeakPolarHBondContact O-CE1 3.34Å; T116-Y149 PolarHBondContact O-OH 3.31Å; T116-W179 HydrophobicContact CG2-CZ3 3.9Å
117	V	92.4	Very high	95.6	Very high	90 Å²	90	71 Å²	71	55%	0.545	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-26	-172.1	-67.1	0	0	0	0	114.7	Y109 A113	Y109-V117 HydrophobicContact CE2-CG2 3.98Å; A113-V117 HydrophobicContact CB-CG2 3.74Å; A113-V117 PolarHBondContact O-N 3.39Å
118	E	92.9	Very high	95.7	Very high	120 Å²	120	70 Å²	70	56%	0.561	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-9.6	176.6	-63.5	172.2	-178.9	0	0	112.5	A113 T116 N120	A113-E118 HydrophobicContact CB-CG 4.14Å; A113-E118 WeakPolarHBondContact O-CB 3.39Å; A113-E118 PolarHBondContact O-N 3.14Å; T116-E118 VanDerWaalsContact C-N 3.33Å; T116-E118 PolarHBondContact O-N 3.47Å; E118-N120 PolarHBondContact O-N 3.24Å
119	R	95.2	Very high	95.7	Very high	59 Å²	59	66.4 Å²	66.4	22%	0.223	34%	0.343	C	S	.	.			trans	-71.9	124.8	-179.3	-179.7	178.8	174.5	-116	7.1	109	F115 T116 V121 Y149 W179	F115-R119 VanDerWaalsContact O-CD 3.29Å; F115-R119 WeakPolarHBondContact O-CD 3.47Å; T116-R119 WeakPolarHBondContact O-CB 3.19Å; T116-R119 PolarHBondContact O-N 2.92Å; T116-R119 VanDerWaalsContact O-N 3.17Å; R119-V121 HydrophobicContact CG-CG2 4.29Å; R119-Y149 HydrophobicContact CB-CD1 4.01Å; R119-Y149 HydrophobicContact CB-CE1 3.85Å; R119-Y149 HydrophobicContact CG-CD1 3.83Å; R119-Y149 HydrophobicContact CG-CE1 4.13Å; R119-Y149 VanDerWaalsContact NH1-CG 3.25Å; R119-Y149 WeakPolarHBondContact O-CD1 3.39Å; R119-Y149 VanDerWaalsContact O-CE1 3.29Å; R119-Y149 WeakPolarHBondContact O-CE1 3.3Å; R119-W179 PolarHBondContact NH1-O 3.2Å
120	N	96.8	Very high	95.6	Very high	83 Å²	83	68.8 Å²	68.8	44%	0.444	36%	0.356	S	S	.	.			trans	-127.1	128.1	168.8	-70.1	-50.8	0	0	0	109.1	E118 Y149 P150	E118-N120 PolarHBondContact O-N 3.24Å; N120-Y149 CarbonylContact C-O 3.6Å; N120-Y149 WeakPolarHBondContact CA-O 3.37Å; N120-P150 VanDerWaalsContact OD1-CD 3.28Å; N120-P150 WeakPolarHBondContact OD1-CD 3.43Å
121	V	97.6	Very high	95.4	Very high	40 Å²	40	69.3 Å²	69.3	24%	0.242	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-121.2	114.8	173.8	-175.3	0	0	0	0	106.9	R119 D147 F148 Y149 H203	R119-V121 HydrophobicContact CG-CG2 4.29Å; V121-D147 WeakPolarHBondContact CG1-O 3.45Å; V121-F148 WeakPolarHBondContact O-CA 3.46Å; V121-Y149 PolarHBondContact N-O 3.38Å; V121-Y149 PolarHBondContact O-N 3.08Å; V121-H203 PolarHBondContact O-CE1 3.06Å
122	P	98	Very high	95	Very high	70 Å²	70	68.8 Å²	68.8	46%	0.455	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-67.6	145.9	179.7	27.8	-33.6	0	0	0	111	L206	P122-L206 HydrophobicContact CB-CD2 3.75Å; P122-L206 HydrophobicContact CB-CG 4.46Å
123	P	98.3	Very high	94.6	Very high	16 Å²	16	69.5 Å²	69.5	10%	0.104	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-71.3	153.2	174.9	26.3	-32.7	0	0	0	113.2	V125 V145 T146 F148 I153 V201 H203 L206	P123-V125 HydrophobicContact CB-CG2 4.33Å; P123-V125 HydrophobicContact CG-CG2 4.34Å; P123-V145 HydrophobicContact CB-CG1 3.41Å; P123-V145 VanDerWaalsContact CB-CG1 3.41Å; P123-V145 HydrophobicContact CG-CG1 4.07Å; P123-T146 WeakPolarHBondContact CA-O 3.26Å; P123-F148 HydrophobicContact CB-CB 3.73Å; P123-F148 HydrophobicContact CB-CD1 4.01Å; P123-F148 HydrophobicContact CB-CG 4.17Å; P123-F148 HydrophobicContact CG-CB 4.32Å; P123-I153 HydrophobicContact CG-CD1 4.41Å; P123-V201 HydrophobicContact CG-CG1 4.07Å; P123-H203 HydrophobicContact CG-CB 4.28Å; P123-L206 HydrophobicContact CG-CD1 3.99Å; P123-L206 HydrophobicContact CG-CD2 4.45Å; P123-L206 HydrophobicContact CG-CG 4.31Å
124	E	97.7	Very high	94.2	Very high	129 Å²	129	73.8 Å²	73.8	60%	0.603	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.7	156.1	-174.6	170.8	-172.2	0	0	109.2	V145 T146	E124-V145 WeakPolarHBondContact O-CA 3.33Å; E124-T146 PolarHBondContact N-O 2.8Å; E124-T146 PolarHBondContact O-N 3.28Å
125	V	98.6	Very high	93.8	Very high	21 Å²	21	73.9 Å²	73.9	13%	0.127	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	120	-174.2	-175	0	0	0	0	109.4	P123 S144 V145 V201 V210 V212	P123-V125 HydrophobicContact CB-CG2 4.33Å; P123-V125 HydrophobicContact CG-CG2 4.34Å; V125-S144 WeakPolarHBondContact CA-O 3.44Å; V125-V145 HydrophobicContact CG1-CG2 4.46Å; V125-V145 HydrophobicContact CG2-CG1 4.32Å; V125-V201 HydrophobicContact CG1-CG2 3.88Å; V125-V201 HydrophobicContact CG2-CB 4.11Å; V125-V201 HydrophobicContact CG2-CG1 4.28Å; V125-V201 HydrophobicContact CG2-CG2 3.82Å; V125-V210 HydrophobicContact CG2-CG1 4.45Å; V125-V212 HydrophobicContact CB-CG2 3.93Å; V125-V212 HydrophobicContact CG1-CB 4.2Å; V125-V212 HydrophobicContact CG1-CG2 3.67Å
126	T	98.1	Very high	93.5	Very high	64 Å²	64	75.8 Å²	75.8	39%	0.393	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133	177.5	-54.3	0	0	0	0	110.4	Y128 C143 S144	T126-Y128 HydrophobicContact CG2-CD1 3.99Å; T126-C143 WeakPolarHBondContact O-CA 3.29Å; T126-S144 PolarHBondContact N-O 2.71Å; T126-S144 PolarHBondContact O-N 2.92Å
127	V	98.1	Very high	93.4	Very high	20 Å²	20	79.1 Å²	79.1	12%	0.121	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.2	175	176.3	0	0	0	0	110.5	L141 L142 C143 W157 C199 V212 W214	V127-L141 HydrophobicContact CG1-CD1 3.91Å; V127-L141 HydrophobicContact CG1-CD2 3.95Å; V127-L141 HydrophobicContact CG1-CG 3.84Å; V127-L142 VanDerWaalsContact CA-O 3.27Å; V127-L142 WeakPolarHBondContact CA-O 3.36Å; V127-C143 HydrophobicContact CG2-CB 4.24Å; V127-W157 HydrophobicContact CG1-CH2 3.67Å; V127-W157 HydrophobicContact CG1-CZ3 4.25Å; V127-W157 HydrophobicContact CG2-CH2 4.08Å; V127-C199 HydrophobicContact CG2-CB 3.63Å; V127-V212 HydrophobicContact CB-CG1 3.99Å; V127-V212 HydrophobicContact CG2-CB 3.89Å; V127-V212 HydrophobicContact CG2-CG1 3.76Å; V127-W214 HydrophobicContact CG1-CB 3.64Å; V127-W214 HydrophobicContact CG1-CG 4.41Å
128	Y	95.8	Very high	93.5	Very high	90 Å²	90	80.2 Å²	80.2	35%	0.353	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	150.3	179.5	58.2	-84.5	0	0	0	111.5	T126 L142	T126-Y128 HydrophobicContact CG2-CD1 3.99Å; Y128-L142 HydrophobicContact CD2-CB 4.29Å; Y128-L142 HydrophobicContact CE1-CB 4.2Å; Y128-L142 HydrophobicContact CE2-CB 3.9Å; Y128-L142 HydrophobicContact CE2-CD2 3.71Å; Y128-L142 HydrophobicContact CE2-CG 4.34Å; Y128-L142 PolarHBondContact N-O 2.9Å; Y128-L142 PolarHBondContact O-N 3.07Å
129	P	95.6	Very high	93.5	Very high	31 Å²	31	74.9 Å²	74.9	20%	0.201	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	148.3	174.1	34.1	-35.7	0	0	0	110.7	R131 P133 L140 L141 M189	P129-R131 VanDerWaalsContact C-N 3.25Å; P129-R131 WeakPolarHBondContact CB-O 3.28Å; P129-R131 PolarHBondContact O-N 2.85Å; P129-P133 HydrophobicContact CG-CG 4.36Å; P129-L140 CarbonylContact C-O 3.58Å; P129-L140 WeakPolarHBondContact CA-O 3.31Å; P129-L141 HydrophobicContact CB-CD1 4.24Å; P129-M189 HydrophobicContact CB-CE 4.45Å
130	E	93.8	Very high	93.6	Very high	99 Å²	99	73.5 Å²	73.5	46%	0.463	37%	0.369	S	S	.	.	S	Bend	trans	-60.6	-39.6	175.7	-173	-162.2	-131.1	0	0	111	L140 L142	E130-L140 HydrophobicContact CB-CB 3.92Å; E130-L140 PolarHBondContact N-O 2.61Å; E130-L142 HydrophobicContact CB-CD1 3.85Å
131	R	91.2	Very high	93.6	Very high	172 Å²	172	69.5 Å²	69.5	65%	0.649	35%	0.348	S	S	*	.	S	Bend	trans	-132.6	165.2	-178.7	-58.3	179.3	-164.2	165.8	6.1	110.5	P129 P133 N139	P129-R131 VanDerWaalsContact C-N 3.25Å; P129-R131 WeakPolarHBondContact CB-O 3.28Å; P129-R131 PolarHBondContact O-N 2.85Å; R131-P133 WeakPolarHBondContact O-CD 3.47Å; R131-P133 VanDerWaalsContact O-N 3.13Å; R131-N139 PolarHBondContact N-OD1 3.03Å; R131-N139 PolarHBondContact O-ND2 2.78Å
132	T	87.3	Confident	93.6	Very high	85 Å²	85	68.7 Å²	68.7	52%	0.521	34%	0.342	S	S	.	.			trans	-50.6	121.2	172.7	-54.7	0	0	0	0	110.5	L134 E219	T132-L134 PolarHBondContact O-N 3.35Å; T132-E219 VanDerWaalsContact CG2-OE1 3.24Å; T132-E219 WeakPolarHBondContact CG2-OE1 3.12Å
133	P	84.9	Confident	93.6	Very high	30 Å²	30	65.4 Å²	65.4	20%	0.195	32%	0.321	C	S	.	.			trans	-76.2	125.7	-174.1	30	-34.1	0	0	0	111.1	P129 R131 N139 W214	P129-P133 HydrophobicContact CG-CG 4.36Å; R131-P133 WeakPolarHBondContact O-CD 3.47Å; R131-P133 VanDerWaalsContact O-N 3.13Å; P133-N139 WeakPolarHBondContact CA-ND2 3.5Å; P133-W214 HydrophobicContact CB-CH2 4.14Å; P133-W214 HydrophobicContact CB-CZ2 3.88Å; P133-W214 HydrophobicContact CG-CZ2 3.88Å
134	L	86.5	Confident	93.6	Very high	93 Å²	93	65.5 Å²	65.5	49%	0.487	32%	0.322	S	S	.	.			trans	-111.7	136.5	169.1	-64.4	176.6	0	0	0	108.8	T132 Q137	T132-L134 PolarHBondContact O-N 3.35Å; L134-Q137 HydrophobicContact CB-CB 4.02Å; L134-Q137 VanDerWaalsContact CD1-OE1 3.25Å; L134-Q137 PolarHBondContact O-N 3.01Å
135	L	85.2	Confident	93.7	Very high	75 Å²	75	59.4 Å²	59.4	39%	0.393	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	141.8	178.4	-65.1	177.4	0	0	0	110.3	Q137 L193	L135-Q137 PolarHBondContact O-N 3.22Å; L135-Q137 VanDerWaalsContact O-N 3.11Å; L135-L193 HydrophobicContact CD1-CB 4.04Å; L135-L193 HydrophobicContact CD1-CD1 4.34Å; L135-L193 HydrophobicContact CD2-CB 4.3Å
136	Q	86.8	Confident	93.7	Very high	164 Å²	164	59.5 Å²	59.5	77%	0.766	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	14.4	-179.2	-58.1	179.1	-23	0	0	115.1	P191	Q136-P191 PolarHBondContact N-O 2.67Å
137	Q	91.4	Very high	93.6	Very high	110 Å²	110	60 Å²	60	51%	0.514	30%	0.295	S	S	.	.	S	Bend	trans	-111.7	139.4	173.6	-173	170.5	-25.2	0	0	110.4	L134 L135 N139 P191	L134-Q137 HydrophobicContact CB-CB 4.02Å; L134-Q137 VanDerWaalsContact CD1-OE1 3.25Å; L134-Q137 PolarHBondContact O-N 3.01Å; L135-Q137 PolarHBondContact O-N 3.22Å; L135-Q137 VanDerWaalsContact O-N 3.11Å; Q137-N139 PolarHBondContact O-N 2.81Å; Q137-P191 WeakPolarHBondContact O-CD 3.34Å
138	H	93.8	Very high	93.6	Very high	113 Å²	113	59.1 Å²	59.1	52%	0.523	29%	0.289	S	S	.	.			trans	-59.3	131.6	175.3	178.9	81.9	0	0	0	111.2	M189 I190	H138-M189 WeakPolarHBondContact CA-O 3.42Å; H138-I190 HydrophobicContact CB-CG1 4.49Å
139	N	93.4	Very high	93.7	Very high	9 Å²	9	56.7 Å²	56.7	5%	0.048	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	167.8	175.2	-156.6	-8.9	0	0	0	109.5	R131 P133 Q137 M189	R131-N139 PolarHBondContact N-OD1 3.03Å; R131-N139 PolarHBondContact O-ND2 2.78Å; P133-N139 WeakPolarHBondContact CA-ND2 3.5Å; Q137-N139 PolarHBondContact O-N 2.81Å; N139-M189 HydrophobicContact CB-CE 4.23Å; N139-M189 PolarHBondContact N-O 3.31Å; N139-M189 WeakPolarHBondContact O-CG 3Å; N139-M189 PolarHBondContact O-N 3.43Å; N139-M189 VanDerWaalsContact O-O 3.11Å
140	L	96.2	Very high	93.8	Very high	29 Å²	29	57.1 Å²	57.1	15%	0.152	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.1	178.6	-164.6	70.3	0	0	0	109	P129 E130 L142 M186 E188	P129-L140 CarbonylContact C-O 3.58Å; P129-L140 WeakPolarHBondContact CA-O 3.31Å; E130-L140 HydrophobicContact CB-CB 3.92Å; E130-L140 PolarHBondContact N-O 2.61Å; L140-L142 HydrophobicContact CB-CD1 4.21Å; L140-L142 HydrophobicContact CD2-CD1 3.89Å; L140-L142 HydrophobicContact CG-CD1 3.87Å; L140-M186 HydrophobicContact CD1-CB 3.94Å; L140-M186 HydrophobicContact CD2-CB 4.09Å; L140-M186 HydrophobicContact CD2-CG 3.83Å; L140-M186 HydrophobicContact CD2-SD 3.9Å; L140-M186 HydrophobicContact CG-CB 4.04Å; L140-M186 HydrophobicContact CG-CG 4.2Å; L140-E188 HydrophobicContact CD1-CG 3.96Å
141	L	97	Very high	93.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127	173.4	-163.9	67.8	0	0	0	109.4	V127 P129 W157 M186 L187 M189 Y197 W214	V127-L141 HydrophobicContact CG1-CD1 3.91Å; V127-L141 HydrophobicContact CG1-CD2 3.95Å; V127-L141 HydrophobicContact CG1-CG 3.84Å; P129-L141 HydrophobicContact CB-CD1 4.24Å; L141-W157 HydrophobicContact CB-CH2 4.25Å; L141-W157 HydrophobicContact CB-CZ2 4.42Å; L141-W157 HydrophobicContact CD2-CE3 4.4Å; L141-W157 HydrophobicContact CD2-CH2 3.37Å; L141-W157 HydrophobicContact CD2-CZ2 4.28Å; L141-W157 HydrophobicContact CD2-CZ3 3.45Å; L141-W157 VanDerWaalsContact CD2-CZ3 3.45Å; L141-W157 HydrophobicContact CG-CH2 3.6Å; L141-W157 HydrophobicContact CG-CZ2 4.19Å; L141-W157 HydrophobicContact CG-CZ3 4.21Å; L141-M186 CarbonylContact O-C 3.55Å; L141-M186 VanDerWaalsContact O-CA 3.28Å; L141-M186 WeakPolarHBondContact O-CA 3.49Å; L141-L187 HydrophobicContact CB-CB 4.47Å; L141-L187 PolarHBondContact N-O 3.29Å; L141-L187 PolarHBondContact O-N 2.85Å; L141-M189 HydrophobicContact CB-CE 3.88Å; L141-M189 HydrophobicContact CB-CG 4.43Å; L141-M189 HydrophobicContact CB-SD 3.96Å; L141-M189 HydrophobicContact CD1-CE 3.89Å; L141-M189 HydrophobicContact CD2-SD 4.3Å; L141-M189 HydrophobicContact CG-CE 4.35Å; L141-Y197 VanDerWaalsContact CD2-CB 3.41Å; L141-Y197 HydrophobicContact CD2-CD1 4.44Å; L141-Y197 HydrophobicContact CD2-CG 3.92Å; L141-W214 HydrophobicContact CD1-CB 4.27Å; L141-W214 HydrophobicContact CD1-CD2 3.76Å; L141-W214 HydrophobicContact CD1-CE3 4.01Å; L141-W214 HydrophobicContact CD1-CG 3.85Å; L141-W214 HydrophobicContact CD2-CB 4.24Å; L141-W214 HydrophobicContact CD2-CD2 4.4Å; L141-W214 HydrophobicContact CD2-CE3 4.05Å; L141-W214 HydrophobicContact CD2-CG 4.5Å
142	L	98.3	Very high	94.2	Very high	23 Å²	23	51.1 Å²	51.1	12%	0.12	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128	-176.9	-78.1	68.9	0	0	0	109.2	V127 Y128 E130 L140 T184 M186	V127-L142 VanDerWaalsContact CA-O 3.27Å; V127-L142 WeakPolarHBondContact CA-O 3.36Å; Y128-L142 HydrophobicContact CD2-CB 4.29Å; Y128-L142 HydrophobicContact CE1-CB 4.2Å; Y128-L142 HydrophobicContact CE2-CB 3.9Å; Y128-L142 HydrophobicContact CE2-CD2 3.71Å; Y128-L142 HydrophobicContact CE2-CG 4.34Å; Y128-L142 PolarHBondContact N-O 2.9Å; Y128-L142 PolarHBondContact O-N 3.07Å; E130-L142 HydrophobicContact CB-CD1 3.85Å; L140-L142 HydrophobicContact CB-CD1 4.21Å; L140-L142 HydrophobicContact CD2-CD1 3.89Å; L140-L142 HydrophobicContact CG-CD1 3.87Å; L142-T184 HydrophobicContact CB-CG2 4.1Å; L142-T184 HydrophobicContact CD2-CG2 4.1Å; L142-T184 HydrophobicContact CG-CG2 4.07Å; L142-M186 HydrophobicContact CD1-CG 4.24Å; L142-M186 HydrophobicContact CG-CG 3.88Å
143	C	98.5	Very high	94.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	102.3	163.7	-176.5	0	0	0	0	108.1	T126 V127 W157 T184 V185 C199	T126-C143 WeakPolarHBondContact O-CA 3.29Å; V127-C143 HydrophobicContact CG2-CB 4.24Å; C143-W157 HydrophobicContact CB-CH2 3.98Å; C143-W157 HydrophobicContact CB-CZ2 3.44Å; C143-W157 VanDerWaalsContact CB-CZ2 3.44Å; C143-T184 WeakPolarHBondContact O-CA 3.32Å; C143-V185 PolarHBondContact N-O 2.71Å; C143-V185 PolarHBondContact O-N 3.32Å; C143-C199 HydrophobicContact CB-CB 3.58Å; C143-C199 WeakPolarHBondContact CB-SG 3.33Å; C143-C199 WeakPolarHBondContact SG-CB 3.41Å; C143-C199 CovalentContact SG-SG 2.02Å; C143-C199 PolarHBondContact SG-SG 2.03Å
144	S	98.4	Very high	95.3	Very high	19 Å²	19	49.7 Å²	49.7	13%	0.133	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.6	177.1	-173.8	0	0	0	0	108.9	V125 T126 T146	V125-S144 WeakPolarHBondContact CA-O 3.44Å; T126-S144 PolarHBondContact N-O 2.71Å; T126-S144 PolarHBondContact O-N 2.92Å; S144-T146 WeakPolarHBondContact OG-CG2 3.46Å
145	V	98.6	Very high	95.9	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	107.7	-179	-171.7	0	0	0	0	107.6	P123 E124 V125 F148 I153 V155 Q182 T183 V201	P123-V145 HydrophobicContact CB-CG1 3.41Å; P123-V145 VanDerWaalsContact CB-CG1 3.41Å; P123-V145 HydrophobicContact CG-CG1 4.07Å; E124-V145 WeakPolarHBondContact O-CA 3.33Å; V125-V145 HydrophobicContact CG1-CG2 4.46Å; V125-V145 HydrophobicContact CG2-CG1 4.32Å; V145-F148 HydrophobicContact CB-CE1 4.35Å; V145-F148 HydrophobicContact CG1-CD1 3.9Å; V145-F148 HydrophobicContact CG1-CE1 3.89Å; V145-F148 WeakPolarHBondContact O-CE1 3.5Å; V145-I153 HydrophobicContact CG1-CD1 3.53Å; V145-V155 HydrophobicContact CG2-CG1 4.43Å; V145-V155 HydrophobicContact CG2-CG2 4.13Å; V145-Q182 CarbonylContact O-C 3.46Å; V145-Q182 VanDerWaalsContact O-CA 3.23Å; V145-Q182 WeakPolarHBondContact O-CA 3.37Å; V145-Q182 WeakPolarHBondContact O-CB 3.42Å; V145-T183 HydrophobicContact CB-CG2 4.18Å; V145-T183 PolarHBondContact N-O 3.45Å; V145-T183 PolarHBondContact O-N 3.45Å; V145-V201 HydrophobicContact CG1-CG1 4.15Å; V145-V201 HydrophobicContact CG2-CG2 3.91Å
146	T	98.1	Very high	96.5	Very high	23 Å²	23	46.6 Å²	46.6	14%	0.141	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	154.9	-165.6	55.9	0	0	0	0	113.2	P123 E124 S144 F148 Q182	P123-T146 WeakPolarHBondContact CA-O 3.26Å; E124-T146 PolarHBondContact N-O 2.8Å; E124-T146 PolarHBondContact O-N 3.28Å; S144-T146 WeakPolarHBondContact OG-CG2 3.46Å; T146-F148 PolarHBondContact O-N 2.99Å; T146-Q182 HydrophobicContact CG2-CB 4.24Å
147	D	97.2	Very high	97.1	Very high	76 Å²	76	38.8 Å²	38.8	41%	0.406	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	57.1	36.8	166.2	-51.5	-32.7	0	0	0	116	V121 N176 F181	V121-D147 WeakPolarHBondContact CG1-O 3.45Å; D147-N176 PolarHBondContact OD1-ND2 3Å; D147-F181 PolarHBondContact N-O 2.83Å; D147-F181 VanDerWaalsContact N-O 3.08Å
148	F	98.1	Very high	97.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	159.2	-178.2	63.9	-91.2	0	0	0	114.1	V121 P123 V145 T146 P150 I153 L173 T180 F181 T183 H203	V121-F148 WeakPolarHBondContact O-CA 3.46Å; P123-F148 HydrophobicContact CB-CB 3.73Å; P123-F148 HydrophobicContact CB-CD1 4.01Å; P123-F148 HydrophobicContact CB-CG 4.17Å; P123-F148 HydrophobicContact CG-CB 4.32Å; V145-F148 HydrophobicContact CB-CE1 4.35Å; V145-F148 HydrophobicContact CG1-CD1 3.9Å; V145-F148 HydrophobicContact CG1-CE1 3.89Å; V145-F148 WeakPolarHBondContact O-CE1 3.5Å; T146-F148 PolarHBondContact O-N 2.99Å; F148-P150 WeakPolarHBondContact CD2-O 3.03Å; F148-I153 HydrophobicContact CD1-CD1 4.07Å; F148-I153 HydrophobicContact CD2-CD1 3.97Å; F148-I153 HydrophobicContact CE1-CD1 3.87Å; F148-I153 HydrophobicContact CE2-CB 3.93Å; F148-I153 HydrophobicContact CE2-CD1 3.78Å; F148-I153 HydrophobicContact CE2-CG1 4.48Å; F148-I153 HydrophobicContact CE2-CG2 3.85Å; F148-I153 HydrophobicContact CG-CD1 4.12Å; F148-I153 HydrophobicContact CZ-CB 4.27Å; F148-I153 HydrophobicContact CZ-CD1 3.74Å; F148-I153 HydrophobicContact CZ-CG2 3.79Å; F148-L173 HydrophobicContact CE2-CD1 3.93Å; F148-L173 HydrophobicContact CZ-CD1 3.7Å; F148-T180 CarbonylContact O-C 3.58Å; F148-T180 WeakPolarHBondContact O-CA 3.42Å; F148-F181 WeakPolarHBondContact CD1-O 3.43Å; F148-F181 HydrophobicContact CD2-CB 4.32Å; F148-F181 HydrophobicContact CE1-CB 4.45Å; F148-F181 WeakPolarHBondContact CE1-O 3.41Å; F148-F181 HydrophobicContact CE2-CB 3.91Å; F148-F181 HydrophobicContact CZ-CB 3.97Å; F148-F181 PolarHBondContact N-O 3.17Å; F148-F181 PolarHBondContact O-N 2.94Å; F148-T183 HydrophobicContact CE1-CG2 4.28Å; F148-T183 HydrophobicContact CZ-CG2 4.23Å; F148-H203 AromaticContact CD2-CD2 3.84Å; F148-H203 AromaticContact CD2-NE2 3.63Å
149	Y	98	Very high	97.5	Very high	40 Å²	40	33.6 Å²	33.6	16%	0.157	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-155.6	138.3	173.3	-179.1	-87.6	0	0	0	110.4	T116 R119 N120 V121 W179 F181 H203	T116-Y149 VanDerWaalsContact O-CE1 3.26Å; T116-Y149 WeakPolarHBondContact O-CE1 3.34Å; T116-Y149 PolarHBondContact O-OH 3.31Å; R119-Y149 HydrophobicContact CB-CD1 4.01Å; R119-Y149 HydrophobicContact CB-CE1 3.85Å; R119-Y149 HydrophobicContact CG-CD1 3.83Å; R119-Y149 HydrophobicContact CG-CE1 4.13Å; R119-Y149 VanDerWaalsContact NH1-CG 3.25Å; R119-Y149 WeakPolarHBondContact O-CD1 3.39Å; R119-Y149 VanDerWaalsContact O-CE1 3.29Å; R119-Y149 WeakPolarHBondContact O-CE1 3.3Å; N120-Y149 CarbonylContact C-O 3.6Å; N120-Y149 WeakPolarHBondContact CA-O 3.37Å; V121-Y149 PolarHBondContact N-O 3.38Å; V121-Y149 PolarHBondContact O-N 3.08Å; Y149-W179 WeakPolarHBondContact CD2-O 3.5Å; Y149-F181 HydrophobicContact CD2-CD2 4.22Å; Y149-F181 AromaticContact CD2-CE2 3.77Å; Y149-F181 HydrophobicContact CD2-CE2 3.77Å; Y149-F181 HydrophobicContact CE2-CE2 4.16Å; Y149-H203 PolarHBondContact O-CE1 2.84Å
150	P	97.4	Very high	97.7	Very high	39 Å²	39	37.5 Å²	37.5	25%	0.253	20%	0.197	S	C	.	.	S	Bend	cis	-71.4	175.9	1.8	32.3	-38.1	0	0	0	112.4	N120 F148 D152 H203 P204	N120-P150 VanDerWaalsContact OD1-CD 3.28Å; N120-P150 WeakPolarHBondContact OD1-CD 3.43Å; F148-P150 WeakPolarHBondContact CD2-O 3.03Å; P150-D152 VanDerWaalsContact C-N 3.26Å; P150-D152 PolarHBondContact O-N 3.24Å; P150-H203 PolarHBondContact O-NE2 2.91Å; P150-P204 HydrophobicContact CG-CG 4.36Å
151	G	96.4	Very high	97.6	Very high	18 Å²	18	39.3 Å²	39.3	19%	0.186	22%	0.223	C	C	.	.	S	Bend	trans	-74.5	-10.1	-177.9	0	0	0	0	0	115.3	I153 L173 F181	G151-I153 PolarHBondContact O-N 3.14Å; G151-L173 WeakPolarHBondContact O-CD1 3.37Å; G151-F181 VanDerWaalsContact CA-CD2 3.45Å
152	D	96.1	Very high	97.6	Very high	127 Å²	127	46.5 Å²	46.5	68%	0.679	26%	0.257	S	S	*	.			trans	-72	120.1	174.8	-173.1	66.2	0	0	0	110.1	P150 H203	P150-D152 VanDerWaalsContact C-N 3.26Å; P150-D152 PolarHBondContact O-N 3.24Å; D152-H203 PolarHBondContact O-CD2 3.3Å; D152-H203 VanDerWaalsContact O-CD2 3.24Å
153	I	98	Very high	97.6	Very high	39 Å²	39	48.7 Å²	48.7	20%	0.2	27%	0.266	C	S	.	.			trans	-154.4	144.8	-173.8	-164.8	163	0	0	0	110.6	P123 V145 F148 G151 V155 T183 V201 E202 H203	P123-I153 HydrophobicContact CG-CD1 4.41Å; V145-I153 HydrophobicContact CG1-CD1 3.53Å; F148-I153 HydrophobicContact CD1-CD1 4.07Å; F148-I153 HydrophobicContact CD2-CD1 3.97Å; F148-I153 HydrophobicContact CE1-CD1 3.87Å; F148-I153 HydrophobicContact CE2-CB 3.93Å; F148-I153 HydrophobicContact CE2-CD1 3.78Å; F148-I153 HydrophobicContact CE2-CG1 4.48Å; F148-I153 HydrophobicContact CE2-CG2 3.85Å; F148-I153 HydrophobicContact CG-CD1 4.12Å; F148-I153 HydrophobicContact CZ-CB 4.27Å; F148-I153 HydrophobicContact CZ-CD1 3.74Å; F148-I153 HydrophobicContact CZ-CG2 3.79Å; G151-I153 PolarHBondContact O-N 3.14Å; I153-V155 HydrophobicContact CD1-CG2 4.36Å; I153-V155 HydrophobicContact CG1-CG2 4.14Å; I153-T183 HydrophobicContact CG2-CG2 4.4Å; I153-V201 HydrophobicContact CD1-CG1 3.8Å; I153-V201 HydrophobicContact CG1-CG1 4.07Å; I153-E202 WeakPolarHBondContact CG1-O 3.48Å; I153-H203 HydrophobicContact CD1-CB 4.31Å; I153-H203 HydrophobicContact CG1-CB 4.19Å
154	S	98	Very high	97.5	Very high	47 Å²	47	51.5 Å²	51.5	33%	0.329	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.9	170.4	-168.3	0	0	0	0	109.8	V201 E202	S154-V201 WeakPolarHBondContact O-CA 3.31Å; S154-E202 PolarHBondContact N-O 2.96Å; S154-E202 PolarHBondContact O-N 3.21Å
155	V	98.4	Very high	97.5	Very high	29 Å²	29	59.8 Å²	59.8	18%	0.176	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	121.2	178.5	-175.7	0	0	0	0	108.2	V145 I153 T183 V185 C199 L200 V201	V145-V155 HydrophobicContact CG2-CG1 4.43Å; V145-V155 HydrophobicContact CG2-CG2 4.13Å; I153-V155 HydrophobicContact CD1-CG2 4.36Å; I153-V155 HydrophobicContact CG1-CG2 4.14Å; V155-T183 HydrophobicContact CG2-CG2 4.32Å; V155-V185 HydrophobicContact CB-CG2 3.74Å; V155-V185 HydrophobicContact CG1-CB 3.82Å; V155-V185 HydrophobicContact CG1-CG1 4.41Å; V155-V185 HydrophobicContact CG1-CG2 3.53Å; V155-V185 HydrophobicContact CG2-CG2 4.33Å; V155-C199 VanDerWaalsContact CG1-SG 3.54Å; V155-L200 WeakPolarHBondContact CA-O 3.48Å; V155-V201 HydrophobicContact CG1-CG2 4.28Å; V155-V201 HydrophobicContact CG2-CG2 4.32Å
156	R	98.3	Very high	97.4	Very high	73 Å²	73	64.1 Å²	64.1	28%	0.275	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.5	-175.4	-67	-173.7	-74.8	152.7	-7.3	111.1	F158 E163 L200 E202	R156-F158 HydrophobicContact CB-CE2 3.91Å; R156-E163 IonicContact NH1-OE2 3.6Å; R156-E163 PolarHBondContact NH1-OE2 3.36Å; R156-L200 PolarHBondContact N-O 3.11Å; R156-L200 PolarHBondContact O-N 3.32Å; R156-E202 IonicContact CZ-OE1 3.68Å; R156-E202 IonicContact NH2-OE1 3.48Å; R156-E202 PolarHBondContact NH2-OE1 3.44Å
157	W	98.6	Very high	97.3	Very high	1 Å²	1	64.1 Å²	64.1	0%	0.004	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	144	173.5	-82.8	110.3	0	0	0	111.2	V127 L141 C143 E163 E164 V168 V185 L187 S198 C199	V127-W157 HydrophobicContact CG1-CH2 3.67Å; V127-W157 HydrophobicContact CG1-CZ3 4.25Å; V127-W157 HydrophobicContact CG2-CH2 4.08Å; L141-W157 HydrophobicContact CB-CH2 4.25Å; L141-W157 HydrophobicContact CB-CZ2 4.42Å; L141-W157 HydrophobicContact CD2-CE3 4.4Å; L141-W157 HydrophobicContact CD2-CH2 3.37Å; L141-W157 HydrophobicContact CD2-CZ2 4.28Å; L141-W157 HydrophobicContact CD2-CZ3 3.45Å; L141-W157 VanDerWaalsContact CD2-CZ3 3.45Å; L141-W157 HydrophobicContact CG-CH2 3.6Å; L141-W157 HydrophobicContact CG-CZ2 4.19Å; L141-W157 HydrophobicContact CG-CZ3 4.21Å; C143-W157 HydrophobicContact CB-CH2 3.98Å; C143-W157 HydrophobicContact CB-CZ2 3.44Å; C143-W157 VanDerWaalsContact CB-CZ2 3.44Å; W157-E163 WeakPolarHBondContact O-CA 3.47Å; W157-E164 HydrophobicContact CB-CB 4.44Å; W157-E164 PolarHBondContact O-N 2.91Å; W157-V168 HydrophobicContact CB-CG2 4.33Å; W157-V185 PolarHBondContact NE1-O 3.32Å; W157-V185 VanDerWaalsContact NE1-O 3.15Å; W157-L187 HydrophobicContact CB-CD2 4.22Å; W157-L187 HydrophobicContact CD2-CB 3.97Å; W157-L187 HydrophobicContact CD2-CD2 3.99Å; W157-L187 HydrophobicContact CE3-CD2 4.08Å; W157-L187 HydrophobicContact CG-CB 3.97Å; W157-L187 HydrophobicContact CG-CD2 4.08Å; W157-L187 HydrophobicContact CG-CG 4.47Å; W157-L187 HydrophobicContact CZ2-CB 4.35Å; W157-S198 CarbonylContact C-O 3.48Å; W157-S198 WeakPolarHBondContact CA-O 3.17Å; W157-C199 HydrophobicContact CD2-CB 4.5Å; W157-C199 HydrophobicContact CE3-CB 4.18Å; W157-C199 HydrophobicContact CH2-CB 3.98Å; W157-C199 HydrophobicContact CZ2-CB 4.35Å; W157-C199 HydrophobicContact CZ3-CB 3.88Å
158	F	98.4	Very high	97.3	Very high	39 Å²	39	62.6 Å²	62.6	17%	0.171	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	139.2	171.9	-71.5	-102.3	0	0	0	109.5	R156 Q162 E163 Y197 S198 L200	R156-F158 HydrophobicContact CB-CE2 3.91Å; F158-Q162 CarbonylContact C-O 3.46Å; F158-Q162 WeakPolarHBondContact CA-O 3.3Å; F158-E163 HydrophobicContact CD1-CB 4.11Å; F158-E163 HydrophobicContact CE1-CB 3.73Å; F158-E163 HydrophobicContact CE1-CG 4.34Å; F158-E163 HydrophobicContact CE2-CG 4.48Å; F158-E163 HydrophobicContact CZ-CB 4.04Å; F158-E163 HydrophobicContact CZ-CG 4.16Å; F158-Y197 CarbonylContact O-C 3.48Å; F158-Y197 VanDerWaalsContact O-CA 3.28Å; F158-Y197 WeakPolarHBondContact O-CA 3.18Å; F158-S198 PolarHBondContact N-O 2.97Å; F158-S198 PolarHBondContact O-N 3.12Å; F158-L200 HydrophobicContact CD2-CB 4.08Å; F158-L200 HydrophobicContact CE2-CB 3.82Å; F158-L200 HydrophobicContact CE2-CD2 3.7Å; F158-L200 HydrophobicContact CE2-CG 4.43Å; F158-L200 HydrophobicContact CZ-CD2 4.14Å
159	R	97	Very high	97.3	Very high	75 Å²	75	68.2 Å²	68.2	28%	0.283	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.3	169.6	-176.8	-176.5	-179.4	-166.6	2.3	108.5	G161 Q162 D195 Y197	R159-G161 PolarHBondContact O-N 3.33Å; R159-G161 VanDerWaalsContact O-N 3.09Å; R159-Q162 PolarHBondContact N-O 3.18Å; R159-Q162 PolarHBondContact O-N 2.79Å; R159-D195 IonicContact CZ-OD2 2.66Å; R159-D195 IonicContact NE-OD1 3.43Å; R159-D195 IonicContact NE-OD2 3.66Å; R159-D195 PolarHBondContact NE-OD2 3.11Å; R159-D195 IonicContact NH2-OD1 3.45Å; R159-D195 IonicContact NH2-OD2 3.77Å; R159-D195 PolarHBondContact NH2-OD2 3.4Å; R159-Y197 HydrophobicContact CB-CD1 4.25Å; R159-Y197 HydrophobicContact CB-CE1 4.19Å; R159-Y197 HydrophobicContact CG-CD1 4.2Å; R159-Y197 HydrophobicContact CG-CE1 3.79Å; R159-Y197 PolarHBondContact NE-OH 3.27Å
160	N	95.7	Very high	97.3	Very high	90 Å²	90	69.5 Å²	69.5	48%	0.481	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	36.2	179.9	-58.2	-32	0	0	0	113.1	Q162 D195 V196	N160-Q162 VanDerWaalsContact C-N 3.34Å; N160-Q162 PolarHBondContact O-N 3.08Å; N160-D195 PolarHBondContact ND2-OD1 3.46Å; N160-V196 PolarHBondContact N-O 3.41Å; N160-V196 PolarHBondContact OD1-N 2.81Å
161	G	95.1	Very high	97.3	Very high	67 Å²	67	71.2 Å²	71.2	69%	0.691	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	-2.9	-179.5	0	0	0	0	0	115.8	R159	R159-G161 PolarHBondContact O-N 3.33Å; R159-G161 VanDerWaalsContact O-N 3.09Å
162	Q	97.5	Very high	97.3	Very high	152 Å²	152	71.9 Å²	71.9	71%	0.71	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.8	173.5	-64.1	-172.2	-7.8	0	0	110.5	F158 R159 N160 E164	F158-Q162 CarbonylContact C-O 3.46Å; F158-Q162 WeakPolarHBondContact CA-O 3.3Å; R159-Q162 PolarHBondContact N-O 3.18Å; R159-Q162 PolarHBondContact O-N 2.79Å; N160-Q162 VanDerWaalsContact C-N 3.34Å; N160-Q162 PolarHBondContact O-N 3.08Å; Q162-E164 PolarHBondContact O-N 3.09Å
163	E	98.1	Very high	97.4	Very high	68 Å²	68	70.2 Å²	70.2	32%	0.318	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	125.7	178.7	-170.4	175.4	132.5	0	0	109.9	R156 W157 F158 R165	R156-E163 IonicContact NH1-OE2 3.6Å; R156-E163 PolarHBondContact NH1-OE2 3.36Å; W157-E163 WeakPolarHBondContact O-CA 3.47Å; F158-E163 HydrophobicContact CD1-CB 4.11Å; F158-E163 HydrophobicContact CE1-CB 3.73Å; F158-E163 HydrophobicContact CE1-CG 4.34Å; F158-E163 HydrophobicContact CE2-CG 4.48Å; F158-E163 HydrophobicContact CZ-CB 4.04Å; F158-E163 HydrophobicContact CZ-CG 4.16Å; E163-R165 HydrophobicContact CG-CG 4.5Å; E163-R165 IonicContact OE1-CZ 3.59Å; E163-R165 IonicContact OE1-NE 3.36Å; E163-R165 PolarHBondContact OE1-NE 3.25Å; E163-R165 IonicContact OE1-NH2 2.79Å; E163-R165 PolarHBondContact OE1-NH2 2.83Å
164	E	97.1	Very high	97.3	Very high	59 Å²	59	71.4 Å²	71.4	28%	0.276	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130	178.5	-175.3	56.8	-88.8	0	0	109.6	W157 Q162 S166 L187	W157-E164 HydrophobicContact CB-CB 4.44Å; W157-E164 PolarHBondContact O-N 2.91Å; Q162-E164 PolarHBondContact O-N 3.09Å; E164-S166 WeakPolarHBondContact OE1-CB 3.4Å; E164-S166 PolarHBondContact OE1-N 3.22Å; E164-L187 HydrophobicContact CB-CD1 4.47Å; E164-L187 HydrophobicContact CG-CD1 3.62Å
165	R	97.3	Very high	97.3	Very high	193 Å²	193	77.1 Å²	77.1	73%	0.728	41%	0.409	S	S	*	.			trans	-125.8	-21.1	-179.3	-64.8	-174.7	177	-166.3	-0.6	112.3	E163	E163-R165 HydrophobicContact CG-CG 4.5Å; E163-R165 IonicContact OE1-CZ 3.59Å; E163-R165 IonicContact OE1-NE 3.36Å; E163-R165 PolarHBondContact OE1-NE 3.25Å; E163-R165 IonicContact OE1-NH2 2.79Å; E163-R165 PolarHBondContact OE1-NH2 2.83Å
166	S	96.8	Very high	97.2	Very high	91 Å²	91	78.3 Å²	78.3	64%	0.636	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	137	178.3	-172.7	0	0	0	0	109.9	E164 V168	E164-S166 WeakPolarHBondContact OE1-CB 3.4Å; E164-S166 PolarHBondContact OE1-N 3.22Å; S166-V168 PolarHBondContact O-N 2.72Å
167	G	95.8	Very high	96.9	Very high	23 Å²	23	77.7 Å²	77.7	24%	0.237	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	13.2	-179.5	0	0	0	0	0	114.5	E188	G167-E188 PolarHBondContact O-N 3.19Å
168	V	98.2	Very high	96.7	Very high	45 Å²	45	82 Å²	82	27%	0.273	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	125.1	175.9	178.3	0	0	0	0	110	W157 S166 V185 M186 L187	W157-V168 HydrophobicContact CB-CG2 4.33Å; S166-V168 PolarHBondContact O-N 2.72Å; V168-V185 HydrophobicContact CG1-CG1 3.59Å; V168-M186 CarbonylContact C-O 3.49Å; V168-M186 VanDerWaalsContact CA-O 3.3Å; V168-M186 WeakPolarHBondContact CA-O 3.37Å; V168-L187 HydrophobicContact CG2-CD1 3.7Å
169	M	98	Very high	96.5	Very high	117 Å²	117	87.1 Å²	87.1	58%	0.576	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.5	179.4	-61.4	-59.6	-67.7	0	0	110.3	V185 M186	M169-V185 CarbonylContact O-C 3.6Å; M169-V185 WeakPolarHBondContact O-CA 3.32Å; M169-M186 HydrophobicContact CB-CB 4.4Å; M169-M186 PolarHBondContact N-O 3.29Å; M169-M186 PolarHBondContact O-N 3.05Å
170	S	97.8	Very high	96.5	Very high	67 Å²	67	83.8 Å²	83.8	47%	0.469	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.2	177.4	175.1	0	0	0	0	110.6	G172 T183 T184	S170-G172 PolarHBondContact O-N 2.84Å; S170-G172 PolarHBondContact OG-N 3.03Å; S170-T183 PolarHBondContact OG-OG1 3.28Å; S170-T184 WeakPolarHBondContact CA-O 3.31Å
171	T	96.5	Very high	96.6	Very high	75 Å²	75	80.4 Å²	80.4	46%	0.46	44%	0.442	S	S	.	.			trans	-68.2	-10.4	168.4	57.7	0	0	0	0	113	T184 M186	T171-T184 PolarHBondContact N-O 3.4Å; T171-T184 PolarHBondContact OG1-N 3.43Å; T171-M186 HydrophobicContact CG2-CE 3.61Å
172	G	96.6	Very high	96.7	Very high	33 Å²	33	80.1 Å²	80.1	34%	0.34	42%	0.423	S	S	.	.			trans	72.7	-172.7	-164.4	0	0	0	0	0	111.8	S170 T183	S170-G172 PolarHBondContact O-N 2.84Å; S170-G172 PolarHBondContact OG-N 3.03Å; G172-T183 WeakPolarHBondContact O-CB 3.31Å; G172-T183 PolarHBondContact O-OG1 3.46Å
173	L	97.7	Very high	96.8	Very high	91 Å²	91	73.3 Å²	73.3	48%	0.476	39%	0.391	S	S	.	.			trans	-84.6	119	-178	-167.6	74.1	0	0	0	110.6	F148 G151 F181	F148-L173 HydrophobicContact CE2-CD1 3.93Å; F148-L173 HydrophobicContact CZ-CD1 3.7Å; G151-L173 WeakPolarHBondContact O-CD1 3.37Å; L173-F181 HydrophobicContact CD1-CB 3.56Å; L173-F181 HydrophobicContact CD1-CD1 4.06Å; L173-F181 HydrophobicContact CD1-CG 3.92Å; L173-F181 HydrophobicContact CD2-CD1 3.53Å; L173-F181 HydrophobicContact CD2-CE1 3.73Å; L173-F181 HydrophobicContact CD2-CG 4.03Å; L173-F181 HydrophobicContact CD2-CZ 4.38Å; L173-F181 HydrophobicContact CG-CB 4.03Å; L173-F181 HydrophobicContact CG-CD1 3.58Å; L173-F181 HydrophobicContact CG-CE1 4.26Å; L173-F181 HydrophobicContact CG-CG 3.99Å
174	V	97.7	Very high	96.8	Very high	64 Å²	64	71.1 Å²	71.1	39%	0.388	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	136.8	177.5	-178.5	0	0	0	0	109.3	F181 Q182	V174-F181 CarbonylContact O-C 3.56Å; V174-F181 WeakPolarHBondContact O-CA 3.12Å; V174-Q182 HydrophobicContact CB-CG 3.83Å; V174-Q182 HydrophobicContact CG1-CG 4.23Å; V174-Q182 PolarHBondContact N-O 2.68Å; V174-Q182 PolarHBondContact O-N 3.12Å
175	R	97.5	Very high	96.9	Very high	167 Å²	167	68.8 Å²	68.8	63%	0.63	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	125.9	179.5	-173.4	-171.7	-61.9	-85.1	0.8	110.4	F181	R175-F181 HydrophobicContact CB-CD1 4.26Å; R175-F181 HydrophobicContact CB-CE1 4.29Å; R175-F181 HydrophobicContact CG-CE1 4.31Å
176	N	94.7	Very high	96.9	Very high	54 Å²	54	61.4 Å²	61.4	29%	0.289	35%	0.347	S	S	.	.			trans	-77.4	-21.9	-177.1	-72.1	-20	0	0	0	114.4	D147 D178 T180 Q182	D147-N176 PolarHBondContact OD1-ND2 3Å; N176-D178 VanDerWaalsContact CB-OD1 3.3Å; N176-D178 WeakPolarHBondContact CB-OD1 2.74Å; N176-T180 PolarHBondContact N-O 2.66Å; N176-T180 VanDerWaalsContact N-O 3.07Å; N176-T180 PolarHBondContact ND2-OG1 2.95Å; N176-Q182 PolarHBondContact OD1-NE2 3.32Å
177	G	93.9	Very high	97	Very high	61 Å²	61	57.2 Å²	57.2	63%	0.629	32%	0.317	S	S	*	.	S	Bend	trans	100.5	-18.4	-177.8	0	0	0	0	0	114.2	W179	G177-W179 VanDerWaalsContact C-N 3.29Å
178	D	94	Very high	97.1	Very high	90 Å²	90	61.1 Å²	61.1	48%	0.481	33%	0.329	S	S	.	.	S	Bend	trans	-93.7	18.9	172.4	71.3	-16.4	0	0	0	112.9	N176 T180	N176-D178 VanDerWaalsContact CB-OD1 3.3Å; N176-D178 WeakPolarHBondContact CB-OD1 2.74Å; D178-T180 VanDerWaalsContact CG-OG1 3.32Å; D178-T180 PolarHBondContact O-N 2.96Å; D178-T180 WeakPolarHBondContact OD1-CB 3.37Å; D178-T180 PolarHBondContact OD1-N 3.45Å; D178-T180 PolarHBondContact OD1-OG1 2.67Å; D178-T180 PolarHBondContact OD2-OG1 2.81Å
179	W	92.7	Very high	96.9	Very high	148 Å²	148	59.2 Å²	59.2	56%	0.561	32%	0.317	S	S	*	.	S	Bend	trans	70.6	5.8	-175.6	-55.9	35.9	0	0	0	114.8	T116 R119 Y149 G177	T116-W179 HydrophobicContact CG2-CZ3 3.9Å; R119-W179 PolarHBondContact NH1-O 3.2Å; Y149-W179 WeakPolarHBondContact CD2-O 3.5Å; G177-W179 VanDerWaalsContact C-N 3.29Å
180	T	97.3	Very high	96.7	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.031	31%	0.313	C	S	.	.			trans	-91.4	165.5	167.1	68.8	0	0	0	0	111.1	F148 N176 D178	F148-T180 CarbonylContact O-C 3.58Å; F148-T180 WeakPolarHBondContact O-CA 3.42Å; N176-T180 PolarHBondContact N-O 2.66Å; N176-T180 VanDerWaalsContact N-O 3.07Å; N176-T180 PolarHBondContact ND2-OG1 2.95Å; D178-T180 VanDerWaalsContact CG-OG1 3.32Å; D178-T180 PolarHBondContact O-N 2.96Å; D178-T180 WeakPolarHBondContact OD1-CB 3.37Å; D178-T180 PolarHBondContact OD1-N 3.45Å; D178-T180 PolarHBondContact OD1-OG1 2.67Å; D178-T180 PolarHBondContact OD2-OG1 2.81Å
181	F	98.3	Very high	96.4	Very high	19 Å²	19	55 Å²	55	8%	0.083	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	160.7	178.2	-57.9	-85.2	0	0	0	110.9	D147 F148 Y149 G151 L173 V174 R175	D147-F181 PolarHBondContact N-O 2.83Å; D147-F181 VanDerWaalsContact N-O 3.08Å; F148-F181 WeakPolarHBondContact CD1-O 3.43Å; F148-F181 HydrophobicContact CD2-CB 4.32Å; F148-F181 HydrophobicContact CE1-CB 4.45Å; F148-F181 WeakPolarHBondContact CE1-O 3.41Å; F148-F181 HydrophobicContact CE2-CB 3.91Å; F148-F181 HydrophobicContact CZ-CB 3.97Å; F148-F181 PolarHBondContact N-O 3.17Å; F148-F181 PolarHBondContact O-N 2.94Å; Y149-F181 HydrophobicContact CD2-CD2 4.22Å; Y149-F181 AromaticContact CD2-CE2 3.77Å; Y149-F181 HydrophobicContact CD2-CE2 3.77Å; Y149-F181 HydrophobicContact CE2-CE2 4.16Å; G151-F181 VanDerWaalsContact CA-CD2 3.45Å; L173-F181 HydrophobicContact CD1-CB 3.56Å; L173-F181 HydrophobicContact CD1-CD1 4.06Å; L173-F181 HydrophobicContact CD1-CG 3.92Å; L173-F181 HydrophobicContact CD2-CD1 3.53Å; L173-F181 HydrophobicContact CD2-CE1 3.73Å; L173-F181 HydrophobicContact CD2-CG 4.03Å; L173-F181 HydrophobicContact CD2-CZ 4.38Å; L173-F181 HydrophobicContact CG-CB 4.03Å; L173-F181 HydrophobicContact CG-CD1 3.58Å; L173-F181 HydrophobicContact CG-CE1 4.26Å; L173-F181 HydrophobicContact CG-CG 3.99Å; V174-F181 CarbonylContact O-C 3.56Å; V174-F181 WeakPolarHBondContact O-CA 3.12Å; R175-F181 HydrophobicContact CB-CD1 4.26Å; R175-F181 HydrophobicContact CB-CE1 4.29Å; R175-F181 HydrophobicContact CG-CE1 4.31Å
182	Q	98.4	Very high	96.2	Very high	61 Å²	61	56.9 Å²	56.9	29%	0.285	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	156.3	170	63	179.1	-45.9	0	0	110.4	V145 T146 V174 N176	V145-Q182 CarbonylContact O-C 3.46Å; V145-Q182 VanDerWaalsContact O-CA 3.23Å; V145-Q182 WeakPolarHBondContact O-CA 3.37Å; V145-Q182 WeakPolarHBondContact O-CB 3.42Å; T146-Q182 HydrophobicContact CG2-CB 4.24Å; V174-Q182 HydrophobicContact CB-CG 3.83Å; V174-Q182 HydrophobicContact CG1-CG 4.23Å; V174-Q182 PolarHBondContact N-O 2.68Å; V174-Q182 PolarHBondContact O-N 3.12Å; N176-Q182 PolarHBondContact OD1-NE2 3.32Å
183	T	98.5	Very high	96	Very high	8 Å²	8	61 Å²	61	5%	0.049	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	146.3	171.9	-168	0	0	0	0	109.6	V145 F148 I153 V155 S170 G172	V145-T183 HydrophobicContact CB-CG2 4.18Å; V145-T183 PolarHBondContact N-O 3.45Å; V145-T183 PolarHBondContact O-N 3.45Å; F148-T183 HydrophobicContact CE1-CG2 4.28Å; F148-T183 HydrophobicContact CZ-CG2 4.23Å; I153-T183 HydrophobicContact CG2-CG2 4.4Å; V155-T183 HydrophobicContact CG2-CG2 4.32Å; S170-T183 PolarHBondContact OG-OG1 3.28Å; G172-T183 WeakPolarHBondContact O-CB 3.31Å; G172-T183 PolarHBondContact O-OG1 3.46Å
184	T	98.4	Very high	95.6	Very high	22 Å²	22	59 Å²	59	14%	0.135	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.6	173.7	-58	0	0	0	0	108.8	L142 C143 S170 T171 M186	L142-T184 HydrophobicContact CB-CG2 4.1Å; L142-T184 HydrophobicContact CD2-CG2 4.1Å; L142-T184 HydrophobicContact CG-CG2 4.07Å; C143-T184 WeakPolarHBondContact O-CA 3.32Å; S170-T184 WeakPolarHBondContact CA-O 3.31Å; T171-T184 PolarHBondContact N-O 3.4Å; T171-T184 PolarHBondContact OG1-N 3.43Å; T184-M186 HydrophobicContact CG2-CG 4.34Å
185	V	98.5	Very high	95.4	Very high	10 Å²	10	56.4 Å²	56.4	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	115.1	175.2	-173.3	0	0	0	0	109.1	C143 V155 W157 V168 M169	C143-V185 PolarHBondContact N-O 2.71Å; C143-V185 PolarHBondContact O-N 3.32Å; V155-V185 HydrophobicContact CB-CG2 3.74Å; V155-V185 HydrophobicContact CG1-CB 3.82Å; V155-V185 HydrophobicContact CG1-CG1 4.41Å; V155-V185 HydrophobicContact CG1-CG2 3.53Å; V155-V185 HydrophobicContact CG2-CG2 4.33Å; W157-V185 PolarHBondContact NE1-O 3.32Å; W157-V185 VanDerWaalsContact NE1-O 3.15Å; V168-V185 HydrophobicContact CG1-CG1 3.59Å; M169-V185 CarbonylContact O-C 3.6Å; M169-V185 WeakPolarHBondContact O-CA 3.32Å
186	M	98.4	Very high	95.4	Very high	39 Å²	39	50.9 Å²	50.9	19%	0.192	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	143.3	-177.4	-71	158	-87.3	0	0	110.4	L140 L141 L142 V168 M169 T171 T184	L140-M186 HydrophobicContact CD1-CB 3.94Å; L140-M186 HydrophobicContact CD2-CB 4.09Å; L140-M186 HydrophobicContact CD2-CG 3.83Å; L140-M186 HydrophobicContact CD2-SD 3.9Å; L140-M186 HydrophobicContact CG-CB 4.04Å; L140-M186 HydrophobicContact CG-CG 4.2Å; L141-M186 CarbonylContact O-C 3.55Å; L141-M186 VanDerWaalsContact O-CA 3.28Å; L141-M186 WeakPolarHBondContact O-CA 3.49Å; L142-M186 HydrophobicContact CD1-CG 4.24Å; L142-M186 HydrophobicContact CG-CG 3.88Å; V168-M186 CarbonylContact C-O 3.49Å; V168-M186 VanDerWaalsContact CA-O 3.3Å; V168-M186 WeakPolarHBondContact CA-O 3.37Å; M169-M186 HydrophobicContact CB-CB 4.4Å; M169-M186 PolarHBondContact N-O 3.29Å; M169-M186 PolarHBondContact O-N 3.05Å; T171-M186 HydrophobicContact CG2-CE 3.61Å; T184-M186 HydrophobicContact CG2-CG 4.34Å
187	L	98.3	Very high	95.5	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	120.5	173.2	172.5	66.7	0	0	0	109.7	L141 W157 E164 V168 M189 Y197	L141-L187 HydrophobicContact CB-CB 4.47Å; L141-L187 PolarHBondContact N-O 3.29Å; L141-L187 PolarHBondContact O-N 2.85Å; W157-L187 HydrophobicContact CB-CD2 4.22Å; W157-L187 HydrophobicContact CD2-CB 3.97Å; W157-L187 HydrophobicContact CD2-CD2 3.99Å; W157-L187 HydrophobicContact CE3-CD2 4.08Å; W157-L187 HydrophobicContact CG-CB 3.97Å; W157-L187 HydrophobicContact CG-CD2 4.08Å; W157-L187 HydrophobicContact CG-CG 4.47Å; W157-L187 HydrophobicContact CZ2-CB 4.35Å; E164-L187 HydrophobicContact CB-CD1 4.47Å; E164-L187 HydrophobicContact CG-CD1 3.62Å; V168-L187 HydrophobicContact CG2-CD1 3.7Å; L187-M189 PolarHBondContact O-N 3.2Å; L187-Y197 HydrophobicContact CD2-CD1 3.51Å; L187-Y197 HydrophobicContact CD2-CE1 3.94Å
188	E	97.2	Very high	95.7	Very high	105 Å²	105	46.6 Å²	46.6	49%	0.491	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	123.5	168	-68.9	-178.2	-178.1	0	0	110.1	L140 G167	L140-E188 HydrophobicContact CD1-CG 3.96Å; G167-E188 PolarHBondContact O-N 3.19Å
189	M	94.2	Very high	95.9	Very high	6 Å²	6	42.3 Å²	42.3	3%	0.03	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	153.4	-177.2	63	164.8	-175.8	0	0	113.1	P129 H138 N139 L141 L187 P191 Y197 W214	P129-M189 HydrophobicContact CB-CE 4.45Å; H138-M189 WeakPolarHBondContact CA-O 3.42Å; N139-M189 HydrophobicContact CB-CE 4.23Å; N139-M189 PolarHBondContact N-O 3.31Å; N139-M189 WeakPolarHBondContact O-CG 3Å; N139-M189 PolarHBondContact O-N 3.43Å; N139-M189 VanDerWaalsContact O-O 3.11Å; L141-M189 HydrophobicContact CB-CE 3.88Å; L141-M189 HydrophobicContact CB-CG 4.43Å; L141-M189 HydrophobicContact CB-SD 3.96Å; L141-M189 HydrophobicContact CD1-CE 3.89Å; L141-M189 HydrophobicContact CD2-SD 4.3Å; L141-M189 HydrophobicContact CG-CE 4.35Å; L187-M189 PolarHBondContact O-N 3.2Å; M189-P191 HydrophobicContact SD-CB 4.37Å; M189-Y197 HydrophobicContact CB-CE1 3.91Å; M189-Y197 HydrophobicContact SD-CD1 4.5Å; M189-Y197 HydrophobicContact SD-CD2 4.17Å; M189-Y197 HydrophobicContact SD-CE1 4.25Å; M189-Y197 HydrophobicContact SD-CE2 3.91Å; M189-Y197 HydrophobicContact SD-CG 4.45Å; M189-W214 HydrophobicContact CE-CE3 4.34Å; M189-W214 HydrophobicContact CE-CH2 3.78Å; M189-W214 HydrophobicContact CE-CZ2 4.4Å; M189-W214 HydrophobicContact CE-CZ3 3.73Å; M189-W214 HydrophobicContact SD-CE3 4.32Å; M189-W214 HydrophobicContact SD-CH2 4.3Å; M189-W214 HydrophobicContact SD-CZ3 3.72Å
190	I	94.5	Very high	96.2	Very high	95 Å²	95	36.7 Å²	36.7	49%	0.487	20%	0.2	S	C	.	.			trans	-122.1	94.9	164.7	-60.5	171.7	0	0	0	105.2	H138	H138-I190 HydrophobicContact CB-CG1 4.49Å
191	P	91.7	Very high	96.3	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-73.6	132.9	-169.3	28.4	-33	0	0	0	111.7	Q136 Q137 M189 Y197 W214 A216	Q136-P191 PolarHBondContact N-O 2.67Å; Q137-P191 WeakPolarHBondContact O-CD 3.34Å; M189-P191 HydrophobicContact SD-CB 4.37Å; P191-Y197 HydrophobicContact CB-CE2 4.41Å; P191-W214 HydrophobicContact CB-CH2 4.16Å; P191-W214 HydrophobicContact CB-CZ3 4.26Å; P191-A216 HydrophobicContact CB-CB 3.82Å
192	E	92	Very high	96.3	Very high	114 Å²	114	39.1 Å²	39.1	53%	0.533	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-98.4	153.8	166.8	-64.7	-177.2	-162.8	0	0	110.6	G194 D195 A216	E192-G194 PolarHBondContact O-N 3.07Å; E192-D195 PolarHBondContact N-OD2 2.86Å; E192-D195 WeakPolarHBondContact O-CB 3.43Å; E192-D195 PolarHBondContact O-N 3.23Å; E192-A216 WeakPolarHBondContact O-CB 2.98Å
193	L	91.1	Very high	96.3	Very high	120 Å²	120	36.8 Å²	36.8	63%	0.628	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	123.2	-178.8	-177.8	68.1	0	0	0	110.2	L135	L135-L193 HydrophobicContact CD1-CB 4.04Å; L135-L193 HydrophobicContact CD1-CD1 4.34Å; L135-L193 HydrophobicContact CD2-CB 4.3Å
194	G	90.3	Very high	96.2	Very high	48 Å²	48	39.9 Å²	39.9	50%	0.495	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.8	-2.7	-179	0	0	0	0	0	114.8	E192 A216	E192-G194 PolarHBondContact O-N 3.07Å; G194-A216 PolarHBondContact N-O 3.45Å
195	D	94.4	Very high	96.1	Very high	10 Å²	10	39.9 Å²	39.9	5%	0.053	23%	0.225	C	C	.	.			trans	-58.3	138.8	169.6	-86.9	-23.9	0	0	0	110.8	R159 N160 E192 Y197 V215 A216	R159-D195 IonicContact CZ-OD2 2.66Å; R159-D195 IonicContact NE-OD1 3.43Å; R159-D195 IonicContact NE-OD2 3.66Å; R159-D195 PolarHBondContact NE-OD2 3.11Å; R159-D195 IonicContact NH2-OD1 3.45Å; R159-D195 IonicContact NH2-OD2 3.77Å; R159-D195 PolarHBondContact NH2-OD2 3.4Å; N160-D195 PolarHBondContact ND2-OD1 3.46Å; E192-D195 PolarHBondContact N-OD2 2.86Å; E192-D195 WeakPolarHBondContact O-CB 3.43Å; E192-D195 PolarHBondContact O-N 3.23Å; D195-Y197 HydrophobicContact CB-CD2 4.23Å; D195-Y197 HydrophobicContact CB-CE2 3.52Å; D195-Y197 PolarHBondContact OD2-OH 3.49Å; D195-Y197 VanDerWaalsContact OD2-OH 3.13Å; D195-V215 WeakPolarHBondContact O-CA 3.32Å; D195-A216 HydrophobicContact CB-CB 3.94Å; D195-A216 PolarHBondContact O-N 2.99Å
196	V	96.1	Very high	96	Very high	50 Å²	50	41 Å²	41	30%	0.303	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	115.5	174.8	-175	0	0	0	0	109.3	N160 A213 V215	N160-V196 PolarHBondContact N-O 3.41Å; N160-V196 PolarHBondContact OD1-N 2.81Å; V196-A213 HydrophobicContact CG1-CB 4.13Å; V196-V215 HydrophobicContact CG1-CG2 4.38Å; V196-V215 HydrophobicContact CG2-CG1 4.4Å; V196-V215 HydrophobicContact CG2-CG2 4.18Å
197	Y	97.3	Very high	95.9	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	133.1	174.2	-63.1	-93	0	0	0	108.8	L141 F158 R159 L187 M189 P191 D195 A213 W214	L141-Y197 VanDerWaalsContact CD2-CB 3.41Å; L141-Y197 HydrophobicContact CD2-CD1 4.44Å; L141-Y197 HydrophobicContact CD2-CG 3.92Å; F158-Y197 CarbonylContact O-C 3.48Å; F158-Y197 VanDerWaalsContact O-CA 3.28Å; F158-Y197 WeakPolarHBondContact O-CA 3.18Å; R159-Y197 HydrophobicContact CB-CD1 4.25Å; R159-Y197 HydrophobicContact CB-CE1 4.19Å; R159-Y197 HydrophobicContact CG-CD1 4.2Å; R159-Y197 HydrophobicContact CG-CE1 3.79Å; R159-Y197 PolarHBondContact NE-OH 3.27Å; L187-Y197 HydrophobicContact CD2-CD1 3.51Å; L187-Y197 HydrophobicContact CD2-CE1 3.94Å; M189-Y197 HydrophobicContact CB-CE1 3.91Å; M189-Y197 HydrophobicContact SD-CD1 4.5Å; M189-Y197 HydrophobicContact SD-CD2 4.17Å; M189-Y197 HydrophobicContact SD-CE1 4.25Å; M189-Y197 HydrophobicContact SD-CE2 3.91Å; M189-Y197 HydrophobicContact SD-CG 4.45Å; P191-Y197 HydrophobicContact CB-CE2 4.41Å; D195-Y197 HydrophobicContact CB-CD2 4.23Å; D195-Y197 HydrophobicContact CB-CE2 3.52Å; D195-Y197 PolarHBondContact OD2-OH 3.49Å; D195-Y197 VanDerWaalsContact OD2-OH 3.13Å; Y197-A213 CarbonylContact O-C 3.56Å; Y197-A213 VanDerWaalsContact O-CA 3.26Å; Y197-A213 WeakPolarHBondContact O-CA 3.37Å; Y197-W214 AromaticContact CD2-CE3 3.57Å; Y197-W214 HydrophobicContact CD2-CE3 3.57Å; Y197-W214 AromaticContact CD2-CZ3 3.61Å; Y197-W214 HydrophobicContact CD2-CZ3 3.61Å; Y197-W214 HydrophobicContact CE2-CE3 4.32Å; Y197-W214 AromaticContact CE2-CZ3 3.89Å; Y197-W214 HydrophobicContact CE2-CZ3 3.89Å; Y197-W214 HydrophobicContact CG-CE3 4.26Å; Y197-W214 PolarHBondContact N-O 3.44Å; Y197-W214 PolarHBondContact O-N 2.83Å
198	S	98.1	Very high	95.9	Very high	22 Å²	22	57.5 Å²	57.5	15%	0.154	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.9	-178.6	-62.5	0	0	0	0	110.9	W157 F158 V212	W157-S198 CarbonylContact C-O 3.48Å; W157-S198 WeakPolarHBondContact CA-O 3.17Å; F158-S198 PolarHBondContact N-O 2.97Å; F158-S198 PolarHBondContact O-N 3.12Å; S198-V212 WeakPolarHBondContact CA-O 3.32Å
199	C	98.5	Very high	95.9	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	111.9	170.6	-177.5	0	0	0	0	109.1	V127 C143 V155 W157 S211 V212	V127-C199 HydrophobicContact CG2-CB 3.63Å; C143-C199 HydrophobicContact CB-CB 3.58Å; C143-C199 WeakPolarHBondContact CB-SG 3.33Å; C143-C199 WeakPolarHBondContact SG-CB 3.41Å; C143-C199 CovalentContact SG-SG 2.02Å; C143-C199 PolarHBondContact SG-SG 2.03Å; V155-C199 VanDerWaalsContact CG1-SG 3.54Å; W157-C199 HydrophobicContact CD2-CB 4.5Å; W157-C199 HydrophobicContact CE3-CB 4.18Å; W157-C199 HydrophobicContact CH2-CB 3.98Å; W157-C199 HydrophobicContact CZ2-CB 4.35Å; W157-C199 HydrophobicContact CZ3-CB 3.88Å; C199-S211 WeakPolarHBondContact O-CA 3.49Å; C199-V212 PolarHBondContact N-O 2.75Å; C199-V212 PolarHBondContact O-N 2.73Å
200	L	98.6	Very high	96.1	Very high	30 Å²	30	58.2 Å²	58.2	16%	0.157	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	122.2	176.5	-176.5	71.4	0	0	0	109.4	V155 R156 F158 P209 V210	V155-L200 WeakPolarHBondContact CA-O 3.48Å; R156-L200 PolarHBondContact N-O 3.11Å; R156-L200 PolarHBondContact O-N 3.32Å; F158-L200 HydrophobicContact CD2-CB 4.08Å; F158-L200 HydrophobicContact CE2-CB 3.82Å; F158-L200 HydrophobicContact CE2-CD2 3.7Å; F158-L200 HydrophobicContact CE2-CG 4.43Å; F158-L200 HydrophobicContact CZ-CD2 4.14Å; L200-P209 HydrophobicContact CD1-CB 3.8Å; L200-V210 CarbonylContact C-O 3.54Å; L200-V210 WeakPolarHBondContact CA-O 3.15Å
201	V	98.7	Very high	96.3	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	124.4	-179.4	-179.2	0	0	0	0	109.7	P123 V125 V145 I153 S154 V155 L206 P209 V210	P123-V201 HydrophobicContact CG-CG1 4.07Å; V125-V201 HydrophobicContact CG1-CG2 3.88Å; V125-V201 HydrophobicContact CG2-CB 4.11Å; V125-V201 HydrophobicContact CG2-CG1 4.28Å; V125-V201 HydrophobicContact CG2-CG2 3.82Å; V145-V201 HydrophobicContact CG1-CG1 4.15Å; V145-V201 HydrophobicContact CG2-CG2 3.91Å; I153-V201 HydrophobicContact CD1-CG1 3.8Å; I153-V201 HydrophobicContact CG1-CG1 4.07Å; S154-V201 WeakPolarHBondContact O-CA 3.31Å; V155-V201 HydrophobicContact CG1-CG2 4.28Å; V155-V201 HydrophobicContact CG2-CG2 4.32Å; V201-L206 HydrophobicContact CG1-CD1 4.29Å; V201-P209 WeakPolarHBondContact O-CA 3.35Å; V201-V210 PolarHBondContact N-O 2.95Å; V201-V210 PolarHBondContact O-N 2.75Å
202	E	98.5	Very high	96.6	Very high	74 Å²	74	58.9 Å²	58.9	35%	0.346	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	127.5	172.2	-56.3	178.3	-170.7	0	0	108.9	I153 S154 R156 P209	I153-E202 WeakPolarHBondContact CG1-O 3.48Å; S154-E202 PolarHBondContact N-O 2.96Å; S154-E202 PolarHBondContact O-N 3.21Å; R156-E202 IonicContact CZ-OE1 3.68Å; R156-E202 IonicContact NH2-OE1 3.48Å; R156-E202 PolarHBondContact NH2-OE1 3.44Å; E202-P209 HydrophobicContact CG-CB 3.88Å; E202-P209 HydrophobicContact CG-CG 3.93Å
203	H	98.6	Very high	96.8	Very high	12 Å²	12	56.2 Å²	56.2	6%	0.056	33%	0.325	C	S	.	.			trans	-152.2	141.6	-176.2	-178.1	-98.1	0	0	0	110	V121 P123 F148 Y149 P150 D152 I153 G205 L206	V121-H203 PolarHBondContact O-CE1 3.06Å; P123-H203 HydrophobicContact CG-CB 4.28Å; F148-H203 AromaticContact CD2-CD2 3.84Å; F148-H203 AromaticContact CD2-NE2 3.63Å; Y149-H203 PolarHBondContact O-CE1 2.84Å; P150-H203 PolarHBondContact O-NE2 2.91Å; D152-H203 PolarHBondContact O-CD2 3.3Å; D152-H203 VanDerWaalsContact O-CD2 3.24Å; I153-H203 HydrophobicContact CD1-CB 4.31Å; I153-H203 HydrophobicContact CG1-CB 4.19Å; H203-G205 PolarHBondContact CE1-N 3.06Å; H203-G205 WeakPolarHBondContact ND1-CA 3.21Å; H203-G205 PolarHBondContact ND1-N 3.36Å; H203-G205 PolarHBondContact O-N 2.79Å; H203-G205 VanDerWaalsContact O-N 3.14Å; H203-L206 HydrophobicContact CB-CD1 3.9Å; H203-L206 HydrophobicContact CB-CG 4.11Å; H203-L206 WeakPolarHBondContact O-CB 3.09Å; H203-L206 PolarHBondContact O-N 2.89Å
204	P	96.9	Very high	97	Very high	73 Å²	73	52.3 Å²	52.3	47%	0.474	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.1	179.8	-27.4	36	0	0	0	115.4	P150 L206	P150-P204 HydrophobicContact CG-CG 4.36Å; P204-L206 VanDerWaalsContact C-N 3.29Å
205	G	95.3	Very high	97.2	Very high	22 Å²	22	52.9 Å²	52.9	23%	0.227	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-10	175	0	0	0	0	0	114.6	H203	H203-G205 PolarHBondContact CE1-N 3.06Å; H203-G205 WeakPolarHBondContact ND1-CA 3.21Å; H203-G205 PolarHBondContact ND1-N 3.36Å; H203-G205 PolarHBondContact O-N 2.79Å; H203-G205 VanDerWaalsContact O-N 3.14Å
206	L	97.6	Very high	97.1	Very high	35 Å²	35	52.6 Å²	52.6	18%	0.183	29%	0.294	C	S	.	.	S	Bend	trans	-95.8	135.8	176.5	-62.1	170.5	0	0	0	110.6	P122 P123 V201 H203 P204 R208 V210	P122-L206 HydrophobicContact CB-CD2 3.75Å; P122-L206 HydrophobicContact CB-CG 4.46Å; P123-L206 HydrophobicContact CG-CD1 3.99Å; P123-L206 HydrophobicContact CG-CD2 4.45Å; P123-L206 HydrophobicContact CG-CG 4.31Å; V201-L206 HydrophobicContact CG1-CD1 4.29Å; H203-L206 HydrophobicContact CB-CD1 3.9Å; H203-L206 HydrophobicContact CB-CG 4.11Å; H203-L206 WeakPolarHBondContact O-CB 3.09Å; H203-L206 PolarHBondContact O-N 2.89Å; P204-L206 VanDerWaalsContact C-N 3.29Å; L206-R208 WeakPolarHBondContact CB-O 3.32Å; L206-R208 PolarHBondContact O-N 2.86Å; L206-V210 HydrophobicContact CD1-CB 4.21Å; L206-V210 HydrophobicContact CD1-CG2 3.89Å; L206-V210 HydrophobicContact CD2-CG2 3.87Å; L206-V210 HydrophobicContact CG-CG2 4.42Å
207	L	96.6	Very high	96.6	Very high	181 Å²	181	57 Å²	57	95%	0.948	31%	0.312	S	S	*	.	S	Bend	trans	-64.7	-29.8	174.3	-69.3	173.1	0	0	0	112.7
208	R	97.8	Very high	95.1	Very high	205 Å²	205	59.9 Å²	59.9	77%	0.774	33%	0.333	S	S	*	.	S	Bend	trans	-149.5	158	178.6	-63.2	-175.4	-166.5	159	5	109	L206 V210	L206-R208 WeakPolarHBondContact CB-O 3.32Å; L206-R208 PolarHBondContact O-N 2.86Å; R208-V210 PolarHBondContact O-N 2.87Å
209	P	97.9	Very high	93.5	Very high	75 Å²	75	65.5 Å²	65.5	49%	0.487	36%	0.357	S	S	.	.			trans	-53.3	134.8	171.3	-24.9	34.7	0	0	0	111.5	L200 V201 E202	L200-P209 HydrophobicContact CD1-CB 3.8Å; V201-P209 WeakPolarHBondContact O-CA 3.35Å; E202-P209 HydrophobicContact CG-CB 3.88Å; E202-P209 HydrophobicContact CG-CG 3.93Å
210	V	98.1	Very high	91.6	Very high	52 Å²	52	72.4 Å²	72.4	32%	0.315	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.4	176.7	169.4	0	0	0	0	108.5	V125 L200 V201 L206 R208 V212	V125-V210 HydrophobicContact CG2-CG1 4.45Å; L200-V210 CarbonylContact C-O 3.54Å; L200-V210 WeakPolarHBondContact CA-O 3.15Å; V201-V210 PolarHBondContact N-O 2.95Å; V201-V210 PolarHBondContact O-N 2.75Å; L206-V210 HydrophobicContact CD1-CB 4.21Å; L206-V210 HydrophobicContact CD1-CG2 3.89Å; L206-V210 HydrophobicContact CD2-CG2 3.87Å; L206-V210 HydrophobicContact CG-CG2 4.42Å; R208-V210 PolarHBondContact O-N 2.87Å; V210-V212 HydrophobicContact CG1-CG2 4.13Å
211	S	97.9	Very high	89.8	Confident	69 Å²	69	73.3 Å²	73.3	48%	0.483	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	117.2	176.1	-178.3	0	0	0	0	109.6	C199	C199-S211 WeakPolarHBondContact O-CA 3.49Å
212	V	98.2	Very high	88	Confident	40 Å²	40	81.1 Å²	81.1	24%	0.242	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	122.3	175.1	-179	0	0	0	0	108.7	V125 V127 S198 C199 V210	V125-V212 HydrophobicContact CB-CG2 3.93Å; V125-V212 HydrophobicContact CG1-CB 4.2Å; V125-V212 HydrophobicContact CG1-CG2 3.67Å; V127-V212 HydrophobicContact CB-CG1 3.99Å; V127-V212 HydrophobicContact CG2-CB 3.89Å; V127-V212 HydrophobicContact CG2-CG1 3.76Å; S198-V212 WeakPolarHBondContact CA-O 3.32Å; C199-V212 PolarHBondContact N-O 2.75Å; C199-V212 PolarHBondContact O-N 2.73Å; V210-V212 HydrophobicContact CG1-CG2 4.13Å
213	A	97.2	Very high	86.4	Confident	59 Å²	59	85.3 Å²	85.3	49%	0.488	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	141.7	-176.8	0	0	0	0	0	112	V196 Y197	V196-A213 HydrophobicContact CG1-CB 4.13Å; Y197-A213 CarbonylContact O-C 3.56Å; Y197-A213 VanDerWaalsContact O-CA 3.26Å; Y197-A213 WeakPolarHBondContact O-CA 3.37Å
214	W	95.5	Very high	85.2	Confident	38 Å²	38	92.5 Å²	92.5	14%	0.144	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128	167.7	178.1	88.9	0	0	0	108.9	V127 P133 L141 M189 P191 Y197 A216	V127-W214 HydrophobicContact CG1-CB 3.64Å; V127-W214 HydrophobicContact CG1-CG 4.41Å; P133-W214 HydrophobicContact CB-CH2 4.14Å; P133-W214 HydrophobicContact CB-CZ2 3.88Å; P133-W214 HydrophobicContact CG-CZ2 3.88Å; L141-W214 HydrophobicContact CD1-CB 4.27Å; L141-W214 HydrophobicContact CD1-CD2 3.76Å; L141-W214 HydrophobicContact CD1-CE3 4.01Å; L141-W214 HydrophobicContact CD1-CG 3.85Å; L141-W214 HydrophobicContact CD2-CB 4.24Å; L141-W214 HydrophobicContact CD2-CD2 4.4Å; L141-W214 HydrophobicContact CD2-CE3 4.05Å; L141-W214 HydrophobicContact CD2-CG 4.5Å; M189-W214 HydrophobicContact CE-CE3 4.34Å; M189-W214 HydrophobicContact CE-CH2 3.78Å; M189-W214 HydrophobicContact CE-CZ2 4.4Å; M189-W214 HydrophobicContact CE-CZ3 3.73Å; M189-W214 HydrophobicContact SD-CE3 4.32Å; M189-W214 HydrophobicContact SD-CH2 4.3Å; M189-W214 HydrophobicContact SD-CZ3 3.72Å; P191-W214 HydrophobicContact CB-CH2 4.16Å; P191-W214 HydrophobicContact CB-CZ3 4.26Å; Y197-W214 AromaticContact CD2-CE3 3.57Å; Y197-W214 HydrophobicContact CD2-CE3 3.57Å; Y197-W214 AromaticContact CD2-CZ3 3.61Å; Y197-W214 HydrophobicContact CD2-CZ3 3.61Å; Y197-W214 HydrophobicContact CE2-CE3 4.32Å; Y197-W214 AromaticContact CE2-CZ3 3.89Å; Y197-W214 HydrophobicContact CE2-CZ3 3.89Å; Y197-W214 HydrophobicContact CG-CE3 4.26Å; Y197-W214 PolarHBondContact N-O 3.44Å; Y197-W214 PolarHBondContact O-N 2.83Å; W214-A216 HydrophobicContact CH2-CB 3.9Å; W214-A216 HydrophobicContact CZ3-CB 3.83Å
215	V	94.2	Very high	83.9	Confident	60 Å²	60	92.2 Å²	92.2	36%	0.364	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	131.8	-178.3	-175.8	0	0	0	0	108.9	D195 V196 Q217	D195-V215 WeakPolarHBondContact O-CA 3.32Å; V196-V215 HydrophobicContact CG1-CG2 4.38Å; V196-V215 HydrophobicContact CG2-CG1 4.4Å; V196-V215 HydrophobicContact CG2-CG2 4.18Å; V215-Q217 WeakPolarHBondContact O-CG 3.38Å; V215-Q217 PolarHBondContact O-N 2.86Å; V215-Q217 VanDerWaalsContact O-N 3.08Å
216	A	91.5	Very high	82.9	Confident	3 Å²	3	95.2 Å²	95.2	3%	0.025	48%	0.477	C	S	.	.			trans	-72.8	97.6	171.3	0	0	0	0	0	109.8	P191 E192 G194 D195 W214	P191-A216 HydrophobicContact CB-CB 3.82Å; E192-A216 WeakPolarHBondContact O-CB 2.98Å; G194-A216 PolarHBondContact N-O 3.45Å; D195-A216 HydrophobicContact CB-CB 3.94Å; D195-A216 PolarHBondContact O-N 2.99Å; W214-A216 HydrophobicContact CH2-CB 3.9Å; W214-A216 HydrophobicContact CZ3-CB 3.83Å
217	Q	85.2	Confident	82.1	Confident	142 Å²	142	97.3 Å²	97.3	66%	0.664	49%	0.494	S	S	*	.			trans	-113.5	149.9	176.4	13.4	177.5	6	0	0	109.2	V215	V215-Q217 WeakPolarHBondContact O-CG 3.38Å; V215-Q217 PolarHBondContact O-N 2.86Å; V215-Q217 VanDerWaalsContact O-N 3.08Å
218	S	66.5	Low	81.5	Confident	65 Å²	65	90.6 Å²	90.6	46%	0.455	47%	0.469	S	S	.	.			trans	-67	134.2	168.7	57.9	0	0	0	0	109.5	Y220	S218-Y220 PolarHBondContact O-N 3.36Å
219	E	63.9	Low	81.1	Confident	141 Å²	141	82.9 Å²	82.9	66%	0.659	45%	0.449	S	S	*	.	S	Bend	trans	-59.8	-7.1	173	-126.5	-170.4	-179.2	0	0	113.8	T132 S221	T132-E219 VanDerWaalsContact CG2-OE1 3.24Å; T132-E219 WeakPolarHBondContact CG2-OE1 3.12Å; E219-S221 PolarHBondContact O-N 2.81Å
220	Y	59.2	Low	80.6	Confident	145 Å²	145	81.8 Å²	81.8	57%	0.569	45%	0.446	S	S	*	.			trans	-63.9	78.8	174.7	-160.3	-93.2	0	0	0	110.5	S218 W222 I225	S218-Y220 PolarHBondContact O-N 3.36Å; Y220-W222 HydrophobicContact CE1-CE3 4.21Å; Y220-W222 PolarHBondContact O-N 3.32Å; Y220-W222 VanDerWaalsContact O-N 3.09Å; Y220-I225 HydrophobicContact CD1-CD1 4.38Å; Y220-I225 HydrophobicContact CD2-CD1 3.83Å; Y220-I225 HydrophobicContact CE1-CD1 3.74Å; Y220-I225 HydrophobicContact CE2-CD1 3.09Å; Y220-I225 HydrophobicContact CG-CD1 4.43Å; Y220-I225 WeakPolarHBondContact OH-CD1 3.26Å
221	S	59.9	Low	80.3	Confident	48 Å²	48	82.2 Å²	82.2	34%	0.336	46%	0.455	S	S	.	.			trans	-72.9	104.7	169	76.5	0	0	0	0	107.7	E219 E223 K224	E219-S221 PolarHBondContact O-N 2.81Å; S221-E223 PolarHBondContact O-N 3.21Å; S221-K224 PolarHBondContact O-N 3.26Å; S221-K224 WeakPolarHBondContact OG-CD 3.38Å; S221-K224 VanDerWaalsContact OG-CG 3.31Å; S221-K224 WeakPolarHBondContact OG-CG 3.38Å
222	W	60.9	Low	80.2	Confident	164 Å²	164	85.6 Å²	85.6	62%	0.621	46%	0.461	S	S	*	.	H	α-helix	trans	-47.1	-29.9	171.9	179	-115.8	0	0	0	111.8	Y220 I225 L226	Y220-W222 HydrophobicContact CE1-CE3 4.21Å; Y220-W222 PolarHBondContact O-N 3.32Å; Y220-W222 VanDerWaalsContact O-N 3.09Å; W222-I225 PolarHBondContact O-N 2.95Å; W222-L226 HydrophobicContact CD2-CD1 3.65Å; W222-L226 HydrophobicContact CE3-CD1 4.33Å; W222-L226 HydrophobicContact CG-CD1 4.09Å; W222-L226 HydrophobicContact CH2-CD1 4Å; W222-L226 HydrophobicContact CZ2-CD1 3.25Å; W222-L226 HydrophobicContact CZ3-CD1 4.48Å; W222-L226 WeakPolarHBondContact O-CB 3.36Å; W222-L226 PolarHBondContact O-N 2.91Å
223	E	66.3	Low	80	Confident	163 Å²	163	88.9 Å²	88.9	76%	0.762	48%	0.477	S	S	*	.	H	α-helix	trans	-60.4	-44.1	176.1	-61.2	-152.5	151	0	0	114.5	S221 I225 L226 S227	S221-E223 PolarHBondContact O-N 3.21Å; E223-I225 VanDerWaalsContact C-N 3.31Å; E223-I225 PolarHBondContact O-N 3.23Å; E223-L226 PolarHBondContact O-N 3.27Å; E223-S227 PolarHBondContact O-N 2.75Å; E223-S227 VanDerWaalsContact O-N 3.12Å
224	K	72.5	Confident	79.9	Confident	162 Å²	162	91.6 Å²	91.6	70%	0.704	48%	0.483	S	S	*	.	H	α-helix	trans	-66.2	-38.5	179.5	-77	177.3	-177.4	168.7	0	110.5	S221 S227 G228	S221-K224 PolarHBondContact O-N 3.26Å; S221-K224 WeakPolarHBondContact OG-CD 3.38Å; S221-K224 VanDerWaalsContact OG-CG 3.31Å; S221-K224 WeakPolarHBondContact OG-CG 3.38Å; K224-S227 PolarHBondContact O-N 2.89Å; K224-S227 PolarHBondContact O-OG 2.97Å; K224-G228 PolarHBondContact O-N 3.05Å
225	I	69.7	Low	79.9	Confident	67 Å²	67	91.9 Å²	91.9	34%	0.344	50%	0.497	S	S	.	.	H	α-helix	trans	-75.3	-34.6	179.3	-69.5	169.6	0	0	0	111.7	Y220 W222 E223 S227 G228 A229	Y220-I225 HydrophobicContact CD1-CD1 4.38Å; Y220-I225 HydrophobicContact CD2-CD1 3.83Å; Y220-I225 HydrophobicContact CE1-CD1 3.74Å; Y220-I225 HydrophobicContact CE2-CD1 3.09Å; Y220-I225 HydrophobicContact CG-CD1 4.43Å; Y220-I225 WeakPolarHBondContact OH-CD1 3.26Å; W222-I225 PolarHBondContact O-N 2.95Å; E223-I225 VanDerWaalsContact C-N 3.31Å; E223-I225 PolarHBondContact O-N 3.23Å; I225-S227 VanDerWaalsContact C-N 3.29Å; I225-S227 PolarHBondContact O-N 3.23Å; I225-G228 PolarHBondContact O-N 3.29Å; I225-A229 WeakPolarHBondContact O-CB 3.41Å; I225-A229 PolarHBondContact O-N 3.11Å
226	L	75.4	Confident	80	Confident	86 Å²	86	92.3 Å²	92.3	45%	0.45	50%	0.497	S	S	.	.	H	α-helix	trans	-59.8	-43.9	172.6	-121.3	74.8	0	0	0	111.3	W222 E223 A230	W222-L226 HydrophobicContact CD2-CD1 3.65Å; W222-L226 HydrophobicContact CE3-CD1 4.33Å; W222-L226 HydrophobicContact CG-CD1 4.09Å; W222-L226 HydrophobicContact CH2-CD1 4Å; W222-L226 HydrophobicContact CZ2-CD1 3.25Å; W222-L226 HydrophobicContact CZ3-CD1 4.48Å; W222-L226 WeakPolarHBondContact O-CB 3.36Å; W222-L226 PolarHBondContact O-N 2.91Å; E223-L226 PolarHBondContact O-N 3.27Å; L226-A230 WeakPolarHBondContact O-CB 3.16Å; L226-A230 PolarHBondContact O-N 3.04Å
227	S	80.6	Confident	80.1	Confident	79 Å²	79	95.8 Å²	95.8	55%	0.552	52%	0.518	S	S	*	.	H	α-helix	trans	-64.6	-43.8	178.2	76.9	0	0	0	0	111.6	E223 K224 I225 A231	E223-S227 PolarHBondContact O-N 2.75Å; E223-S227 VanDerWaalsContact O-N 3.12Å; K224-S227 PolarHBondContact O-N 2.89Å; K224-S227 PolarHBondContact O-OG 2.97Å; I225-S227 VanDerWaalsContact C-N 3.29Å; I225-S227 PolarHBondContact O-N 3.23Å; S227-A231 WeakPolarHBondContact O-CB 3.2Å; S227-A231 PolarHBondContact O-N 3.34Å
228	G	84.1	Confident	80.6	Confident	40 Å²	40	94 Å²	94	41%	0.412	52%	0.517	S	S	.	.	H	α-helix	trans	-64.9	-43.8	175.3	0	0	0	0	0	113.9	K224 I225 A231 F232	K224-G228 PolarHBondContact O-N 3.05Å; I225-G228 PolarHBondContact O-N 3.29Å; G228-A231 PolarHBondContact O-N 3.39Å; G228-F232 WeakPolarHBondContact O-CB 3.42Å; G228-F232 PolarHBondContact O-N 2.85Å
229	A	87.9	Confident	81.9	Confident	43 Å²	43	97.9 Å²	97.9	36%	0.355	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-41.9	178.7	0	0	0	0	0	111.4	I225 F232 L233	I225-A229 WeakPolarHBondContact O-CB 3.41Å; I225-A229 PolarHBondContact O-N 3.11Å; A229-F232 PolarHBondContact O-N 2.87Å; A229-L233 WeakPolarHBondContact O-CB 3.49Å; A229-L233 VanDerWaalsContact O-CG 3.22Å; A229-L233 WeakPolarHBondContact O-CG 3.43Å; A229-L233 PolarHBondContact O-N 2.81Å
230	A	89	Confident	83.4	Confident	51 Å²	51	96.1 Å²	96.1	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-44.5	174.6	0	0	0	0	0	111.5	L226 L233 L234	L226-A230 WeakPolarHBondContact O-CB 3.16Å; L226-A230 PolarHBondContact O-N 3.04Å; A230-L233 PolarHBondContact O-N 2.89Å; A230-L234 WeakPolarHBondContact O-CB 3.24Å; A230-L234 VanDerWaalsContact O-CG 3.26Å; A230-L234 WeakPolarHBondContact O-CG 3.34Å; A230-L234 PolarHBondContact O-N 3.07Å
231	A	91.6	Very high	85.2	Confident	62 Å²	62	93.5 Å²	93.5	51%	0.512	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-41.2	175.8	0	0	0	0	0	112.4	S227 G228 L234 G235	S227-A231 WeakPolarHBondContact O-CB 3.2Å; S227-A231 PolarHBondContact O-N 3.34Å; G228-A231 PolarHBondContact O-N 3.39Å; A231-L234 PolarHBondContact O-N 2.8Å; A231-G235 PolarHBondContact O-N 3.06Å
232	F	94.2	Very high	86.7	Confident	139 Å²	139	93 Å²	93	61%	0.61	52%	0.521	S	S	*	.	H	α-helix	trans	-65.9	-43.2	177.2	-174	-104.8	0	0	0	112.2	G228 A229 G235 L236	G228-F232 WeakPolarHBondContact O-CB 3.42Å; G228-F232 PolarHBondContact O-N 2.85Å; A229-F232 PolarHBondContact O-N 2.87Å; F232-G235 PolarHBondContact O-N 2.8Å; F232-L236 HydrophobicContact CD1-CD1 3.68Å; F232-L236 HydrophobicContact CD1-CG 4.35Å; F232-L236 HydrophobicContact CE1-CD1 3.28Å; F232-L236 HydrophobicContact CE1-CG 4.04Å; F232-L236 HydrophobicContact CZ-CD1 3.86Å; F232-L236 HydrophobicContact CZ-CG 4.21Å; F232-L236 WeakPolarHBondContact O-CB 3.25Å; F232-L236 WeakPolarHBondContact O-CG 3.33Å; F232-L236 PolarHBondContact O-N 2.82Å
233	L	95	Very high	88.3	Confident	110 Å²	110	86.8 Å²	86.8	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-64.3	-43.5	175.9	-71.2	172.4	0	0	0	111.4	A229 A230 L236 T237	A229-L233 WeakPolarHBondContact O-CB 3.49Å; A229-L233 VanDerWaalsContact O-CG 3.22Å; A229-L233 WeakPolarHBondContact O-CG 3.43Å; A229-L233 PolarHBondContact O-N 2.81Å; A230-L233 PolarHBondContact O-N 2.89Å; L233-L236 PolarHBondContact O-N 2.86Å; L233-T237 WeakPolarHBondContact O-CG2 3.47Å; L233-T237 PolarHBondContact O-N 2.81Å; L233-T237 PolarHBondContact O-OG1 3.27Å
234	L	94.8	Very high	89.6	Confident	116 Å²	116	82.8 Å²	82.8	61%	0.607	49%	0.492	S	S	*	.	H	α-helix	trans	-59.3	-47	173.2	-74.1	168.2	0	0	0	111.2	A230 A231 L236 T237 V238	A230-L234 WeakPolarHBondContact O-CB 3.24Å; A230-L234 VanDerWaalsContact O-CG 3.26Å; A230-L234 WeakPolarHBondContact O-CG 3.34Å; A230-L234 PolarHBondContact O-N 3.07Å; A231-L234 PolarHBondContact O-N 2.8Å; L234-L236 PolarHBondContact O-N 3.48Å; L234-T237 PolarHBondContact O-N 3.44Å; L234-T237 PolarHBondContact O-OG1 3.21Å; L234-V238 WeakPolarHBondContact O-CG2 3.26Å; L234-V238 PolarHBondContact O-N 3.37Å
235	G	94.7	Very high	90.5	Very high	43 Å²	43	80.3 Å²	80.3	44%	0.443	49%	0.485	S	S	.	.	H	α-helix	trans	-59.9	-43.4	176.5	0	0	0	0	0	113.4	A231 F232 V238 F239	A231-G235 PolarHBondContact O-N 3.06Å; F232-G235 PolarHBondContact O-N 2.8Å; G235-V238 PolarHBondContact O-N 3.4Å; G235-F239 WeakPolarHBondContact O-CB 3.15Å; G235-F239 PolarHBondContact O-N 2.93Å
236	L	96.3	Very high	91.4	Very high	69 Å²	69	82.3 Å²	82.3	36%	0.361	49%	0.493	S	S	.	.	H	α-helix	trans	-62.5	-42.2	175.6	-81.8	173.1	0	0	0	112.1	F232 L233 L234 F239 L240	F232-L236 HydrophobicContact CD1-CD1 3.68Å; F232-L236 HydrophobicContact CD1-CG 4.35Å; F232-L236 HydrophobicContact CE1-CD1 3.28Å; F232-L236 HydrophobicContact CE1-CG 4.04Å; F232-L236 HydrophobicContact CZ-CD1 3.86Å; F232-L236 HydrophobicContact CZ-CG 4.21Å; F232-L236 WeakPolarHBondContact O-CB 3.25Å; F232-L236 WeakPolarHBondContact O-CG 3.33Å; F232-L236 PolarHBondContact O-N 2.82Å; L233-L236 PolarHBondContact O-N 2.86Å; L234-L236 PolarHBondContact O-N 3.48Å; L236-F239 PolarHBondContact O-N 3.4Å; L236-L240 WeakPolarHBondContact O-CB 3.41Å; L236-L240 VanDerWaalsContact O-CG 3.25Å; L236-L240 WeakPolarHBondContact O-CG 3.25Å; L236-L240 PolarHBondContact O-N 2.89Å
237	T	94.5	Very high	92.1	Very high	77 Å²	77	83.5 Å²	83.5	47%	0.472	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-42.5	177.1	59.5	0	0	0	0	111.9	L233 L234 L240 V241	L233-T237 WeakPolarHBondContact O-CG2 3.47Å; L233-T237 PolarHBondContact O-N 2.81Å; L233-T237 PolarHBondContact O-OG1 3.27Å; L234-T237 PolarHBondContact O-N 3.44Å; L234-T237 PolarHBondContact O-OG1 3.21Å; T237-L240 PolarHBondContact O-N 2.82Å; T237-V241 WeakPolarHBondContact O-CB 3.3Å; T237-V241 VanDerWaalsContact O-CG2 3.24Å; T237-V241 WeakPolarHBondContact O-CG2 3.31Å; T237-V241 PolarHBondContact O-N 2.95Å
238	V	94.9	Very high	92.4	Very high	105 Å²	105	86.9 Å²	86.9	64%	0.636	50%	0.504	S	S	*	.	H	α-helix	trans	-62.9	-43	175.2	173.4	0	0	0	0	111.1	L234 G235 G242	L234-V238 WeakPolarHBondContact O-CG2 3.26Å; L234-V238 PolarHBondContact O-N 3.37Å; G235-V238 PolarHBondContact O-N 3.4Å; V238-G242 PolarHBondContact O-N 2.69Å
239	F	95.2	Very high	92.4	Very high	145 Å²	145	87.7 Å²	87.7	64%	0.636	51%	0.507	S	S	*	.	H	α-helix	trans	-63.2	-46.6	177.3	178.3	-99.3	0	0	0	112.3	G235 L236 G242 A243	G235-F239 WeakPolarHBondContact O-CB 3.15Å; G235-F239 PolarHBondContact O-N 2.93Å; L236-F239 PolarHBondContact O-N 3.4Å; F239-G242 PolarHBondContact O-N 2.82Å; F239-A243 WeakPolarHBondContact O-CB 3.39Å; F239-A243 PolarHBondContact O-N 2.81Å
240	L	95.8	Very high	92.1	Very high	105 Å²	105	90.5 Å²	90.5	55%	0.55	51%	0.513	S	S	.	.	H	α-helix	trans	-63.9	-42.4	178.9	-70.9	172.6	0	0	0	111.7	L236 T237 A243 V244	L236-L240 WeakPolarHBondContact O-CB 3.41Å; L236-L240 VanDerWaalsContact O-CG 3.25Å; L236-L240 WeakPolarHBondContact O-CG 3.25Å; L236-L240 PolarHBondContact O-N 2.89Å; T237-L240 PolarHBondContact O-N 2.82Å; L240-A243 PolarHBondContact O-N 3.39Å; L240-V244 WeakPolarHBondContact O-CG2 3.23Å; L240-V244 PolarHBondContact O-N 3.37Å
241	V	95.6	Very high	91.6	Very high	90 Å²	90	95.2 Å²	95.2	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-62	-44.6	174.4	171.5	0	0	0	0	110.7	T237 V244 I245	T237-V241 WeakPolarHBondContact O-CB 3.3Å; T237-V241 VanDerWaalsContact O-CG2 3.24Å; T237-V241 WeakPolarHBondContact O-CG2 3.31Å; T237-V241 PolarHBondContact O-N 2.95Å; V241-V244 PolarHBondContact O-N 3.49Å; V241-I245 HydrophobicContact CG1-CD1 3.94Å; V241-I245 VanDerWaalsContact O-CG1 3.31Å; V241-I245 WeakPolarHBondContact O-CG1 3.48Å; V241-I245 PolarHBondContact O-N 2.7Å; V241-I245 VanDerWaalsContact O-N 3.07Å
242	G	92.6	Very high	90.7	Very high	36 Å²	36	94.5 Å²	94.5	37%	0.371	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-43.8	175.8	0	0	0	0	0	113.2	V238 F239 I245 H246	V238-G242 PolarHBondContact O-N 2.69Å; F239-G242 PolarHBondContact O-N 2.82Å; G242-I245 PolarHBondContact O-N 3.09Å; G242-H246 WeakPolarHBondContact O-CB 3.37Å; G242-H246 PolarHBondContact O-N 3.44Å
243	A	93.8	Very high	89.3	Confident	35 Å²	35	91.2 Å²	91.2	29%	0.289	51%	0.512	S	S	.	.	H	α-helix	trans	-63.4	-42	177.7	0	0	0	0	0	112.2	F239 L240 I245 H246 L247	F239-A243 WeakPolarHBondContact O-CB 3.39Å; F239-A243 PolarHBondContact O-N 2.81Å; L240-A243 PolarHBondContact O-N 3.39Å; A243-I245 PolarHBondContact O-N 2.81Å; A243-H246 PolarHBondContact O-N 2.79Å; A243-L247 WeakPolarHBondContact O-CB 3.1Å; A243-L247 VanDerWaalsContact O-CG 3.26Å; A243-L247 WeakPolarHBondContact O-CG 3.37Å; A243-L247 PolarHBondContact O-N 3.45Å
244	V	93.5	Very high	88.1	Confident	79 Å²	79	91.2 Å²	91.2	48%	0.479	52%	0.516	S	S	.	.	H	α-helix	trans	-63.7	-40.7	176.1	171.5	0	0	0	0	111.4	L240 V241 K248	L240-V244 WeakPolarHBondContact O-CG2 3.23Å; L240-V244 PolarHBondContact O-N 3.37Å; V241-V244 PolarHBondContact O-N 3.49Å; V244-K248 HydrophobicContact CG1-CD 4.49Å; V244-K248 WeakPolarHBondContact O-CB 3.27Å; V244-K248 WeakPolarHBondContact O-CG 3.3Å; V244-K248 PolarHBondContact O-N 3.3Å
245	I	90.8	Very high	86.3	Confident	110 Å²	110	93.1 Å²	93.1	56%	0.564	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-44.7	175.5	-67	166.7	0	0	0	110.6	V241 G242 A243 K248 A249	V241-I245 HydrophobicContact CG1-CD1 3.94Å; V241-I245 VanDerWaalsContact O-CG1 3.31Å; V241-I245 WeakPolarHBondContact O-CG1 3.48Å; V241-I245 PolarHBondContact O-N 2.7Å; V241-I245 VanDerWaalsContact O-N 3.07Å; G242-I245 PolarHBondContact O-N 3.09Å; A243-I245 PolarHBondContact O-N 2.81Å; I245-K248 PolarHBondContact O-N 3.04Å; I245-A249 PolarHBondContact O-N 3.11Å
246	H	89.5	Confident	84.4	Confident	108 Å²	108	96.3 Å²	96.3	50%	0.5	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-43.8	178.7	-175.9	-89.7	0	0	0	112.6	G242 A243 K248 A249 Q250	G242-H246 WeakPolarHBondContact O-CB 3.37Å; G242-H246 PolarHBondContact O-N 3.44Å; A243-H246 PolarHBondContact O-N 2.79Å; H246-K248 VanDerWaalsContact C-N 3.31Å; H246-K248 PolarHBondContact O-N 2.83Å; H246-A249 PolarHBondContact O-N 3.34Å; H246-A249 VanDerWaalsContact O-N 3.16Å; H246-Q250 VanDerWaalsContact CE1-CD 3.49Å; H246-Q250 PolarHBondContact CE1-NE2 2.87Å; H246-Q250 VanDerWaalsContact CE1-NE2 3.26Å; H246-Q250 PolarHBondContact O-N 3.3Å
247	L	90.2	Very high	81.8	Confident	111 Å²	111	100.9 Å²	100.9	58%	0.581	55%	0.553	S	S	*	*	H	α-helix	trans	-61.8	-39.3	175.2	-73.3	168.1	0	0	0	111.7	A243 K251	A243-L247 WeakPolarHBondContact O-CB 3.1Å; A243-L247 VanDerWaalsContact O-CG 3.26Å; A243-L247 WeakPolarHBondContact O-CG 3.37Å; A243-L247 PolarHBondContact O-N 3.45Å; L247-K251 WeakPolarHBondContact O-CB 3.47Å; L247-K251 PolarHBondContact O-N 3.33Å
248	K	87.3	Confident	79.4	Confident	150 Å²	150	102.6 Å²	102.6	65%	0.652	57%	0.565	S	S	*	*	H	α-helix	trans	-65	-40.2	172.7	-77.2	-177.6	177.7	-176.8	0	112.2	V244 I245 H246 K251 A252	V244-K248 HydrophobicContact CG1-CD 4.49Å; V244-K248 WeakPolarHBondContact O-CB 3.27Å; V244-K248 WeakPolarHBondContact O-CG 3.3Å; V244-K248 PolarHBondContact O-N 3.3Å; I245-K248 PolarHBondContact O-N 3.04Å; H246-K248 VanDerWaalsContact C-N 3.31Å; H246-K248 PolarHBondContact O-N 2.83Å; K248-K251 PolarHBondContact O-N 3.47Å; K248-A252 PolarHBondContact O-N 2.77Å; K248-A252 VanDerWaalsContact O-N 3.09Å
249	A	83.4	Confident	77.1	Confident	58 Å²	58	101.1 Å²	101.1	48%	0.479	57%	0.571	S	S	.	*	H	α-helix	trans	-65.9	-42.8	177.2	0	0	0	0	0	112.5	I245 H246 A252 S253	I245-A249 PolarHBondContact O-N 3.11Å; H246-A249 PolarHBondContact O-N 3.34Å; H246-A249 VanDerWaalsContact O-N 3.16Å; A249-A252 PolarHBondContact O-N 2.79Å; A249-S253 PolarHBondContact O-N 3.15Å; A249-S253 PolarHBondContact O-OG 3.49Å
250	Q	81.7	Confident	74.5	Confident	102 Å²	102	101.8 Å²	101.8	48%	0.477	58%	0.581	S	S	.	*	H	α-helix	trans	-63.3	-41.4	175.1	-78.7	-168.1	-24.7	0	0	112.4	H246 A252 S253 V254	H246-Q250 VanDerWaalsContact CE1-CD 3.49Å; H246-Q250 PolarHBondContact CE1-NE2 2.87Å; H246-Q250 VanDerWaalsContact CE1-NE2 3.26Å; H246-Q250 PolarHBondContact O-N 3.3Å; Q250-A252 VanDerWaalsContact C-N 3.31Å; Q250-A252 PolarHBondContact O-N 3.47Å; Q250-S253 WeakPolarHBondContact CA-OG 3.27Å; Q250-S253 PolarHBondContact O-N 3.45Å; Q250-S253 PolarHBondContact O-OG 2.61Å; Q250-V254 WeakPolarHBondContact O-CG2 3.39Å; Q250-V254 PolarHBondContact O-N 2.83Å; Q250-V254 VanDerWaalsContact O-N 3.11Å
251	K	78.2	Confident	71.8	Confident	149 Å²	149	105.8 Å²	105.8	65%	0.648	60%	0.597	S	S	*	*	H	α-helix	trans	-61	-42.9	176.3	-167.5	176.1	-178.9	-177.5	0	111.1	L247 K248 V254 E255	L247-K251 WeakPolarHBondContact O-CB 3.47Å; L247-K251 PolarHBondContact O-N 3.33Å; K248-K251 PolarHBondContact O-N 3.47Å; K251-V254 PolarHBondContact O-N 2.9Å; K251-E255 PolarHBondContact O-N 3.45Å
252	A	73.6	Confident	69.3	Low	48 Å²	48	106.2 Å²	106.2	40%	0.397	61%	0.61	S	S	.	*	H	α-helix	trans	-64.8	-39.1	176	0	0	0	0	0	113.1	K248 A249 Q250 V254 E255 T256	K248-A252 PolarHBondContact O-N 2.77Å; K248-A252 VanDerWaalsContact O-N 3.09Å; A249-A252 PolarHBondContact O-N 2.79Å; Q250-A252 VanDerWaalsContact C-N 3.31Å; Q250-A252 PolarHBondContact O-N 3.47Å; A252-V254 PolarHBondContact O-N 3.27Å; A252-E255 PolarHBondContact O-N 3.03Å; A252-T256 PolarHBondContact O-N 2.66Å; A252-T256 PolarHBondContact O-OG1 2.81Å
253	S	64.9	Low	67	Low	69 Å²	69	110.1 Å²	110.1	48%	0.483	63%	0.632	S	S	.	*	H	α-helix	trans	-67.9	-34.5	178.3	57.9	0	0	0	0	113.3	A249 Q250 E255 T256 Q257	A249-S253 PolarHBondContact O-N 3.15Å; A249-S253 PolarHBondContact O-OG 3.49Å; Q250-S253 WeakPolarHBondContact CA-OG 3.27Å; Q250-S253 PolarHBondContact O-N 3.45Å; Q250-S253 PolarHBondContact O-OG 2.61Å; S253-E255 VanDerWaalsContact C-N 3.34Å; S253-T256 PolarHBondContact O-N 2.75Å; S253-Q257 PolarHBondContact O-N 3.19Å
254	V	68.3	Low	64.6	Low	111 Å²	111	120.3 Å²	120.3	67%	0.673	66%	0.663	S	S	*	*	H	α-helix	trans	-66.5	-39.4	174.3	172.7	0	0	0	0	110.7	Q250 K251 A252 T256 Q257	Q250-V254 WeakPolarHBondContact O-CG2 3.39Å; Q250-V254 PolarHBondContact O-N 2.83Å; Q250-V254 VanDerWaalsContact O-N 3.11Å; K251-V254 PolarHBondContact O-N 2.9Å; A252-V254 PolarHBondContact O-N 3.27Å; V254-T256 VanDerWaalsContact C-N 3.32Å; V254-T256 PolarHBondContact O-N 2.66Å; V254-Q257 PolarHBondContact O-N 2.73Å
255	E	57.9	Low	62.3	Low	155 Å²	155	120.8 Å²	120.8	72%	0.724	68%	0.675	S	S	*	*	H	α-helix	trans	-72.1	-26	178.1	-126.1	156.1	-167.7	0	0	112.8	K251 A252 S253 Q257	K251-E255 PolarHBondContact O-N 3.45Å; A252-E255 PolarHBondContact O-N 3.03Å; S253-E255 VanDerWaalsContact C-N 3.34Å; E255-Q257 VanDerWaalsContact C-N 3.34Å
256	T	54.9	Low	60	Low	110 Å²	110	123.5 Å²	123.5	68%	0.675	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	10.1	179.2	-32.4	0	0	0	0	113.3	A252 S253 V254 P258	A252-T256 PolarHBondContact O-N 2.66Å; A252-T256 PolarHBondContact O-OG1 2.81Å; S253-T256 PolarHBondContact O-N 2.75Å; V254-T256 VanDerWaalsContact C-N 3.32Å; V254-T256 PolarHBondContact O-N 2.66Å; T256-P258 WeakPolarHBondContact O-CD 3.47Å
257	Q	42.3	Very low	57.9	Low	166 Å²	166	126.7 Å²	126.7	78%	0.776	71%	0.709	S	S	*	*			trans	-102.1	81.3	170.7	-139.6	176.6	-20.9	0	0	109.8	S253 V254 E255 G259	S253-Q257 PolarHBondContact O-N 3.19Å; V254-Q257 PolarHBondContact O-N 2.73Å; E255-Q257 VanDerWaalsContact C-N 3.34Å; Q257-G259 PolarHBondContact O-N 3.33Å; Q257-G259 VanDerWaalsContact O-N 3.12Å
258	P	43.7	Very low	55.8	Low	112 Å²	112	126.4 Å²	126.4	73%	0.727	71%	0.714	S	S	*	*			trans	-68.7	111.6	170.7	28.4	-30.5	0	0	0	107.8	T256 N260	T256-P258 WeakPolarHBondContact O-CD 3.47Å; P258-N260 PolarHBondContact O-N 3.42Å
259	G	45.4	Very low	54.1	Low	74 Å²	74	125.1 Å²	125.1	76%	0.763	72%	0.721	S	S	*	*			trans	-58.9	105	170.5	0	0	0	0	0	110.3	Q257 E261	Q257-G259 PolarHBondContact O-N 3.33Å; Q257-G259 VanDerWaalsContact O-N 3.12Å; G259-E261 PolarHBondContact O-N 3.38Å
260	N	40.9	Very low	52.3	Low	159 Å²	159	131.6 Å²	131.6	85%	0.85	74%	0.741	S	S	*	*			trans	-61.5	83.3	152.9	-95.2	-18.8	0	0	0	108.3	P258	P258-N260 PolarHBondContact O-N 3.42Å
261	E	40.3	Very low	50.7	Low	189 Å²	189	131.5 Å²	131.5	88%	0.883	75%	0.749	S	S	*	*			trans	-175	94.4	159	-110.4	145.3	-169.5	0	0	111.3	G259	G259-E261 PolarHBondContact O-N 3.38Å
262	A	43.1	Very low	49.5	Very low	99 Å²	99	139.4 Å²	139.4	82%	0.818	78%	0.777	S	S	*	*			trans	171.4	63.7	140.6	0	0	0	0	0	109.6
263	S	43.7	Very low	48.3	Very low	118 Å²	118	144 Å²	144	83%	0.825	80%	0.796	S	S	*	*	S	Bend	trans	-145.2	62.6	167.7	-61.4	0	0	0	0	109.5
264	R	43.6	Very low	47.4	Very low	250 Å²	250	147.9 Å²	147.9	94%	0.943	81%	0.813	S	S	*	*			trans	-174.1	66.3	161.7	-104.5	166.7	-161.4	178.9	6.1	110.6
265	A	43.7	Very low	46.3	Very low	88 Å²	88	149.9 Å²	149.9	73%	0.727	82%	0.82	S	S	*	*			trans	-133.4	95.5	155.8	0	0	0	0	0	105.5
266	L	44	Very low	45.6	Very low	168 Å²	168	149.6 Å²	149.6	88%	0.88	83%	0.826	S	S	*	*				69.4	81.9	104.7	-71.8	163.3	0	0	0	111.5
267	L	45.7	Very low	45	Very low	174 Å²	174	152.1 Å²	152.1	91%	0.911	84%	0.836	S	S	*	*			trans	-101.1	113.2	153.9	-82.9	165.9	0	0	0	107.7
268	P	46.1	Very low	45.2	Very low	106 Å²	106	151.2 Å²	151.2	69%	0.688	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-80.2	159.4	172.5	33.6	-31.4	0	0	0	110.8
269	P	50.7	Low	45.3	Very low	123 Å²	123	154 Å²	154	80%	0.799	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-83.4	134.7	-175.3	32.9	-31	0	0	0	111
270	H	46.2	Very low	45.3	Very low	194 Å²	194	160.2 Å²	160.2	90%	0.898	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-91.1	129.8	168.1	-99.3	-38.9	0	0	0	110.9
271	P	46.6	Very low	45.6	Very low	100 Å²	100	160.3 Å²	160.3	65%	0.649	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-98.1	131.5	168.9	34.3	-25.6	0	0	0	110.9
272	Y	53.9	Low	46.1	Very low	314 Å²	314	157.6 Å²	157.6	100%	1.231	85%	0.852	S	S	*	*			trans	-173.8	0	135.5	-97	-67.9	0	0	0	108.8

Retrieved 272 of 272 residues in 123.2 ms (Link to these results)

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