A0A077Z8T7_TRITR Loading...

Protein cbg

AlphaFold DB , UniProt , Accession A0A077Z8T7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 437 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50	Low	65.9	Low	201 Å²	201	121.1 Å²	121.1	99%	0.99	63%	0.634	S	S	*	*				0	127.1	0	-72.2	-82	178.2	0	0	106.8
2	P	55.3	Low	66	Low	105 Å²	105	118.8 Å²	118.8	68%	0.682	62%	0.622	S	S	*	*			cis	-130.6	111.5	46.2	34.6	-16.2	0	0	0	114
3	H	63.2	Low	65.8	Low	140 Å²	140	116.8 Å²	116.8	65%	0.648	61%	0.611	S	S	*	*			trans	-84.3	-15.6	169.2	-75.5	-69.4	0	0	0	113	A5 L6	H3-A5 PolarHBondContact O-N 3.35Å; H3-L6 PolarHBondContact O-N 3Å
4	W	64.7	Low	65.4	Low	199 Å²	199	112.9 Å²	112.9	75%	0.754	61%	0.605	S	S	*	*	H	α-helix	trans	-68.6	-31.2	-176.4	-64.8	89.5	0	0	0	113.6	L6	W4-L6 VanDerWaalsContact C-N 3.3Å; W4-L6 PolarHBondContact O-N 3.24Å
5	A	66.8	Low	64.7	Low	67 Å²	67	113.9 Å²	113.9	55%	0.554	61%	0.609	S	S	*	*	H	α-helix	trans	-67.9	-30.2	178.4	0	0	0	0	0	112.8	H3 L9	H3-A5 PolarHBondContact O-N 3.35Å; A5-L9 PolarHBondContact O-N 3.03Å
6	L	68.3	Low	63.9	Low	117 Å²	117	117.1 Å²	117.1	61%	0.613	62%	0.616	S	S	*	*	H	α-helix	trans	-71.4	-38.3	-177.7	-150.8	81.9	0	0	0	111.6	H3 W4 L9 T10	H3-L6 PolarHBondContact O-N 3Å; W4-L6 VanDerWaalsContact C-N 3.3Å; W4-L6 PolarHBondContact O-N 3.24Å; L6-L9 PolarHBondContact O-N 2.95Å; L6-T10 WeakPolarHBondContact O-CG2 3.42Å; L6-T10 PolarHBondContact O-N 2.99Å; L6-T10 VanDerWaalsContact O-N 3.15Å; L6-T10 PolarHBondContact O-OG1 3.02Å
7	F	69.8	Low	63.1	Low	157 Å²	157	120.1 Å²	120.1	69%	0.689	62%	0.623	S	S	*	*	H	α-helix	trans	-69.9	-36.2	-177.5	-83.8	-76.9	0	0	0	113.4	T10 G11	F7-T10 WeakPolarHBondContact CA-OG1 3.26Å; F7-T10 PolarHBondContact O-OG1 3.45Å; F7-G11 PolarHBondContact O-N 2.97Å; F7-G11 VanDerWaalsContact O-N 3.1Å
8	I	73.5	Confident	62.3	Low	120 Å²	120	120 Å²	120	62%	0.615	63%	0.629	S	S	*	*	H	α-helix	trans	-68.5	-39.6	178	-60.9	174	0	0	0	110.3	G11 L12	I8-G11 PolarHBondContact O-N 2.98Å; I8-L12 HydrophobicContact CG2-CD1 4.17Å; I8-L12 PolarHBondContact O-N 2.77Å; I8-L12 VanDerWaalsContact O-N 3.15Å
9	L	70	Confident	61.5	Low	113 Å²	113	118.7 Å²	118.7	59%	0.592	63%	0.631	S	S	*	*	H	α-helix	trans	-66.3	-40.8	178.5	-164.6	74.1	0	0	0	112	A5 L6 L13	A5-L9 PolarHBondContact O-N 3.03Å; L6-L9 PolarHBondContact O-N 2.95Å; L9-L13 HydrophobicContact CG-CD1 4.41Å; L9-L13 PolarHBondContact O-N 2.9Å; L9-L13 VanDerWaalsContact O-N 3.11Å
10	T	74	Confident	60.7	Low	78 Å²	78	116.8 Å²	116.8	48%	0.479	63%	0.633	S	S	.	*	H	α-helix	trans	-67.5	-35.1	176.4	50.1	0	0	0	0	112.7	L6 F7 L13 A14	L6-T10 WeakPolarHBondContact O-CG2 3.42Å; L6-T10 PolarHBondContact O-N 2.99Å; L6-T10 VanDerWaalsContact O-N 3.15Å; L6-T10 PolarHBondContact O-OG1 3.02Å; F7-T10 WeakPolarHBondContact CA-OG1 3.26Å; F7-T10 PolarHBondContact O-OG1 3.45Å; T10-L13 PolarHBondContact O-N 3.38Å; T10-A14 PolarHBondContact O-N 3.13Å
11	G	69.5	Low	60	Low	35 Å²	35	116.4 Å²	116.4	36%	0.361	65%	0.646	S	S	.	*	H	α-helix	trans	-66.9	-41.2	177.5	0	0	0	0	0	112.9	F7 I8 A14 L15	F7-G11 PolarHBondContact O-N 2.97Å; F7-G11 VanDerWaalsContact O-N 3.1Å; I8-G11 PolarHBondContact O-N 2.98Å; G11-A14 PolarHBondContact O-N 2.9Å; G11-L15 PolarHBondContact O-N 2.92Å
12	L	66.4	Low	59.7	Low	93 Å²	93	111.6 Å²	111.6	49%	0.487	63%	0.628	S	S	.	*	H	α-helix	trans	-66.7	-40	175.1	-85.9	154.5	0	0	0	112.1	I8 A14 L15 F16	I8-L12 HydrophobicContact CG2-CD1 4.17Å; I8-L12 PolarHBondContact O-N 2.77Å; I8-L12 VanDerWaalsContact O-N 3.15Å; L12-A14 PolarHBondContact O-N 3.19Å; L12-L15 PolarHBondContact O-N 3.37Å; L12-F16 WeakPolarHBondContact O-CD2 3.19Å; L12-F16 PolarHBondContact O-N 2.92Å; L12-F16 VanDerWaalsContact O-N 3.14Å
13	L	64.1	Low	59	Low	93 Å²	93	111 Å²	111	49%	0.487	63%	0.626	S	S	.	*	H	α-helix	trans	-62.5	-39.7	174.7	-92.7	152.1	0	0	0	112.3	L9 T10 L15 F16 F17	L9-L13 HydrophobicContact CG-CD1 4.41Å; L9-L13 PolarHBondContact O-N 2.9Å; L9-L13 VanDerWaalsContact O-N 3.11Å; T10-L13 PolarHBondContact O-N 3.38Å; L13-L15 PolarHBondContact O-N 3.31Å; L13-F16 PolarHBondContact O-N 2.9Å; L13-F17 HydrophobicContact CD2-CE2 4.19Å; L13-F17 WeakPolarHBondContact O-CD2 3.47Å; L13-F17 PolarHBondContact O-N 3.19Å
14	A	60.7	Low	58.5	Low	63 Å²	63	112.7 Å²	112.7	52%	0.521	63%	0.632	S	S	.	*	H	α-helix	trans	-66.8	-35	178	0	0	0	0	0	113.1	T10 G11 L12 F17	T10-A14 PolarHBondContact O-N 3.13Å; G11-A14 PolarHBondContact O-N 2.9Å; L12-A14 PolarHBondContact O-N 3.19Å; A14-F17 PolarHBondContact O-N 2.93Å
15	L	54.2	Low	58.9	Low	127 Å²	127	106.2 Å²	106.2	67%	0.665	63%	0.626	S	S	*	*	H	α-helix	trans	-73.3	-27.4	176.2	-79.8	160.8	0	0	0	113.1	G11 L12 L13 T18	G11-L15 PolarHBondContact O-N 2.92Å; L12-L15 PolarHBondContact O-N 3.37Å; L13-L15 PolarHBondContact O-N 3.31Å; L15-T18 PolarHBondContact O-OG1 2.91Å
16	F	51.7	Low	59.6	Low	166 Å²	166	104.5 Å²	104.5	73%	0.728	61%	0.608	S	S	*	*	H	α-helix	trans	-78.5	-19.7	173.9	-93.8	-81.2	0	0	0	113.6	L12 L13	L12-F16 WeakPolarHBondContact O-CD2 3.19Å; L12-F16 PolarHBondContact O-N 2.92Å; L12-F16 VanDerWaalsContact O-N 3.14Å; L13-F16 PolarHBondContact O-N 2.9Å
17	F	50.2	Low	60.4	Low	168 Å²	168	102.2 Å²	102.2	74%	0.737	60%	0.602	S	S	*	*	S	Bend	trans	-87.2	-9.1	-179.7	-95.2	-76.7	0	0	0	114.9	L13 A14	L13-F17 HydrophobicContact CD2-CE2 4.19Å; L13-F17 WeakPolarHBondContact O-CD2 3.47Å; L13-F17 PolarHBondContact O-N 3.19Å; A14-F17 PolarHBondContact O-N 2.93Å
18	T	49.8	Very low	61.2	Low	118 Å²	118	96.4 Å²	96.4	72%	0.724	58%	0.577	S	S	*	*	S	Bend	trans	-94.1	5.3	-177.4	49.2	0	0	0	0	115.5	L15	L15-T18 PolarHBondContact O-OG1 2.91Å
19	S	46.6	Very low	61.7	Low	96 Å²	96	93.9 Å²	93.9	67%	0.671	57%	0.57	S	S	*	*	S	Bend	trans	-134.6	64.4	-178.5	57.6	0	0	0	0	114.8
20	A	45.6	Very low	62.4	Low	80 Å²	80	91.7 Å²	91.7	66%	0.661	56%	0.564	S	S	*	*			trans	-168.1	51	151.2	0	0	0	0	0	113.2	T22	A20-T22 PolarHBondContact O-N 3.08Å
21	A	45.3	Very low	63	Low	109 Å²	109	96.3 Å²	96.3	90%	0.901	58%	0.581	S	S	*	*			trans	-82.5	55.1	148.2	0	0	0	0	0	108.3	S23	A21-S23 PolarHBondContact O-N 2.75Å
22	T	44.1	Very low	64	Low	100 Å²	100	95.4 Å²	95.4	61%	0.613	57%	0.568	S	S	*	*			trans	-64.4	106.8	165.8	32.2	0	0	0	0	106.6	A20 F24	A20-T22 PolarHBondContact O-N 3.08Å; T22-F24 VanDerWaalsContact C-N 3.27Å; T22-F24 WeakPolarHBondContact O-CD2 3.48Å; T22-F24 PolarHBondContact O-N 3.45Å
23	S	41.6	Very low	65.2	Low	92 Å²	92	96 Å²	96	64%	0.643	57%	0.572	S	S	*	*			trans	-55.5	94.3	167	-178.2	0	0	0	0	108	A21 G25	A21-S23 PolarHBondContact O-N 2.75Å; S23-G25 PolarHBondContact O-N 3.44Å
24	F	52.4	Low	66.6	Low	176 Å²	176	94 Å²	94	77%	0.772	56%	0.563	S	S	*	*			trans	-58.8	124.5	162.5	-77	-86.8	0	0	0	105.9	T22	T22-F24 VanDerWaalsContact C-N 3.27Å; T22-F24 WeakPolarHBondContact O-CD2 3.48Å; T22-F24 PolarHBondContact O-N 3.45Å
25	G	71.4	Confident	68.2	Low	62 Å²	62	94.3 Å²	94.3	64%	0.639	55%	0.554	S	S	*	*			trans	-45.9	146	-179.1	0	0	0	0	0	111.8	S23 S27	S23-G25 PolarHBondContact O-N 3.44Å; G25-S27 PolarHBondContact O-N 2.87Å
26	N	82	Confident	70	Confident	32 Å²	32	91 Å²	91	17%	0.171	54%	0.541	C	S	.	.			trans	-51.2	141.6	-179.2	-165.1	1.8	0	0	0	110.6	G48 Q49 P50 F114	N26-G48 PolarHBondContact OD1-N 3.34Å; N26-Q49 HydrophobicContact CB-CB 4.23Å; N26-Q49 PolarHBondContact ND2-O 2.79Å; N26-Q49 PolarHBondContact OD1-N 2.76Å; N26-Q49 PolarHBondContact OD1-O 2.74Å; N26-P50 PolarHBondContact ND2-O 2.77Å; N26-F114 HydrophobicContact CB-CD1 3.89Å; N26-F114 HydrophobicContact CB-CE1 3.82Å; N26-F114 WeakPolarHBondContact O-CE1 3.35Å; N26-F114 WeakPolarHBondContact O-CZ 3.4Å
27	S	85.7	Confident	71.9	Confident	69 Å²	69	88.3 Å²	88.3	48%	0.483	53%	0.526	S	S	.	.			trans	-139.5	161.1	-176.1	60.1	0	0	0	0	110.8	G25 T47 G48	G25-S27 PolarHBondContact O-N 2.87Å; S27-T47 CarbonylContact O-C 3.48Å; S27-T47 WeakPolarHBondContact O-CA 3.07Å; S27-G48 PolarHBondContact O-N 2.86Å
28	I	85.9	Confident	73.5	Confident	34 Å²	34	88.9 Å²	88.9	17%	0.174	53%	0.531	C	S	.	.	B	Isolated β-bridge	trans	-79.4	125.2	176	-53.6	-177.7	0	0	0	108.2	S30 L45 V112 F114 R124 F126	I28-S30 WeakPolarHBondContact CG2-O 3.35Å; I28-L45 HydrophobicContact CD1-CD1 4.48Å; I28-L45 HydrophobicContact CG1-CD1 4.4Å; I28-L45 HydrophobicContact CG2-CD1 4.33Å; I28-V112 HydrophobicContact CD1-CB 4.04Å; I28-V112 HydrophobicContact CD1-CG1 4Å; I28-V112 HydrophobicContact CD1-CG2 4.19Å; I28-F114 HydrophobicContact CG1-CE2 4.19Å; I28-F114 HydrophobicContact CG1-CZ 3.81Å; I28-R124 HydrophobicContact CD1-CB 3.74Å; I28-R124 HydrophobicContact CD1-CG 3.86Å; I28-F126 HydrophobicContact CD1-CE2 3.6Å; I28-F126 HydrophobicContact CD1-CZ 3.67Å
29	S	85	Confident	75.3	Confident	67 Å²	67	92.8 Å²	92.8	47%	0.469	53%	0.532	S	S	.	.			trans	-76.1	-27.2	-174	66.1	0	0	0	0	114.1	R46	S29-R46 WeakPolarHBondContact CB-O 3.44Å; S29-R46 PolarHBondContact N-O 2.92Å; S29-R46 WeakPolarHBondContact OG-CB 3.08Å; S29-R46 WeakPolarHBondContact OG-CG 3.42Å; S29-R46 PolarHBondContact OG-O 2.82Å
30	S	85.1	Confident	77.5	Confident	67 Å²	67	90 Å²	90	47%	0.469	51%	0.509	S	S	.	.	S	Bend	trans	-161	165.4	-173.6	46.5	0	0	0	0	111.4	I28	I28-S30 WeakPolarHBondContact CG2-O 3.35Å
31	E	85.2	Confident	79.7	Confident	176 Å²	176	86.2 Å²	86.2	82%	0.822	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-58.4	136.2	174.2	-168.1	174.7	-178.8	0	0	110.7
32	P	90.4	Very high	82.1	Confident	15 Å²	15	82.8 Å²	82.8	10%	0.097	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-63.8	143.6	-179	26.1	-35.4	0	0	0	111.9	I43 S44 L45 F126	P32-I43 HydrophobicContact CB-CG2 4.03Å; P32-S44 CarbonylContact C-O 3.5Å; P32-S44 WeakPolarHBondContact CA-O 3.32Å; P32-L45 HydrophobicContact CB-CB 4.11Å; P32-F126 VanDerWaalsContact CD-CE1 3.45Å; P32-F126 HydrophobicContact CG-CB 4.42Å; P32-F126 HydrophobicContact CG-CD1 3.73Å; P32-F126 HydrophobicContact CG-CD2 4.09Å; P32-F126 HydrophobicContact CG-CE1 3.91Å; P32-F126 HydrophobicContact CG-CE2 4.25Å; P32-F126 HydrophobicContact CG-CG 3.81Å; P32-F126 HydrophobicContact CG-CZ 4.16Å
33	L	93.3	Very high	84.4	Confident	106 Å²	106	78.1 Å²	78.1	56%	0.555	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	124.7	169.3	-177	70.7	0	0	0	109.3	I43 S44	L33-I43 WeakPolarHBondContact O-CA 3.42Å; L33-S44 PolarHBondContact N-O 3.1Å; L33-S44 PolarHBondContact O-N 3.14Å
34	V	92.7	Very high	86.9	Confident	50 Å²	50	75 Å²	75	30%	0.303	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.1	178.1	-178.1	0	0	0	0	109.3	I41 I128	V34-I41 HydrophobicContact CG1-CG2 3.64Å; V34-I128 HydrophobicContact CG1-CB 4.43Å; V34-I128 HydrophobicContact CG1-CD1 4.43Å; V34-I128 HydrophobicContact CG2-CB 4.37Å; V34-I128 HydrophobicContact CG2-CG2 3.69Å
35	E	94.2	Very high	88.8	Confident	71 Å²	71	67.1 Å²	67.1	33%	0.332	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	109.2	172.8	-66.7	176.4	-170.4	0	0	109.6	R37 I41 K42	E35-R37 HydrophobicContact CB-CG 4.48Å; E35-R37 PolarHBondContact O-N 2.78Å; E35-R37 IonicContact OE2-CZ 2.75Å; E35-R37 IonicContact OE2-NE 3.17Å; E35-R37 PolarHBondContact OE2-NE 3.35Å; E35-R37 VanDerWaalsContact OE2-NE 3.17Å; E35-R37 IonicContact OE2-NH2 2.71Å; E35-R37 PolarHBondContact OE2-NH2 2.74Å; E35-I41 WeakPolarHBondContact O-CA 3.27Å; E35-K42 HydrophobicContact CB-CB 4.2Å; E35-K42 PolarHBondContact N-O 3.45Å; E35-K42 PolarHBondContact O-N 3.26Å
36	C	92.7	Very high	89.8	Confident	58 Å²	58	71 Å²	71	39%	0.392	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	98.1	171.5	-55.8	0	0	0	0	109.3	C130	C36-C130 HydrophobicContact CB-CB 3.68Å; C36-C130 WeakPolarHBondContact CB-SG 3.38Å; C36-C130 VanDerWaalsContact SG-CA 3.51Å; C36-C130 WeakPolarHBondContact SG-CB 3.35Å; C36-C130 CovalentContact SG-SG 2.03Å; C36-C130 PolarHBondContact SG-SG 3.17Å
37	R	90.5	Very high	90.2	Very high	108 Å²	108	69.6 Å²	69.6	41%	0.408	35%	0.346	S	S	.	.			trans	-91.8	171	177.2	-55.5	169.9	172.5	-154.7	-8	109.6	E35 R39 N40 Y88 Y132	E35-R37 HydrophobicContact CB-CG 4.48Å; E35-R37 PolarHBondContact O-N 2.78Å; E35-R37 IonicContact OE2-CZ 2.75Å; E35-R37 IonicContact OE2-NE 3.17Å; E35-R37 PolarHBondContact OE2-NE 3.35Å; E35-R37 VanDerWaalsContact OE2-NE 3.17Å; E35-R37 IonicContact OE2-NH2 2.71Å; E35-R37 PolarHBondContact OE2-NH2 2.74Å; R37-R39 VanDerWaalsContact C-N 3.31Å; R37-R39 PolarHBondContact O-N 3.1Å; R37-N40 CarbonylContact C-O 3.6Å; R37-N40 WeakPolarHBondContact CA-O 3.4Å; R37-N40 VanDerWaalsContact CB-O 3.26Å; R37-N40 WeakPolarHBondContact CB-O 3.39Å; R37-N40 WeakPolarHBondContact CD-OD1 3.4Å; R37-N40 PolarHBondContact N-O 3.17Å; R37-Y88 WeakPolarHBondContact O-CE2 3.04Å; R37-Y88 VanDerWaalsContact O-CZ 3.31Å; R37-Y88 PolarHBondContact O-OH 3.31Å; R37-Y132 PolarHBondContact O-OH 2.71Å
38	E	84.5	Confident	90.3	Very high	181 Å²	181	68.8 Å²	68.8	85%	0.846	35%	0.349	S	S	*	.	S	Bend	trans	-58.2	-35.5	-175.7	-65.1	178.5	-179.5	0	0	114.8
39	R	87.3	Confident	90.4	Very high	199 Å²	199	71.2 Å²	71.2	75%	0.751	36%	0.359	S	S	*	.	S	Bend	trans	-116.6	-20.8	-176.3	-64.9	-173.8	-178.8	-172.3	0.1	114.9	R37 Y88	R37-R39 VanDerWaalsContact C-N 3.31Å; R37-R39 PolarHBondContact O-N 3.1Å; R39-Y88 VanDerWaalsContact C-CE2 3.42Å; R39-Y88 WeakPolarHBondContact O-CD2 3.34Å; R39-Y88 PolarHBondContact O-N 2.86Å
40	N	92.6	Very high	90.5	Very high	37 Å²	37	70.5 Å²	70.5	20%	0.198	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	166.6	-174.5	47.6	51	0	0	0	112.3	R37 V85 M86 D87 Y88	R37-N40 CarbonylContact C-O 3.6Å; R37-N40 WeakPolarHBondContact CA-O 3.4Å; R37-N40 VanDerWaalsContact CB-O 3.26Å; R37-N40 WeakPolarHBondContact CB-O 3.39Å; R37-N40 WeakPolarHBondContact CD-OD1 3.4Å; R37-N40 PolarHBondContact N-O 3.17Å; N40-V85 HydrophobicContact CB-CG1 3.7Å; N40-M86 CarbonylContact C-O 3.59Å; N40-M86 WeakPolarHBondContact CA-O 3.13Å; N40-M86 WeakPolarHBondContact CB-O 3.39Å; N40-D87 WeakPolarHBondContact CB-OD1 3.21Å; N40-Y88 PolarHBondContact O-OH 3.28Å
41	I	91.9	Very high	90.7	Very high	1 Å²	1	67.4 Å²	67.4	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.2	174.7	-52.8	164.7	0	0	0	107.1	V34 E35 I43 V85 M86 Y88 I128	V34-I41 HydrophobicContact CG1-CG2 3.64Å; E35-I41 WeakPolarHBondContact O-CA 3.27Å; I41-I43 HydrophobicContact CB-CD1 4.44Å; I41-I43 HydrophobicContact CG2-CD1 3.99Å; I41-I43 HydrophobicContact CG2-CG1 4.24Å; I41-V85 WeakPolarHBondContact O-CA 3.48Å; I41-M86 HydrophobicContact CB-CE 4.07Å; I41-M86 HydrophobicContact CB-CG 4.21Å; I41-M86 HydrophobicContact CD1-CE 3.41Å; I41-M86 VanDerWaalsContact CD1-CE 3.41Å; I41-M86 HydrophobicContact CG1-CE 4.29Å; I41-M86 HydrophobicContact CG2-CE 4.45Å; I41-M86 PolarHBondContact N-O 3.31Å; I41-M86 PolarHBondContact O-N 3.27Å; I41-Y88 HydrophobicContact CD1-CD1 3.76Å; I41-Y88 HydrophobicContact CD1-CE1 3.43Å; I41-Y88 VanDerWaalsContact CD1-CE1 3.43Å; I41-Y88 HydrophobicContact CG1-CD1 3.84Å; I41-Y88 HydrophobicContact CG1-CE1 3.19Å; I41-I128 HydrophobicContact CD1-CD1 4.27Å; I41-I128 HydrophobicContact CG2-CD1 3.73Å
42	K	94.6	Very high	90.8	Very high	37 Å²	37	65.2 Å²	65.2	16%	0.161	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126.5	171.8	175.3	-179.5	178.2	175.5	0	109	E35 S44 E83 V85	E35-K42 HydrophobicContact CB-CB 4.2Å; E35-K42 PolarHBondContact N-O 3.45Å; E35-K42 PolarHBondContact O-N 3.26Å; K42-S44 WeakPolarHBondContact CE-OG 3.46Å; K42-E83 WeakPolarHBondContact CE-OE2 3.19Å; K42-E83 IonicContact NZ-OE2 2.93Å; K42-E83 PolarHBondContact NZ-OE2 3.24Å; K42-V85 HydrophobicContact CB-CG2 4.14Å; K42-V85 HydrophobicContact CG-CG2 4.13Å
43	I	94.4	Very high	90.8	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.2	177.2	-54.9	96.6	0	0	0	107.9	P32 L33 I41 M55 E83 M84 M86 V110 I128	P32-I43 HydrophobicContact CB-CG2 4.03Å; L33-I43 WeakPolarHBondContact O-CA 3.42Å; I41-I43 HydrophobicContact CB-CD1 4.44Å; I41-I43 HydrophobicContact CG2-CD1 3.99Å; I41-I43 HydrophobicContact CG2-CG1 4.24Å; I43-M55 HydrophobicContact CG2-CE 4.44Å; I43-E83 CarbonylContact O-C 3.57Å; I43-E83 VanDerWaalsContact O-CA 3.23Å; I43-E83 WeakPolarHBondContact O-CA 3.43Å; I43-M84 HydrophobicContact CB-CG 3.93Å; I43-M84 HydrophobicContact CD1-CG 3.83Å; I43-M84 HydrophobicContact CD1-SD 4.31Å; I43-M84 HydrophobicContact CG1-CG 4.45Å; I43-M84 PolarHBondContact N-O 2.83Å; I43-M84 PolarHBondContact O-N 3.46Å; I43-M86 HydrophobicContact CD1-CE 4.31Å; I43-M86 HydrophobicContact CD1-CG 4.33Å; I43-V110 HydrophobicContact CD1-CG2 4.07Å; I43-V110 HydrophobicContact CG1-CG2 4.2Å; I43-I128 HydrophobicContact CD1-CD1 3.85Å; I43-I128 HydrophobicContact CG1-CD1 3.82Å
44	S	93.9	Very high	90.7	Very high	28 Å²	28	62 Å²	62	20%	0.196	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.3	178.5	-66.5	0	0	0	0	109.9	P32 L33 K42 I82	P32-S44 CarbonylContact C-O 3.5Å; P32-S44 WeakPolarHBondContact CA-O 3.32Å; L33-S44 PolarHBondContact N-O 3.1Å; L33-S44 PolarHBondContact O-N 3.14Å; K42-S44 WeakPolarHBondContact CE-OG 3.46Å; S44-I82 WeakPolarHBondContact CA-O 3Å
45	L	91.7	Very high	90.7	Very high	9 Å²	9	59.6 Å²	59.6	5%	0.047	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	159.8	177.1	69.9	120.5	0	0	0	111.8	I28 P32 T47 M55 N81 I82 V112	I28-L45 HydrophobicContact CD1-CD1 4.48Å; I28-L45 HydrophobicContact CG1-CD1 4.4Å; I28-L45 HydrophobicContact CG2-CD1 4.33Å; P32-L45 HydrophobicContact CB-CB 4.11Å; L45-T47 HydrophobicContact CD1-CG2 3.77Å; L45-M55 HydrophobicContact CD2-CE 3.14Å; L45-M55 HydrophobicContact CD2-CG 4.47Å; L45-M55 HydrophobicContact CD2-SD 3.52Å; L45-M55 VanDerWaalsContact CD2-SD 3.52Å; L45-N81 WeakPolarHBondContact O-CA 3.28Å; L45-I82 HydrophobicContact CD1-CD1 3.72Å; L45-I82 HydrophobicContact CD1-CG1 3.72Å; L45-I82 HydrophobicContact CD2-CD1 3.89Å; L45-I82 HydrophobicContact CD2-CG1 3.65Å; L45-I82 HydrophobicContact CG-CD1 3.87Å; L45-I82 HydrophobicContact CG-CG1 3.39Å; L45-I82 PolarHBondContact N-O 2.78Å; L45-I82 PolarHBondContact O-N 2.79Å; L45-V112 HydrophobicContact CD1-CG1 4.33Å; L45-V112 HydrophobicContact CD2-CG2 4.04Å
46	R	91.6	Very high	90.8	Very high	145 Å²	145	56.9 Å²	56.9	55%	0.547	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.9	178.8	-176.7	174.9	179.8	-176.5	0.1	110.7	S29 T80 N81	S29-R46 WeakPolarHBondContact CB-O 3.44Å; S29-R46 PolarHBondContact N-O 2.92Å; S29-R46 WeakPolarHBondContact OG-CB 3.08Å; S29-R46 WeakPolarHBondContact OG-CG 3.42Å; S29-R46 PolarHBondContact OG-O 2.82Å; R46-T80 CarbonylContact C-O 3.59Å; R46-T80 VanDerWaalsContact CA-O 3.29Å; R46-T80 WeakPolarHBondContact CA-O 3.07Å; R46-N81 WeakPolarHBondContact CB-OD1 3.48Å; R46-N81 VanDerWaalsContact CG-OD1 3.29Å; R46-N81 WeakPolarHBondContact CG-OD1 3.38Å
47	T	90.7	Very high	90.9	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.012	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-98.8	159.1	176	56.4	0	0	0	0	111.5	S27 L45 Q49 F51 T80 F114	S27-T47 CarbonylContact O-C 3.48Å; S27-T47 WeakPolarHBondContact O-CA 3.07Å; L45-T47 HydrophobicContact CD1-CG2 3.77Å; T47-Q49 WeakPolarHBondContact CB-O 3.39Å; T47-Q49 PolarHBondContact OG1-O 3.36Å; T47-F51 HydrophobicContact CG2-CB 4.11Å; T47-F51 HydrophobicContact CG2-CD2 3.87Å; T47-F51 HydrophobicContact CG2-CG 4.27Å; T47-T80 PolarHBondContact N-O 2.97Å; T47-T80 WeakPolarHBondContact O-CB 3.39Å; T47-T80 WeakPolarHBondContact O-CG2 3.49Å; T47-T80 PolarHBondContact OG1-O 3Å; T47-T80 VanDerWaalsContact OG1-O 3.14Å; T47-F114 HydrophobicContact CG2-CE1 4.34Å
48	G	87.9	Confident	90.8	Very high	52 Å²	52	51.5 Å²	51.5	54%	0.536	24%	0.244	S	C	.	.	S	Bend	trans	-68.8	-37.8	177.7	0	0	0	0	0	112.9	N26 S27	N26-G48 PolarHBondContact OD1-N 3.34Å; S27-G48 PolarHBondContact O-N 2.86Å
49	Q	87.4	Confident	91.1	Very high	84 Å²	84	46.4 Å²	46.4	39%	0.393	24%	0.24	S	C	.	.	S	Bend	trans	-124.5	165.9	178.2	-62.8	176.5	-8.8	0	0	110.2	N26 T47 F51	N26-Q49 HydrophobicContact CB-CB 4.23Å; N26-Q49 PolarHBondContact ND2-O 2.79Å; N26-Q49 PolarHBondContact OD1-N 2.76Å; N26-Q49 PolarHBondContact OD1-O 2.74Å; T47-Q49 WeakPolarHBondContact CB-O 3.39Å; T47-Q49 PolarHBondContact OG1-O 3.36Å; Q49-F51 PolarHBondContact O-N 3.05Å
50	P	88	Confident	91.4	Very high	52 Å²	52	38.2 Å²	38.2	34%	0.338	21%	0.211	S	C	.	.			trans	-48.9	131.4	174.2	-29.9	37.5	0	0	0	112.3	N26	N26-P50 PolarHBondContact ND2-O 2.77Å
51	F	88.4	Confident	91.3	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.013	21%	0.213	C	C	.	.			trans	-93.3	118.8	-175	-175.3	-101.8	0	0	0	111	T47 Q49 M55 F70 K79 I82 V112 Q113 F114	T47-F51 HydrophobicContact CG2-CB 4.11Å; T47-F51 HydrophobicContact CG2-CD2 3.87Å; T47-F51 HydrophobicContact CG2-CG 4.27Å; Q49-F51 PolarHBondContact O-N 3.05Å; F51-M55 HydrophobicContact CE1-CG 4.32Å; F51-F70 HydrophobicContact CD1-CB 3.87Å; F51-F70 AromaticContact CD1-CD2 3.75Å; F51-F70 HydrophobicContact CD1-CD2 3.75Å; F51-F70 HydrophobicContact CD1-CE2 4.48Å; F51-F70 AromaticContact CD1-CG 3.81Å; F51-F70 HydrophobicContact CD1-CG 3.81Å; F51-F70 HydrophobicContact CE1-CB 4.33Å; F51-F70 AromaticContact CE1-CD2 3.57Å; F51-F70 HydrophobicContact CE1-CD2 3.57Å; F51-F70 HydrophobicContact CE1-CE2 4.18Å; F51-F70 HydrophobicContact CE1-CG 4.12Å; F51-K79 PolarHBondContact N-O 3.45Å; F51-I82 HydrophobicContact CB-CD1 4.09Å; F51-I82 HydrophobicContact CB-CG2 3.94Å; F51-I82 HydrophobicContact CD1-CD1 3.2Å; F51-I82 HydrophobicContact CD1-CG1 4.5Å; F51-I82 HydrophobicContact CD1-CG2 4.18Å; F51-I82 HydrophobicContact CD2-CD1 4.15Å; F51-I82 HydrophobicContact CE1-CD1 3.46Å; F51-I82 VanDerWaalsContact CE1-CD1 3.46Å; F51-I82 HydrophobicContact CE2-CD1 4.37Å; F51-I82 HydrophobicContact CG-CD1 3.55Å; F51-I82 HydrophobicContact CG-CG2 4.42Å; F51-I82 HydrophobicContact CZ-CD1 4.05Å; F51-V112 HydrophobicContact CE2-CG1 3.75Å; F51-V112 HydrophobicContact CZ-CG1 3.71Å; F51-Q113 VanDerWaalsContact CZ-O 3.31Å; F51-Q113 WeakPolarHBondContact CZ-O 3.25Å; F51-F114 AromaticContact CD2-CD1 3.79Å; F51-F114 HydrophobicContact CD2-CD1 3.79Å; F51-F114 AromaticContact CD2-CE1 3.78Å; F51-F114 HydrophobicContact CD2-CE1 3.78Å; F51-F114 AromaticContact CE2-CD1 3.63Å; F51-F114 HydrophobicContact CE2-CD1 3.63Å; F51-F114 AromaticContact CE2-CE1 3.8Å; F51-F114 HydrophobicContact CE2-CE1 3.8Å; F51-F114 HydrophobicContact CE2-CG 4.13Å; F51-F114 HydrophobicContact CE2-CZ 4.44Å
52	Q	87.4	Confident	91.3	Very high	129 Å²	129	46.6 Å²	46.6	60%	0.603	25%	0.253	S	S	*	.			trans	-113.7	20.6	177.7	-63.7	-178.9	-13.3	0	0	112
53	G	90.5	Very high	91.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	-95.5	-159.3	-179.3	0	0	0	0	0	113	F70 Q113 F114	G53-F70 WeakPolarHBondContact O-CB 3.3Å; G53-F70 PolarHBondContact O-N 3.44Å; G53-Q113 CarbonylContact C-O 3.55Å; G53-Q113 WeakPolarHBondContact CA-O 3.35Å; G53-F114 WeakPolarHBondContact CA-O 3.02Å
54	R	91.7	Very high	91	Very high	53 Å²	53	55.6 Å²	55.6	20%	0.2	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.3	177.4	-59.5	-179.3	55.2	-173	-4.7	110.8	F56 S61 S67 K68 D69 Q113 P116	R54-F56 HydrophobicContact CB-CD1 4.36Å; R54-S61 PolarHBondContact NH2-O 3.11Å; R54-S67 PolarHBondContact NH2-OG 2.97Å; R54-K68 CarbonylContact C-O 3.57Å; R54-K68 WeakPolarHBondContact CA-O 3.32Å; R54-D69 HydrophobicContact CG-CB 3.9Å; R54-Q113 PolarHBondContact N-O 2.67Å; R54-Q113 PolarHBondContact O-N 3.17Å; R54-P116 WeakPolarHBondContact CD-O 3.24Å
55	M	93.9	Very high	90.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.3	164.9	-63.5	170.9	67.7	0	0	108.9	I43 L45 F51 S67 K68 F70 I82 M84 V110 V111 V112	I43-M55 HydrophobicContact CG2-CE 4.44Å; L45-M55 HydrophobicContact CD2-CE 3.14Å; L45-M55 HydrophobicContact CD2-CG 4.47Å; L45-M55 HydrophobicContact CD2-SD 3.52Å; L45-M55 VanDerWaalsContact CD2-SD 3.52Å; F51-M55 HydrophobicContact CE1-CG 4.32Å; M55-S67 CarbonylContact O-C 3.53Å; M55-S67 WeakPolarHBondContact O-CA 3.49Å; M55-K68 PolarHBondContact N-O 2.89Å; M55-K68 PolarHBondContact O-N 3.2Å; M55-F70 HydrophobicContact CB-CE2 3.87Å; M55-F70 HydrophobicContact CG-CD2 4.36Å; M55-F70 HydrophobicContact CG-CE2 3.53Å; M55-F70 HydrophobicContact CG-CZ 4.23Å; M55-F70 HydrophobicContact SD-CE2 3.46Å; M55-F70 WeakPolarHBondContact SD-CE2 3.48Å; M55-F70 HydrophobicContact SD-CZ 3.52Å; M55-F70 VanDerWaalsContact SD-CZ 3.52Å; M55-I82 HydrophobicContact CG-CD1 4.02Å; M55-I82 HydrophobicContact SD-CB 4.31Å; M55-I82 HydrophobicContact SD-CD1 3.42Å; M55-I82 WeakPolarHBondContact SD-CD1 3.46Å; M55-I82 HydrophobicContact SD-CG1 3.67Å; M55-M84 HydrophobicContact CB-SD 3.89Å; M55-M84 HydrophobicContact CE-CB 3.98Å; M55-M84 HydrophobicContact CE-CG 3.49Å; M55-M84 VanDerWaalsContact CE-CG 3.49Å; M55-M84 HydrophobicContact CE-SD 3.59Å; M55-M84 VanDerWaalsContact CE-SD 3.59Å; M55-M84 HydrophobicContact SD-CB 4.45Å; M55-V110 HydrophobicContact CE-CG1 4.36Å; M55-V111 WeakPolarHBondContact CA-O 3.42Å; M55-V112 HydrophobicContact CG-CG2 4.4Å
56	F	95.4	Very high	91.1	Very high	15 Å²	15	60.8 Å²	60.8	7%	0.066	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	159.8	178.7	57.5	-93.1	0	0	0	112.6	R54 S61 C66 V111 Q113 I119	R54-F56 HydrophobicContact CB-CD1 4.36Å; F56-S61 VanDerWaalsContact CD2-CB 3.44Å; F56-C66 CarbonylContact C-O 3.55Å; F56-C66 WeakPolarHBondContact CA-O 3.3Å; F56-V111 HydrophobicContact CD2-CB 4.08Å; F56-V111 HydrophobicContact CD2-CG2 4.42Å; F56-V111 HydrophobicContact CE1-CB 4.19Å; F56-V111 HydrophobicContact CE1-CG1 4.1Å; F56-V111 HydrophobicContact CE2-CB 3.62Å; F56-V111 HydrophobicContact CE2-CG1 4.05Å; F56-V111 HydrophobicContact CE2-CG2 3.87Å; F56-V111 HydrophobicContact CZ-CB 3.69Å; F56-V111 HydrophobicContact CZ-CG1 3.61Å; F56-V111 HydrophobicContact CZ-CG2 4.31Å; F56-V111 PolarHBondContact N-O 3.05Å; F56-V111 PolarHBondContact O-N 3Å; F56-Q113 HydrophobicContact CE1-CB 3.89Å; F56-I119 HydrophobicContact CZ-CD1 4.38Å
57	I	94.7	Very high	91.2	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.015	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	128.7	171	-52.2	-52.9	0	0	0	109.2	G59 N60 S61 C66 M84 M86 C91 V110	I57-G59 PolarHBondContact O-N 3.32Å; I57-N60 HydrophobicContact CB-CB 4.45Å; I57-N60 CarbonylContact O-C 3.52Å; I57-N60 PolarHBondContact O-N 3.42Å; I57-S61 PolarHBondContact O-N 2.93Å; I57-C66 HydrophobicContact CB-CB 4.42Å; I57-C66 HydrophobicContact CG1-CB 4.44Å; I57-C66 PolarHBondContact N-O 2.66Å; I57-M84 HydrophobicContact CD1-CE 3.49Å; I57-M84 VanDerWaalsContact CD1-CE 3.49Å; I57-M84 HydrophobicContact CD1-SD 4.46Å; I57-M84 HydrophobicContact CG1-CE 3.98Å; I57-M86 HydrophobicContact CD1-CE 4.03Å; I57-M86 HydrophobicContact CD1-CG 4.21Å; I57-M86 HydrophobicContact CD1-SD 3.29Å; I57-M86 WeakPolarHBondContact CD1-SD 3.49Å; I57-M86 HydrophobicContact CG1-CB 4.42Å; I57-M86 HydrophobicContact CG1-SD 3.67Å; I57-C91 HydrophobicContact CB-CB 3.98Å; I57-C91 HydrophobicContact CG1-CB 3.86Å; I57-C91 HydrophobicContact CG2-CB 4.03Å; I57-C91 WeakPolarHBondContact CG2-O 3.06Å; I57-V110 HydrophobicContact CD1-CB 4.48Å; I57-V110 HydrophobicContact CD1-CG2 3.66Å
58	R	89.5	Confident	91.3	Very high	50 Å²	50	57.8 Å²	57.8	19%	0.189	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	138.8	178.3	-172.9	-177.1	-179.9	145.3	-45.2	110.7	N60 T109 V111 Q228 D331	R58-N60 PolarHBondContact O-N 2.86Å; R58-N60 VanDerWaalsContact O-N 3.13Å; R58-N60 PolarHBondContact O-ND2 3.28Å; R58-T109 HydrophobicContact CB-CG2 4.2Å; R58-T109 WeakPolarHBondContact CB-O 3.5Å; R58-T109 PolarHBondContact N-O 3.01Å; R58-V111 HydrophobicContact CB-CG2 4.24Å; R58-Q228 VanDerWaalsContact NH2-CD 3.31Å; R58-D331 IonicContact CZ-OD2 2.66Å; R58-D331 IonicContact NH1-OD2 2.83Å; R58-D331 PolarHBondContact NH1-OD2 3.04Å; R58-D331 IonicContact NH2-OD2 2.7Å; R58-D331 PolarHBondContact NH2-OD2 2.81Å
59	G	90.6	Very high	91.4	Very high	74 Å²	74	56.2 Å²	56.2	76%	0.763	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	-10.9	-175.9	0	0	0	0	0	115.1	I57	I57-G59 PolarHBondContact O-N 3.32Å
60	N	92.7	Very high	91.5	Very high	27 Å²	27	52.5 Å²	52.5	14%	0.144	28%	0.28	C	S	.	.			trans	-126.5	21.3	-174.8	-70.1	-92.4	0	0	0	112.9	I57 R58 Q62 R63 C66 C91	I57-N60 HydrophobicContact CB-CB 4.45Å; I57-N60 CarbonylContact O-C 3.52Å; I57-N60 PolarHBondContact O-N 3.42Å; R58-N60 PolarHBondContact O-N 2.86Å; R58-N60 VanDerWaalsContact O-N 3.13Å; R58-N60 PolarHBondContact O-ND2 3.28Å; N60-Q62 PolarHBondContact O-N 3.11Å; N60-Q62 VanDerWaalsContact O-N 3.15Å; N60-R63 PolarHBondContact O-N 3.45Å; N60-R63 VanDerWaalsContact O-N 3.14Å; N60-C66 HydrophobicContact CB-CB 3.84Å; N60-C66 WeakPolarHBondContact O-CB 3.47Å; N60-C91 HydrophobicContact CB-CB 4.38Å; N60-C91 VanDerWaalsContact CG-C 3.46Å; N60-C91 VanDerWaalsContact ND2-C 3.31Å; N60-C91 PolarHBondContact ND2-O 2.92Å
61	S	90.7	Very high	91.2	Very high	34 Å²	34	52.4 Å²	52.4	24%	0.238	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.1	-175.7	63.3	0	0	0	0	115.2	R54 F56 I57 S67	R54-S61 PolarHBondContact NH2-O 3.11Å; F56-S61 VanDerWaalsContact CD2-CB 3.44Å; I57-S61 PolarHBondContact O-N 2.93Å; S61-S67 VanDerWaalsContact O-CB 3.25Å; S61-S67 WeakPolarHBondContact O-CB 3.4Å
62	Q	90.9	Very high	90.5	Very high	180 Å²	180	62.1 Å²	62.1	84%	0.841	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-16.8	179.2	-57.2	-62.4	-2.4	0	0	113	N60	N60-Q62 PolarHBondContact O-N 3.11Å; N60-Q62 VanDerWaalsContact O-N 3.15Å
63	R	93.2	Very high	89.5	Confident	144 Å²	144	60.2 Å²	60.2	54%	0.543	31%	0.311	S	S	.	.	S	Bend	trans	-87.3	128.6	179	-65	-175.9	-177.8	-177.8	2.4	109.7	N60 E65 C66 S67	N60-R63 PolarHBondContact O-N 3.45Å; N60-R63 VanDerWaalsContact O-N 3.14Å; R63-E65 VanDerWaalsContact C-N 3.25Å; R63-E65 PolarHBondContact O-N 3.41Å; R63-C66 HydrophobicContact CB-CB 4.06Å; R63-C66 CarbonylContact O-C 3.44Å; R63-C66 PolarHBondContact O-N 2.95Å; R63-S67 WeakPolarHBondContact O-CB 3.43Å; R63-S67 PolarHBondContact O-N 2.82Å; R63-S67 VanDerWaalsContact O-N 3.09Å
64	A	90.7	Very high	87.7	Confident	84 Å²	84	66.1 Å²	66.1	69%	0.694	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-64	-31	-176.9	0	0	0	0	0	112.5	C66	A64-C66 PolarHBondContact O-N 2.62Å
65	E	92.1	Very high	86.3	Confident	143 Å²	143	66.1 Å²	66.1	67%	0.668	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-72.3	-19.2	177.2	-50.1	81.5	-177.5	0	0	112.4	R63	R63-E65 VanDerWaalsContact C-N 3.25Å; R63-E65 PolarHBondContact O-N 3.41Å
66	C	95.2	Very high	84.7	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.02	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-110.2	-1.7	-175.2	-54.9	0	0	0	0	113.1	F56 I57 N60 R63 A64 C91	F56-C66 CarbonylContact C-O 3.55Å; F56-C66 WeakPolarHBondContact CA-O 3.3Å; I57-C66 HydrophobicContact CB-CB 4.42Å; I57-C66 HydrophobicContact CG1-CB 4.44Å; I57-C66 PolarHBondContact N-O 2.66Å; N60-C66 HydrophobicContact CB-CB 3.84Å; N60-C66 WeakPolarHBondContact O-CB 3.47Å; R63-C66 HydrophobicContact CB-CB 4.06Å; R63-C66 CarbonylContact O-C 3.44Å; R63-C66 PolarHBondContact O-N 2.95Å; A64-C66 PolarHBondContact O-N 2.62Å; C66-C91 WeakPolarHBondContact CA-SG 3.11Å; C66-C91 HydrophobicContact CB-CB 3.74Å; C66-C91 WeakPolarHBondContact CB-SG 3.22Å; C66-C91 WeakPolarHBondContact SG-CA 2.99Å; C66-C91 WeakPolarHBondContact SG-CB 3.48Å; C66-C91 CovalentContact SG-SG 2.03Å; C66-C91 PolarHBondContact SG-SG 2.89Å
67	S	94.1	Very high	83	Confident	20 Å²	20	71.1 Å²	71.1	14%	0.14	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	127.1	-177.6	167.4	0	0	0	0	110.4	R54 M55 S61 R63	R54-S67 PolarHBondContact NH2-OG 2.97Å; M55-S67 CarbonylContact O-C 3.53Å; M55-S67 WeakPolarHBondContact O-CA 3.49Å; S61-S67 VanDerWaalsContact O-CB 3.25Å; S61-S67 WeakPolarHBondContact O-CB 3.4Å; R63-S67 WeakPolarHBondContact O-CB 3.43Å; R63-S67 PolarHBondContact O-N 2.82Å; R63-S67 VanDerWaalsContact O-N 3.09Å
68	K	92.3	Very high	81.9	Confident	64 Å²	64	77.4 Å²	77.4	28%	0.278	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.3	174.7	-170.3	168.2	176.6	179.8	0	110	R54 M55 F70 E83	R54-K68 CarbonylContact C-O 3.57Å; R54-K68 WeakPolarHBondContact CA-O 3.32Å; M55-K68 PolarHBondContact N-O 2.89Å; M55-K68 PolarHBondContact O-N 3.2Å; K68-F70 HydrophobicContact CB-CE2 4.03Å; K68-F70 HydrophobicContact CB-CZ 4.27Å; K68-F70 HydrophobicContact CD-CE1 3.96Å; K68-F70 HydrophobicContact CD-CE2 4.17Å; K68-F70 HydrophobicContact CD-CZ 3.58Å; K68-F70 HydrophobicContact CG-CD2 4.42Å; K68-F70 HydrophobicContact CG-CE1 4.24Å; K68-F70 HydrophobicContact CG-CE2 3.85Å; K68-F70 HydrophobicContact CG-CZ 3.77Å; K68-F70 WeakPolarHBondContact O-CD2 3.34Å; K68-E83 WeakPolarHBondContact CD-O 3.39Å; K68-E83 PolarHBondContact NZ-O 3.49Å
69	D	90.3	Very high	81.6	Confident	18 Å²	18	80.9 Å²	80.9	10%	0.096	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.2	176.4	-178.3	-13.8	0	0	0	110.3	R54 A71 R72 H73	R54-D69 HydrophobicContact CG-CB 3.9Å; D69-A71 WeakPolarHBondContact OD1-CB 3.39Å; D69-A71 PolarHBondContact OD1-N 2.05Å; D69-R72 VanDerWaalsContact OD2-CD 3.3Å; D69-R72 WeakPolarHBondContact OD2-CD 3.29Å; D69-R72 WeakPolarHBondContact OD2-CG 3.06Å; D69-R72 IonicContact OD2-CZ 3.99Å; D69-R72 IonicContact OD2-NE 3.36Å; D69-R72 PolarHBondContact OD2-NE 2.88Å; D69-H73 PolarHBondContact O-CE1 3.23Å; D69-H73 PolarHBondContact O-ND1 3Å
70	F	88.7	Confident	81.5	Confident	6 Å²	6	79.3 Å²	79.3	3%	0.026	42%	0.42	C	S	.	.	S	Bend	trans	-84.8	-13	-174.5	-66	-93.5	0	0	0	113.3	F51 G53 M55 K68 V76 I82	F51-F70 HydrophobicContact CD1-CB 3.87Å; F51-F70 AromaticContact CD1-CD2 3.75Å; F51-F70 HydrophobicContact CD1-CD2 3.75Å; F51-F70 HydrophobicContact CD1-CE2 4.48Å; F51-F70 AromaticContact CD1-CG 3.81Å; F51-F70 HydrophobicContact CD1-CG 3.81Å; F51-F70 HydrophobicContact CE1-CB 4.33Å; F51-F70 AromaticContact CE1-CD2 3.57Å; F51-F70 HydrophobicContact CE1-CD2 3.57Å; F51-F70 HydrophobicContact CE1-CE2 4.18Å; F51-F70 HydrophobicContact CE1-CG 4.12Å; G53-F70 WeakPolarHBondContact O-CB 3.3Å; G53-F70 PolarHBondContact O-N 3.44Å; M55-F70 HydrophobicContact CB-CE2 3.87Å; M55-F70 HydrophobicContact CG-CD2 4.36Å; M55-F70 HydrophobicContact CG-CE2 3.53Å; M55-F70 HydrophobicContact CG-CZ 4.23Å; M55-F70 HydrophobicContact SD-CE2 3.46Å; M55-F70 WeakPolarHBondContact SD-CE2 3.48Å; M55-F70 HydrophobicContact SD-CZ 3.52Å; M55-F70 VanDerWaalsContact SD-CZ 3.52Å; K68-F70 HydrophobicContact CB-CE2 4.03Å; K68-F70 HydrophobicContact CB-CZ 4.27Å; K68-F70 HydrophobicContact CD-CE1 3.96Å; K68-F70 HydrophobicContact CD-CE2 4.17Å; K68-F70 HydrophobicContact CD-CZ 3.58Å; K68-F70 HydrophobicContact CG-CD2 4.42Å; K68-F70 HydrophobicContact CG-CE1 4.24Å; K68-F70 HydrophobicContact CG-CE2 3.85Å; K68-F70 HydrophobicContact CG-CZ 3.77Å; K68-F70 WeakPolarHBondContact O-CD2 3.34Å; F70-V76 HydrophobicContact CD1-CG1 3.91Å; F70-I82 HydrophobicContact CD1-CB 4.11Å; F70-I82 HydrophobicContact CD1-CG2 3.82Å; F70-I82 HydrophobicContact CE1-CB 3.56Å; F70-I82 HydrophobicContact CE1-CG2 3.79Å; F70-I82 HydrophobicContact CE2-CD1 4.27Å; F70-I82 HydrophobicContact CG-CG2 4.43Å; F70-I82 HydrophobicContact CZ-CB 3.79Å; F70-I82 HydrophobicContact CZ-CD1 4.31Å; F70-I82 HydrophobicContact CZ-CG1 4.41Å; F70-I82 HydrophobicContact CZ-CG2 4.39Å
71	A	82.2	Confident	81.4	Confident	51 Å²	51	82.9 Å²	82.9	42%	0.421	44%	0.439	S	S	.	.	S	Bend	trans	-75.2	-28.3	173.4	0	0	0	0	0	112.5	D69	D69-A71 WeakPolarHBondContact OD1-CB 3.39Å; D69-A71 PolarHBondContact OD1-N 2.05Å
72	R	72.8	Confident	81.4	Confident	207 Å²	207	81.4 Å²	81.4	78%	0.781	43%	0.429	S	S	*	.	S	Bend	trans	-93.8	-8.6	-174.2	-67.1	-178	-178.2	-178.4	0.3	114.8	D69 P74	D69-R72 VanDerWaalsContact OD2-CD 3.3Å; D69-R72 WeakPolarHBondContact OD2-CD 3.29Å; D69-R72 WeakPolarHBondContact OD2-CG 3.06Å; D69-R72 IonicContact OD2-CZ 3.99Å; D69-R72 IonicContact OD2-NE 3.36Å; D69-R72 PolarHBondContact OD2-NE 2.88Å; R72-P74 WeakPolarHBondContact O-CD 3.12Å
73	H	67.6	Low	81.5	Confident	88 Å²	88	77.2 Å²	77.2	41%	0.407	41%	0.409	S	S	.	.	S	Bend	trans	-93.2	111.6	-175.6	-78.7	79.7	0	0	0	111.7	D69 G75 V76	D69-H73 PolarHBondContact O-CE1 3.23Å; D69-H73 PolarHBondContact O-ND1 3Å; H73-G75 PolarHBondContact O-N 2.92Å; H73-V76 HydrophobicContact CB-CG2 3.96Å; H73-V76 PolarHBondContact O-N 3.47Å
74	P	53.2	Low	81.5	Confident	125 Å²	125	70.7 Å²	70.7	81%	0.812	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	124.9	176.6	23.8	-31.3	0	0	0	110.4	R72	R72-P74 WeakPolarHBondContact O-CD 3.12Å
75	G	61.4	Low	81.6	Confident	53 Å²	53	70 Å²	70	55%	0.546	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.1	3.3	179	0	0	0	0	0	116	H73	H73-G75 PolarHBondContact O-N 2.92Å
76	V	60.3	Low	81.7	Confident	24 Å²	24	63.3 Å²	63.3	15%	0.145	34%	0.34	C	S	.	.			trans	-102.2	2.2	172.6	-167.2	0	0	0	0	112.6	F70 H73 N78 K79	F70-V76 HydrophobicContact CD1-CG1 3.91Å; H73-V76 HydrophobicContact CB-CG2 3.96Å; H73-V76 PolarHBondContact O-N 3.47Å; V76-N78 PolarHBondContact O-N 2.98Å; V76-K79 HydrophobicContact CG1-CB 4.16Å; V76-K79 HydrophobicContact CG1-CD 4.48Å; V76-K79 PolarHBondContact O-N 3.08Å
77	D	59.6	Low	81.5	Confident	95 Å²	95	67.1 Å²	67.1	51%	0.508	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-15.4	-161.7	-58.4	-46.9	0	0	0	115.7
78	N	70.9	Confident	81.3	Confident	136 Å²	136	66.7 Å²	66.7	73%	0.727	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138	20.8	178.1	-70.3	-48.1	0	0	0	115	V76	V76-N78 PolarHBondContact O-N 2.98Å
79	K	83.1	Confident	81.2	Confident	122 Å²	122	70.4 Å²	70.4	53%	0.53	38%	0.379	S	S	.	.			trans	-88.3	127.8	-179.2	-63.4	-177.1	-179.4	174.4	0	111.6	F51 V76	F51-K79 PolarHBondContact N-O 3.45Å; V76-K79 HydrophobicContact CG1-CB 4.16Å; V76-K79 HydrophobicContact CG1-CD 4.48Å; V76-K79 PolarHBondContact O-N 3.08Å
80	T	88.8	Confident	81.2	Confident	41 Å²	41	71 Å²	71	25%	0.252	39%	0.387	S	S	.	.	S	Bend	trans	-84.2	-22.6	167.3	48.7	0	0	0	0	112.1	R46 T47	R46-T80 CarbonylContact C-O 3.59Å; R46-T80 VanDerWaalsContact CA-O 3.29Å; R46-T80 WeakPolarHBondContact CA-O 3.07Å; T47-T80 PolarHBondContact N-O 2.97Å; T47-T80 WeakPolarHBondContact O-CB 3.39Å; T47-T80 WeakPolarHBondContact O-CG2 3.49Å; T47-T80 PolarHBondContact OG1-O 3Å; T47-T80 VanDerWaalsContact OG1-O 3.14Å
81	N	90.9	Very high	81.3	Confident	102 Å²	102	70.9 Å²	70.9	55%	0.545	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	116.3	174.1	-63.5	-33.8	0	0	0	109	L45 R46	L45-N81 WeakPolarHBondContact O-CA 3.28Å; R46-N81 WeakPolarHBondContact CB-OD1 3.48Å; R46-N81 VanDerWaalsContact CG-OD1 3.29Å; R46-N81 WeakPolarHBondContact CG-OD1 3.38Å
82	I	91.3	Very high	81.6	Confident	3 Å²	3	71.1 Å²	71.1	2%	0.015	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.9	177.3	65.3	177.5	0	0	0	110.3	S44 L45 F51 M55 F70	S44-I82 WeakPolarHBondContact CA-O 3Å; L45-I82 HydrophobicContact CD1-CD1 3.72Å; L45-I82 HydrophobicContact CD1-CG1 3.72Å; L45-I82 HydrophobicContact CD2-CD1 3.89Å; L45-I82 HydrophobicContact CD2-CG1 3.65Å; L45-I82 HydrophobicContact CG-CD1 3.87Å; L45-I82 HydrophobicContact CG-CG1 3.39Å; L45-I82 PolarHBondContact N-O 2.78Å; L45-I82 PolarHBondContact O-N 2.79Å; F51-I82 HydrophobicContact CB-CD1 4.09Å; F51-I82 HydrophobicContact CB-CG2 3.94Å; F51-I82 HydrophobicContact CD1-CD1 3.2Å; F51-I82 HydrophobicContact CD1-CG1 4.5Å; F51-I82 HydrophobicContact CD1-CG2 4.18Å; F51-I82 HydrophobicContact CD2-CD1 4.15Å; F51-I82 HydrophobicContact CE1-CD1 3.46Å; F51-I82 VanDerWaalsContact CE1-CD1 3.46Å; F51-I82 HydrophobicContact CE2-CD1 4.37Å; F51-I82 HydrophobicContact CG-CD1 3.55Å; F51-I82 HydrophobicContact CG-CG2 4.42Å; F51-I82 HydrophobicContact CZ-CD1 4.05Å; M55-I82 HydrophobicContact CG-CD1 4.02Å; M55-I82 HydrophobicContact SD-CB 4.31Å; M55-I82 HydrophobicContact SD-CD1 3.42Å; M55-I82 WeakPolarHBondContact SD-CD1 3.46Å; M55-I82 HydrophobicContact SD-CG1 3.67Å; F70-I82 HydrophobicContact CD1-CB 4.11Å; F70-I82 HydrophobicContact CD1-CG2 3.82Å; F70-I82 HydrophobicContact CE1-CB 3.56Å; F70-I82 HydrophobicContact CE1-CG2 3.79Å; F70-I82 HydrophobicContact CE2-CD1 4.27Å; F70-I82 HydrophobicContact CG-CG2 4.43Å; F70-I82 HydrophobicContact CZ-CB 3.79Å; F70-I82 HydrophobicContact CZ-CD1 4.31Å; F70-I82 HydrophobicContact CZ-CG1 4.41Å; F70-I82 HydrophobicContact CZ-CG2 4.39Å
83	E	92.9	Very high	82.4	Confident	93 Å²	93	62 Å²	62	44%	0.435	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	140.2	-175.1	53.8	-175.4	163.7	0	0	111.2	K42 I43 K68	K42-E83 WeakPolarHBondContact CE-OE2 3.19Å; K42-E83 IonicContact NZ-OE2 2.93Å; K42-E83 PolarHBondContact NZ-OE2 3.24Å; I43-E83 CarbonylContact O-C 3.57Å; I43-E83 VanDerWaalsContact O-CA 3.23Å; I43-E83 WeakPolarHBondContact O-CA 3.43Å; K68-E83 WeakPolarHBondContact CD-O 3.39Å; K68-E83 PolarHBondContact NZ-O 3.49Å
84	M	92.7	Very high	83.4	Confident	7 Å²	7	61.5 Å²	61.5	3%	0.034	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	150.1	170.8	73.9	175	-69.6	0	0	110.1	I43 M55 I57 V110	I43-M84 HydrophobicContact CB-CG 3.93Å; I43-M84 HydrophobicContact CD1-CG 3.83Å; I43-M84 HydrophobicContact CD1-SD 4.31Å; I43-M84 HydrophobicContact CG1-CG 4.45Å; I43-M84 PolarHBondContact N-O 2.83Å; I43-M84 PolarHBondContact O-N 3.46Å; M55-M84 HydrophobicContact CB-SD 3.89Å; M55-M84 HydrophobicContact CE-CB 3.98Å; M55-M84 HydrophobicContact CE-CG 3.49Å; M55-M84 VanDerWaalsContact CE-CG 3.49Å; M55-M84 HydrophobicContact CE-SD 3.59Å; M55-M84 VanDerWaalsContact CE-SD 3.59Å; M55-M84 HydrophobicContact SD-CB 4.45Å; I57-M84 HydrophobicContact CD1-CE 3.49Å; I57-M84 VanDerWaalsContact CD1-CE 3.49Å; I57-M84 HydrophobicContact CD1-SD 4.46Å; I57-M84 HydrophobicContact CG1-CE 3.98Å; M84-V110 HydrophobicContact SD-CB 4.5Å; M84-V110 HydrophobicContact SD-CG1 3.44Å; M84-V110 WeakPolarHBondContact SD-CG1 3.23Å; M84-V110 HydrophobicContact SD-CG2 4.26Å
85	V	93.5	Very high	85.1	Confident	69 Å²	69	62.1 Å²	62.1	42%	0.418	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.5	175	-178.7	0	0	0	0	107.3	N40 I41 K42	N40-V85 HydrophobicContact CB-CG1 3.7Å; I41-V85 WeakPolarHBondContact O-CA 3.48Å; K42-V85 HydrophobicContact CB-CG2 4.14Å; K42-V85 HydrophobicContact CG-CG2 4.13Å
86	M	92.9	Very high	86.2	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	141.9	172.1	61.1	157.9	174.1	0	0	111.1	N40 I41 I43 I57 I128	N40-M86 CarbonylContact C-O 3.59Å; N40-M86 WeakPolarHBondContact CA-O 3.13Å; N40-M86 WeakPolarHBondContact CB-O 3.39Å; I41-M86 HydrophobicContact CB-CE 4.07Å; I41-M86 HydrophobicContact CB-CG 4.21Å; I41-M86 HydrophobicContact CD1-CE 3.41Å; I41-M86 VanDerWaalsContact CD1-CE 3.41Å; I41-M86 HydrophobicContact CG1-CE 4.29Å; I41-M86 HydrophobicContact CG2-CE 4.45Å; I41-M86 PolarHBondContact N-O 3.31Å; I41-M86 PolarHBondContact O-N 3.27Å; I43-M86 HydrophobicContact CD1-CE 4.31Å; I43-M86 HydrophobicContact CD1-CG 4.33Å; I57-M86 HydrophobicContact CD1-CE 4.03Å; I57-M86 HydrophobicContact CD1-CG 4.21Å; I57-M86 HydrophobicContact CD1-SD 3.29Å; I57-M86 WeakPolarHBondContact CD1-SD 3.49Å; I57-M86 HydrophobicContact CG1-CB 4.42Å; I57-M86 HydrophobicContact CG1-SD 3.67Å; M86-I128 HydrophobicContact CE-CD1 3.21Å; M86-I128 HydrophobicContact CE-CG1 4.03Å
87	D	92.6	Very high	87.3	Confident	84 Å²	84	71 Å²	71	45%	0.449	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	143.3	176.7	-65.6	-41.7	0	0	0	111.5	N40 N89 A90	N40-D87 WeakPolarHBondContact CB-OD1 3.21Å; D87-N89 PolarHBondContact O-N 3.09Å; D87-A90 HydrophobicContact CB-CB 4.15Å; D87-A90 PolarHBondContact O-N 2.9Å; D87-A90 VanDerWaalsContact O-N 3.08Å
88	Y	90.3	Very high	88.1	Confident	10 Å²	10	67.4 Å²	67.4	4%	0.039	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-27.2	179.5	-65.8	-66.8	0	0	0	114	R37 R39 N40 I41 A90 T93 Y106 C130 Y132	R37-Y88 WeakPolarHBondContact O-CE2 3.04Å; R37-Y88 VanDerWaalsContact O-CZ 3.31Å; R37-Y88 PolarHBondContact O-OH 3.31Å; R39-Y88 VanDerWaalsContact C-CE2 3.42Å; R39-Y88 WeakPolarHBondContact O-CD2 3.34Å; R39-Y88 PolarHBondContact O-N 2.86Å; N40-Y88 PolarHBondContact O-OH 3.28Å; I41-Y88 HydrophobicContact CD1-CD1 3.76Å; I41-Y88 HydrophobicContact CD1-CE1 3.43Å; I41-Y88 VanDerWaalsContact CD1-CE1 3.43Å; I41-Y88 HydrophobicContact CG1-CD1 3.84Å; I41-Y88 HydrophobicContact CG1-CE1 3.19Å; Y88-A90 VanDerWaalsContact C-N 3.29Å; Y88-T93 WeakPolarHBondContact O-CB 3.19Å; Y88-Y106 AromaticContact CD1-CD1 3.55Å; Y88-Y106 HydrophobicContact CD1-CD1 3.55Å; Y88-Y106 AromaticContact CD1-CD2 3.94Å; Y88-Y106 HydrophobicContact CD1-CD2 3.94Å; Y88-Y106 HydrophobicContact CD1-CE1 4.22Å; Y88-Y106 AromaticContact CD1-CG 3.39Å; Y88-Y106 HydrophobicContact CD1-CG 3.39Å; Y88-Y106 HydrophobicContact CE1-CD1 4.42Å; Y88-Y106 HydrophobicContact CE1-CD2 4.04Å; Y88-Y106 AromaticContact CE1-CG 3.82Å; Y88-Y106 HydrophobicContact CE1-CG 3.82Å; Y88-Y106 AromaticContact CG-CD1 3.9Å; Y88-Y106 HydrophobicContact CG-CD1 3.9Å; Y88-Y106 HydrophobicContact CG-CE1 4.14Å; Y88-Y106 HydrophobicContact CG-CG 4.11Å; Y88-C130 HydrophobicContact CE1-CB 4.18Å; Y88-Y132 HydrophobicContact CE1-CE2 4.39Å; Y88-Y132 AromaticContact CZ-CE2 3.99Å; Y88-Y132 PolarHBondContact OH-OH 3.39Å
89	N	88.6	Confident	88.3	Confident	143 Å²	143	68.5 Å²	68.5	77%	0.765	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	3.6	-178.5	-64.1	-33.1	0	0	0	112.6	D87	D87-N89 PolarHBondContact O-N 3.09Å
90	A	90	Very high	87.7	Confident	31 Å²	31	65.1 Å²	65.1	26%	0.256	34%	0.343	S	S	.	.	S	Bend	trans	-120.9	177.5	-178	0	0	0	0	0	111.2	D87 Y88 G92 T93	D87-A90 HydrophobicContact CB-CB 4.15Å; D87-A90 PolarHBondContact O-N 2.9Å; D87-A90 VanDerWaalsContact O-N 3.08Å; Y88-A90 VanDerWaalsContact C-N 3.29Å; A90-G92 PolarHBondContact O-N 2.76Å; A90-T93 PolarHBondContact O-N 2.81Å; A90-T93 PolarHBondContact O-OG1 3.24Å
91	C	92.6	Very high	87	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.014	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	23.8	169.1	-49.7	0	0	0	0	116.2	I57 N60 C66 T93	I57-C91 HydrophobicContact CB-CB 3.98Å; I57-C91 HydrophobicContact CG1-CB 3.86Å; I57-C91 HydrophobicContact CG2-CB 4.03Å; I57-C91 WeakPolarHBondContact CG2-O 3.06Å; N60-C91 HydrophobicContact CB-CB 4.38Å; N60-C91 VanDerWaalsContact CG-C 3.46Å; N60-C91 VanDerWaalsContact ND2-C 3.31Å; N60-C91 PolarHBondContact ND2-O 2.92Å; C66-C91 WeakPolarHBondContact CA-SG 3.11Å; C66-C91 HydrophobicContact CB-CB 3.74Å; C66-C91 WeakPolarHBondContact CB-SG 3.22Å; C66-C91 WeakPolarHBondContact SG-CA 2.99Å; C66-C91 WeakPolarHBondContact SG-CB 3.48Å; C66-C91 CovalentContact SG-SG 2.03Å; C66-C91 PolarHBondContact SG-SG 2.89Å; C91-T93 PolarHBondContact O-N 3.07Å
92	G	87.6	Confident	86.3	Confident	57 Å²	57	66.5 Å²	66.5	59%	0.588	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	25.3	179.1	0	0	0	0	0	114	A90 E94	A90-G92 PolarHBondContact O-N 2.76Å; G92-E94 PolarHBondContact O-N 3.38Å
93	T	89.6	Confident	85.9	Confident	15 Å²	15	66.6 Å²	66.6	9%	0.092	35%	0.35	C	S	.	.			trans	-54.7	122.8	177.4	-58.7	0	0	0	0	110.6	Y88 A90 C91 Y106 S108	Y88-T93 WeakPolarHBondContact O-CB 3.19Å; A90-T93 PolarHBondContact O-N 2.81Å; A90-T93 PolarHBondContact O-OG1 3.24Å; C91-T93 PolarHBondContact O-N 3.07Å; T93-Y106 HydrophobicContact CG2-CD1 4.1Å; T93-S108 WeakPolarHBondContact CA-OG 3.26Å; T93-S108 WeakPolarHBondContact CB-OG 3.43Å; T93-S108 WeakPolarHBondContact CG2-OG 3.41Å; T93-S108 PolarHBondContact OG1-OG 3.34Å; T93-S108 VanDerWaalsContact OG1-OG 3.09Å
94	E	88.4	Confident	85.6	Confident	77 Å²	77	64 Å²	64	36%	0.36	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	129.9	178.7	-64.3	175.6	-166.7	0	0	109.7	G92 Y106 A107 K278	G92-E94 PolarHBondContact O-N 3.38Å; E94-Y106 CarbonylContact O-C 3.59Å; E94-Y106 WeakPolarHBondContact O-CA 3.42Å; E94-A107 HydrophobicContact CB-CB 4.27Å; E94-A107 WeakPolarHBondContact CB-O 3.35Å; E94-A107 PolarHBondContact N-O 2.99Å; E94-A107 PolarHBondContact O-N 2.8Å; E94-K278 IonicContact OE2-NZ 3.17Å
95	R	88.9	Confident	85.2	Confident	139 Å²	139	64.2 Å²	64.2	53%	0.525	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	104.4	178.1	-61.6	-178.1	69.4	-170.4	7.7	109.3	Y106	R95-Y106 HydrophobicContact CG-CD1 3.76Å; R95-Y106 HydrophobicContact CG-CE1 3.68Å; R95-Y106 VanDerWaalsContact NE-CE1 3.28Å; R95-Y106 PolarHBondContact NH2-OH 2.91Å
96	I	84.2	Confident	85.1	Confident	57 Å²	57	62.4 Å²	62.4	29%	0.292	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.4	-178.4	-55.1	168.4	0	0	0	107.9	T105	I96-T105 PolarHBondContact N-O 3.17Å; I96-T105 PolarHBondContact O-N 3.33Å
97	R	83.2	Confident	85	Confident	206 Å²	206	62.3 Å²	62.3	78%	0.777	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	118	170.3	-65	-172.1	178.9	99.8	-3	108	V104	R97-V104 HydrophobicContact CG-CG2 4.48Å
98	S	76.6	Confident	84.9	Confident	20 Å²	20	58.6 Å²	58.6	14%	0.14	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	140	170.8	-173.2	0	0	0	0	109.4	S100 P101 K102 G103	S98-S100 PolarHBondContact OG-N 3.44Å; S98-S100 PolarHBondContact OG-O 3.31Å; S98-P101 WeakPolarHBondContact CB-O 3.3Å; S98-P101 PolarHBondContact OG-O 3.26Å; S98-K102 WeakPolarHBondContact O-CA 3.47Å; S98-G103 PolarHBondContact N-O 2.74Å; S98-G103 PolarHBondContact O-N 3.28Å; S98-G103 VanDerWaalsContact O-N 3.09Å
99	L	76.5	Confident	84.9	Confident	159 Å²	159	58.9 Å²	58.9	83%	0.832	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.6	-20	174.3	-68.3	167.4	0	0	0	111.6	K102	L99-K102 WeakPolarHBondContact O-CG 3.34Å
100	S	70.6	Confident	85.1	Confident	51 Å²	51	52.1 Å²	52.1	36%	0.357	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.8	105.5	-176.3	-169.5	0	0	0	0	110.5	S98	S98-S100 PolarHBondContact OG-N 3.44Å; S98-S100 PolarHBondContact OG-O 3.31Å
101	P	72.3	Confident	85.3	Confident	83 Å²	83	51.3 Å²	51.3	54%	0.539	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	cis	-62.1	147.2	-11.4	26.3	-32.6	0	0	0	111.4	S98 G103 F131	S98-P101 WeakPolarHBondContact CB-O 3.3Å; S98-P101 PolarHBondContact OG-O 3.26Å; P101-G103 PolarHBondContact O-N 3.16Å; P101-F131 HydrophobicContact CB-CE1 4.26Å; P101-F131 HydrophobicContact CB-CZ 3.97Å; P101-F131 HydrophobicContact CG-CE1 3.66Å; P101-F131 HydrophobicContact CG-CE2 4.41Å; P101-F131 HydrophobicContact CG-CZ 3.51Å
102	K	77.1	Confident	85.3	Confident	89 Å²	89	51.2 Å²	51.2	39%	0.387	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	129.5	173.7	-72.2	-177.6	-176.9	165.3	0	109.6	S98 L99 A133 E134 D136	S98-K102 WeakPolarHBondContact O-CA 3.47Å; L99-K102 WeakPolarHBondContact O-CG 3.34Å; K102-A133 WeakPolarHBondContact O-CA 3.48Å; K102-E134 HydrophobicContact CB-CB 4.19Å; K102-E134 PolarHBondContact O-N 3.23Å; K102-D136 WeakPolarHBondContact CE-OD2 3.27Å; K102-D136 IonicContact NZ-OD1 2.74Å; K102-D136 PolarHBondContact NZ-OD1 2.89Å; K102-D136 IonicContact NZ-OD2 3Å; K102-D136 PolarHBondContact NZ-OD2 2.79Å
103	G	83.2	Confident	85.5	Confident	5 Å²	5	48.8 Å²	48.8	5%	0.052	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.6	-171.3	177.7	0	0	0	0	0	112.8	S98 P101 Y132	S98-G103 PolarHBondContact N-O 2.74Å; S98-G103 PolarHBondContact O-N 3.28Å; S98-G103 VanDerWaalsContact O-N 3.09Å; P101-G103 PolarHBondContact O-N 3.16Å; G103-Y132 CarbonylContact C-O 3.29Å; G103-Y132 WeakPolarHBondContact CA-O 3.45Å
104	V	86	Confident	85.5	Confident	39 Å²	39	49.7 Å²	49.7	24%	0.236	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.4	-178.4	-175.3	0	0	0	0	109.2	R97 Y106 Y132	R97-V104 HydrophobicContact CG-CG2 4.48Å; V104-Y106 HydrophobicContact CB-CE2 4.32Å; V104-Y106 HydrophobicContact CG1-CD2 4.3Å; V104-Y106 HydrophobicContact CG1-CE2 3.76Å; V104-Y132 PolarHBondContact N-O 3.07Å; V104-Y132 PolarHBondContact O-N 2.71Å
105	T	85.4	Confident	85.5	Confident	11 Å²	11	49.4 Å²	49.4	7%	0.067	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	127.5	169.4	-55.4	0	0	0	0	109.8	I96 R129 C130 F131	I96-T105 PolarHBondContact N-O 3.17Å; I96-T105 PolarHBondContact O-N 3.33Å; T105-R129 HydrophobicContact CG2-CB 4.16Å; T105-R129 HydrophobicContact CG2-CG 4.4Å; T105-C130 CarbonylContact C-O 3.52Å; T105-C130 WeakPolarHBondContact CA-O 3.23Å; T105-F131 WeakPolarHBondContact OG1-CD2 3.39Å
106	Y	91.3	Very high	85.3	Confident	31 Å²	31	45.3 Å²	45.3	12%	0.122	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.2	166.3	-64	-90.4	0	0	0	108.6	Y88 T93 E94 R95 V104 R129 C130 Y132	Y88-Y106 AromaticContact CD1-CD1 3.55Å; Y88-Y106 HydrophobicContact CD1-CD1 3.55Å; Y88-Y106 AromaticContact CD1-CD2 3.94Å; Y88-Y106 HydrophobicContact CD1-CD2 3.94Å; Y88-Y106 HydrophobicContact CD1-CE1 4.22Å; Y88-Y106 AromaticContact CD1-CG 3.39Å; Y88-Y106 HydrophobicContact CD1-CG 3.39Å; Y88-Y106 HydrophobicContact CE1-CD1 4.42Å; Y88-Y106 HydrophobicContact CE1-CD2 4.04Å; Y88-Y106 AromaticContact CE1-CG 3.82Å; Y88-Y106 HydrophobicContact CE1-CG 3.82Å; Y88-Y106 AromaticContact CG-CD1 3.9Å; Y88-Y106 HydrophobicContact CG-CD1 3.9Å; Y88-Y106 HydrophobicContact CG-CE1 4.14Å; Y88-Y106 HydrophobicContact CG-CG 4.11Å; T93-Y106 HydrophobicContact CG2-CD1 4.1Å; E94-Y106 CarbonylContact O-C 3.59Å; E94-Y106 WeakPolarHBondContact O-CA 3.42Å; R95-Y106 HydrophobicContact CG-CD1 3.76Å; R95-Y106 HydrophobicContact CG-CE1 3.68Å; R95-Y106 VanDerWaalsContact NE-CE1 3.28Å; R95-Y106 PolarHBondContact NH2-OH 2.91Å; V104-Y106 HydrophobicContact CB-CE2 4.32Å; V104-Y106 HydrophobicContact CG1-CD2 4.3Å; V104-Y106 HydrophobicContact CG1-CE2 3.76Å; Y106-R129 CarbonylContact O-C 3.59Å; Y106-R129 WeakPolarHBondContact O-CA 3.44Å; Y106-C130 PolarHBondContact N-O 2.81Å; Y106-C130 PolarHBondContact O-N 2.84Å; Y106-Y132 AromaticContact CD2-CD2 3.81Å; Y106-Y132 HydrophobicContact CD2-CD2 3.81Å; Y106-Y132 AromaticContact CD2-CE2 3.94Å; Y106-Y132 HydrophobicContact CD2-CE2 3.94Å; Y106-Y132 AromaticContact CE2-CD2 3.83Å; Y106-Y132 HydrophobicContact CE2-CD2 3.83Å; Y106-Y132 HydrophobicContact CE2-CE2 4.15Å
107	A	89.4	Confident	85.3	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	137	-178.2	0	0	0	0	0	111.6	E94 I128 R129	E94-A107 HydrophobicContact CB-CB 4.27Å; E94-A107 WeakPolarHBondContact CB-O 3.35Å; E94-A107 PolarHBondContact N-O 2.99Å; E94-A107 PolarHBondContact O-N 2.8Å; A107-I128 VanDerWaalsContact CA-O 3.27Å; A107-I128 WeakPolarHBondContact CA-O 3.44Å; A107-R129 HydrophobicContact CB-CG 3.96Å
108	S	91.3	Very high	85.6	Confident	5 Å²	5	44.8 Å²	44.8	4%	0.035	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	151.7	177	-65.6	0	0	0	0	110.2	T93 I128	T93-S108 WeakPolarHBondContact CA-OG 3.26Å; T93-S108 WeakPolarHBondContact CB-OG 3.43Å; T93-S108 WeakPolarHBondContact CG2-OG 3.41Å; T93-S108 PolarHBondContact OG1-OG 3.34Å; T93-S108 VanDerWaalsContact OG1-OG 3.09Å; S108-I128 PolarHBondContact N-O 3.29Å; S108-I128 VanDerWaalsContact N-O 3.07Å; S108-I128 WeakPolarHBondContact O-CG1 3.34Å; S108-I128 PolarHBondContact O-N 2.03Å
109	T	90.1	Very high	86	Confident	17 Å²	17	49.4 Å²	49.4	10%	0.104	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	113.5	175.3	-60.7	0	0	0	0	110.1	R58 F126 H127	R58-T109 HydrophobicContact CB-CG2 4.2Å; R58-T109 WeakPolarHBondContact CB-O 3.5Å; R58-T109 PolarHBondContact N-O 3.01Å; T109-F126 CarbonylContact C-O 3.59Å; T109-F126 WeakPolarHBondContact CA-O 3.45Å; T109-H127 PolarHBondContact OG1-ND1 2.85Å
110	V	93.6	Very high	86.4	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	128.6	175.7	179.5	0	0	0	0	108.9	I43 M55 I57 M84 S125 F126 I128	I43-V110 HydrophobicContact CD1-CG2 4.07Å; I43-V110 HydrophobicContact CG1-CG2 4.2Å; M55-V110 HydrophobicContact CE-CG1 4.36Å; I57-V110 HydrophobicContact CD1-CB 4.48Å; I57-V110 HydrophobicContact CD1-CG2 3.66Å; M84-V110 HydrophobicContact SD-CB 4.5Å; M84-V110 HydrophobicContact SD-CG1 3.44Å; M84-V110 WeakPolarHBondContact SD-CG1 3.23Å; M84-V110 HydrophobicContact SD-CG2 4.26Å; V110-S125 CarbonylContact O-C 3.58Å; V110-S125 VanDerWaalsContact O-CA 3.26Å; V110-S125 WeakPolarHBondContact O-CA 3.42Å; V110-F126 PolarHBondContact N-O 2.82Å; V110-F126 PolarHBondContact O-N 2.81Å; V110-I128 HydrophobicContact CG2-CD1 3.91Å; V110-I128 HydrophobicContact CG2-CG1 4.23Å
111	V	93	Very high	86.8	Confident	13 Å²	13	51 Å²	51	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.7	175.3	-176.6	0	0	0	0	109.1	M55 F56 R58	M55-V111 WeakPolarHBondContact CA-O 3.42Å; F56-V111 HydrophobicContact CD2-CB 4.08Å; F56-V111 HydrophobicContact CD2-CG2 4.42Å; F56-V111 HydrophobicContact CE1-CB 4.19Å; F56-V111 HydrophobicContact CE1-CG1 4.1Å; F56-V111 HydrophobicContact CE2-CB 3.62Å; F56-V111 HydrophobicContact CE2-CG1 4.05Å; F56-V111 HydrophobicContact CE2-CG2 3.87Å; F56-V111 HydrophobicContact CZ-CB 3.69Å; F56-V111 HydrophobicContact CZ-CG1 3.61Å; F56-V111 HydrophobicContact CZ-CG2 4.31Å; F56-V111 PolarHBondContact N-O 3.05Å; F56-V111 PolarHBondContact O-N 3Å; R58-V111 HydrophobicContact CB-CG2 4.24Å
112	V	93.7	Very high	87.3	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	106	171.5	-175.6	0	0	0	0	107.5	I28 L45 F51 M55 D123 R124 F126	I28-V112 HydrophobicContact CD1-CB 4.04Å; I28-V112 HydrophobicContact CD1-CG1 4Å; I28-V112 HydrophobicContact CD1-CG2 4.19Å; L45-V112 HydrophobicContact CD1-CG1 4.33Å; L45-V112 HydrophobicContact CD2-CG2 4.04Å; F51-V112 HydrophobicContact CE2-CG1 3.75Å; F51-V112 HydrophobicContact CZ-CG1 3.71Å; M55-V112 HydrophobicContact CG-CG2 4.4Å; V112-D123 WeakPolarHBondContact O-CA 3.45Å; V112-D123 VanDerWaalsContact O-CB 3.32Å; V112-D123 WeakPolarHBondContact O-CB 3.47Å; V112-R124 PolarHBondContact N-O 2.84Å; V112-R124 PolarHBondContact O-N 2.81Å; V112-R124 VanDerWaalsContact O-N 3.08Å; V112-F126 HydrophobicContact CG2-CD2 4.15Å; V112-F126 HydrophobicContact CG2-CE2 3.89Å
113	Q	91.2	Very high	87.9	Confident	6 Å²	6	45.1 Å²	45.1	3%	0.028	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	116.1	-176.8	-173.2	-170.4	50.9	0	0	109	F51 G53 R54 F56 H115 I117 F118 I119 D123	F51-Q113 VanDerWaalsContact CZ-O 3.31Å; F51-Q113 WeakPolarHBondContact CZ-O 3.25Å; G53-Q113 CarbonylContact C-O 3.55Å; G53-Q113 WeakPolarHBondContact CA-O 3.35Å; R54-Q113 PolarHBondContact N-O 2.67Å; R54-Q113 PolarHBondContact O-N 3.17Å; F56-Q113 HydrophobicContact CE1-CB 3.89Å; Q113-H115 VanDerWaalsContact CG-O 3.22Å; Q113-H115 WeakPolarHBondContact CG-O 3.38Å; Q113-H115 PolarHBondContact OE1-O 2.88Å; Q113-H115 VanDerWaalsContact OE1-O 3.11Å; Q113-I117 PolarHBondContact NE2-O 2.92Å; Q113-F118 WeakPolarHBondContact CG-O 3.31Å; Q113-F118 PolarHBondContact NE2-O 2.82Å; Q113-I119 HydrophobicContact CG-CG1 4.38Å; Q113-I119 VanDerWaalsContact NE2-CG1 3.3Å; Q113-D123 WeakPolarHBondContact CG-OD2 3.35Å
114	F	90.2	Very high	88.3	Confident	34 Å²	34	49.6 Å²	49.6	15%	0.149	25%	0.253	C	S	.	.	S	Bend	trans	-74.6	-29	-178.4	-77.7	-82.8	0	0	0	112.9	N26 I28 T47 F51 G53 G122 D123	N26-F114 HydrophobicContact CB-CD1 3.89Å; N26-F114 HydrophobicContact CB-CE1 3.82Å; N26-F114 WeakPolarHBondContact O-CE1 3.35Å; N26-F114 WeakPolarHBondContact O-CZ 3.4Å; I28-F114 HydrophobicContact CG1-CE2 4.19Å; I28-F114 HydrophobicContact CG1-CZ 3.81Å; T47-F114 HydrophobicContact CG2-CE1 4.34Å; F51-F114 AromaticContact CD2-CD1 3.79Å; F51-F114 HydrophobicContact CD2-CD1 3.79Å; F51-F114 AromaticContact CD2-CE1 3.78Å; F51-F114 HydrophobicContact CD2-CE1 3.78Å; F51-F114 AromaticContact CE2-CD1 3.63Å; F51-F114 HydrophobicContact CE2-CD1 3.63Å; F51-F114 AromaticContact CE2-CE1 3.8Å; F51-F114 HydrophobicContact CE2-CE1 3.8Å; F51-F114 HydrophobicContact CE2-CG 4.13Å; F51-F114 HydrophobicContact CE2-CZ 4.44Å; G53-F114 WeakPolarHBondContact CA-O 3.02Å; F114-G122 WeakPolarHBondContact CE2-O 3.31Å; F114-D123 PolarHBondContact N-OD1 2.91Å
115	H	87.9	Confident	88.5	Confident	72 Å²	72	50.5 Å²	50.5	33%	0.333	26%	0.261	S	S	.	.	S	Bend	trans	-91	140.7	178.4	-179.1	-78.3	0	0	0	110.7	Q113 I117 F118 T120	Q113-H115 VanDerWaalsContact CG-O 3.22Å; Q113-H115 WeakPolarHBondContact CG-O 3.38Å; Q113-H115 PolarHBondContact OE1-O 2.88Å; Q113-H115 VanDerWaalsContact OE1-O 3.11Å; H115-I117 VanDerWaalsContact C-N 3.25Å; H115-I117 PolarHBondContact ND1-N 2.04Å; H115-I117 VanDerWaalsContact ND1-N 3.11Å; H115-I117 PolarHBondContact O-N 3.34Å; H115-I117 VanDerWaalsContact O-N 3.16Å; H115-F118 WeakPolarHBondContact CB-O 3.35Å; H115-F118 AromaticContact CE1-CD2 3.58Å; H115-F118 PolarHBondContact ND1-N 3.39Å; H115-T120 HydrophobicContact CB-CG2 3.84Å
116	P	84.1	Confident	88.8	Confident	52 Å²	52	52.1 Å²	52.1	34%	0.338	27%	0.267	S	S	.	.	S	Bend	trans	-64.6	-22.1	-173.3	-24.5	33.9	0	0	0	115.9	R54	R54-P116 WeakPolarHBondContact CD-O 3.24Å
117	I	85.3	Confident	88.7	Confident	114 Å²	114	54 Å²	54	59%	0.585	28%	0.277	S	S	*	.	S	Bend	trans	-120.9	-62.9	-174.2	-54.3	173.9	0	0	0	111.5	Q113 H115	Q113-I117 PolarHBondContact NE2-O 2.92Å; H115-I117 VanDerWaalsContact C-N 3.25Å; H115-I117 PolarHBondContact ND1-N 2.04Å; H115-I117 VanDerWaalsContact ND1-N 3.11Å; H115-I117 PolarHBondContact O-N 3.34Å; H115-I117 VanDerWaalsContact O-N 3.16Å
118	F	87.9	Confident	88.8	Confident	138 Å²	138	54.6 Å²	54.6	61%	0.605	28%	0.28	S	S	*	.	S	Bend	trans	-90.5	150.8	-174.1	-55.8	-66.5	0	0	0	114.5	Q113 H115	Q113-F118 WeakPolarHBondContact CG-O 3.31Å; Q113-F118 PolarHBondContact NE2-O 2.82Å; H115-F118 WeakPolarHBondContact CB-O 3.35Å; H115-F118 AromaticContact CE1-CD2 3.58Å; H115-F118 PolarHBondContact ND1-N 3.39Å
119	I	85.5	Confident	88.6	Confident	117 Å²	117	58.6 Å²	58.6	60%	0.6	29%	0.294	S	S	*	.			trans	-80.1	134.6	170.2	-62.2	177	0	0	0	108.8	F56 Q113 D123	F56-I119 HydrophobicContact CZ-CD1 4.38Å; Q113-I119 HydrophobicContact CG-CG1 4.38Å; Q113-I119 VanDerWaalsContact NE2-CG1 3.3Å; I119-D123 WeakPolarHBondContact CA-OD2 3.44Å; I119-D123 HydrophobicContact CG2-CB 4.18Å; I119-D123 WeakPolarHBondContact CG2-OD2 3.46Å
120	T	85.8	Confident	88.6	Confident	62 Å²	62	57.9 Å²	57.9	38%	0.38	29%	0.29	S	S	.	.			trans	-123	165.5	-179.1	72.7	0	0	0	0	111.6	H115 G122 D123	H115-T120 HydrophobicContact CB-CG2 3.84Å; T120-G122 PolarHBondContact O-N 3.03Å; T120-G122 VanDerWaalsContact O-N 3.12Å; T120-D123 PolarHBondContact N-OD2 2.83Å; T120-D123 VanDerWaalsContact O-CB 3.25Å; T120-D123 WeakPolarHBondContact O-CB 3.45Å; T120-D123 VanDerWaalsContact O-CG 3.29Å; T120-D123 PolarHBondContact O-N 3.21Å; T120-D123 PolarHBondContact OG1-OD1 3.27Å
121	H	79.6	Confident	88.3	Confident	182 Å²	182	61.9 Å²	61.9	84%	0.843	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.5	178.2	177.8	-99.1	0	0	0	114.1	D123 R124	H121-D123 PolarHBondContact O-N 2.88Å; H121-R124 PolarHBondContact O-NH1 2.87Å
122	G	82.8	Confident	87.9	Confident	34 Å²	34	65.2 Å²	65.2	35%	0.351	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-16.6	177.1	0	0	0	0	0	114	F114 T120	F114-G122 WeakPolarHBondContact CE2-O 3.31Å; T120-G122 PolarHBondContact O-N 3.03Å; T120-G122 VanDerWaalsContact O-N 3.12Å
123	D	89	Confident	87.3	Confident	15 Å²	15	68.2 Å²	68.2	8%	0.08	34%	0.344	C	S	.	.			trans	-71.8	157.3	-174.2	-61	-12.1	0	0	0	111.7	V112 Q113 F114 I119 T120 H121	V112-D123 WeakPolarHBondContact O-CA 3.45Å; V112-D123 VanDerWaalsContact O-CB 3.32Å; V112-D123 WeakPolarHBondContact O-CB 3.47Å; Q113-D123 WeakPolarHBondContact CG-OD2 3.35Å; F114-D123 PolarHBondContact N-OD1 2.91Å; I119-D123 WeakPolarHBondContact CA-OD2 3.44Å; I119-D123 HydrophobicContact CG2-CB 4.18Å; I119-D123 WeakPolarHBondContact CG2-OD2 3.46Å; T120-D123 PolarHBondContact N-OD2 2.83Å; T120-D123 VanDerWaalsContact O-CB 3.25Å; T120-D123 WeakPolarHBondContact O-CB 3.45Å; T120-D123 VanDerWaalsContact O-CG 3.29Å; T120-D123 PolarHBondContact O-N 3.21Å; T120-D123 PolarHBondContact OG1-OD1 3.27Å; H121-D123 PolarHBondContact O-N 2.88Å
124	R	90.7	Very high	86.5	Confident	99 Å²	99	74.2 Å²	74.2	37%	0.374	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	137.2	-176.9	-63	-66.7	177.4	-105.3	3.6	110.3	I28 V112 H121 F126	I28-R124 HydrophobicContact CD1-CB 3.74Å; I28-R124 HydrophobicContact CD1-CG 3.86Å; V112-R124 PolarHBondContact N-O 2.84Å; V112-R124 PolarHBondContact O-N 2.81Å; V112-R124 VanDerWaalsContact O-N 3.08Å; H121-R124 PolarHBondContact O-NH1 2.87Å; R124-F126 HydrophobicContact CB-CE2 3.85Å; R124-F126 HydrophobicContact CB-CZ 3.98Å
125	S	91.2	Very high	85.5	Confident	58 Å²	58	79.2 Å²	79.2	41%	0.406	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	142	168.6	54.8	0	0	0	0	110.1	V110	V110-S125 CarbonylContact O-C 3.58Å; V110-S125 VanDerWaalsContact O-CA 3.26Å; V110-S125 WeakPolarHBondContact O-CA 3.42Å
126	F	91.4	Very high	84.1	Confident	45 Å²	45	80.8 Å²	80.8	20%	0.197	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	116.7	177	-60.5	-81.1	0	0	0	108.6	I28 P32 T109 V110 V112 R124 I128	I28-F126 HydrophobicContact CD1-CE2 3.6Å; I28-F126 HydrophobicContact CD1-CZ 3.67Å; P32-F126 VanDerWaalsContact CD-CE1 3.45Å; P32-F126 HydrophobicContact CG-CB 4.42Å; P32-F126 HydrophobicContact CG-CD1 3.73Å; P32-F126 HydrophobicContact CG-CD2 4.09Å; P32-F126 HydrophobicContact CG-CE1 3.91Å; P32-F126 HydrophobicContact CG-CE2 4.25Å; P32-F126 HydrophobicContact CG-CG 3.81Å; P32-F126 HydrophobicContact CG-CZ 4.16Å; T109-F126 CarbonylContact C-O 3.59Å; T109-F126 WeakPolarHBondContact CA-O 3.45Å; V110-F126 PolarHBondContact N-O 2.82Å; V110-F126 PolarHBondContact O-N 2.81Å; V112-F126 HydrophobicContact CG2-CD2 4.15Å; V112-F126 HydrophobicContact CG2-CE2 3.89Å; R124-F126 HydrophobicContact CB-CE2 3.85Å; R124-F126 HydrophobicContact CB-CZ 3.98Å; F126-I128 HydrophobicContact CB-CG2 4.34Å; F126-I128 PolarHBondContact O-N 2.96Å
127	H	89.2	Confident	82.7	Confident	71 Å²	71	83.3 Å²	83.3	33%	0.329	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	103.3	172.6	-172.1	69.4	0	0	0	108.9	T109	T109-H127 PolarHBondContact OG1-ND1 2.85Å
128	I	90.7	Very high	81.1	Confident	11 Å²	11	83.2 Å²	83.2	6%	0.056	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	142.1	-175.8	59.2	164.2	0	0	0	110.4	V34 I41 I43 M86 A107 S108 V110 F126	V34-I128 HydrophobicContact CG1-CB 4.43Å; V34-I128 HydrophobicContact CG1-CD1 4.43Å; V34-I128 HydrophobicContact CG2-CB 4.37Å; V34-I128 HydrophobicContact CG2-CG2 3.69Å; I41-I128 HydrophobicContact CD1-CD1 4.27Å; I41-I128 HydrophobicContact CG2-CD1 3.73Å; I43-I128 HydrophobicContact CD1-CD1 3.85Å; I43-I128 HydrophobicContact CG1-CD1 3.82Å; M86-I128 HydrophobicContact CE-CD1 3.21Å; M86-I128 HydrophobicContact CE-CG1 4.03Å; A107-I128 VanDerWaalsContact CA-O 3.27Å; A107-I128 WeakPolarHBondContact CA-O 3.44Å; S108-I128 PolarHBondContact N-O 3.29Å; S108-I128 VanDerWaalsContact N-O 3.07Å; S108-I128 WeakPolarHBondContact O-CG1 3.34Å; S108-I128 PolarHBondContact O-N 2.03Å; V110-I128 HydrophobicContact CG2-CD1 3.91Å; V110-I128 HydrophobicContact CG2-CG1 4.23Å; F126-I128 HydrophobicContact CB-CG2 4.34Å; F126-I128 PolarHBondContact O-N 2.96Å
129	R	87.6	Confident	78.9	Confident	89 Å²	89	82.7 Å²	82.7	34%	0.336	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.7	-179.6	-66	174.8	74.9	96.9	-8.8	110.6	T105 Y106 A107	T105-R129 HydrophobicContact CG2-CB 4.16Å; T105-R129 HydrophobicContact CG2-CG 4.4Å; Y106-R129 CarbonylContact O-C 3.59Å; Y106-R129 WeakPolarHBondContact O-CA 3.44Å; A107-R129 HydrophobicContact CB-CG 3.96Å
130	C	90	Very high	77.1	Confident	2 Å²	2	82 Å²	82	1%	0.014	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	117.9	171.7	-67.5	0	0	0	0	108.7	C36 Y88 T105 Y106 Y132	C36-C130 HydrophobicContact CB-CB 3.68Å; C36-C130 WeakPolarHBondContact CB-SG 3.38Å; C36-C130 VanDerWaalsContact SG-CA 3.51Å; C36-C130 WeakPolarHBondContact SG-CB 3.35Å; C36-C130 CovalentContact SG-SG 2.03Å; C36-C130 PolarHBondContact SG-SG 3.17Å; Y88-C130 HydrophobicContact CE1-CB 4.18Å; T105-C130 CarbonylContact C-O 3.52Å; T105-C130 WeakPolarHBondContact CA-O 3.23Å; Y106-C130 PolarHBondContact N-O 2.81Å; Y106-C130 PolarHBondContact O-N 2.84Å; C130-Y132 HydrophobicContact CB-CE2 4.25Å
131	F	87.8	Confident	75.2	Confident	86 Å²	86	84 Å²	84	38%	0.377	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.8	178.1	175.6	-110.4	0	0	0	111.1	P101 T105 A133	P101-F131 HydrophobicContact CB-CE1 4.26Å; P101-F131 HydrophobicContact CB-CZ 3.97Å; P101-F131 HydrophobicContact CG-CE1 3.66Å; P101-F131 HydrophobicContact CG-CE2 4.41Å; P101-F131 HydrophobicContact CG-CZ 3.51Å; T105-F131 WeakPolarHBondContact OG1-CD2 3.39Å; F131-A133 HydrophobicContact CE1-CB 3.69Å; F131-A133 HydrophobicContact CZ-CB 4.11Å
132	Y	85	Confident	73.8	Confident	83 Å²	83	84.2 Å²	84.2	33%	0.325	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	109.5	172.3	-68.7	-88.8	0	0	0	108.6	R37 Y88 G103 V104 Y106 C130	R37-Y132 PolarHBondContact O-OH 2.71Å; Y88-Y132 HydrophobicContact CE1-CE2 4.39Å; Y88-Y132 AromaticContact CZ-CE2 3.99Å; Y88-Y132 PolarHBondContact OH-OH 3.39Å; G103-Y132 CarbonylContact C-O 3.29Å; G103-Y132 WeakPolarHBondContact CA-O 3.45Å; V104-Y132 PolarHBondContact N-O 3.07Å; V104-Y132 PolarHBondContact O-N 2.71Å; Y106-Y132 AromaticContact CD2-CD2 3.81Å; Y106-Y132 HydrophobicContact CD2-CD2 3.81Å; Y106-Y132 AromaticContact CD2-CE2 3.94Å; Y106-Y132 HydrophobicContact CD2-CE2 3.94Å; Y106-Y132 AromaticContact CE2-CD2 3.83Å; Y106-Y132 HydrophobicContact CE2-CD2 3.83Å; Y106-Y132 HydrophobicContact CE2-CE2 4.15Å; C130-Y132 HydrophobicContact CB-CE2 4.25Å
133	A	80.1	Confident	71.9	Confident	62 Å²	62	91.4 Å²	91.4	51%	0.512	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	133.7	174.4	0	0	0	0	0	110.2	K102 F131 L135	K102-A133 WeakPolarHBondContact O-CA 3.48Å; F131-A133 HydrophobicContact CE1-CB 3.69Å; F131-A133 HydrophobicContact CZ-CB 4.11Å; A133-L135 PolarHBondContact O-N 2.94Å
134	E	75.9	Confident	70	Confident	132 Å²	132	99.8 Å²	99.8	62%	0.617	52%	0.517	S	S	*	.			trans	-82.3	108.6	163.6	-172.8	170.6	-165.7	0	0	106.7	K102 D136	K102-E134 HydrophobicContact CB-CB 4.19Å; K102-E134 PolarHBondContact O-N 3.23Å; E134-D136 PolarHBondContact O-N 3.22Å; E134-D136 VanDerWaalsContact O-N 3.14Å
135	L	68	Low	67.7	Low	139 Å²	139	101 Å²	101	73%	0.728	54%	0.536	S	S	*	.			trans	-70.1	110.7	174	-66.2	171.6	0	0	0	107.6	A133 T137	A133-L135 PolarHBondContact O-N 2.94Å; L135-T137 HydrophobicContact CB-CG2 4.13Å; L135-T137 PolarHBondContact O-N 2.94Å
136	D	59.5	Low	66	Low	106 Å²	106	102 Å²	102	57%	0.567	55%	0.554	S	S	*	*			trans	-66.5	77.4	158.8	-76.5	-28.2	0	0	0	106.7	K102 E134 T138	K102-D136 WeakPolarHBondContact CE-OD2 3.27Å; K102-D136 IonicContact NZ-OD1 2.74Å; K102-D136 PolarHBondContact NZ-OD1 2.89Å; K102-D136 IonicContact NZ-OD2 3Å; K102-D136 PolarHBondContact NZ-OD2 2.79Å; E134-D136 PolarHBondContact O-N 3.22Å; E134-D136 VanDerWaalsContact O-N 3.14Å; D136-T138 PolarHBondContact O-N 2.97Å
137	T	52.9	Low	64.1	Low	105 Å²	105	108.8 Å²	108.8	64%	0.644	58%	0.584	S	S	*	*			trans	-69.7	93.7	163.1	56.9	0	0	0	0	105.9	L135 V139	L135-T137 HydrophobicContact CB-CG2 4.13Å; L135-T137 PolarHBondContact O-N 2.94Å; T137-V139 PolarHBondContact O-N 3.2Å
138	T	52	Low	62.3	Low	111 Å²	111	112.9 Å²	112.9	68%	0.681	61%	0.607	S	S	*	*			trans	-60.7	103.3	153.7	53.3	0	0	0	0	104.8	D136 T140	D136-T138 PolarHBondContact O-N 2.97Å; T138-T140 PolarHBondContact O-N 3.44Å
139	V	42.2	Very low	60.5	Low	127 Å²	127	117.8 Å²	117.8	77%	0.77	64%	0.64	S	S	*	*			trans	-66.8	79.9	164.5	-178.7	0	0	0	0	105.5	T137 S141	T137-V139 PolarHBondContact O-N 3.2Å; V139-S141 VanDerWaalsContact C-N 3.28Å; V139-S141 PolarHBondContact O-N 2.82Å
140	T	47.8	Very low	59	Low	104 Å²	104	119.8 Å²	119.8	64%	0.638	66%	0.662	S	S	*	*			trans	-70.4	97.7	161.7	46.6	0	0	0	0	105.2	T138 Q142	T138-T140 PolarHBondContact O-N 3.44Å; T140-Q142 PolarHBondContact O-N 3.38Å; T140-Q142 VanDerWaalsContact O-N 3.13Å
141	S	46.1	Very low	57.7	Low	104 Å²	104	125.5 Å²	125.5	73%	0.727	70%	0.697	S	S	*	*			trans	-59	116.8	165.6	58.3	0	0	0	0	107	V139 F143	V139-S141 VanDerWaalsContact C-N 3.28Å; V139-S141 PolarHBondContact O-N 2.82Å; S141-F143 VanDerWaalsContact C-N 3.31Å; S141-F143 PolarHBondContact O-N 3.41Å
142	Q	49.3	Very low	56	Low	185 Å²	185	125 Å²	125	86%	0.864	71%	0.708	S	S	*	*			trans	-74.9	90.7	175.7	-61.5	-174.2	9.1	0	0	107.7	T140	T140-Q142 PolarHBondContact O-N 3.38Å; T140-Q142 VanDerWaalsContact O-N 3.13Å
143	F	44.5	Very low	54.4	Low	186 Å²	186	127.9 Å²	127.9	82%	0.816	73%	0.728	S	S	*	*			trans	-132.3	79.6	156.9	-137.6	-82	0	0	0	108.4	S141 V145	S141-F143 VanDerWaalsContact C-N 3.31Å; S141-F143 PolarHBondContact O-N 3.41Å; F143-V145 HydrophobicContact CE1-CG2 4.46Å
144	E	47.4	Very low	52.9	Low	190 Å²	190	131.7 Å²	131.7	89%	0.888	74%	0.735	S	S	*	*			trans	-137.7	119.9	160.7	-132.6	178.7	-179.6	0	0	109.7
145	V	42.4	Very low	51.6	Low	126 Å²	126	133.3 Å²	133.3	76%	0.764	75%	0.745	S	S	*	*			trans	-79.4	123.3	-175	173	0	0	0	0	109.1	F143 K147	F143-V145 HydrophobicContact CE1-CG2 4.46Å; V145-K147 PolarHBondContact O-N 2.91Å
146	G	55.5	Low	50.8	Low	77 Å²	77	134.2 Å²	134.2	79%	0.794	75%	0.747	S	S	*	*	S	Bend	trans	74.1	25.3	140.8	0	0	0	0	0	119.1
147	K	53.3	Low	50.8	Low	188 Å²	188	133.4 Å²	133.4	82%	0.817	74%	0.741	S	S	*	*	S	Bend	trans	-98.2	139.5	156.2	-70.5	-177.5	-175.4	172.7	0	109.3	V145 P149	V145-K147 PolarHBondContact O-N 2.91Å; K147-P149 VanDerWaalsContact O-N 3.15Å
148	I	49.8	Very low	51.4	Low	157 Å²	157	134 Å²	134	81%	0.805	74%	0.741	S	S	*	*			trans	-45.2	121.4	178.3	-59.9	163.1	0	0	0	108.1	T150	I148-T150 PolarHBondContact O-N 2.88Å
149	P	52.9	Low	52.1	Low	115 Å²	115	131.8 Å²	131.8	75%	0.747	73%	0.728	S	S	*	*			trans	-63.9	112.3	-178.5	24.9	-32.2	0	0	0	108.4	K147 T151	K147-P149 VanDerWaalsContact O-N 3.15Å; P149-T151 PolarHBondContact O-N 3.45Å
150	T	57.1	Low	53.9	Low	131 Å²	131	126.1 Å²	126.1	80%	0.804	69%	0.693	S	S	*	*			trans	-72	110.3	166	46.4	0	0	0	0	107.1	I148 A152	I148-T150 PolarHBondContact O-N 2.88Å; T150-A152 PolarHBondContact O-N 3.07Å
151	T	63.3	Low	55.6	Low	121 Å²	121	127.8 Å²	127.8	74%	0.742	69%	0.692	S	S	*	*			trans	-68	101.1	164.4	50.2	0	0	0	0	107.1	P149 I153	P149-T151 PolarHBondContact O-N 3.45Å; T151-I153 PolarHBondContact O-N 2.92Å
152	A	52	Low	57.8	Low	76 Å²	76	124 Å²	124	63%	0.628	67%	0.665	S	S	*	*			trans	-64.7	103.4	165.3	0	0	0	0	0	106.9	T150 E154	T150-A152 PolarHBondContact O-N 3.07Å; A152-E154 HydrophobicContact CB-CG 4.13Å; A152-E154 PolarHBondContact O-N 3.01Å
153	I	50	Low	59.9	Low	143 Å²	143	117.7 Å²	117.7	73%	0.733	64%	0.642	S	S	*	*			trans	-76.4	81.9	165.8	-57.4	173.8	0	0	0	105	T151 M155	T151-I153 PolarHBondContact O-N 2.92Å; I153-M155 VanDerWaalsContact C-N 3.32Å; I153-M155 HydrophobicContact CG2-CG 4.03Å; I153-M155 PolarHBondContact O-N 3.36Å
154	E	50	Low	62.4	Low	142 Å²	142	109.2 Å²	109.2	66%	0.664	60%	0.604	S	S	*	*			trans	-70.8	95.3	170.9	-67.5	-174.5	179.8	0	0	107.4	A152 M156	A152-E154 HydrophobicContact CB-CG 4.13Å; A152-E154 PolarHBondContact O-N 3.01Å; E154-M156 PolarHBondContact O-N 2.99Å
155	M	47.3	Very low	64.7	Low	167 Å²	167	101.7 Å²	101.7	82%	0.823	57%	0.571	S	S	*	*			trans	-73.7	77.3	165.7	-64.5	-144.9	-62.3	0	0	108.1	I153 M157	I153-M155 VanDerWaalsContact C-N 3.32Å; I153-M155 HydrophobicContact CG2-CG 4.03Å; I153-M155 PolarHBondContact O-N 3.36Å; M155-M157 PolarHBondContact O-N 2.82Å
156	M	52.3	Low	67.2	Low	157 Å²	157	95.9 Å²	95.9	77%	0.773	54%	0.536	S	S	*	.			trans	-68.9	110.3	164.3	-74.8	-169.7	164.9	0	0	107.5	E154	E154-M156 PolarHBondContact O-N 2.99Å
157	M	58.2	Low	69.2	Low	89 Å²	89	94.3 Å²	94.3	44%	0.438	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-72	129.4	168.4	-64.3	-114.2	-61.3	0	0	107.9	M155 I215 Y216	M155-M157 PolarHBondContact O-N 2.82Å; M157-I215 HydrophobicContact CE-CD1 3.51Å; M157-Y216 HydrophobicContact CE-CE2 3.73Å
158	D	66.4	Low	71.1	Confident	119 Å²	119	86.8 Å²	86.8	64%	0.636	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-55	133.2	172.1	-72.7	-32.9	0	0	0	109.5
159	P	67.2	Low	72.8	Confident	63 Å²	63	86 Å²	86	41%	0.409	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-60	149.9	174.5	25	-32.7	0	0	0	110.7	I323	P159-I323 HydrophobicContact CB-CD1 4.13Å; P159-I323 HydrophobicContact CB-CG2 4.18Å
160	P	78.9	Confident	74.6	Confident	8 Å²	8	83.1 Å²	83.1	5%	0.052	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-60.6	149.6	178.2	24.5	-32.6	0	0	0	111.4	C162 C191 I212 I283 I325	P160-C162 PolarHBondContact O-N 2.95Å; P160-C191 HydrophobicContact CB-CB 4.13Å; P160-C191 HydrophobicContact CG-CB 4.37Å; P160-I212 HydrophobicContact CB-CG2 3.96Å; P160-I212 HydrophobicContact CG-CG2 4.48Å; P160-I283 HydrophobicContact CG-CD1 3.7Å; P160-I283 HydrophobicContact CG-CG1 4.03Å; P160-I283 HydrophobicContact CG-CG2 4.31Å; P160-I325 WeakPolarHBondContact O-CD1 3.41Å
161	K	84.7	Confident	76.1	Confident	140 Å²	140	79.3 Å²	79.3	61%	0.609	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	116	169.9	-71.6	-172.1	177.5	-177.8	0	108.7	C191 A192 N194	K161-C191 WeakPolarHBondContact O-CA 3.36Å; K161-A192 PolarHBondContact N-O 2.81Å; K161-A192 PolarHBondContact O-N 3Å; K161-N194 WeakPolarHBondContact CD-OD1 3.06Å
162	C	91.6	Very high	77.4	Confident	23 Å²	23	78.7 Å²	78.7	16%	0.155	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	148.2	177.8	-54	0	0	0	0	111.9	P160 E190 C191 I281 I325 V327	P160-C162 PolarHBondContact O-N 2.95Å; C162-E190 CarbonylContact C-O 3.49Å; C162-E190 VanDerWaalsContact CA-O 3.28Å; C162-E190 WeakPolarHBondContact CA-O 3.46Å; C162-C191 HydrophobicContact CB-CB 4.16Å; C162-C191 WeakPolarHBondContact CB-SG 3.44Å; C162-C191 WeakPolarHBondContact SG-CB 3.14Å; C162-C191 CovalentContact SG-SG 2.04Å; C162-C191 PolarHBondContact SG-SG 3.09Å; C162-I281 HydrophobicContact CB-CD1 3.72Å; C162-I325 HydrophobicContact CB-CG2 4.17Å; C162-I325 VanDerWaalsContact SG-CD1 3.58Å; C162-V327 HydrophobicContact CB-CG1 4Å
163	S	93.1	Very high	79.3	Confident	54 Å²	54	75.5 Å²	75.5	38%	0.378	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	149.4	-179.4	65.3	0	0	0	0	110.5	W189 E190	S163-W189 WeakPolarHBondContact O-CA 3.46Å; S163-E190 PolarHBondContact N-O 2.81Å; S163-E190 PolarHBondContact O-N 3.07Å; S163-E190 PolarHBondContact OG-O 2.88Å
164	Y	96.3	Very high	81.4	Confident	8 Å²	8	72.9 Å²	72.9	3%	0.031	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	121.6	176.2	178	-164.1	0	0	0	109	V166 H187 R188 W189 F277 C279 V327 T329	Y164-V166 HydrophobicContact CE2-CG2 4.38Å; Y164-H187 HydrophobicContact CE2-CB 4.08Å; Y164-H187 AromaticContact CE2-ND1 3.66Å; Y164-H187 AromaticContact CZ-ND1 3.65Å; Y164-H187 PolarHBondContact OH-CE1 3Å; Y164-H187 PolarHBondContact OH-ND1 2.67Å; Y164-R188 WeakPolarHBondContact CA-O 3.36Å; Y164-W189 AromaticContact CD1-NE1 3.39Å; Y164-W189 AromaticContact CD2-CD1 3.7Å; Y164-W189 AromaticContact CD2-CD2 3.97Å; Y164-W189 HydrophobicContact CD2-CD2 3.97Å; Y164-W189 AromaticContact CD2-CE2 3.51Å; Y164-W189 HydrophobicContact CD2-CG 4.1Å; Y164-W189 HydrophobicContact CD2-CZ2 4.02Å; Y164-W189 AromaticContact CD2-NE1 3.31Å; Y164-W189 VanDerWaalsContact CD2-NE1 3.31Å; Y164-W189 AromaticContact CE1-CE2 4Å; Y164-W189 AromaticContact CE1-CZ2 3.97Å; Y164-W189 HydrophobicContact CE1-CZ2 3.97Å; Y164-W189 AromaticContact CE1-NE1 3.59Å; Y164-W189 HydrophobicContact CE2-CD2 4.11Å; Y164-W189 AromaticContact CE2-CE2 3.39Å; Y164-W189 HydrophobicContact CE2-CH2 4.06Å; Y164-W189 AromaticContact CE2-CZ2 3.38Å; Y164-W189 HydrophobicContact CE2-CZ2 3.38Å; Y164-W189 AromaticContact CE2-NE1 3.6Å; Y164-W189 AromaticContact CG-CD1 3.57Å; Y164-W189 AromaticContact CG-CE2 3.95Å; Y164-W189 HydrophobicContact CG-CG 4.38Å; Y164-W189 AromaticContact CG-NE1 3.25Å; Y164-W189 VanDerWaalsContact CG-NE1 3.25Å; Y164-W189 AromaticContact CZ-CE2 3.65Å; Y164-W189 AromaticContact CZ-CZ2 3.35Å; Y164-W189 AromaticContact CZ-NE1 3.73Å; Y164-W189 WeakPolarHBondContact OH-CZ2 3.43Å; Y164-F277 HydrophobicContact CD1-CB 4.38Å; Y164-F277 HydrophobicContact CE1-CB 3.31Å; Y164-F277 HydrophobicContact CE1-CG 4.38Å; Y164-F277 WeakPolarHBondContact OH-CB 3.43Å; Y164-F277 WeakPolarHBondContact OH-CG 3.33Å; Y164-C279 HydrophobicContact CD1-CB 4.46Å; Y164-V327 HydrophobicContact CD1-CG2 4.2Å; Y164-V327 HydrophobicContact CG-CG2 4.37Å; Y164-T329 HydrophobicContact CD1-CG2 3.47Å; Y164-T329 VanDerWaalsContact CD1-CG2 3.47Å; Y164-T329 HydrophobicContact CD2-CG2 3.83Å; Y164-T329 HydrophobicContact CE1-CG2 3.54Å; Y164-T329 HydrophobicContact CE2-CG2 3.82Å; Y164-T329 HydrophobicContact CG-CG2 3.61Å
165	T	96	Very high	83.4	Confident	31 Å²	31	69.1 Å²	69.1	19%	0.19	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	147.3	-178.2	58	0	0	0	0	111.2	V175 R188	T165-V175 HydrophobicContact CG2-CG2 4.23Å; T165-R188 PolarHBondContact N-O 2.88Å; T165-R188 PolarHBondContact O-N 2.8Å
166	V	96.5	Very high	85.6	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.024	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.9	169.6	-175.8	0	0	0	0	107.3	Y164 V175 V176 V185 F186 F277 T329 I332	Y164-V166 HydrophobicContact CE2-CG2 4.38Å; V166-V175 CarbonylContact O-C 3.47Å; V166-V175 WeakPolarHBondContact O-CA 3.14Å; V166-V176 HydrophobicContact CG1-CB 4.45Å; V166-V176 HydrophobicContact CG1-CG2 4.37Å; V166-V176 PolarHBondContact O-N 3.3Å; V166-V185 HydrophobicContact CG1-CB 3.76Å; V166-V185 HydrophobicContact CG1-CG1 4.27Å; V166-V185 HydrophobicContact CG1-CG2 3.82Å; V166-F186 CarbonylContact C-O 3.5Å; V166-F186 WeakPolarHBondContact CA-O 3.5Å; V166-F277 HydrophobicContact CG2-CD2 4.03Å; V166-F277 HydrophobicContact CG2-CE2 4.2Å; V166-T329 HydrophobicContact CG2-CG2 4.01Å; V166-I332 HydrophobicContact CB-CD1 3.84Å; V166-I332 HydrophobicContact CG1-CD1 4.06Å; V166-I332 HydrophobicContact CG2-CD1 3.92Å
167	R	96.3	Very high	87.4	Confident	44 Å²	44	62.3 Å²	62.3	17%	0.166	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142	-167.8	-50.8	-177.5	81	-179.4	5.9	111.1	F171 N172 G173 P174 V185 F186	R167-F171 WeakPolarHBondContact CD-O 2.9Å; R167-F171 PolarHBondContact NH1-O 3.25Å; R167-N172 VanDerWaalsContact CZ-C 3.43Å; R167-N172 PolarHBondContact NH1-OD1 3.23Å; R167-N172 VanDerWaalsContact NH2-C 3.34Å; R167-N172 PolarHBondContact NH2-O 3.03Å; R167-G173 PolarHBondContact NE-O 2.05Å; R167-G173 PolarHBondContact NH2-O 3.22Å; R167-P174 VanDerWaalsContact CA-O 3.27Å; R167-P174 WeakPolarHBondContact CA-O 3.39Å; R167-V185 CarbonylContact O-C 3.56Å; R167-V185 WeakPolarHBondContact O-CA 3.35Å; R167-F186 PolarHBondContact N-O 2.91Å; R167-F186 PolarHBondContact O-N 2.86Å
168	S	93.3	Very high	89	Confident	30 Å²	30	61.1 Å²	61.1	21%	0.21	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	151.8	-178.6	57	0	0	0	0	112.7	S170 P174	S168-S170 PolarHBondContact O-N 2.86Å; S168-P174 PolarHBondContact N-O 2.92Å; S168-P174 VanDerWaalsContact N-O 3.08Å; S168-P174 WeakPolarHBondContact OG-CG 3.42Å
169	N	85.5	Confident	90.3	Very high	140 Å²	140	55.8 Å²	55.8	75%	0.749	31%	0.306	S	S	*	.	S	Bend	trans	64.1	-40.9	172.8	-56.4	-26.9	0	0	0	116.5	F186	N169-F186 WeakPolarHBondContact O-CE2 3.23Å
170	S	90.3	Very high	91.5	Very high	55 Å²	55	58.3 Å²	58.3	39%	0.385	31%	0.31	S	S	.	.	S	Bend	trans	-149	162.4	-175.8	68.6	0	0	0	0	112	S168 N172 G173	S168-S170 PolarHBondContact O-N 2.86Å; S170-N172 PolarHBondContact O-N 3Å; S170-N172 VanDerWaalsContact O-N 3.1Å; S170-G173 PolarHBondContact O-N 2.98Å; S170-G173 PolarHBondContact OG-N 2.9Å; S170-G173 VanDerWaalsContact OG-N 3.12Å
171	F	88.8	Confident	92.2	Very high	51 Å²	51	60.4 Å²	60.4	22%	0.224	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-30.2	174.3	179.5	-101.1	0	0	0	113.7	R167 R188 L259 Y261	R167-F171 WeakPolarHBondContact CD-O 2.9Å; R167-F171 PolarHBondContact NH1-O 3.25Å; F171-R188 HydrophobicContact CE2-CB 4.13Å; F171-R188 HydrophobicContact CE2-CG 3.81Å; F171-R188 HydrophobicContact CZ-CG 3.87Å; F171-L259 HydrophobicContact CE1-CD2 4.12Å; F171-L259 HydrophobicContact CE2-CD2 4.32Å; F171-L259 HydrophobicContact CZ-CD1 3.77Å; F171-L259 HydrophobicContact CZ-CD2 3.52Å; F171-L259 HydrophobicContact CZ-CG 4Å; F171-Y261 HydrophobicContact CD2-CD2 4.39Å; F171-Y261 HydrophobicContact CD2-CG 4.18Å; F171-Y261 HydrophobicContact CE2-CD1 4.32Å; F171-Y261 AromaticContact CE2-CG 3.98Å; F171-Y261 HydrophobicContact CE2-CG 3.98Å
172	N	90.3	Very high	92.6	Very high	109 Å²	109	55.4 Å²	55.4	58%	0.583	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	12	179.3	-76.2	-39.5	0	0	0	114.5	R167 S170 R188	R167-N172 VanDerWaalsContact CZ-C 3.43Å; R167-N172 PolarHBondContact NH1-OD1 3.23Å; R167-N172 VanDerWaalsContact NH2-C 3.34Å; R167-N172 PolarHBondContact NH2-O 3.03Å; S170-N172 PolarHBondContact O-N 3Å; S170-N172 VanDerWaalsContact O-N 3.1Å; N172-R188 PolarHBondContact OD1-NH1 2.75Å
173	G	91.4	Very high	92.7	Very high	8 Å²	8	57.6 Å²	57.6	8%	0.082	32%	0.321	C	S	.	.	S	Bend	trans	-69.7	180	-175.9	0	0	0	0	0	115.5	R167 S170	R167-G173 PolarHBondContact NE-O 2.05Å; R167-G173 PolarHBondContact NH2-O 3.22Å; S170-G173 PolarHBondContact O-N 2.98Å; S170-G173 PolarHBondContact OG-N 2.9Å; S170-G173 VanDerWaalsContact OG-N 3.12Å
174	P	94.2	Very high	92.7	Very high	88 Å²	88	59.8 Å²	59.8	57%	0.571	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-68.8	151.7	175.5	29.3	-32.2	0	0	0	111.2	R167 S168 V176	R167-P174 VanDerWaalsContact CA-O 3.27Å; R167-P174 WeakPolarHBondContact CA-O 3.39Å; S168-P174 PolarHBondContact N-O 2.92Å; S168-P174 VanDerWaalsContact N-O 3.08Å; S168-P174 WeakPolarHBondContact OG-CG 3.42Å; P174-V176 PolarHBondContact O-N 3.02Å
175	V	93.5	Very high	92.7	Very high	64 Å²	64	59.6 Å²	59.6	39%	0.388	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-67.8	128.1	175.3	178.2	0	0	0	0	109.4	T165 V166	T165-V175 HydrophobicContact CG2-CG2 4.23Å; V166-V175 CarbonylContact O-C 3.47Å; V166-V175 WeakPolarHBondContact O-CA 3.14Å
176	V	92.6	Very high	92.8	Very high	9 Å²	9	58.9 Å²	58.9	6%	0.055	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-71	130.5	-179	-178	0	0	0	0	109.8	V166 P174 A179 V185 I332	V166-V176 HydrophobicContact CG1-CB 4.45Å; V166-V176 HydrophobicContact CG1-CG2 4.37Å; V166-V176 PolarHBondContact O-N 3.3Å; P174-V176 PolarHBondContact O-N 3.02Å; V176-A179 HydrophobicContact CG1-CB 3.74Å; V176-V185 HydrophobicContact CG2-CG1 3.95Å; V176-I332 HydrophobicContact CG1-CG2 3.85Å
177	R	91.1	Very high	92.8	Very high	172 Å²	172	58.9 Å²	58.9	65%	0.649	32%	0.318	S	S	*	.	S	Bend	trans	-117.9	-24.6	169.5	-62.3	-174.4	179.5	-148.3	-1.3	112.4	L333	R177-L333 PolarHBondContact O-N 3.2Å
178	S	91.7	Very high	92.8	Very high	63 Å²	63	58.4 Å²	58.4	44%	0.441	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	135.7	175.8	-173.6	0	0	0	0	108.3	L333	S178-L333 CarbonylContact C-O 3.48Å; S178-L333 WeakPolarHBondContact CA-O 3.44Å
179	A	92.4	Very high	93	Very high	8 Å²	8	57 Å²	57	7%	0.066	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	160.1	175.8	0	0	0	0	0	110.3	V176 D183 V266 L333 V334 I335	V176-A179 HydrophobicContact CG1-CB 3.74Å; A179-D183 HydrophobicContact CB-CB 4.39Å; A179-V266 HydrophobicContact CB-CB 4.47Å; A179-V266 HydrophobicContact CB-CG1 4.21Å; A179-V266 HydrophobicContact CB-CG2 3.84Å; A179-L333 PolarHBondContact N-O 3.4Å; A179-V334 CarbonylContact O-C 3.57Å; A179-V334 VanDerWaalsContact O-CA 3.31Å; A179-V334 WeakPolarHBondContact O-CA 3.11Å; A179-I335 PolarHBondContact O-N 3.14Å
180	K	92.7	Very high	93.4	Very high	116 Å²	116	53.3 Å²	53.3	50%	0.504	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	154.2	172.3	-62.7	-177.5	177.9	-174	0	110.5	G182 D183 V266 I335	K180-G182 PolarHBondContact O-N 3.4Å; K180-D183 PolarHBondContact N-OD2 2.89Å; K180-D183 WeakPolarHBondContact O-CB 3.37Å; K180-D183 PolarHBondContact O-N 2.91Å; K180-D183 VanDerWaalsContact O-N 3.11Å; K180-V266 WeakPolarHBondContact O-CB 3.48Å; K180-I335 WeakPolarHBondContact CA-O 3.36Å; K180-I335 HydrophobicContact CG-CB 4.38Å
181	V	93.1	Very high	93.3	Very high	52 Å²	52	51.3 Å²	51.3	32%	0.315	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	132.5	171.8	177	0	0	0	0	109.6	D183 V266 K268 V334 I335 S337	V181-D183 VanDerWaalsContact C-N 3.32Å; V181-V266 WeakPolarHBondContact CA-O 3.32Å; V181-K268 HydrophobicContact CG2-CG 4.05Å; V181-V334 HydrophobicContact CG2-CG1 3.5Å; V181-I335 PolarHBondContact N-O 2.91Å; V181-S337 PolarHBondContact O-OG 3.42Å
182	G	93	Very high	93	Very high	34 Å²	34	51.2 Å²	51.2	35%	0.351	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-6.4	-176.9	0	0	0	0	0	115.1	K180 V266	K180-G182 PolarHBondContact O-N 3.4Å; G182-V266 PolarHBondContact N-O 2.97Å
183	D	93.9	Very high	91.8	Very high	70 Å²	70	47 Å²	47	37%	0.374	26%	0.262	S	S	.	.			trans	-62.9	138.6	171	-75.9	-10.6	0	0	0	110.1	A179 K180 V181 E265 V266	A179-D183 HydrophobicContact CB-CB 4.39Å; K180-D183 PolarHBondContact N-OD2 2.89Å; K180-D183 WeakPolarHBondContact O-CB 3.37Å; K180-D183 PolarHBondContact O-N 2.91Å; K180-D183 VanDerWaalsContact O-N 3.11Å; V181-D183 VanDerWaalsContact C-N 3.32Å; D183-E265 CarbonylContact O-C 3.59Å; D183-E265 WeakPolarHBondContact O-CA 3.27Å; D183-V266 HydrophobicContact CB-CG2 4.25Å; D183-V266 WeakPolarHBondContact O-CG2 3.45Å; D183-V266 PolarHBondContact O-N 2.94Å
184	E	94.1	Very high	90.2	Very high	100 Å²	100	50.1 Å²	50.1	47%	0.467	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	126.9	176.8	-62.8	-167.2	136.2	0	0	111.6	K263	E184-K263 WeakPolarHBondContact OE1-CE 3.44Å; E184-K263 IonicContact OE1-NZ 3.22Å; E184-K263 PolarHBondContact OE1-NZ 3.13Å; E184-K263 VanDerWaalsContact OE2-CE 3.25Å; E184-K263 WeakPolarHBondContact OE2-CE 3.49Å; E184-K263 IonicContact OE2-NZ 2.67Å; E184-K263 PolarHBondContact OE2-NZ 3.32Å
185	V	96.2	Very high	88.1	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.024	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	159.8	178	-65.2	0	0	0	0	112.3	V166 R167 V176 T264 V266	V166-V185 HydrophobicContact CG1-CB 3.76Å; V166-V185 HydrophobicContact CG1-CG1 4.27Å; V166-V185 HydrophobicContact CG1-CG2 3.82Å; R167-V185 CarbonylContact O-C 3.56Å; R167-V185 WeakPolarHBondContact O-CA 3.35Å; V176-V185 HydrophobicContact CG2-CG1 3.95Å; V185-T264 WeakPolarHBondContact CG2-OG1 3.39Å; V185-T264 PolarHBondContact N-O 3.29Å; V185-T264 PolarHBondContact O-N 3.39Å; V185-V266 HydrophobicContact CB-CG2 4.17Å; V185-V266 HydrophobicContact CG1-CG2 3.39Å; V185-V266 HydrophobicContact CG2-CG2 3.67Å
186	F	97	Very high	86	Confident	16 Å²	16	51.5 Å²	51.5	7%	0.07	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	116.4	179.9	-69.1	-94.3	0	0	0	109.8	V166 R167 N169 A262 K263	V166-F186 CarbonylContact C-O 3.5Å; V166-F186 WeakPolarHBondContact CA-O 3.5Å; R167-F186 PolarHBondContact N-O 2.91Å; R167-F186 PolarHBondContact O-N 2.86Å; N169-F186 WeakPolarHBondContact O-CE2 3.23Å; F186-A262 WeakPolarHBondContact CA-O 3.39Å; F186-K263 HydrophobicContact CD1-CB 4.1Å; F186-K263 HydrophobicContact CD1-CG 4.33Å; F186-K263 HydrophobicContact CE1-CB 3.82Å; F186-K263 HydrophobicContact CE1-CD 4Å; F186-K263 HydrophobicContact CE1-CG 3.82Å; F186-K263 HydrophobicContact CE2-CG 4.48Å; F186-K263 HydrophobicContact CZ-CB 4.42Å; F186-K263 HydrophobicContact CZ-CD 3.83Å; F186-K263 HydrophobicContact CZ-CG 3.91Å
187	H	97.6	Very high	83.6	Confident	3 Å²	3	60.6 Å²	60.6	1%	0.014	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	128.1	168.3	-65.8	-105.9	0	0	0	108.6	Y164 W189 Y261 A262 T264 F277	Y164-H187 HydrophobicContact CE2-CB 4.08Å; Y164-H187 AromaticContact CE2-ND1 3.66Å; Y164-H187 AromaticContact CZ-ND1 3.65Å; Y164-H187 PolarHBondContact OH-CE1 3Å; Y164-H187 PolarHBondContact OH-ND1 2.67Å; H187-W189 HydrophobicContact CB-CE3 4.35Å; H187-W189 HydrophobicContact CB-CH2 3.42Å; H187-W189 VanDerWaalsContact CB-CH2 3.42Å; H187-W189 HydrophobicContact CB-CZ2 4.25Å; H187-W189 HydrophobicContact CB-CZ3 3.48Å; H187-W189 VanDerWaalsContact CB-CZ3 3.48Å; H187-Y261 WeakPolarHBondContact O-CA 3.38Å; H187-Y261 WeakPolarHBondContact O-CB 3.22Å; H187-A262 PolarHBondContact N-O 3.49Å; H187-A262 PolarHBondContact O-N 3.46Å; H187-T264 PolarHBondContact CD2-OG1 3.03Å; H187-T264 PolarHBondContact NE2-OG1 3.45Å; H187-F277 AromaticContact CE1-CE1 3.98Å; H187-F277 AromaticContact CE1-CE2 3.74Å; H187-F277 AromaticContact CE1-CZ 3.71Å
188	R	96.8	Very high	81.5	Confident	34 Å²	34	54.9 Å²	54.9	13%	0.128	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.7	-179.4	176.1	-178.1	175.6	152.5	-7.8	109.8	Y164 T165 F171 N172 E190 L259	Y164-R188 WeakPolarHBondContact CA-O 3.36Å; T165-R188 PolarHBondContact N-O 2.88Å; T165-R188 PolarHBondContact O-N 2.8Å; F171-R188 HydrophobicContact CE2-CB 4.13Å; F171-R188 HydrophobicContact CE2-CG 3.81Å; F171-R188 HydrophobicContact CZ-CG 3.87Å; N172-R188 PolarHBondContact OD1-NH1 2.75Å; R188-E190 IonicContact CZ-OE2 2.97Å; R188-E190 VanDerWaalsContact CZ-OE2 3.22Å; R188-E190 IonicContact NE-OE2 3.91Å; R188-E190 PolarHBondContact NE-OE2 2.93Å; R188-E190 IonicContact NH2-OE1 3.83Å; R188-E190 IonicContact NH2-OE2 3.01Å; R188-E190 PolarHBondContact NH2-OE2 2.85Å; R188-L259 HydrophobicContact CG-CD1 4.01Å
189	W	96.7	Very high	79.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	134	168.1	-60.3	-96.7	0	0	0	109	S163 Y164 H187 M218 V220 L248 L251 L259 A260 A262 I281	S163-W189 WeakPolarHBondContact O-CA 3.46Å; Y164-W189 AromaticContact CD1-NE1 3.39Å; Y164-W189 AromaticContact CD2-CD1 3.7Å; Y164-W189 AromaticContact CD2-CD2 3.97Å; Y164-W189 HydrophobicContact CD2-CD2 3.97Å; Y164-W189 AromaticContact CD2-CE2 3.51Å; Y164-W189 HydrophobicContact CD2-CG 4.1Å; Y164-W189 HydrophobicContact CD2-CZ2 4.02Å; Y164-W189 AromaticContact CD2-NE1 3.31Å; Y164-W189 VanDerWaalsContact CD2-NE1 3.31Å; Y164-W189 AromaticContact CE1-CE2 4Å; Y164-W189 AromaticContact CE1-CZ2 3.97Å; Y164-W189 HydrophobicContact CE1-CZ2 3.97Å; Y164-W189 AromaticContact CE1-NE1 3.59Å; Y164-W189 HydrophobicContact CE2-CD2 4.11Å; Y164-W189 AromaticContact CE2-CE2 3.39Å; Y164-W189 HydrophobicContact CE2-CH2 4.06Å; Y164-W189 AromaticContact CE2-CZ2 3.38Å; Y164-W189 HydrophobicContact CE2-CZ2 3.38Å; Y164-W189 AromaticContact CE2-NE1 3.6Å; Y164-W189 AromaticContact CG-CD1 3.57Å; Y164-W189 AromaticContact CG-CE2 3.95Å; Y164-W189 HydrophobicContact CG-CG 4.38Å; Y164-W189 AromaticContact CG-NE1 3.25Å; Y164-W189 VanDerWaalsContact CG-NE1 3.25Å; Y164-W189 AromaticContact CZ-CE2 3.65Å; Y164-W189 AromaticContact CZ-CZ2 3.35Å; Y164-W189 AromaticContact CZ-NE1 3.73Å; Y164-W189 WeakPolarHBondContact OH-CZ2 3.43Å; H187-W189 HydrophobicContact CB-CE3 4.35Å; H187-W189 HydrophobicContact CB-CH2 3.42Å; H187-W189 VanDerWaalsContact CB-CH2 3.42Å; H187-W189 HydrophobicContact CB-CZ2 4.25Å; H187-W189 HydrophobicContact CB-CZ3 3.48Å; H187-W189 VanDerWaalsContact CB-CZ3 3.48Å; W189-M218 HydrophobicContact CB-CE 4.06Å; W189-M218 WeakPolarHBondContact O-CE 3.47Å; W189-V220 HydrophobicContact CB-CG2 3.83Å; W189-V220 HydrophobicContact CD2-CG1 4.19Å; W189-V220 HydrophobicContact CD2-CG2 4.11Å; W189-V220 HydrophobicContact CG-CG1 4.27Å; W189-V220 HydrophobicContact CG-CG2 3.7Å; W189-V220 HydrophobicContact CZ2-CG1 4.35Å; W189-L248 HydrophobicContact CH2-CD1 4.41Å; W189-L251 HydrophobicContact CE3-CD1 4.48Å; W189-L251 HydrophobicContact CH2-CD1 4.3Å; W189-L251 HydrophobicContact CH2-CD2 3.69Å; W189-L251 HydrophobicContact CZ3-CD1 4.2Å; W189-L251 HydrophobicContact CZ3-CD2 3.62Å; W189-L251 HydrophobicContact CZ3-CG 4.49Å; W189-L259 WeakPolarHBondContact O-CA 3.44Å; W189-L259 WeakPolarHBondContact O-CD1 3.48Å; W189-A260 HydrophobicContact CB-CB 4.3Å; W189-A260 HydrophobicContact CE3-CB 4.37Å; W189-A260 PolarHBondContact N-O 3.41Å; W189-A260 PolarHBondContact O-N 3.46Å; W189-A262 HydrophobicContact CZ3-CB 4.47Å; W189-I281 HydrophobicContact CB-CD1 4.48Å
190	E	93.5	Very high	77.6	Confident	63 Å²	63	68.7 Å²	68.7	29%	0.294	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	126.7	-177.6	-177.6	173	-173.3	0	0	110.4	C162 S163 R188 L259	C162-E190 CarbonylContact C-O 3.49Å; C162-E190 VanDerWaalsContact CA-O 3.28Å; C162-E190 WeakPolarHBondContact CA-O 3.46Å; S163-E190 PolarHBondContact N-O 2.81Å; S163-E190 PolarHBondContact O-N 3.07Å; S163-E190 PolarHBondContact OG-O 2.88Å; R188-E190 IonicContact CZ-OE2 2.97Å; R188-E190 VanDerWaalsContact CZ-OE2 3.22Å; R188-E190 IonicContact NE-OE2 3.91Å; R188-E190 PolarHBondContact NE-OE2 2.93Å; R188-E190 IonicContact NH2-OE1 3.83Å; R188-E190 IonicContact NH2-OE2 3.01Å; R188-E190 PolarHBondContact NH2-OE2 2.85Å; E190-L259 HydrophobicContact CB-CD1 3.85Å; E190-L259 HydrophobicContact CG-CD1 4.06Å
191	C	89.7	Confident	76	Confident	13 Å²	13	68.6 Å²	68.6	9%	0.088	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	99.5	171.8	-68.6	0	0	0	0	109.4	P160 K161 C162 M218 G258	P160-C191 HydrophobicContact CB-CB 4.13Å; P160-C191 HydrophobicContact CG-CB 4.37Å; K161-C191 WeakPolarHBondContact O-CA 3.36Å; C162-C191 HydrophobicContact CB-CB 4.16Å; C162-C191 WeakPolarHBondContact CB-SG 3.44Å; C162-C191 WeakPolarHBondContact SG-CB 3.14Å; C162-C191 CovalentContact SG-SG 2.04Å; C162-C191 PolarHBondContact SG-SG 3.09Å; C191-M218 HydrophobicContact CB-SD 3.85Å; C191-M218 PolarHBondContact SG-SD 2.97Å; C191-G258 PolarHBondContact N-O 2.9Å
192	A	80.6	Confident	74.2	Confident	50 Å²	50	71.4 Å²	71.4	41%	0.413	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.1	174.4	0	0	0	0	0	109.8	K161	K161-A192 PolarHBondContact N-O 2.81Å; K161-A192 PolarHBondContact O-N 3Å
193	G	66.7	Low	72.4	Confident	20 Å²	20	75.9 Å²	75.9	21%	0.206	41%	0.414	C	S	.	.			trans	-66.6	139.9	164.2	0	0	0	0	0	111	N195	G193-N195 PolarHBondContact O-N 2.99Å
194	N	57.8	Low	70.5	Confident	74 Å²	74	80.4 Å²	80.4	40%	0.396	44%	0.439	S	S	.	.			trans	-63.9	101.2	150.3	-61.8	-29.5	0	0	0	104.5	K161 G196	K161-N194 WeakPolarHBondContact CD-OD1 3.06Å; N194-G196 PolarHBondContact O-N 3.08Å
195	N	50	Low	68.7	Low	115 Å²	115	84 Å²	84	62%	0.615	45%	0.448	S	S	*	.			trans	-49.9	107.1	154.9	-68.5	-36.6	0	0	0	103.3	G193 K197	G193-N195 PolarHBondContact O-N 2.99Å; N195-K197 PolarHBondContact O-N 3.19Å
196	G	48.4	Very low	66.8	Low	66 Å²	66	94.1 Å²	94.1	68%	0.68	49%	0.487	S	S	*	.			trans	-44.3	114.8	-176	0	0	0	0	0	105.9	N194 A198	N194-G196 PolarHBondContact O-N 3.08Å; G196-A198 WeakPolarHBondContact O-CA 3.41Å; G196-A198 PolarHBondContact O-N 3.34Å
197	K	43.5	Very low	64.6	Low	199 Å²	199	99.2 Å²	99.2	87%	0.865	51%	0.506	S	S	*	.			trans	-47.7	113.3	-173.6	-81.3	179.2	-179.1	170.1	0	104.2	N195 D199	N195-K197 PolarHBondContact O-N 3.19Å; K197-D199 PolarHBondContact O-N 2.86Å
198	A	46.3	Very low	62.3	Low	53 Å²	53	104 Å²	104	44%	0.438	54%	0.535	S	S	.	.			trans	-48.5	110	-170.9	0	0	0	0	0	107.1	G196 R200	G196-A198 WeakPolarHBondContact O-CA 3.41Å; G196-A198 PolarHBondContact O-N 3.34Å; A198-R200 PolarHBondContact O-N 3.48Å
199	D	48.7	Very low	60.2	Low	119 Å²	119	111.1 Å²	111.1	64%	0.636	57%	0.567	S	S	*	*			trans	-50.7	106.7	-177.7	-111.8	-12.5	0	0	0	106.3	K197 C201 K202 R207	K197-D199 PolarHBondContact O-N 2.86Å; D199-C201 PolarHBondContact O-N 3.41Å; D199-K202 PolarHBondContact O-N 3.25Å; D199-R207 PolarHBondContact O-NH2 3.4Å
200	R	54	Low	58.4	Low	242 Å²	242	114.2 Å²	114.2	91%	0.913	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-12.5	-171.9	-79.5	-171.3	-74.5	-123.6	0.6	111.6	A198	A198-R200 PolarHBondContact O-N 3.48Å
201	C	57.8	Low	56.9	Low	114 Å²	114	116.7 Å²	116.7	77%	0.77	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	4	-174.5	-58.6	0	0	0	0	115.6	D199	D199-C201 PolarHBondContact O-N 3.41Å
202	K	56.4	Low	55.9	Low	111 Å²	111	117.2 Å²	117.2	48%	0.483	60%	0.597	S	S	.	*			trans	-130.8	89.1	175	-65.5	-165.8	-174.9	179.8	0	112.7	D199 N204 R207	D199-K202 PolarHBondContact O-N 3.25Å; K202-N204 PolarHBondContact O-N 3.48Å; K202-R207 PolarHBondContact O-NH2 2.86Å
203	P	54.9	Low	55.4	Low	127 Å²	127	116.4 Å²	116.4	83%	0.825	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-14.3	-176.5	26	-31.8	0	0	0	115.2
204	N	54.9	Low	55.7	Low	166 Å²	166	120.6 Å²	120.6	89%	0.888	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.1	30.2	-166.8	-143	25.1	0	0	0	116.1	K202	K202-N204 PolarHBondContact O-N 3.48Å
205	R	56.1	Low	56.7	Low	174 Å²	174	118.4 Å²	118.4	66%	0.657	59%	0.591	S	S	*	*	S	Bend	trans	-112.3	127.1	171.4	-151.9	-175.4	-67.9	-156.5	-4.1	108.6	R207	R205-R207 WeakPolarHBondContact O-CG 3.49Å; R205-R207 PolarHBondContact O-N 3.22Å
206	Y	54.6	Low	58.4	Low	218 Å²	218	115.3 Å²	115.3	86%	0.855	57%	0.571	S	S	*	*			trans	-47.4	105	169.9	-179.4	-103.8	0	0	0	108.9	V208	Y206-V208 HydrophobicContact CD1-CG2 4.03Å; Y206-V208 HydrophobicContact CE1-CG2 3.82Å; Y206-V208 PolarHBondContact O-N 2.94Å
207	R	51	Low	60.3	Low	123 Å²	123	112.2 Å²	112.2	46%	0.464	54%	0.539	S	S	.	.			trans	-86.7	101.1	-177.9	-72.2	-176.2	175	154.5	-6	107.5	D199 K202 R205 K209	D199-R207 PolarHBondContact O-NH2 3.4Å; K202-R207 PolarHBondContact O-NH2 2.86Å; R205-R207 WeakPolarHBondContact O-CG 3.49Å; R205-R207 PolarHBondContact O-N 3.22Å; R207-K209 VanDerWaalsContact C-N 3.3Å; R207-K209 PolarHBondContact O-N 3.33Å
208	V	50	Low	62.6	Low	102 Å²	102	102.8 Å²	102.8	62%	0.618	50%	0.498	S	S	*	.			trans	-64.6	101.4	159.8	-172.3	0	0	0	0	105.8	Y206 V210	Y206-V208 HydrophobicContact CD1-CG2 4.03Å; Y206-V208 HydrophobicContact CE1-CG2 3.82Å; Y206-V208 PolarHBondContact O-N 2.94Å; V208-V210 HydrophobicContact CB-CG2 4.18Å; V208-V210 HydrophobicContact CG1-CG2 3.38Å; V208-V210 PolarHBondContact O-N 3.43Å
209	K	53.6	Low	64.9	Low	185 Å²	185	100.4 Å²	100.4	80%	0.804	48%	0.478	S	S	*	.			trans	-72.3	78.5	166.4	-73.4	-177.5	-178.7	176	0	106.4	R207 K211	R207-K209 VanDerWaalsContact C-N 3.3Å; R207-K209 PolarHBondContact O-N 3.33Å; K209-K211 PolarHBondContact O-N 2.84Å
210	V	57.5	Low	67.3	Low	64 Å²	64	94.8 Å²	94.8	39%	0.388	45%	0.448	S	S	.	.			trans	-70.6	114.2	169.2	-170.9	0	0	0	0	106.4	V208 I212 I215	V208-V210 HydrophobicContact CB-CG2 4.18Å; V208-V210 HydrophobicContact CG1-CG2 3.38Å; V208-V210 PolarHBondContact O-N 3.43Å; V210-I212 PolarHBondContact O-N 3.34Å; V210-I215 HydrophobicContact CB-CD1 4.46Å; V210-I215 HydrophobicContact CG1-CD1 3.35Å; V210-I215 HydrophobicContact CG1-CG1 3.76Å
211	K	63.3	Low	69.3	Low	116 Å²	116	83.6 Å²	83.6	50%	0.504	41%	0.406	S	S	.	.			trans	-71.4	128.7	168.6	-67.6	179.6	180	174.4	0	106.7	K209 S213 E214	K209-K211 PolarHBondContact O-N 2.84Å; K211-S213 WeakPolarHBondContact CB-OG 3.4Å; K211-S213 PolarHBondContact O-N 2.93Å; K211-S213 VanDerWaalsContact O-N 3.1Å; K211-E214 HydrophobicContact CB-CG 4.1Å; K211-E214 WeakPolarHBondContact O-CB 3.04Å; K211-E214 PolarHBondContact O-N 2.95Å
212	I	67.5	Low	71.1	Confident	23 Å²	23	78.8 Å²	78.8	12%	0.118	37%	0.374	C	S	.	.	H	α-helix	trans	-56.7	-28.6	174.9	-66.5	-178.4	0	0	0	110.5	P160 V210 E214 I215 Y216	P160-I212 HydrophobicContact CB-CG2 3.96Å; P160-I212 HydrophobicContact CG-CG2 4.48Å; V210-I212 PolarHBondContact O-N 3.34Å; I212-E214 PolarHBondContact O-N 3.48Å; I212-I215 PolarHBondContact O-N 3.42Å; I212-Y216 HydrophobicContact CG2-CD2 3.6Å; I212-Y216 HydrophobicContact CG2-CE2 4.29Å; I212-Y216 HydrophobicContact CG2-CG 4.49Å; I212-Y216 PolarHBondContact O-N 3.47Å
213	S	69.6	Low	73	Confident	33 Å²	33	73.5 Å²	73.5	23%	0.231	35%	0.351	C	S	.	.	H	α-helix	trans	-64.1	-15.6	172.3	63.2	0	0	0	0	114.5	K211 K286	K211-S213 WeakPolarHBondContact CB-OG 3.4Å; K211-S213 PolarHBondContact O-N 2.93Å; K211-S213 VanDerWaalsContact O-N 3.1Å; S213-K286 WeakPolarHBondContact O-CE 3.2Å; S213-K286 PolarHBondContact O-NZ 3.43Å
214	E	74.2	Confident	75	Confident	108 Å²	108	71.1 Å²	71.1	51%	0.505	33%	0.326	S	S	.	.	H	α-helix	trans	-85.6	-29.5	174	-69.9	165.7	-167.4	0	0	111.8	K211 I212 K286	K211-E214 HydrophobicContact CB-CG 4.1Å; K211-E214 WeakPolarHBondContact O-CB 3.04Å; K211-E214 PolarHBondContact O-N 2.95Å; I212-E214 PolarHBondContact O-N 3.48Å; E214-K286 VanDerWaalsContact O-CD 3.27Å; E214-K286 WeakPolarHBondContact O-CD 3.33Å
215	I	78.7	Confident	76.9	Confident	28 Å²	28	63.4 Å²	63.4	14%	0.144	29%	0.285	C	S	.	.	H	α-helix	trans	-90.2	-37.6	179.6	-61.3	168.2	0	0	0	111.1	M157 V210 I212 N285 K286 L287	M157-I215 HydrophobicContact CE-CD1 3.51Å; V210-I215 HydrophobicContact CB-CD1 4.46Å; V210-I215 HydrophobicContact CG1-CD1 3.35Å; V210-I215 HydrophobicContact CG1-CG1 3.76Å; I212-I215 PolarHBondContact O-N 3.42Å; I215-N285 CarbonylContact O-C 3.57Å; I215-N285 PolarHBondContact O-OD1 2.84Å; I215-N285 VanDerWaalsContact O-OD1 3.1Å; I215-K286 WeakPolarHBondContact O-CB 3.42Å; I215-K286 PolarHBondContact O-N 3.08Å; I215-L287 HydrophobicContact CG2-CD1 4.22Å; I215-L287 HydrophobicContact CG2-CG 4.47Å
216	Y	85.3	Confident	78.6	Confident	50 Å²	50	56.1 Å²	56.1	20%	0.196	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	140.7	-172.8	-62.9	-78.6	0	0	0	112.2	M157 I212 I283 C284 K286	M157-Y216 HydrophobicContact CE-CE2 3.73Å; I212-Y216 HydrophobicContact CG2-CD2 3.6Å; I212-Y216 HydrophobicContact CG2-CE2 4.29Å; I212-Y216 HydrophobicContact CG2-CG 4.49Å; I212-Y216 PolarHBondContact O-N 3.47Å; Y216-I283 HydrophobicContact CD1-CG2 3.46Å; Y216-I283 VanDerWaalsContact CD1-CG2 3.46Å; Y216-I283 HydrophobicContact CE1-CG2 4.24Å; Y216-I283 HydrophobicContact CG-CG2 3.89Å; Y216-C284 CarbonylContact C-O 3.45Å; Y216-C284 WeakPolarHBondContact CA-O 3.42Å; Y216-K286 VanDerWaalsContact O-CE 3.32Å; Y216-K286 WeakPolarHBondContact O-CE 3.5Å
217	G	89.1	Confident	80.3	Confident	2 Å²	2	46 Å²	46	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	175	163	0	0	0	0	0	110.3	L257 C284	G217-L257 CarbonylContact C-O 3.53Å; G217-L257 WeakPolarHBondContact CA-O 3.4Å; G217-C284 VanDerWaalsContact C-SG 3.51Å; G217-C284 PolarHBondContact N-O 3Å; G217-C284 PolarHBondContact O-N 2.94Å
218	M	92.2	Very high	81.5	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	151.5	-178.5	84.5	-168.8	178.2	0	0	112.2	W189 C191 Y253 L257 G258 A260 I281 K282 I283 S295	W189-M218 HydrophobicContact CB-CE 4.06Å; W189-M218 WeakPolarHBondContact O-CE 3.47Å; C191-M218 HydrophobicContact CB-SD 3.85Å; C191-M218 PolarHBondContact SG-SD 2.97Å; M218-Y253 HydrophobicContact CG-CE1 4.43Å; M218-Y253 VanDerWaalsContact O-CE1 3.3Å; M218-Y253 WeakPolarHBondContact O-CE1 3.45Å; M218-L257 VanDerWaalsContact CG-O 3.3Å; M218-L257 WeakPolarHBondContact CG-O 3.27Å; M218-L257 PolarHBondContact N-O 2.03Å; M218-G258 VanDerWaalsContact CE-C 3.45Å; M218-G258 WeakPolarHBondContact CE-O 3.47Å; M218-A260 HydrophobicContact CE-CB 3.64Å; M218-I281 HydrophobicContact CB-CG2 3.66Å; M218-I281 HydrophobicContact CG-CG2 4.17Å; M218-I281 HydrophobicContact SD-CG2 4.31Å; M218-K282 CarbonylContact C-O 3.6Å; M218-K282 WeakPolarHBondContact CA-O 3.01Å; M218-I283 HydrophobicContact CB-CD1 4.13Å; M218-S295 VanDerWaalsContact O-CB 3.29Å; M218-S295 WeakPolarHBondContact O-CB 3.23Å; M218-S295 PolarHBondContact O-OG 3.16Å
219	L	94.6	Very high	82.9	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.5	168	174.3	69.1	0	0	0	108.1	I281 K282 L294 P297	L219-I281 WeakPolarHBondContact O-CA 3.41Å; L219-K282 HydrophobicContact CB-CB 4.41Å; L219-K282 PolarHBondContact N-O 3.31Å; L219-K282 PolarHBondContact O-N 2.75Å; L219-L294 HydrophobicContact CB-CD2 4.36Å; L219-L294 HydrophobicContact CB-CG 4.25Å; L219-L294 HydrophobicContact CD2-CD1 3.85Å; L219-L294 HydrophobicContact CD2-CG 3.9Å; L219-P297 HydrophobicContact CD1-CB 3.99Å; L219-P297 HydrophobicContact CD1-CG 3.81Å
220	V	97.2	Very high	84.2	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	125.5	170.2	-177.1	0	0	0	0	108.2	W189 G240 L251 Y253 A260 C279 I281	W189-V220 HydrophobicContact CB-CG2 3.83Å; W189-V220 HydrophobicContact CD2-CG1 4.19Å; W189-V220 HydrophobicContact CD2-CG2 4.11Å; W189-V220 HydrophobicContact CG-CG1 4.27Å; W189-V220 HydrophobicContact CG-CG2 3.7Å; W189-V220 HydrophobicContact CZ2-CG1 4.35Å; V220-G240 WeakPolarHBondContact O-CA 3.33Å; V220-L251 HydrophobicContact CB-CD1 3.6Å; V220-L251 HydrophobicContact CG1-CD1 3.72Å; V220-L251 HydrophobicContact CG2-CD1 4.25Å; V220-Y253 PolarHBondContact N-OH 3.14Å; V220-A260 HydrophobicContact CG2-CB 3.95Å; V220-C279 HydrophobicContact CG1-CB 4.15Å; V220-I281 HydrophobicContact CG2-CG1 4.33Å
221	H	96	Very high	85.6	Confident	7 Å²	7	43.1 Å²	43.1	3%	0.032	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	171.3	179.5	71.8	83.5	0	0	0	111	C223 D237 Q280	H221-C223 PolarHBondContact O-N 3.32Å; H221-D237 WeakPolarHBondContact CB-O 3.22Å; H221-Q280 PolarHBondContact N-O 2.92Å; H221-Q280 PolarHBondContact O-N 3.45Å
222	S	96.1	Very high	86.9	Confident	14 Å²	14	41.9 Å²	41.9	10%	0.098	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.1	57	177.2	-55.1	0	0	0	0	112.3	Y224 V236 D237	S222-Y224 WeakPolarHBondContact O-CD2 2.99Å; S222-Y224 WeakPolarHBondContact O-CE2 3.45Å; S222-V236 CarbonylContact C-O 3.57Å; S222-V236 WeakPolarHBondContact CA-O 3.36Å; S222-V236 PolarHBondContact N-O 3.44Å; S222-D237 PolarHBondContact N-O 3.48Å
223	C	97.7	Very high	88.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	138.5	178.5	-66.4	0	0	0	0	111.9	H221 E234 I235 V236 K278 C279	H221-C223 PolarHBondContact O-N 3.32Å; C223-E234 CarbonylContact O-C 3.59Å; C223-E234 WeakPolarHBondContact O-CA 3.48Å; C223-I235 HydrophobicContact CB-CD1 4.3Å; C223-I235 HydrophobicContact CB-CG1 3.74Å; C223-I235 WeakPolarHBondContact O-CG1 3.42Å; C223-I235 PolarHBondContact O-N 2.83Å; C223-V236 HydrophobicContact CB-CB 3.64Å; C223-V236 HydrophobicContact CB-CG2 3.77Å; C223-V236 PolarHBondContact N-O 2.04Å; C223-V236 PolarHBondContact O-N 2.91Å; C223-K278 CarbonylContact C-O 3.57Å; C223-K278 WeakPolarHBondContact CA-O 3.26Å; C223-C279 HydrophobicContact CB-CB 4.12Å; C223-C279 WeakPolarHBondContact CB-SG 3.25Å; C223-C279 WeakPolarHBondContact SG-CB 3.19Å; C223-C279 CovalentContact SG-SG 2.04Å; C223-C279 PolarHBondContact SG-SG 3.23Å
224	Y	96.1	Very high	89.4	Confident	76 Å²	76	45 Å²	45	30%	0.298	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	139.5	178.8	-60.2	-91.3	0	0	0	110.6	S222 N232 T233 E234 F277 K278	S222-Y224 WeakPolarHBondContact O-CD2 2.99Å; S222-Y224 WeakPolarHBondContact O-CE2 3.45Å; Y224-N232 HydrophobicContact CD1-CB 4.32Å; Y224-T233 CarbonylContact C-O 3.51Å; Y224-T233 VanDerWaalsContact CA-O 3.26Å; Y224-T233 WeakPolarHBondContact CA-O 3.37Å; Y224-E234 HydrophobicContact CD1-CB 3.99Å; Y224-E234 HydrophobicContact CE1-CB 3.67Å; Y224-E234 HydrophobicContact CE1-CG 4.03Å; Y224-F277 CarbonylContact O-C 3.49Å; Y224-F277 WeakPolarHBondContact O-CA 3.34Å; Y224-K278 PolarHBondContact N-O 3.32Å; Y224-K278 PolarHBondContact O-N 2.86Å
225	V	95	Very high	90.5	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.024	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126.8	162.3	60.1	0	0	0	0	108.6	N232 T233 I235 F267 Y269 V275 F277	V225-N232 WeakPolarHBondContact O-CA 3.29Å; V225-T233 PolarHBondContact N-O 2.72Å; V225-T233 PolarHBondContact O-N 2.97Å; V225-I235 HydrophobicContact CB-CG2 4.45Å; V225-I235 HydrophobicContact CG1-CG2 3.85Å; V225-F267 HydrophobicContact CB-CE2 4.33Å; V225-F267 HydrophobicContact CG1-CE2 4.1Å; V225-F267 HydrophobicContact CG2-CE2 3.98Å; V225-F267 HydrophobicContact CG2-CZ 4.49Å; V225-Y269 HydrophobicContact CG1-CE2 4.4Å; V225-Y269 HydrophobicContact CG2-CE2 4.24Å; V225-Y269 PolarHBondContact O-OH 3.49Å; V225-V275 HydrophobicContact CG2-CB 4.21Å; V225-V275 HydrophobicContact CG2-CG1 4.49Å; V225-F277 HydrophobicContact CB-CD1 3.89Å; V225-F277 HydrophobicContact CB-CE1 3.85Å; V225-F277 HydrophobicContact CG2-CD1 4.02Å; V225-F277 HydrophobicContact CG2-CE1 3.69Å; V225-F277 HydrophobicContact CG2-CZ 4.28Å
226	E	92.4	Very high	91.3	Very high	22 Å²	22	38.6 Å²	38.6	10%	0.103	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	143.5	-176.3	-58.8	-168.7	164.5	0	0	111.4	R231 N232 V275 H276 K278	E226-R231 VanDerWaalsContact CA-O 3.25Å; E226-R231 WeakPolarHBondContact CA-O 3.48Å; E226-N232 HydrophobicContact CG-CB 3.72Å; E226-V275 WeakPolarHBondContact O-CA 3.48Å; E226-H276 VanDerWaalsContact CB-NE2 3.33Å; E226-H276 WeakPolarHBondContact CB-NE2 3.39Å; E226-H276 PolarHBondContact N-O 2.89Å; E226-H276 PolarHBondContact O-N 3.36Å; E226-H276 VanDerWaalsContact O-N 3.16Å; E226-H276 IonicContact OE2-CD2 3.15Å; E226-H276 IonicContact OE2-CE1 3.31Å; E226-H276 IonicContact OE2-NE2 3.72Å; E226-H276 PolarHBondContact OE2-NE2 2.96Å; E226-K278 VanDerWaalsContact CD-NZ 3.34Å; E226-K278 WeakPolarHBondContact OE1-CD 3.28Å; E226-K278 IonicContact OE1-NZ 2.86Å; E226-K278 PolarHBondContact OE1-NZ 3.1Å; E226-K278 WeakPolarHBondContact OE2-CD 3.41Å; E226-K278 WeakPolarHBondContact OE2-CE 3.15Å; E226-K278 IonicContact OE2-NZ 3.91Å; E226-K278 PolarHBondContact OE2-NZ 3.04Å
227	D	88.9	Confident	91.7	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.027	19%	0.186	C	C	.	.			trans	-91.7	-175.6	170.8	74.3	8.2	0	0	0	112.2	Q229 G230 R231 Y269 Y272	D227-Q229 VanDerWaalsContact C-N 3.28Å; D227-Q229 PolarHBondContact O-N 2.9Å; D227-Q229 WeakPolarHBondContact OD1-CA 3.43Å; D227-Q229 PolarHBondContact OD1-N 2.78Å; D227-G230 PolarHBondContact O-N 3Å; D227-G230 PolarHBondContact OD1-N 2.69Å; D227-R231 VanDerWaalsContact CG-CB 3.5Å; D227-R231 PolarHBondContact N-O 3.16Å; D227-R231 WeakPolarHBondContact OD1-CB 3.29Å; D227-R231 PolarHBondContact OD1-N 2.63Å; D227-R231 VanDerWaalsContact OD2-CB 3.24Å; D227-R231 WeakPolarHBondContact OD2-CB 3.36Å; D227-Y269 HydrophobicContact CB-CD2 3.71Å; D227-Y269 HydrophobicContact CB-CE2 3.98Å; D227-Y269 HydrophobicContact CB-CG 4.39Å; D227-Y272 HydrophobicContact CB-CG 4.36Å
228	Q	76.6	Confident	92	Very high	77 Å²	77	40.4 Å²	40.4	36%	0.36	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.1	178.5	-48.4	-157.7	-39.4	0	0	115	R58 F274	R58-Q228 VanDerWaalsContact NH2-CD 3.31Å; Q228-F274 HydrophobicContact CG-CB 3.73Å
229	Q	79.9	Confident	91.9	Very high	143 Å²	143	43.9 Å²	43.9	67%	0.668	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-1	-178.2	-66.4	-66.2	-26.6	0	0	112.1	D227 Y272	D227-Q229 VanDerWaalsContact C-N 3.28Å; D227-Q229 PolarHBondContact O-N 2.9Å; D227-Q229 WeakPolarHBondContact OD1-CA 3.43Å; D227-Q229 PolarHBondContact OD1-N 2.78Å; Q229-Y272 HydrophobicContact CG-CD1 4.47Å; Q229-Y272 HydrophobicContact CG-CE1 3.59Å
230	G	80.8	Confident	91.9	Very high	44 Å²	44	43.8 Å²	43.8	45%	0.454	23%	0.227	S	C	.	.			trans	83.9	12.1	-177.7	0	0	0	0	0	113.6	D227 N232	D227-G230 PolarHBondContact O-N 3Å; D227-G230 PolarHBondContact OD1-N 2.69Å; G230-N232 PolarHBondContact O-N 2.71Å
231	R	86.1	Confident	91.9	Very high	150 Å²	150	44.7 Å²	44.7	57%	0.566	23%	0.233	S	C	*	.			trans	-68.7	127.4	168	-173.7	-176.8	177.8	173.1	-0.7	108	E226 D227 Y269	E226-R231 VanDerWaalsContact CA-O 3.25Å; E226-R231 WeakPolarHBondContact CA-O 3.48Å; D227-R231 VanDerWaalsContact CG-CB 3.5Å; D227-R231 PolarHBondContact N-O 3.16Å; D227-R231 WeakPolarHBondContact OD1-CB 3.29Å; D227-R231 PolarHBondContact OD1-N 2.63Å; D227-R231 VanDerWaalsContact OD2-CB 3.24Å; D227-R231 WeakPolarHBondContact OD2-CB 3.36Å; R231-Y269 HydrophobicContact CG-CE1 4.46Å
232	N	90.9	Very high	91.9	Very high	89 Å²	89	45.2 Å²	45.2	48%	0.476	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.3	179.3	63.2	12	0	0	0	111.4	Y224 V225 E226 G230	Y224-N232 HydrophobicContact CD1-CB 4.32Å; V225-N232 WeakPolarHBondContact O-CA 3.29Å; E226-N232 HydrophobicContact CG-CB 3.72Å; G230-N232 PolarHBondContact O-N 2.71Å
233	T	94.2	Very high	91.8	Very high	54 Å²	54	48.4 Å²	48.4	33%	0.331	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126.3	173.7	-57.9	0	0	0	0	108.4	Y224 V225 I235 Y269	Y224-T233 CarbonylContact C-O 3.51Å; Y224-T233 VanDerWaalsContact CA-O 3.26Å; Y224-T233 WeakPolarHBondContact CA-O 3.37Å; V225-T233 PolarHBondContact N-O 2.72Å; V225-T233 PolarHBondContact O-N 2.97Å; T233-I235 PolarHBondContact O-N 2.9Å; T233-Y269 VanDerWaalsContact CB-OH 3.28Å; T233-Y269 WeakPolarHBondContact CB-OH 3.5Å; T233-Y269 PolarHBondContact N-OH 3.14Å; T233-Y269 PolarHBondContact OG1-OH 3.38Å
234	E	95.5	Very high	91.5	Very high	67 Å²	67	51.6 Å²	51.6	31%	0.313	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	121.4	176.7	-171.4	-176	-141.3	0	0	110	C223 Y224 V236 D237 K243	C223-E234 CarbonylContact O-C 3.59Å; C223-E234 WeakPolarHBondContact O-CA 3.48Å; Y224-E234 HydrophobicContact CD1-CB 3.99Å; Y224-E234 HydrophobicContact CE1-CB 3.67Å; Y224-E234 HydrophobicContact CE1-CG 4.03Å; E234-V236 WeakPolarHBondContact CG-O 3.32Å; E234-D237 WeakPolarHBondContact OE1-CA 3.45Å; E234-K243 HydrophobicContact CG-CG 4.25Å; E234-K243 WeakPolarHBondContact OE2-CE 3.44Å; E234-K243 IonicContact OE2-NZ 2.81Å
235	I	96.3	Very high	91.3	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-25.6	178.5	59.2	176.8	0	0	0	112.5	C223 V225 T233 S242 K243 L248 F277	C223-I235 HydrophobicContact CB-CD1 4.3Å; C223-I235 HydrophobicContact CB-CG1 3.74Å; C223-I235 WeakPolarHBondContact O-CG1 3.42Å; C223-I235 PolarHBondContact O-N 2.83Å; V225-I235 HydrophobicContact CB-CG2 4.45Å; V225-I235 HydrophobicContact CG1-CG2 3.85Å; T233-I235 PolarHBondContact O-N 2.9Å; I235-S242 WeakPolarHBondContact O-CA 3.42Å; I235-K243 PolarHBondContact O-N 2.76Å; I235-L248 HydrophobicContact CB-CD2 4.46Å; I235-L248 HydrophobicContact CD1-CD2 3.77Å; I235-L248 HydrophobicContact CG1-CD2 4.06Å; I235-F277 HydrophobicContact CD1-CD1 3.78Å; I235-F277 HydrophobicContact CD1-CE1 4.11Å
236	V	96.9	Very high	91.1	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.2	170.5	-175.6	0	0	0	0	108.2	S222 C223 E234 G240 C241 L248	S222-V236 CarbonylContact C-O 3.57Å; S222-V236 WeakPolarHBondContact CA-O 3.36Å; S222-V236 PolarHBondContact N-O 3.44Å; C223-V236 HydrophobicContact CB-CB 3.64Å; C223-V236 HydrophobicContact CB-CG2 3.77Å; C223-V236 PolarHBondContact N-O 2.04Å; C223-V236 PolarHBondContact O-N 2.91Å; E234-V236 WeakPolarHBondContact CG-O 3.32Å; V236-G240 VanDerWaalsContact CG1-C 3.43Å; V236-C241 WeakPolarHBondContact CA-O 3.39Å; V236-L248 HydrophobicContact CG2-CD2 3.51Å
237	D	94.2	Very high	91.1	Very high	19 Å²	19	62 Å²	62	10%	0.102	32%	0.319	C	S	.	.			trans	-85.1	179.9	-176.1	71.2	16.7	0	0	0	114.7	H221 S222 E234 D239 G240 C241 K243	H221-D237 WeakPolarHBondContact CB-O 3.22Å; S222-D237 PolarHBondContact N-O 3.48Å; E234-D237 WeakPolarHBondContact OE1-CA 3.45Å; D237-D239 PolarHBondContact O-N 2.77Å; D237-D239 WeakPolarHBondContact OD1-CA 3.41Å; D237-D239 WeakPolarHBondContact OD1-CB 2.92Å; D237-D239 PolarHBondContact OD1-N 3.01Å; D237-G240 PolarHBondContact O-N 2.88Å; D237-G240 PolarHBondContact OD1-N 3.32Å; D237-C241 PolarHBondContact N-O 2.84Å; D237-C241 PolarHBondContact OD1-N 3.43Å; D237-K243 HydrophobicContact CB-CD 4.05Å; D237-K243 VanDerWaalsContact CB-CE 3.41Å; D237-K243 HydrophobicContact CB-CG 4.38Å; D237-K243 IonicContact OD2-NZ 3.43Å; D237-K243 PolarHBondContact OD2-NZ 2.87Å
238	S	93.5	Very high	91.4	Very high	70 Å²	70	61.8 Å²	61.8	49%	0.49	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.2	179.4	61.1	0	0	0	0	114.4	G240	S238-G240 VanDerWaalsContact C-N 3.34Å
239	D	91.8	Very high	92.2	Very high	74 Å²	74	60.3 Å²	60.3	40%	0.396	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.3	178.6	-63.6	-20.4	0	0	0	111.2	D237 P297 K309	D237-D239 PolarHBondContact O-N 2.77Å; D237-D239 WeakPolarHBondContact OD1-CA 3.41Å; D237-D239 WeakPolarHBondContact OD1-CB 2.92Å; D237-D239 PolarHBondContact OD1-N 3.01Å; D239-P297 VanDerWaalsContact O-CB 3.24Å; D239-P297 WeakPolarHBondContact O-CB 3.42Å; D239-K309 IonicContact OD2-NZ 3.58Å; D239-K309 PolarHBondContact OD2-NZ 3.04Å
240	G	94.8	Very high	93	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.01	30%	0.295	C	S	.	.	S	Bend	trans	88	14.4	-177.7	0	0	0	0	0	114.1	V220 V236 D237 S238 P297	V220-G240 WeakPolarHBondContact O-CA 3.33Å; V236-G240 VanDerWaalsContact CG1-C 3.43Å; D237-G240 PolarHBondContact O-N 2.88Å; D237-G240 PolarHBondContact OD1-N 3.32Å; S238-G240 VanDerWaalsContact C-N 3.34Å; G240-P297 VanDerWaalsContact O-CG 3.31Å; G240-P297 WeakPolarHBondContact O-CG 3.36Å
241	C	96.1	Very high	93.7	Very high	19 Å²	19	54.3 Å²	54.3	13%	0.128	28%	0.278	C	S	.	.			trans	-101.2	145.2	-179.2	-66.7	0	0	0	0	112.4	V236 D237 C299	V236-C241 WeakPolarHBondContact CA-O 3.39Å; D237-C241 PolarHBondContact N-O 2.84Å; D237-C241 PolarHBondContact OD1-N 3.43Å; C241-C299 WeakPolarHBondContact CA-SG 3.44Å; C241-C299 HydrophobicContact CB-CB 3.87Å; C241-C299 WeakPolarHBondContact CB-SG 3.25Å; C241-C299 WeakPolarHBondContact SG-CA 3.38Å; C241-C299 WeakPolarHBondContact SG-CB 3.5Å; C241-C299 CovalentContact SG-SG 2.05Å; C241-C299 PolarHBondContact SG-SG 3.08Å
242	S	95.2	Very high	94.2	Very high	19 Å²	19	50.7 Å²	50.7	13%	0.133	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-66	135.9	177.8	175.6	0	0	0	0	111.7	I235 D244 L248 D250	I235-S242 WeakPolarHBondContact O-CA 3.42Å; S242-D244 PolarHBondContact OG-N 2.95Å; S242-D244 PolarHBondContact OG-O 2.95Å; S242-D244 VanDerWaalsContact OG-O 3.08Å; S242-L248 WeakPolarHBondContact CB-O 3.41Å; S242-L248 PolarHBondContact OG-O 3.31Å; S242-D250 WeakPolarHBondContact CB-OD1 3.35Å; S242-D250 PolarHBondContact N-OD1 3.04Å; S242-D250 VanDerWaalsContact N-OD1 3.14Å
243	K	94	Very high	94.4	Very high	81 Å²	81	47.8 Å²	47.8	35%	0.352	25%	0.252	S	S	.	.	S	Bend	trans	-80.8	-32.2	171.3	-71.7	-58.1	-160.7	-147.8	0	112.3	E234 I235 D237	E234-K243 HydrophobicContact CG-CG 4.25Å; E234-K243 WeakPolarHBondContact OE2-CE 3.44Å; E234-K243 IonicContact OE2-NZ 2.81Å; I235-K243 PolarHBondContact O-N 2.76Å; D237-K243 HydrophobicContact CB-CD 4.05Å; D237-K243 VanDerWaalsContact CB-CE 3.41Å; D237-K243 HydrophobicContact CB-CG 4.38Å; D237-K243 IonicContact OD2-NZ 3.43Å; D237-K243 PolarHBondContact OD2-NZ 2.87Å
244	D	91.9	Very high	94.3	Very high	66 Å²	66	46.6 Å²	46.6	35%	0.353	24%	0.243	S	C	.	.			trans	-141.8	104.6	-177.7	-170.2	-25.6	0	0	0	109.2	S242 D246 L247 L248	S242-D244 PolarHBondContact OG-N 2.95Å; S242-D244 PolarHBondContact OG-O 2.95Å; S242-D244 VanDerWaalsContact OG-O 3.08Å; D244-D246 PolarHBondContact O-N 2.82Å; D244-D246 WeakPolarHBondContact OD1-CB 3.46Å; D244-D246 PolarHBondContact OD1-N 2.62Å; D244-L247 HydrophobicContact CB-CB 4.3Å; D244-L247 HydrophobicContact CB-CD1 4.15Å; D244-L247 HydrophobicContact CB-CG 4.24Å; D244-L247 PolarHBondContact O-N 2.65Å; D244-L247 PolarHBondContact OD1-N 2.78Å; D244-L248 PolarHBondContact O-N 2.86Å
245	R	92	Very high	93.9	Very high	110 Å²	110	50.8 Å²	50.8	42%	0.415	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-15.5	-175.8	-71.1	-178.4	171.7	160.5	-0.1	113.4	D250 N301	R245-D250 IonicContact CZ-OD2 2.78Å; R245-D250 IonicContact NE-OD2 3.8Å; R245-D250 PolarHBondContact NE-OD2 2.86Å; R245-D250 IonicContact NH2-OD2 2.62Å; R245-D250 PolarHBondContact NH2-OD2 2.79Å; R245-N301 PolarHBondContact NH1-OD1 3.35Å
246	D	90.4	Very high	93.4	Very high	156 Å²	156	54.7 Å²	54.7	83%	0.834	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-34.6	175.5	-63.8	-28	0	0	0	110.2	D244	D244-D246 PolarHBondContact O-N 2.82Å; D244-D246 WeakPolarHBondContact OD1-CB 3.46Å; D244-D246 PolarHBondContact OD1-N 2.62Å
247	L	92.5	Very high	93.1	Very high	54 Å²	54	55.8 Å²	55.8	28%	0.283	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-42.9	175	-61.5	-179.6	0	0	0	113	D244 T264 F267	D244-L247 HydrophobicContact CB-CB 4.3Å; D244-L247 HydrophobicContact CB-CD1 4.15Å; D244-L247 HydrophobicContact CB-CG 4.24Å; D244-L247 PolarHBondContact O-N 2.65Å; D244-L247 PolarHBondContact OD1-N 2.78Å; L247-T264 WeakPolarHBondContact O-CG2 3.4Å; L247-F267 HydrophobicContact CB-CD1 4.44Å; L247-F267 HydrophobicContact CB-CE1 3.98Å; L247-F267 HydrophobicContact CB-CZ 4.18Å; L247-F267 HydrophobicContact CD2-CB 4.33Å; L247-F267 HydrophobicContact CD2-CD1 3.96Å; L247-F267 HydrophobicContact CD2-CD2 4.17Å; L247-F267 HydrophobicContact CD2-CE1 4.28Å; L247-F267 HydrophobicContact CD2-CE2 4.47Å; L247-F267 HydrophobicContact CD2-CG 3.9Å
248	L	95.4	Very high	92.9	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	30%	0.295	C	S	.	.	S	Bend	trans	-149.1	111	-179.6	-179.1	65.3	0	0	0	109.2	W189 I235 V236 S242 D244 L251 A262 T264	W189-L248 HydrophobicContact CH2-CD1 4.41Å; I235-L248 HydrophobicContact CB-CD2 4.46Å; I235-L248 HydrophobicContact CD1-CD2 3.77Å; I235-L248 HydrophobicContact CG1-CD2 4.06Å; V236-L248 HydrophobicContact CG2-CD2 3.51Å; S242-L248 WeakPolarHBondContact CB-O 3.41Å; S242-L248 PolarHBondContact OG-O 3.31Å; D244-L248 PolarHBondContact O-N 2.86Å; L248-L251 HydrophobicContact CD1-CD2 4.18Å; L248-L251 HydrophobicContact CD2-CD2 4.31Å; L248-L251 HydrophobicContact CG-CD2 4.27Å; L248-A262 HydrophobicContact CD1-CB 3.64Å; L248-T264 HydrophobicContact CB-CG2 4.43Å; L248-T264 HydrophobicContact CD1-CG2 3.55Å
249	P	94.7	Very high	92.9	Very high	47 Å²	47	52.9 Å²	52.9	31%	0.305	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-67.6	169.4	177.3	29.7	-35.1	0	0	0	111.4	L251 A262 K263	P249-L251 PolarHBondContact O-N 2.93Å; P249-A262 HydrophobicContact CG-CB 4.23Å; P249-K263 WeakPolarHBondContact CG-O 3.43Å
250	D	95.2	Very high	93.1	Very high	45 Å²	45	49.4 Å²	49.4	24%	0.241	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-58.2	135.5	173.5	-67.3	-40.8	0	0	0	110.4	S242 R245	S242-D250 WeakPolarHBondContact CB-OD1 3.35Å; S242-D250 PolarHBondContact N-OD1 3.04Å; S242-D250 VanDerWaalsContact N-OD1 3.14Å; R245-D250 IonicContact CZ-OD2 2.78Å; R245-D250 IonicContact NE-OD2 3.8Å; R245-D250 PolarHBondContact NE-OD2 2.86Å; R245-D250 IonicContact NH2-OD2 2.62Å; R245-D250 PolarHBondContact NH2-OD2 2.79Å
251	L	96.6	Very high	93.2	Very high	16 Å²	16	51.8 Å²	51.8	8%	0.084	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-70.8	136.2	-170.9	-52.6	-176.8	0	0	0	111	W189 V220 L248 P249 Y253 A262	W189-L251 HydrophobicContact CE3-CD1 4.48Å; W189-L251 HydrophobicContact CH2-CD1 4.3Å; W189-L251 HydrophobicContact CH2-CD2 3.69Å; W189-L251 HydrophobicContact CZ3-CD1 4.2Å; W189-L251 HydrophobicContact CZ3-CD2 3.62Å; W189-L251 HydrophobicContact CZ3-CG 4.49Å; V220-L251 HydrophobicContact CB-CD1 3.6Å; V220-L251 HydrophobicContact CG1-CD1 3.72Å; V220-L251 HydrophobicContact CG2-CD1 4.25Å; L248-L251 HydrophobicContact CD1-CD2 4.18Å; L248-L251 HydrophobicContact CD2-CD2 4.31Å; L248-L251 HydrophobicContact CG-CD2 4.27Å; P249-L251 PolarHBondContact O-N 2.93Å; L251-Y253 HydrophobicContact CB-CE2 3.9Å; L251-Y253 WeakPolarHBondContact O-CD2 3.29Å; L251-A262 HydrophobicContact CD2-CB 3.72Å
252	L	95.7	Very high	93.2	Very high	73 Å²	73	51 Å²	51	38%	0.382	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.8	173.7	-61.2	175.6	0	0	0	109.3	A260 Y261	L252-A260 CarbonylContact O-C 3.56Å; L252-A260 VanDerWaalsContact O-CA 3.23Å; L252-A260 WeakPolarHBondContact O-CA 3.45Å; L252-Y261 HydrophobicContact CB-CD1 4.24Å; L252-Y261 HydrophobicContact CB-CD2 4.37Å; L252-Y261 HydrophobicContact CB-CE1 3.83Å; L252-Y261 HydrophobicContact CB-CE2 3.98Å; L252-Y261 HydrophobicContact CB-CG 4.49Å; L252-Y261 HydrophobicContact CD1-CD2 4.5Å; L252-Y261 HydrophobicContact CD1-CE2 3.73Å; L252-Y261 HydrophobicContact CG-CE2 4.48Å; L252-Y261 PolarHBondContact N-O 2.73Å; L252-Y261 WeakPolarHBondContact O-CD1 2.97Å; L252-Y261 PolarHBondContact O-N 2.66Å
253	Y	94.8	Very high	93.2	Very high	28 Å²	28	54 Å²	54	11%	0.11	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	144.8	178.5	-70.6	-102	0	0	0	109.9	M218 V220 L251 L259 A260 P296	M218-Y253 HydrophobicContact CG-CE1 4.43Å; M218-Y253 VanDerWaalsContact O-CE1 3.3Å; M218-Y253 WeakPolarHBondContact O-CE1 3.45Å; V220-Y253 PolarHBondContact N-OH 3.14Å; L251-Y253 HydrophobicContact CB-CE2 3.9Å; L251-Y253 WeakPolarHBondContact O-CD2 3.29Å; Y253-L259 WeakPolarHBondContact CA-O 3.32Å; Y253-A260 HydrophobicContact CD1-CB 3.73Å; Y253-A260 HydrophobicContact CE1-CB 3.56Å; Y253-A260 HydrophobicContact CE2-CB 4.36Å; Y253-A260 HydrophobicContact CG-CB 4.21Å; Y253-P296 HydrophobicContact CD2-CB 3.79Å; Y253-P296 HydrophobicContact CD2-CG 4.17Å; Y253-P296 HydrophobicContact CE2-CB 4.32Å; Y253-P296 HydrophobicContact CG-CB 4.29Å; Y253-P296 HydrophobicContact CG-CG 4.19Å
254	N	91.9	Very high	93.3	Very high	30 Å²	30	50.6 Å²	50.6	16%	0.16	26%	0.258	C	S	.	.			trans	-73.7	166.9	169.7	77.2	-32.9	0	0	0	111.3	D256 L257 G258 L259	N254-D256 PolarHBondContact O-N 2.94Å; N254-D256 VanDerWaalsContact O-N 3.17Å; N254-L257 PolarHBondContact O-N 3.23Å; N254-L257 WeakPolarHBondContact OD1-CA 2.99Å; N254-L257 PolarHBondContact OD1-N 3.03Å; N254-G258 PolarHBondContact OD1-N 3.44Å; N254-L259 HydrophobicContact CB-CB 4.05Å; N254-L259 HydrophobicContact CB-CD2 4.27Å; N254-L259 VanDerWaalsContact CG-CB 3.5Å; N254-L259 PolarHBondContact N-O 2.98Å; N254-L259 PolarHBondContact OD1-N 3.37Å; N254-L259 PolarHBondContact OD1-O 3.31Å
255	N	88.3	Confident	93.5	Very high	155 Å²	155	53.2 Å²	53.2	83%	0.829	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-33.8	178.7	-64.5	-22	0	0	0	112.8	L257	N255-L257 VanDerWaalsContact C-N 3.27Å; N255-L257 PolarHBondContact O-N 3.21Å
256	D	85.8	Confident	93.6	Very high	84 Å²	84	48.7 Å²	48.7	45%	0.449	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	0	178.2	-59.9	-39.1	0	0	0	113.4	N254 G258 K286	N254-D256 PolarHBondContact O-N 2.94Å; N254-D256 VanDerWaalsContact O-N 3.17Å; D256-G258 PolarHBondContact O-N 2.79Å; D256-K286 VanDerWaalsContact C-NZ 3.3Å; D256-K286 WeakPolarHBondContact O-CE 3.41Å; D256-K286 PolarHBondContact O-NZ 2.89Å
257	L	90.2	Very high	93.8	Very high	24 Å²	24	42.9 Å²	42.9	13%	0.126	22%	0.22	C	C	.	.	S	Bend	trans	50.6	17.2	-177.1	-51.6	177.9	0	0	0	114.6	G217 M218 N254 N255 C291 P296	G217-L257 CarbonylContact C-O 3.53Å; G217-L257 WeakPolarHBondContact CA-O 3.4Å; M218-L257 VanDerWaalsContact CG-O 3.3Å; M218-L257 WeakPolarHBondContact CG-O 3.27Å; M218-L257 PolarHBondContact N-O 2.03Å; N254-L257 PolarHBondContact O-N 3.23Å; N254-L257 WeakPolarHBondContact OD1-CA 2.99Å; N254-L257 PolarHBondContact OD1-N 3.03Å; N255-L257 VanDerWaalsContact C-N 3.27Å; N255-L257 PolarHBondContact O-N 3.21Å; L257-C291 HydrophobicContact CD1-CB 3.83Å; L257-P296 HydrophobicContact CD2-CG 4.03Å
258	G	90.1	Very high	93.7	Very high	10 Å²	10	42.2 Å²	42.2	10%	0.103	21%	0.214	C	C	.	.	S	Bend	trans	-101.5	-5	179.7	0	0	0	0	0	112.5	C191 M218 N254 D256	C191-G258 PolarHBondContact N-O 2.9Å; M218-G258 VanDerWaalsContact CE-C 3.45Å; M218-G258 WeakPolarHBondContact CE-O 3.47Å; N254-G258 PolarHBondContact OD1-N 3.44Å; D256-G258 PolarHBondContact O-N 2.79Å
259	L	92.9	Very high	93.5	Very high	18 Å²	18	43.2 Å²	43.2	9%	0.094	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.8	-179.7	-174.6	77	0	0	0	108.9	F171 R188 W189 E190 Y253 N254	F171-L259 HydrophobicContact CE1-CD2 4.12Å; F171-L259 HydrophobicContact CE2-CD2 4.32Å; F171-L259 HydrophobicContact CZ-CD1 3.77Å; F171-L259 HydrophobicContact CZ-CD2 3.52Å; F171-L259 HydrophobicContact CZ-CG 4Å; R188-L259 HydrophobicContact CG-CD1 4.01Å; W189-L259 WeakPolarHBondContact O-CA 3.44Å; W189-L259 WeakPolarHBondContact O-CD1 3.48Å; E190-L259 HydrophobicContact CB-CD1 3.85Å; E190-L259 HydrophobicContact CG-CD1 4.06Å; Y253-L259 WeakPolarHBondContact CA-O 3.32Å; N254-L259 HydrophobicContact CB-CB 4.05Å; N254-L259 HydrophobicContact CB-CD2 4.27Å; N254-L259 VanDerWaalsContact CG-CB 3.5Å; N254-L259 PolarHBondContact N-O 2.98Å; N254-L259 PolarHBondContact OD1-N 3.37Å; N254-L259 PolarHBondContact OD1-O 3.31Å
260	A	96.2	Very high	93.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.5	172	0	0	0	0	0	109	W189 M218 V220 L252 Y253	W189-A260 HydrophobicContact CB-CB 4.3Å; W189-A260 HydrophobicContact CE3-CB 4.37Å; W189-A260 PolarHBondContact N-O 3.41Å; W189-A260 PolarHBondContact O-N 3.46Å; M218-A260 HydrophobicContact CE-CB 3.64Å; V220-A260 HydrophobicContact CG2-CB 3.95Å; L252-A260 CarbonylContact O-C 3.56Å; L252-A260 VanDerWaalsContact O-CA 3.23Å; L252-A260 WeakPolarHBondContact O-CA 3.45Å; Y253-A260 HydrophobicContact CD1-CB 3.73Å; Y253-A260 HydrophobicContact CE1-CB 3.56Å; Y253-A260 HydrophobicContact CE2-CB 4.36Å; Y253-A260 HydrophobicContact CG-CB 4.21Å
261	Y	96.5	Very high	92.7	Very high	52 Å²	52	50.7 Å²	50.7	20%	0.204	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	156.6	-177.2	67.3	-83.2	0	0	0	113.5	F171 H187 L252	F171-Y261 HydrophobicContact CD2-CD2 4.39Å; F171-Y261 HydrophobicContact CD2-CG 4.18Å; F171-Y261 HydrophobicContact CE2-CD1 4.32Å; F171-Y261 AromaticContact CE2-CG 3.98Å; F171-Y261 HydrophobicContact CE2-CG 3.98Å; H187-Y261 WeakPolarHBondContact O-CA 3.38Å; H187-Y261 WeakPolarHBondContact O-CB 3.22Å; L252-Y261 HydrophobicContact CB-CD1 4.24Å; L252-Y261 HydrophobicContact CB-CD2 4.37Å; L252-Y261 HydrophobicContact CB-CE1 3.83Å; L252-Y261 HydrophobicContact CB-CE2 3.98Å; L252-Y261 HydrophobicContact CB-CG 4.49Å; L252-Y261 HydrophobicContact CD1-CD2 4.5Å; L252-Y261 HydrophobicContact CD1-CE2 3.73Å; L252-Y261 HydrophobicContact CG-CE2 4.48Å; L252-Y261 PolarHBondContact N-O 2.73Å; L252-Y261 WeakPolarHBondContact O-CD1 2.97Å; L252-Y261 PolarHBondContact O-N 2.66Å
262	A	97.1	Very high	92.3	Very high	3 Å²	3	53.8 Å²	53.8	3%	0.025	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	142.1	174.2	0	0	0	0	0	110.3	F186 H187 W189 L248 P249 L251	F186-A262 WeakPolarHBondContact CA-O 3.39Å; H187-A262 PolarHBondContact N-O 3.49Å; H187-A262 PolarHBondContact O-N 3.46Å; W189-A262 HydrophobicContact CZ3-CB 4.47Å; L248-A262 HydrophobicContact CD1-CB 3.64Å; P249-A262 HydrophobicContact CG-CB 4.23Å; L251-A262 HydrophobicContact CD2-CB 3.72Å
263	K	96	Very high	92	Very high	80 Å²	80	52.6 Å²	52.6	35%	0.348	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	131.2	170.7	-176.2	-178.2	178.1	-177.2	0	108.4	E184 F186 P249	E184-K263 WeakPolarHBondContact OE1-CE 3.44Å; E184-K263 IonicContact OE1-NZ 3.22Å; E184-K263 PolarHBondContact OE1-NZ 3.13Å; E184-K263 VanDerWaalsContact OE2-CE 3.25Å; E184-K263 WeakPolarHBondContact OE2-CE 3.49Å; E184-K263 IonicContact OE2-NZ 2.67Å; E184-K263 PolarHBondContact OE2-NZ 3.32Å; F186-K263 HydrophobicContact CD1-CB 4.1Å; F186-K263 HydrophobicContact CD1-CG 4.33Å; F186-K263 HydrophobicContact CE1-CB 3.82Å; F186-K263 HydrophobicContact CE1-CD 4Å; F186-K263 HydrophobicContact CE1-CG 3.82Å; F186-K263 HydrophobicContact CE2-CG 4.48Å; F186-K263 HydrophobicContact CZ-CB 4.42Å; F186-K263 HydrophobicContact CZ-CD 3.83Å; F186-K263 HydrophobicContact CZ-CG 3.91Å; P249-K263 WeakPolarHBondContact CG-O 3.43Å
264	T	95.7	Very high	91.9	Very high	10 Å²	10	54.3 Å²	54.3	6%	0.061	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	168.2	-178.5	57.7	0	0	0	0	110.8	V185 H187 L247 L248	V185-T264 WeakPolarHBondContact CG2-OG1 3.39Å; V185-T264 PolarHBondContact N-O 3.29Å; V185-T264 PolarHBondContact O-N 3.39Å; H187-T264 PolarHBondContact CD2-OG1 3.03Å; H187-T264 PolarHBondContact NE2-OG1 3.45Å; L247-T264 WeakPolarHBondContact O-CG2 3.4Å; L248-T264 HydrophobicContact CB-CG2 4.43Å; L248-T264 HydrophobicContact CD1-CG2 3.55Å
265	E	94.5	Very high	91.9	Very high	122 Å²	122	53 Å²	53	57%	0.57	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	143.9	165.1	-68	176.2	-172	0	0	109.2	D183 F267	D183-E265 CarbonylContact O-C 3.59Å; D183-E265 WeakPolarHBondContact O-CA 3.27Å; E265-F267 WeakPolarHBondContact O-CD1 3.17Å; E265-F267 PolarHBondContact O-N 3.3Å
266	V	94.4	Very high	92.2	Very high	14 Å²	14	46.5 Å²	46.5	9%	0.085	24%	0.236	C	C	.	.			trans	-66.9	130.5	179	171.4	0	0	0	0	110.4	A179 K180 V181 G182 D183 V185 V334	A179-V266 HydrophobicContact CB-CB 4.47Å; A179-V266 HydrophobicContact CB-CG1 4.21Å; A179-V266 HydrophobicContact CB-CG2 3.84Å; K180-V266 WeakPolarHBondContact O-CB 3.48Å; V181-V266 WeakPolarHBondContact CA-O 3.32Å; G182-V266 PolarHBondContact N-O 2.97Å; D183-V266 HydrophobicContact CB-CG2 4.25Å; D183-V266 WeakPolarHBondContact O-CG2 3.45Å; D183-V266 PolarHBondContact O-N 2.94Å; V185-V266 HydrophobicContact CB-CG2 4.17Å; V185-V266 HydrophobicContact CG1-CG2 3.39Å; V185-V266 HydrophobicContact CG2-CG2 3.67Å; V266-V334 HydrophobicContact CG1-CB 4.32Å; V266-V334 HydrophobicContact CG1-CG1 3.64Å; V266-V334 HydrophobicContact CG1-CG2 3.76Å
267	F	94.2	Very high	92.7	Very high	35 Å²	35	43 Å²	43	15%	0.154	22%	0.217	C	C	.	.			trans	-131.5	163.3	176.5	63.2	-93.8	0	0	0	111	V225 L247 E265 F277	V225-F267 HydrophobicContact CB-CE2 4.33Å; V225-F267 HydrophobicContact CG1-CE2 4.1Å; V225-F267 HydrophobicContact CG2-CE2 3.98Å; V225-F267 HydrophobicContact CG2-CZ 4.49Å; L247-F267 HydrophobicContact CB-CD1 4.44Å; L247-F267 HydrophobicContact CB-CE1 3.98Å; L247-F267 HydrophobicContact CB-CZ 4.18Å; L247-F267 HydrophobicContact CD2-CB 4.33Å; L247-F267 HydrophobicContact CD2-CD1 3.96Å; L247-F267 HydrophobicContact CD2-CD2 4.17Å; L247-F267 HydrophobicContact CD2-CE1 4.28Å; L247-F267 HydrophobicContact CD2-CE2 4.47Å; L247-F267 HydrophobicContact CD2-CG 3.9Å; E265-F267 WeakPolarHBondContact O-CD1 3.17Å; E265-F267 PolarHBondContact O-N 3.3Å; F267-F277 HydrophobicContact CE1-CE1 4.37Å; F267-F277 HydrophobicContact CE1-CZ 4.46Å; F267-F277 HydrophobicContact CE2-CE1 4.43Å; F267-F277 AromaticContact CZ-CE1 3.78Å; F267-F277 HydrophobicContact CZ-CE1 3.78Å; F267-F277 HydrophobicContact CZ-CZ 4.17Å
268	K	91.9	Very high	92.9	Very high	39 Å²	39	43.2 Å²	43.2	17%	0.17	22%	0.217	C	C	.	.			trans	-147.3	169.8	175	63	160	-175.1	164.2	0	112.1	V181 Y272 V275 V334 D336	V181-K268 HydrophobicContact CG2-CG 4.05Å; K268-Y272 WeakPolarHBondContact CD-O 3.39Å; K268-V275 HydrophobicContact CB-CG1 4.09Å; K268-V334 HydrophobicContact CB-CB 3.9Å; K268-V334 HydrophobicContact CB-CG1 3.8Å; K268-V334 HydrophobicContact CB-CG2 4.29Å; K268-V334 HydrophobicContact CD-CB 4.11Å; K268-V334 HydrophobicContact CD-CG1 3.93Å; K268-V334 HydrophobicContact CG-CB 4.24Å; K268-V334 HydrophobicContact CG-CG1 3.78Å; K268-D336 WeakPolarHBondContact CE-OD1 3.4Å; K268-D336 IonicContact NZ-OD1 2.74Å; K268-D336 PolarHBondContact NZ-OD1 2.99Å; K268-D336 IonicContact NZ-OD2 2.77Å; K268-D336 PolarHBondContact NZ-OD2 3.41Å
269	Y	91.1	Very high	93.2	Very high	22 Å²	22	43 Å²	43	9%	0.086	21%	0.213	C	C	.	.			trans	-73.6	149.4	168.6	-67.7	-85.9	0	0	0	111	V225 D227 R231 T233 D271 Y272 V275	V225-Y269 HydrophobicContact CG1-CE2 4.4Å; V225-Y269 HydrophobicContact CG2-CE2 4.24Å; V225-Y269 PolarHBondContact O-OH 3.49Å; D227-Y269 HydrophobicContact CB-CD2 3.71Å; D227-Y269 HydrophobicContact CB-CE2 3.98Å; D227-Y269 HydrophobicContact CB-CG 4.39Å; R231-Y269 HydrophobicContact CG-CE1 4.46Å; T233-Y269 VanDerWaalsContact CB-OH 3.28Å; T233-Y269 WeakPolarHBondContact CB-OH 3.5Å; T233-Y269 PolarHBondContact N-OH 3.14Å; T233-Y269 PolarHBondContact OG1-OH 3.38Å; Y269-D271 PolarHBondContact O-N 3.43Å; Y269-Y272 PolarHBondContact O-N 3.45Å; Y269-V275 HydrophobicContact CD2-CG1 4.24Å
270	P	86	Confident	93.3	Very high	97 Å²	97	45.1 Å²	45.1	63%	0.63	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	136.6	165.8	-22.5	33.7	0	0	0	109.9	Y272	P270-Y272 VanDerWaalsContact O-CD2 3.28Å; P270-Y272 WeakPolarHBondContact O-CD2 3.38Å; P270-Y272 PolarHBondContact O-N 2.97Å; P270-Y272 VanDerWaalsContact O-N 3.15Å
271	D	85.9	Confident	93.1	Very high	153 Å²	153	45.1 Å²	45.1	82%	0.818	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.6	-5.1	177.9	-46.7	-44.3	0	0	0	117.9	Y269	Y269-D271 PolarHBondContact O-N 3.43Å
272	Y	89.4	Confident	92.8	Very high	80 Å²	80	45 Å²	45	31%	0.314	22%	0.223	S	C	.	.			trans	-121.2	114.1	179.9	-59.7	-76.6	0	0	0	112.9	D227 Q229 K268 Y269 P270 F274	D227-Y272 HydrophobicContact CB-CG 4.36Å; Q229-Y272 HydrophobicContact CG-CD1 4.47Å; Q229-Y272 HydrophobicContact CG-CE1 3.59Å; K268-Y272 WeakPolarHBondContact CD-O 3.39Å; Y269-Y272 PolarHBondContact O-N 3.45Å; P270-Y272 VanDerWaalsContact O-CD2 3.28Å; P270-Y272 WeakPolarHBondContact O-CD2 3.38Å; P270-Y272 PolarHBondContact O-N 2.97Å; P270-Y272 VanDerWaalsContact O-N 3.15Å; Y272-F274 VanDerWaalsContact C-N 3.33Å; Y272-F274 PolarHBondContact O-N 3.04Å
273	S	89.7	Confident	92.4	Very high	48 Å²	48	45.7 Å²	45.7	34%	0.336	23%	0.226	S	C	.	.			trans	-84.2	3.4	-177.3	-49.3	0	0	0	0	114.7	L333 V334	S273-L333 CarbonylContact O-C 3.57Å; S273-L333 WeakPolarHBondContact O-CA 3.31Å; S273-V334 WeakPolarHBondContact CB-O 3.42Å; S273-V334 PolarHBondContact O-N 3.13Å
274	F	91.7	Very high	91.9	Very high	65 Å²	65	42.2 Å²	42.2	29%	0.285	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132.4	177.9	-70.1	-97.3	0	0	0	111	Q228 Y272 D331 I332 L333	Q228-F274 HydrophobicContact CG-CB 3.73Å; Y272-F274 VanDerWaalsContact C-N 3.33Å; Y272-F274 PolarHBondContact O-N 3.04Å; F274-D331 HydrophobicContact CD1-CB 4.19Å; F274-I332 VanDerWaalsContact CA-O 3.31Å; F274-I332 WeakPolarHBondContact CA-O 3.2Å; F274-L333 HydrophobicContact CD1-CB 4.14Å; F274-L333 HydrophobicContact CD2-CD1 4.15Å; F274-L333 HydrophobicContact CE1-CB 3.76Å; F274-L333 HydrophobicContact CE1-CD1 4.1Å; F274-L333 HydrophobicContact CE1-CG 4.46Å; F274-L333 HydrophobicContact CE2-CD1 3.74Å; F274-L333 HydrophobicContact CZ-CB 4.2Å; F274-L333 HydrophobicContact CZ-CD1 3.71Å; F274-L333 HydrophobicContact CZ-CG 4.41Å
275	V	92.8	Very high	91.2	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148.9	176.4	-60.5	0	0	0	0	110.2	V225 E226 K268 Y269 F277 I332 V334	V225-V275 HydrophobicContact CG2-CB 4.21Å; V225-V275 HydrophobicContact CG2-CG1 4.49Å; E226-V275 WeakPolarHBondContact O-CA 3.48Å; K268-V275 HydrophobicContact CB-CG1 4.09Å; Y269-V275 HydrophobicContact CD2-CG1 4.24Å; V275-F277 HydrophobicContact CG2-CE2 4.48Å; V275-I332 HydrophobicContact CG2-CB 4.43Å; V275-I332 PolarHBondContact N-O 3.03Å; V275-I332 VanDerWaalsContact N-O 3.12Å; V275-I332 PolarHBondContact O-N 2.91Å; V275-V334 HydrophobicContact CG2-CG2 3.75Å
276	H	93.7	Very high	90.4	Very high	19 Å²	19	41.3 Å²	41.3	9%	0.088	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	161	166.2	60.8	-87.7	0	0	0	109.5	E226 D331	E226-H276 VanDerWaalsContact CB-NE2 3.33Å; E226-H276 WeakPolarHBondContact CB-NE2 3.39Å; E226-H276 PolarHBondContact N-O 2.89Å; E226-H276 PolarHBondContact O-N 3.36Å; E226-H276 VanDerWaalsContact O-N 3.16Å; E226-H276 IonicContact OE2-CD2 3.15Å; E226-H276 IonicContact OE2-CE1 3.31Å; E226-H276 IonicContact OE2-NE2 3.72Å; E226-H276 PolarHBondContact OE2-NE2 2.96Å; H276-D331 IonicContact ND1-OD1 2.71Å
277	F	96.1	Very high	89.6	Confident	9 Å²	9	45.5 Å²	45.5	4%	0.039	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.3	-177.7	-57.1	-88.4	0	0	0	110	Y164 V166 H187 Y224 V225 I235 F267 V275 I328 T329 I332	Y164-F277 HydrophobicContact CD1-CB 4.38Å; Y164-F277 HydrophobicContact CE1-CB 3.31Å; Y164-F277 HydrophobicContact CE1-CG 4.38Å; Y164-F277 WeakPolarHBondContact OH-CB 3.43Å; Y164-F277 WeakPolarHBondContact OH-CG 3.33Å; V166-F277 HydrophobicContact CG2-CD2 4.03Å; V166-F277 HydrophobicContact CG2-CE2 4.2Å; H187-F277 AromaticContact CE1-CE1 3.98Å; H187-F277 AromaticContact CE1-CE2 3.74Å; H187-F277 AromaticContact CE1-CZ 3.71Å; Y224-F277 CarbonylContact O-C 3.49Å; Y224-F277 WeakPolarHBondContact O-CA 3.34Å; V225-F277 HydrophobicContact CB-CD1 3.89Å; V225-F277 HydrophobicContact CB-CE1 3.85Å; V225-F277 HydrophobicContact CG2-CD1 4.02Å; V225-F277 HydrophobicContact CG2-CE1 3.69Å; V225-F277 HydrophobicContact CG2-CZ 4.28Å; I235-F277 HydrophobicContact CD1-CD1 3.78Å; I235-F277 HydrophobicContact CD1-CE1 4.11Å; F267-F277 HydrophobicContact CE1-CE1 4.37Å; F267-F277 HydrophobicContact CE1-CZ 4.46Å; F267-F277 HydrophobicContact CE2-CE1 4.43Å; F267-F277 AromaticContact CZ-CE1 3.78Å; F267-F277 HydrophobicContact CZ-CE1 3.78Å; F267-F277 HydrophobicContact CZ-CZ 4.17Å; V275-F277 HydrophobicContact CG2-CE2 4.48Å; F277-I328 WeakPolarHBondContact O-CA 3.47Å; F277-T329 HydrophobicContact CB-CG2 3.97Å; F277-T329 HydrophobicContact CD2-CG2 4.33Å; F277-T329 PolarHBondContact N-OG1 2.85Å; F277-T329 PolarHBondContact O-N 2.97Å; F277-I332 HydrophobicContact CE2-CD1 4.14Å
278	K	94.4	Very high	88.6	Confident	30 Å²	30	51.6 Å²	51.6	13%	0.13	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.2	174.2	-58.9	-165.2	176.1	153	0	108.9	E94 C223 Y224 E226 V327 I328	E94-K278 IonicContact OE2-NZ 3.17Å; C223-K278 CarbonylContact C-O 3.57Å; C223-K278 WeakPolarHBondContact CA-O 3.26Å; Y224-K278 PolarHBondContact N-O 3.32Å; Y224-K278 PolarHBondContact O-N 2.86Å; E226-K278 VanDerWaalsContact CD-NZ 3.34Å; E226-K278 WeakPolarHBondContact OE1-CD 3.28Å; E226-K278 IonicContact OE1-NZ 2.86Å; E226-K278 PolarHBondContact OE1-NZ 3.1Å; E226-K278 WeakPolarHBondContact OE2-CD 3.41Å; E226-K278 WeakPolarHBondContact OE2-CE 3.15Å; E226-K278 IonicContact OE2-NZ 3.91Å; E226-K278 PolarHBondContact OE2-NZ 3.04Å; K278-V327 WeakPolarHBondContact CA-O 3.43Å; K278-I328 HydrophobicContact CB-CG1 4.34Å; K278-I328 HydrophobicContact CD-CD1 4.01Å; K278-I328 HydrophobicContact CD-CG1 4.21Å; K278-I328 HydrophobicContact CG-CB 4.45Å; K278-I328 HydrophobicContact CG-CD1 4.22Å; K278-I328 HydrophobicContact CG-CG1 3.88Å; K278-I328 HydrophobicContact CG-CG2 4.02Å
279	C	96.6	Very high	87.8	Confident	4 Å²	4	55.2 Å²	55.2	3%	0.027	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	159.5	175.2	-66.2	0	0	0	0	110.6	Y164 V220 C223 V327	Y164-C279 HydrophobicContact CD1-CB 4.46Å; V220-C279 HydrophobicContact CG1-CB 4.15Å; C223-C279 HydrophobicContact CB-CB 4.12Å; C223-C279 WeakPolarHBondContact CB-SG 3.25Å; C223-C279 WeakPolarHBondContact SG-CB 3.19Å; C223-C279 CovalentContact SG-SG 2.04Å; C223-C279 PolarHBondContact SG-SG 3.23Å; C279-V327 HydrophobicContact CB-CG2 3.92Å; C279-V327 PolarHBondContact N-O 2.85Å; C279-V327 WeakPolarHBondContact O-CG2 3.48Å; C279-V327 PolarHBondContact O-N 2.9Å
280	Q	94.8	Very high	87.2	Confident	64 Å²	64	56.2 Å²	56.2	30%	0.299	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.9	167.4	-55.8	-163.9	-60.3	0	0	109.9	H221 I325 D326	H221-Q280 PolarHBondContact N-O 2.92Å; H221-Q280 PolarHBondContact O-N 3.45Å; Q280-I325 CarbonylContact C-O 3.52Å; Q280-I325 WeakPolarHBondContact CA-O 3.48Å; Q280-D326 WeakPolarHBondContact CG-OD1 3.26Å; Q280-D326 PolarHBondContact NE2-OD1 3.01Å
281	I	93.2	Very high	87.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	116.7	176.6	-60.2	177.7	0	0	0	108.6	C162 W189 M218 L219 V220 I283 N324 I325 V327	C162-I281 HydrophobicContact CB-CD1 3.72Å; W189-I281 HydrophobicContact CB-CD1 4.48Å; M218-I281 HydrophobicContact CB-CG2 3.66Å; M218-I281 HydrophobicContact CG-CG2 4.17Å; M218-I281 HydrophobicContact SD-CG2 4.31Å; L219-I281 WeakPolarHBondContact O-CA 3.41Å; V220-I281 HydrophobicContact CG2-CG1 4.33Å; I281-I283 HydrophobicContact CG2-CD1 3.97Å; I281-N324 CarbonylContact O-C 3.56Å; I281-N324 WeakPolarHBondContact O-CA 3.31Å; I281-I325 HydrophobicContact CB-CB 4.49Å; I281-I325 PolarHBondContact N-O 2.99Å; I281-I325 PolarHBondContact O-N 3.12Å; I281-V327 HydrophobicContact CD1-CB 4.45Å; I281-V327 HydrophobicContact CD1-CG1 3.81Å; I281-V327 HydrophobicContact CD1-CG2 3.77Å; I281-V327 HydrophobicContact CG1-CG1 4.48Å; I281-V327 HydrophobicContact CG1-CG2 3.98Å
282	K	90.5	Very high	87.1	Confident	48 Å²	48	52.1 Å²	52.1	21%	0.209	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	126.6	173.5	-173.5	177.6	-67.3	160.8	0	109.7	M218 L219 L294 A322	M218-K282 CarbonylContact C-O 3.6Å; M218-K282 WeakPolarHBondContact CA-O 3.01Å; L219-K282 HydrophobicContact CB-CB 4.41Å; L219-K282 PolarHBondContact N-O 3.31Å; L219-K282 PolarHBondContact O-N 2.75Å; K282-L294 HydrophobicContact CD-CD1 3.86Å; K282-L294 HydrophobicContact CD-CD2 3.87Å; K282-L294 HydrophobicContact CD-CG 4.42Å; K282-L294 HydrophobicContact CG-CD2 4.14Å; K282-A322 HydrophobicContact CD-CB 4.49Å; K282-A322 HydrophobicContact CG-CB 4.32Å
283	I	87.2	Confident	86.8	Confident	18 Å²	18	53.1 Å²	53.1	9%	0.092	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	130.3	178	-56.7	-57.2	0	0	0	110.1	P160 Y216 M218 I281 I323 I325	P160-I283 HydrophobicContact CG-CD1 3.7Å; P160-I283 HydrophobicContact CG-CG1 4.03Å; P160-I283 HydrophobicContact CG-CG2 4.31Å; Y216-I283 HydrophobicContact CD1-CG2 3.46Å; Y216-I283 VanDerWaalsContact CD1-CG2 3.46Å; Y216-I283 HydrophobicContact CE1-CG2 4.24Å; Y216-I283 HydrophobicContact CG-CG2 3.89Å; M218-I283 HydrophobicContact CB-CD1 4.13Å; I281-I283 HydrophobicContact CG2-CD1 3.97Å; I283-I323 PolarHBondContact N-O 2.81Å; I283-I323 VanDerWaalsContact N-O 3.08Å; I283-I325 HydrophobicContact CD1-CD1 4.08Å; I283-I325 HydrophobicContact CG1-CD1 3.78Å; I283-I325 HydrophobicContact CG1-CG1 4.47Å
284	C	85.1	Confident	86.6	Confident	8 Å²	8	52.7 Å²	52.7	5%	0.054	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.5	173.7	59	0	0	0	0	111.3	Y216 G217 C291 L294	Y216-C284 CarbonylContact C-O 3.45Å; Y216-C284 WeakPolarHBondContact CA-O 3.42Å; G217-C284 VanDerWaalsContact C-SG 3.51Å; G217-C284 PolarHBondContact N-O 3Å; G217-C284 PolarHBondContact O-N 2.94Å; C284-C291 HydrophobicContact CB-CB 4.1Å; C284-C291 WeakPolarHBondContact CB-SG 3.33Å; C284-C291 VanDerWaalsContact SG-CA 3.59Å; C284-C291 WeakPolarHBondContact SG-CB 3.43Å; C284-C291 CovalentContact SG-SG 2.05Å; C284-C291 PolarHBondContact SG-SG 2.96Å; C284-L294 HydrophobicContact CB-CD2 3.59Å
285	N	81.4	Confident	86.6	Confident	65 Å²	65	49.8 Å²	49.8	35%	0.348	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	126.4	170.4	-168.4	-16.7	0	0	0	109.1	I215 L287 G290 C291	I215-N285 CarbonylContact O-C 3.57Å; I215-N285 PolarHBondContact O-OD1 2.84Å; I215-N285 VanDerWaalsContact O-OD1 3.1Å; N285-L287 VanDerWaalsContact C-N 3.33Å; N285-L287 WeakPolarHBondContact OD1-CB 3.32Å; N285-L287 VanDerWaalsContact OD1-CG 3.26Å; N285-L287 WeakPolarHBondContact OD1-CG 3.25Å; N285-L287 PolarHBondContact OD1-N 2.55Å; N285-G290 CarbonylContact O-C 3.59Å; N285-G290 VanDerWaalsContact O-C 3.29Å; N285-G290 WeakPolarHBondContact O-CA 3.5Å; N285-G290 PolarHBondContact O-N 3.08Å; N285-C291 PolarHBondContact O-N 3.34Å
286	K	79.1	Confident	86.5	Confident	47 Å²	47	53.1 Å²	53.1	20%	0.204	29%	0.292	C	S	.	.			trans	-75	-24.5	175.7	-67.6	173.7	165.9	-168.1	0	112.6	S213 E214 I215 Y216 D256 N288 D289	S213-K286 WeakPolarHBondContact O-CE 3.2Å; S213-K286 PolarHBondContact O-NZ 3.43Å; E214-K286 VanDerWaalsContact O-CD 3.27Å; E214-K286 WeakPolarHBondContact O-CD 3.33Å; I215-K286 WeakPolarHBondContact O-CB 3.42Å; I215-K286 PolarHBondContact O-N 3.08Å; Y216-K286 VanDerWaalsContact O-CE 3.32Å; Y216-K286 WeakPolarHBondContact O-CE 3.5Å; D256-K286 VanDerWaalsContact C-NZ 3.3Å; D256-K286 WeakPolarHBondContact O-CE 3.41Å; D256-K286 PolarHBondContact O-NZ 2.89Å; K286-N288 PolarHBondContact O-N 3.02Å; K286-D289 PolarHBondContact O-N 2.85Å
287	L	75.8	Confident	86.5	Confident	103 Å²	103	53.6 Å²	53.6	54%	0.539	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-60.4	136	174	-58.3	173.5	0	0	0	108.8	I215 N285 D289	I215-L287 HydrophobicContact CG2-CD1 4.22Å; I215-L287 HydrophobicContact CG2-CG 4.47Å; N285-L287 VanDerWaalsContact C-N 3.33Å; N285-L287 WeakPolarHBondContact OD1-CB 3.32Å; N285-L287 VanDerWaalsContact OD1-CG 3.26Å; N285-L287 WeakPolarHBondContact OD1-CG 3.25Å; N285-L287 PolarHBondContact OD1-N 2.55Å; L287-D289 VanDerWaalsContact C-N 3.33Å; L287-D289 PolarHBondContact O-N 2.97Å
288	N	73.6	Confident	86.2	Confident	163 Å²	163	58.9 Å²	58.9	87%	0.872	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	58.8	37.6	-178.4	-50.2	-32.4	0	0	0	114.2	K286 G290	K286-N288 PolarHBondContact O-N 3.02Å; N288-G290 PolarHBondContact O-N 2.86Å; N288-G290 VanDerWaalsContact O-N 3.08Å
289	D	75	Confident	86	Confident	115 Å²	115	59 Å²	59	62%	0.615	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	59.4	20	175.7	-60.5	-47	0	0	0	115.2	K286 L287 C291 Q292	K286-D289 PolarHBondContact O-N 2.85Å; L287-D289 VanDerWaalsContact C-N 3.33Å; L287-D289 PolarHBondContact O-N 2.97Å; D289-C291 PolarHBondContact O-N 2.85Å; D289-Q292 HydrophobicContact CB-CB 4.3Å; D289-Q292 WeakPolarHBondContact O-CB 3.4Å; D289-Q292 PolarHBondContact O-N 3.2Å
290	G	78.8	Confident	85.2	Confident	42 Å²	42	61.1 Å²	61.1	43%	0.433	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-13.1	-175.9	0	0	0	0	0	115.3	N285 N288	N285-G290 CarbonylContact O-C 3.59Å; N285-G290 VanDerWaalsContact O-C 3.29Å; N285-G290 WeakPolarHBondContact O-CA 3.5Å; N285-G290 PolarHBondContact O-N 3.08Å; N288-G290 PolarHBondContact O-N 2.86Å; N288-G290 VanDerWaalsContact O-N 3.08Å
291	C	86.5	Confident	83.8	Confident	7 Å²	7	63.4 Å²	63.4	5%	0.047	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-18	173.3	-67	0	0	0	0	114.1	L257 C284 N285 D289 S293 L294 S295	L257-C291 HydrophobicContact CD1-CB 3.83Å; C284-C291 HydrophobicContact CB-CB 4.1Å; C284-C291 WeakPolarHBondContact CB-SG 3.33Å; C284-C291 VanDerWaalsContact SG-CA 3.59Å; C284-C291 WeakPolarHBondContact SG-CB 3.43Å; C284-C291 CovalentContact SG-SG 2.05Å; C284-C291 PolarHBondContact SG-SG 2.96Å; N285-C291 PolarHBondContact O-N 3.34Å; D289-C291 PolarHBondContact O-N 2.85Å; C291-S293 VanDerWaalsContact C-N 3.33Å; C291-S293 PolarHBondContact O-N 2.95Å; C291-L294 PolarHBondContact O-N 2.93Å; C291-S295 PolarHBondContact O-N 3.39Å; C291-S295 VanDerWaalsContact O-O 3.11Å
292	Q	83.7	Confident	82.2	Confident	158 Å²	158	72.1 Å²	72.1	74%	0.738	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-34.1	-167.1	-170.4	175.4	38.5	0	0	113.9	D289	D289-Q292 HydrophobicContact CB-CB 4.3Å; D289-Q292 WeakPolarHBondContact O-CB 3.4Å; D289-Q292 PolarHBondContact O-N 3.2Å
293	S	82.2	Confident	80.6	Confident	100 Å²	100	81.5 Å²	81.5	70%	0.699	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	1.1	176.9	64.3	0	0	0	0	113.9	C291	C291-S293 VanDerWaalsContact C-N 3.33Å; C291-S293 PolarHBondContact O-N 2.95Å
294	L	87.4	Confident	79.2	Confident	39 Å²	39	87 Å²	87	20%	0.204	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-49.7	-173.4	-169.8	74.4	0	0	0	112.2	L219 K282 C284 C291	L219-L294 HydrophobicContact CB-CD2 4.36Å; L219-L294 HydrophobicContact CB-CG 4.25Å; L219-L294 HydrophobicContact CD2-CD1 3.85Å; L219-L294 HydrophobicContact CD2-CG 3.9Å; K282-L294 HydrophobicContact CD-CD1 3.86Å; K282-L294 HydrophobicContact CD-CD2 3.87Å; K282-L294 HydrophobicContact CD-CG 4.42Å; K282-L294 HydrophobicContact CG-CD2 4.14Å; C284-L294 HydrophobicContact CB-CD2 3.59Å; C291-L294 PolarHBondContact O-N 2.93Å
295	S	89.8	Confident	77.9	Confident	4 Å²	4	88.7 Å²	88.7	3%	0.028	46%	0.464	C	S	.	.	S	Bend	trans	-137.9	132.7	-172.7	-175.3	0	0	0	0	111.3	M218 C291	M218-S295 VanDerWaalsContact O-CB 3.29Å; M218-S295 WeakPolarHBondContact O-CB 3.23Å; M218-S295 PolarHBondContact O-OG 3.16Å; C291-S295 PolarHBondContact O-N 3.39Å; C291-S295 VanDerWaalsContact O-O 3.11Å
296	P	92.5	Very high	76.7	Confident	73 Å²	73	96.2 Å²	96.2	47%	0.474	49%	0.488	S	S	.	.	S	Bend	cis	-69	155.7	-5.9	-19.6	35.2	0	0	0	112.5	Y253 L257	Y253-P296 HydrophobicContact CD2-CB 3.79Å; Y253-P296 HydrophobicContact CD2-CG 4.17Å; Y253-P296 HydrophobicContact CE2-CB 4.32Å; Y253-P296 HydrophobicContact CG-CB 4.29Å; Y253-P296 HydrophobicContact CG-CG 4.19Å; L257-P296 HydrophobicContact CD2-CG 4.03Å
297	P	92.6	Very high	75.7	Confident	28 Å²	28	101.3 Å²	101.3	18%	0.182	52%	0.516	C	S	.	.			trans	-71.9	145	-179.7	29.7	-32.4	0	0	0	111.7	L219 D239 G240 C299	L219-P297 HydrophobicContact CD1-CB 3.99Å; L219-P297 HydrophobicContact CD1-CG 3.81Å; D239-P297 VanDerWaalsContact O-CB 3.24Å; D239-P297 WeakPolarHBondContact O-CB 3.42Å; G240-P297 VanDerWaalsContact O-CG 3.31Å; G240-P297 WeakPolarHBondContact O-CG 3.36Å; P297-C299 PolarHBondContact O-N 3.47Å
298	V	89.7	Confident	74.8	Confident	120 Å²	120	104.4 Å²	104.4	73%	0.727	52%	0.521	S	S	*	.			trans	-87	90.5	176.8	-177.1	0	0	0	0	109.6	S300	V298-S300 PolarHBondContact O-N 2.85Å
299	C	89.9	Confident	73.8	Confident	33 Å²	33	101.4 Å²	101.4	22%	0.223	50%	0.5	C	S	.	.			trans	-91.9	83	-179.9	-54.3	0	0	0	0	111	C241 P297	C241-C299 WeakPolarHBondContact CA-SG 3.44Å; C241-C299 HydrophobicContact CB-CB 3.87Å; C241-C299 WeakPolarHBondContact CB-SG 3.25Å; C241-C299 WeakPolarHBondContact SG-CA 3.38Å; C241-C299 WeakPolarHBondContact SG-CB 3.5Å; C241-C299 CovalentContact SG-SG 2.05Å; C241-C299 PolarHBondContact SG-SG 3.08Å; P297-C299 PolarHBondContact O-N 3.47Å
300	S	80.5	Confident	72.7	Confident	48 Å²	48	106.5 Å²	106.5	34%	0.336	51%	0.51	S	S	.	.			trans	-81.6	150.7	170.9	-172.3	0	0	0	0	111.2	V298 R302	V298-S300 PolarHBondContact O-N 2.85Å; S300-R302 PolarHBondContact O-N 2.89Å; S300-R302 VanDerWaalsContact O-N 3.16Å
301	N	66.1	Low	71.4	Confident	112 Å²	112	108 Å²	108	60%	0.599	52%	0.519	S	S	*	.			trans	-58.9	123	169.2	-74.7	-16	0	0	0	108.1	R245 R303	R245-N301 PolarHBondContact NH1-OD1 3.35Å; N301-R303 PolarHBondContact O-N 3.38Å
302	R	59.3	Low	69.9	Low	184 Å²	184	112.4 Å²	112.4	69%	0.694	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.8	-7	-168.8	-70.6	-179.3	175.3	177.9	2.6	119	S300	S300-R302 PolarHBondContact O-N 2.89Å; S300-R302 VanDerWaalsContact O-N 3.16Å
303	R	56.7	Low	68.3	Low	244 Å²	244	109.8 Å²	109.8	92%	0.921	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-33.8	179.7	-83.5	-172.9	173.1	-171.8	-1.2	114.5	N301	N301-R303 PolarHBondContact O-N 3.38Å
304	E	57.6	Low	66.7	Low	133 Å²	133	110.7 Å²	110.7	62%	0.621	54%	0.537	S	S	*	.	S	Bend	trans	-91.7	-14.4	-177.6	-72.9	-177	161.4	0	0	114.3
305	D	57.7	Low	64.8	Low	45 Å²	45	118 Å²	118	24%	0.241	57%	0.567	C	S	.	*	H	α-helix	trans	-82.9	-22.9	-162.1	-141.6	30.9	0	0	0	114.1	L307 R308 K309	D305-L307 PolarHBondContact O-N 2.91Å; D305-R308 PolarHBondContact O-N 2.75Å; D305-K309 PolarHBondContact O-N 2.97Å; D305-K309 VanDerWaalsContact OD2-CE 3.31Å; D305-K309 WeakPolarHBondContact OD2-CE 3.11Å; D305-K309 IonicContact OD2-NZ 3.59Å
306	R	55.7	Low	62.9	Low	223 Å²	223	122.8 Å²	122.8	84%	0.842	59%	0.592	S	S	*	*	H	α-helix	trans	-63.5	-27.9	177.6	-69.6	-171.6	-179.6	-179.7	0.4	112.9
307	L	58.1	Low	60.5	Low	154 Å²	154	130.8 Å²	130.8	81%	0.806	61%	0.613	S	S	*	*	H	α-helix	trans	-83	-31.9	178.8	-69.4	169	0	0	0	112.3	D305	D305-L307 PolarHBondContact O-N 2.91Å
308	R	56.7	Low	58.1	Low	167 Å²	167	136.9 Å²	136.9	63%	0.63	64%	0.644	S	S	*	*	H	α-helix	trans	-82.8	-33.2	179.7	-72.9	-175.9	173	-177.8	-0.1	113.6	D305 R310 A311	D305-R308 PolarHBondContact O-N 2.75Å; R308-R310 VanDerWaalsContact C-N 3.26Å; R308-R310 PolarHBondContact O-N 3.25Å; R308-A311 PolarHBondContact O-N 2.81Å
309	K	52.8	Low	56.1	Low	101 Å²	101	135.5 Å²	135.5	44%	0.439	64%	0.64	S	S	.	*	H	α-helix	trans	-62.2	-26.2	-178.8	-83.7	-175.3	171.7	-174.7	0	114.4	D239 D305 A311 T313	D239-K309 IonicContact OD2-NZ 3.58Å; D239-K309 PolarHBondContact OD2-NZ 3.04Å; D305-K309 PolarHBondContact O-N 2.97Å; D305-K309 VanDerWaalsContact OD2-CE 3.31Å; D305-K309 WeakPolarHBondContact OD2-CE 3.11Å; D305-K309 IonicContact OD2-NZ 3.59Å; K309-A311 VanDerWaalsContact C-N 3.32Å; K309-T313 PolarHBondContact O-N 3.5Å; K309-T313 PolarHBondContact O-OG1 2.86Å
310	R	52.2	Low	54	Low	221 Å²	221	136.8 Å²	136.8	83%	0.834	66%	0.659	S	S	*	*	H	α-helix	trans	-71.1	-22.5	172.7	-92.5	-179	177.3	167	-0.9	114	R308	R308-R310 VanDerWaalsContact C-N 3.26Å; R308-R310 PolarHBondContact O-N 3.25Å
311	A	52	Low	52.7	Low	73 Å²	73	143.7 Å²	143.7	60%	0.603	69%	0.686	S	S	*	*	H	α-helix	trans	-87.6	-24.3	-179.7	0	0	0	0	0	113.4	R308 K309 T314	R308-A311 PolarHBondContact O-N 2.81Å; K309-A311 VanDerWaalsContact C-N 3.32Å; A311-T314 PolarHBondContact O-OG1 3.39Å
312	I	54.5	Low	52.6	Low	100 Å²	100	140 Å²	140	51%	0.513	67%	0.671	S	S	.	*	H	α-helix	trans	-98.1	-26.1	-171.4	-61	172.9	0	0	0	112.6	T314 K315 L316	I312-T314 PolarHBondContact O-N 2.66Å; I312-K315 PolarHBondContact O-N 2.78Å; I312-L316 HydrophobicContact CG2-CD1 3.97Å
313	T	50.7	Low	53.4	Low	103 Å²	103	134.5 Å²	134.5	63%	0.632	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-17.4	-176.9	20.7	0	0	0	0	114.2	K309	K309-T313 PolarHBondContact O-N 3.5Å; K309-T313 PolarHBondContact O-OG1 2.86Å
314	T	49	Very low	54.8	Low	120 Å²	120	125.1 Å²	125.1	74%	0.736	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-15.3	176.3	37.5	0	0	0	0	114.7	A311 I312	A311-T314 PolarHBondContact O-OG1 3.39Å; I312-T314 PolarHBondContact O-N 2.66Å
315	K	45.8	Very low	56.2	Low	192 Å²	192	120.4 Å²	120.4	84%	0.835	60%	0.601	S	S	*	*	S	Bend	trans	-107.3	-1.7	-175.5	-76.5	-169.3	177.3	-175.7	0	116.5	I312	I312-K315 PolarHBondContact O-N 2.78Å
316	L	51.2	Low	57.7	Low	104 Å²	104	121.5 Å²	121.5	55%	0.545	61%	0.607	S	S	.	*			trans	-111.6	17.2	-176.7	-86.9	153.1	0	0	0	114.8	I312 D318	I312-L316 HydrophobicContact CG2-CD1 3.97Å; L316-D318 VanDerWaalsContact C-N 3.31Å; L316-D318 PolarHBondContact O-N 2.66Å
317	R	41.6	Very low	59.4	Low	241 Å²	241	111.3 Å²	111.3	91%	0.909	57%	0.569	S	S	*	*	S	Bend	trans	-82.1	0.8	179.7	-104.2	-176.8	93.4	176.9	6.5	115.6
318	D	43	Very low	61.1	Low	157 Å²	157	106.2 Å²	106.2	84%	0.84	54%	0.542	S	S	*	.			trans	-144.2	65.1	178.8	-162.3	26.6	0	0	0	111.4	L316	L316-D318 VanDerWaalsContact C-N 3.31Å; L316-D318 PolarHBondContact O-N 2.66Å
319	S	47.4	Very low	62.8	Low	91 Å²	91	98.6 Å²	98.6	64%	0.636	51%	0.514	S	S	*	.			trans	-101.5	99.2	158.9	-165.2	0	0	0	0	106.1
320	G	46.4	Very low	64.5	Low	60 Å²	60	97.2 Å²	97.2	62%	0.619	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.9	146.7	176.3	0	0	0	0	0	112.2	A322	G320-A322 VanDerWaalsContact C-N 3.35Å; G320-A322 PolarHBondContact O-N 3.42Å
321	Q	52.8	Low	66.2	Low	193 Å²	193	88 Å²	88	90%	0.902	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	11.7	71.7	174.4	-82.3	176.8	-31.8	0	0	114.9	I323	Q321-I323 PolarHBondContact O-N 3.41Å
322	A	62.8	Low	68.1	Low	35 Å²	35	84.9 Å²	84.9	29%	0.289	46%	0.456	S	S	.	.			trans	-64.1	120.3	168.9	0	0	0	0	0	108.6	K282 G320 N324	K282-A322 HydrophobicContact CD-CB 4.49Å; K282-A322 HydrophobicContact CG-CB 4.32Å; G320-A322 VanDerWaalsContact C-N 3.35Å; G320-A322 PolarHBondContact O-N 3.42Å; A322-N324 PolarHBondContact O-N 3.32Å
323	I	76.5	Confident	69.8	Low	68 Å²	68	82.7 Å²	82.7	35%	0.349	45%	0.445	S	S	.	.			trans	-76.4	113.5	176	-55.7	176.8	0	0	0	107.3	P159 I283 Q321 I325	P159-I323 HydrophobicContact CB-CD1 4.13Å; P159-I323 HydrophobicContact CB-CG2 4.18Å; I283-I323 PolarHBondContact N-O 2.81Å; I283-I323 VanDerWaalsContact N-O 3.08Å; Q321-I323 PolarHBondContact O-N 3.41Å; I323-I325 HydrophobicContact CG2-CD1 4.47Å; I323-I325 HydrophobicContact CG2-CG1 4.05Å
324	N	85.4	Confident	71.8	Confident	47 Å²	47	77.8 Å²	77.8	25%	0.251	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.5	171.8	-62.8	-40.8	0	0	0	108.4	I281 A322	I281-N324 CarbonylContact O-C 3.56Å; I281-N324 WeakPolarHBondContact O-CA 3.31Å; A322-N324 PolarHBondContact O-N 3.32Å
325	I	87.5	Confident	73.8	Confident	33 Å²	33	75.6 Å²	75.6	17%	0.169	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.6	-178.8	-59.2	171.8	0	0	0	108.2	P160 C162 Q280 I281 I283 I323 V327	P160-I325 WeakPolarHBondContact O-CD1 3.41Å; C162-I325 HydrophobicContact CB-CG2 4.17Å; C162-I325 VanDerWaalsContact SG-CD1 3.58Å; Q280-I325 CarbonylContact C-O 3.52Å; Q280-I325 WeakPolarHBondContact CA-O 3.48Å; I281-I325 HydrophobicContact CB-CB 4.49Å; I281-I325 PolarHBondContact N-O 2.99Å; I281-I325 PolarHBondContact O-N 3.12Å; I283-I325 HydrophobicContact CD1-CD1 4.08Å; I283-I325 HydrophobicContact CG1-CD1 3.78Å; I283-I325 HydrophobicContact CG1-CG1 4.47Å; I323-I325 HydrophobicContact CG2-CD1 4.47Å; I323-I325 HydrophobicContact CG2-CG1 4.05Å; I325-V327 HydrophobicContact CG2-CG1 4.25Å
326	D	89.4	Confident	75.7	Confident	69 Å²	69	70.9 Å²	70.9	37%	0.369	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	126.4	175.2	-61.5	-32.7	0	0	0	110.2	Q280	Q280-D326 WeakPolarHBondContact CG-OD1 3.26Å; Q280-D326 PolarHBondContact NE2-OD1 3.01Å
327	V	92.8	Very high	77.1	Confident	8 Å²	8	69 Å²	69	5%	0.048	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	140.8	177.3	-65.4	0	0	0	0	110.7	C162 Y164 K278 C279 I281 I325	C162-V327 HydrophobicContact CB-CG1 4Å; Y164-V327 HydrophobicContact CD1-CG2 4.2Å; Y164-V327 HydrophobicContact CG-CG2 4.37Å; K278-V327 WeakPolarHBondContact CA-O 3.43Å; C279-V327 HydrophobicContact CB-CG2 3.92Å; C279-V327 PolarHBondContact N-O 2.85Å; C279-V327 WeakPolarHBondContact O-CG2 3.48Å; C279-V327 PolarHBondContact O-N 2.9Å; I281-V327 HydrophobicContact CD1-CB 4.45Å; I281-V327 HydrophobicContact CD1-CG1 3.81Å; I281-V327 HydrophobicContact CD1-CG2 3.77Å; I281-V327 HydrophobicContact CG1-CG1 4.48Å; I281-V327 HydrophobicContact CG1-CG2 3.98Å; I325-V327 HydrophobicContact CG2-CG1 4.25Å
328	I	92	Very high	78.8	Confident	47 Å²	47	66.1 Å²	66.1	24%	0.241	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	136.2	-173.7	-53.8	176.6	0	0	0	109	F277 K278	F277-I328 WeakPolarHBondContact O-CA 3.47Å; K278-I328 HydrophobicContact CB-CG1 4.34Å; K278-I328 HydrophobicContact CD-CD1 4.01Å; K278-I328 HydrophobicContact CD-CG1 4.21Å; K278-I328 HydrophobicContact CG-CB 4.45Å; K278-I328 HydrophobicContact CG-CD1 4.22Å; K278-I328 HydrophobicContact CG-CG1 3.88Å; K278-I328 HydrophobicContact CG-CG2 4.02Å
329	T	92.9	Very high	79.8	Confident	7 Å²	7	65 Å²	65	4%	0.043	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-81.7	157.1	173.4	68.7	0	0	0	0	110.9	Y164 V166 F277	Y164-T329 HydrophobicContact CD1-CG2 3.47Å; Y164-T329 VanDerWaalsContact CD1-CG2 3.47Å; Y164-T329 HydrophobicContact CD2-CG2 3.83Å; Y164-T329 HydrophobicContact CE1-CG2 3.54Å; Y164-T329 HydrophobicContact CE2-CG2 3.82Å; Y164-T329 HydrophobicContact CG-CG2 3.61Å; V166-T329 HydrophobicContact CG2-CG2 4.01Å; F277-T329 HydrophobicContact CB-CG2 3.97Å; F277-T329 HydrophobicContact CD2-CG2 4.33Å; F277-T329 PolarHBondContact N-OG1 2.85Å; F277-T329 PolarHBondContact O-N 2.97Å
330	P	89.3	Confident	80.1	Confident	72 Å²	72	68.8 Å²	68.8	47%	0.468	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-57.8	158.1	162.3	-20	32.6	0	0	0	111.6	I332	P330-I332 PolarHBondContact O-N 2.85Å
331	D	88.4	Confident	80	Confident	29 Å²	29	71.3 Å²	71.3	16%	0.155	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-60.9	131.5	169	-67.5	14.6	0	0	0	110.5	R58 F274 H276	R58-D331 IonicContact CZ-OD2 2.66Å; R58-D331 IonicContact NH1-OD2 2.83Å; R58-D331 PolarHBondContact NH1-OD2 3.04Å; R58-D331 IonicContact NH2-OD2 2.7Å; R58-D331 PolarHBondContact NH2-OD2 2.81Å; F274-D331 HydrophobicContact CD1-CB 4.19Å; H276-D331 IonicContact ND1-OD1 2.71Å
332	I	90.9	Very high	79.7	Confident	6 Å²	6	67.9 Å²	67.9	3%	0.031	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.2	175.7	-60.4	167.8	0	0	0	108	V166 V176 F274 V275 F277 P330 V334	V166-I332 HydrophobicContact CB-CD1 3.84Å; V166-I332 HydrophobicContact CG1-CD1 4.06Å; V166-I332 HydrophobicContact CG2-CD1 3.92Å; V176-I332 HydrophobicContact CG1-CG2 3.85Å; F274-I332 VanDerWaalsContact CA-O 3.31Å; F274-I332 WeakPolarHBondContact CA-O 3.2Å; V275-I332 HydrophobicContact CG2-CB 4.43Å; V275-I332 PolarHBondContact N-O 3.03Å; V275-I332 VanDerWaalsContact N-O 3.12Å; V275-I332 PolarHBondContact O-N 2.91Å; F277-I332 HydrophobicContact CE2-CD1 4.14Å; P330-I332 PolarHBondContact O-N 2.85Å; I332-V334 HydrophobicContact CG2-CG2 4.11Å; I332-V334 PolarHBondContact O-N 2.76Å
333	L	91	Very high	78.6	Confident	55 Å²	55	71.6 Å²	71.6	29%	0.288	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	114.7	168	174.8	64.2	0	0	0	109	R177 S178 A179 S273 F274 I335	R177-L333 PolarHBondContact O-N 3.2Å; S178-L333 CarbonylContact C-O 3.48Å; S178-L333 WeakPolarHBondContact CA-O 3.44Å; A179-L333 PolarHBondContact N-O 3.4Å; S273-L333 CarbonylContact O-C 3.57Å; S273-L333 WeakPolarHBondContact O-CA 3.31Å; F274-L333 HydrophobicContact CD1-CB 4.14Å; F274-L333 HydrophobicContact CD2-CD1 4.15Å; F274-L333 HydrophobicContact CE1-CB 3.76Å; F274-L333 HydrophobicContact CE1-CD1 4.1Å; F274-L333 HydrophobicContact CE1-CG 4.46Å; F274-L333 HydrophobicContact CE2-CD1 3.74Å; F274-L333 HydrophobicContact CZ-CB 4.2Å; F274-L333 HydrophobicContact CZ-CD1 3.71Å; F274-L333 HydrophobicContact CZ-CG 4.41Å; L333-I335 HydrophobicContact CD2-CG1 4.45Å; L333-I335 HydrophobicContact CG-CG1 4.21Å
334	V	92	Very high	76.7	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114.7	175.7	-175.6	0	0	0	0	109.1	A179 V181 V266 K268 S273 V275 I332	A179-V334 CarbonylContact O-C 3.57Å; A179-V334 VanDerWaalsContact O-CA 3.31Å; A179-V334 WeakPolarHBondContact O-CA 3.11Å; V181-V334 HydrophobicContact CG2-CG1 3.5Å; V266-V334 HydrophobicContact CG1-CB 4.32Å; V266-V334 HydrophobicContact CG1-CG1 3.64Å; V266-V334 HydrophobicContact CG1-CG2 3.76Å; K268-V334 HydrophobicContact CB-CB 3.9Å; K268-V334 HydrophobicContact CB-CG1 3.8Å; K268-V334 HydrophobicContact CB-CG2 4.29Å; K268-V334 HydrophobicContact CD-CB 4.11Å; K268-V334 HydrophobicContact CD-CG1 3.93Å; K268-V334 HydrophobicContact CG-CB 4.24Å; K268-V334 HydrophobicContact CG-CG1 3.78Å; S273-V334 WeakPolarHBondContact CB-O 3.42Å; S273-V334 PolarHBondContact O-N 3.13Å; V275-V334 HydrophobicContact CG2-CG2 3.75Å; I332-V334 HydrophobicContact CG2-CG2 4.11Å; I332-V334 PolarHBondContact O-N 2.76Å
335	I	90.4	Very high	74.3	Confident	74 Å²	74	79.3 Å²	79.3	38%	0.379	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	136.4	179.4	-54.7	173.2	0	0	0	108.4	A179 K180 V181 L333	A179-I335 PolarHBondContact O-N 3.14Å; K180-I335 WeakPolarHBondContact CA-O 3.36Å; K180-I335 HydrophobicContact CG-CB 4.38Å; V181-I335 PolarHBondContact N-O 2.91Å; L333-I335 HydrophobicContact CD2-CG1 4.45Å; L333-I335 HydrophobicContact CG-CG1 4.21Å
336	D	86.7	Confident	71.8	Confident	93 Å²	93	87.1 Å²	87.1	50%	0.497	49%	0.49	S	S	.	.			trans	-60.6	140.4	173.4	-70.1	-56.8	0	0	0	111	K268 E338	K268-D336 WeakPolarHBondContact CE-OD1 3.4Å; K268-D336 IonicContact NZ-OD1 2.74Å; K268-D336 PolarHBondContact NZ-OD1 2.99Å; K268-D336 IonicContact NZ-OD2 2.77Å; K268-D336 PolarHBondContact NZ-OD2 3.41Å; D336-E338 PolarHBondContact O-N 3.15Å; D336-E338 VanDerWaalsContact O-N 3.16Å
337	S	80.7	Confident	68.9	Low	63 Å²	63	92.8 Å²	92.8	44%	0.441	51%	0.514	S	S	.	.			trans	-74.4	106.7	170.2	-48.8	0	0	0	0	107.2	V181 V339	V181-S337 PolarHBondContact O-OG 3.42Å; S337-V339 PolarHBondContact O-N 3.5Å
338	E	76.5	Confident	65.8	Low	182 Å²	182	99 Å²	99	85%	0.85	55%	0.547	S	S	*	.			trans	-58.6	129.4	169.2	-67.1	176.2	-170.8	0	0	107.8	D336 E340	D336-E338 PolarHBondContact O-N 3.15Å; D336-E338 VanDerWaalsContact O-N 3.16Å; E338-E340 VanDerWaalsContact C-N 3.32Å; E338-E340 PolarHBondContact O-N 3.09Å
339	V	63.7	Low	63	Low	134 Å²	134	103.3 Å²	103.3	81%	0.812	57%	0.571	S	S	*	*			trans	-66.4	102.2	166.5	-179.2	0	0	0	0	105	S337 S341	S337-V339 PolarHBondContact O-N 3.5Å; V339-S341 VanDerWaalsContact C-N 3.33Å; V339-S341 PolarHBondContact O-N 2.75Å
340	E	53.6	Low	60	Low	170 Å²	170	111.4 Å²	111.4	79%	0.794	61%	0.605	S	S	*	*			trans	-53	109.4	160.4	-108	163.8	-179.4	0	0	105.2	E338 T342	E338-E340 VanDerWaalsContact C-N 3.32Å; E338-E340 PolarHBondContact O-N 3.09Å; E340-T342 PolarHBondContact O-N 2.87Å
341	S	43.8	Very low	57.1	Low	113 Å²	113	117 Å²	117	79%	0.79	62%	0.623	S	S	*	*			trans	-64.2	83.4	171.3	52.8	0	0	0	0	106.3	V339 S343	V339-S341 VanDerWaalsContact C-N 3.33Å; V339-S341 PolarHBondContact O-N 2.75Å; S341-S343 VanDerWaalsContact C-N 3.29Å; S341-S343 PolarHBondContact O-N 3.49Å
342	T	46.7	Very low	54.2	Low	121 Å²	121	125.1 Å²	125.1	74%	0.742	66%	0.659	S	S	*	*			trans	-63.1	103	164.1	51.8	0	0	0	0	104.8	E340 A344	E340-T342 PolarHBondContact O-N 2.87Å; T342-A344 PolarHBondContact O-N 2.68Å
343	S	39.9	Very low	51.3	Low	113 Å²	113	133.9 Å²	133.9	79%	0.79	70%	0.697	S	S	*	*			trans	-41.1	116.9	165.6	44.4	0	0	0	0	108.1	S341 E345	S341-S343 VanDerWaalsContact C-N 3.29Å; S341-S343 PolarHBondContact O-N 3.49Å; S343-E345 PolarHBondContact O-N 3.4Å; S343-E345 VanDerWaalsContact O-N 3.11Å
344	A	38.1	Very low	48.4	Very low	94 Å²	94	135.5 Å²	135.5	78%	0.777	72%	0.718	S	S	*	*			trans	-59.1	111	179.7	0	0	0	0	0	109.8	T342	T342-A344 PolarHBondContact O-N 2.68Å
345	E	33.9	Very low	45.5	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	76%	0.763	S	S	*	*			trans	-173.3	82.3	156.8	-106.5	156.8	-164.5	0	0	109.2	S343	S343-E345 PolarHBondContact O-N 3.4Å; S343-E345 VanDerWaalsContact O-N 3.11Å
346	Q	34.6	Very low	42.7	Very low	197 Å²	197	150.8 Å²	150.8	92%	0.921	79%	0.785	S	S	*	*				173.8	121.7	114.3	-100.5	169.9	-51.3	0	0	110.3
347	Q	28.7	Very low	40.3	Very low	187 Å²	187	152.2 Å²	152.2	87%	0.874	80%	0.799	S	S	*	*			trans	-71.2	146.5	173.3	-130	158.8	-35.7	0	0	110.2
348	D	27.9	Very low	38.4	Very low	138 Å²	138	156.4 Å²	156.4	74%	0.738	81%	0.81	S	S	*	*			trans	79.1	99.2	147.2	-133.5	11	0	0	0	117.5
349	D	34.4	Very low	36.4	Very low	138 Å²	138	154.1 Å²	154.1	74%	0.738	80%	0.799	S	S	*	*				-169.8	128.9	109.1	-107.3	-39.6	0	0	0	113.1
350	K	28.8	Very low	35.4	Very low	177 Å²	177	158.3 Å²	158.3	77%	0.77	80%	0.8	S	S	*	*			trans	-3.9	128.7	159.5	-70.6	161.6	177.6	160.2	0	118.3
351	K	27.8	Very low	34.4	Very low	191 Å²	191	161.7 Å²	161.7	83%	0.83	81%	0.805	S	S	*	*				-173.5	108.2	109.4	-101.3	164.2	-175.1	174	0	111.6	K353	K351-K353 PolarHBondContact O-N 3.28Å
352	E	29.1	Very low	34.2	Very low	198 Å²	198	163 Å²	163	93%	0.925	79%	0.793	S	S	*	*			trans	-62.2	96.5	164.7	-167.9	176	-165.8	0	0	109.1	A354	E352-A354 PolarHBondContact O-N 3.37Å
353	K	28.9	Very low	34.2	Very low	191 Å²	191	160.8 Å²	160.8	83%	0.83	77%	0.773	S	S	*	*			trans	-86.5	102.7	165.8	-80.5	-174.6	179	176.5	0	107.9	K351 K355	K351-K353 PolarHBondContact O-N 3.28Å; K353-K355 PolarHBondContact O-N 3.05Å
354	A	30.1	Very low	34.4	Very low	88 Å²	88	162.7 Å²	162.7	73%	0.727	77%	0.77	S	S	*	*			trans	-47.1	126.4	169.9	0	0	0	0	0	110.8	E352 Q356	E352-A354 PolarHBondContact O-N 3.37Å; A354-Q356 PolarHBondContact O-N 3.32Å
355	K	30.4	Very low	34.9	Very low	217 Å²	217	161.6 Å²	161.6	94%	0.943	76%	0.756	S	S	*	*			trans	-61.4	94.9	174	-68	177.6	177.3	-176.9	0	109.3	K353	K353-K355 PolarHBondContact O-N 3.05Å
356	Q	33.5	Very low	35.5	Very low	178 Å²	178	157.5 Å²	157.5	83%	0.832	74%	0.737	S	S	*	*			trans	-85.9	139.3	161.4	-91.5	-176.3	-15	0	0	109.3	A354 F358	A354-Q356 PolarHBondContact O-N 3.32Å; Q356-F358 PolarHBondContact O-N 3.01Å
357	P	34.4	Very low	36	Very low	124 Å²	124	154.6 Å²	154.6	81%	0.805	72%	0.722	S	S	*	*			trans	-71.6	108.2	-172.7	18.8	-14.5	0	0	0	110.1	H359	P357-H359 VanDerWaalsContact C-N 3.25Å; P357-H359 PolarHBondContact O-N 3.45Å
358	F	41.4	Very low	36.3	Very low	151 Å²	151	152.3 Å²	152.3	66%	0.662	72%	0.715	S	S	*	*			trans	-76.1	74.1	173.6	-172.9	-98.6	0	0	0	109.3	Q356 W362	Q356-F358 PolarHBondContact O-N 3.01Å; F358-W362 HydrophobicContact CE1-CB 3.99Å; F358-W362 HydrophobicContact CE1-CG 4.3Å; F358-W362 HydrophobicContact CE2-CB 4.49Å; F358-W362 HydrophobicContact CZ-CB 3.63Å; F358-W362 HydrophobicContact CZ-CD2 4.33Å; F358-W362 AromaticContact CZ-CG 3.74Å; F358-W362 HydrophobicContact CZ-CG 3.74Å
359	H	35.4	Very low	36.8	Very low	134 Å²	134	149.3 Å²	149.3	62%	0.62	71%	0.705	S	S	*	*			trans	-148.3	88.5	179	-126.7	-84.9	0	0	0	112	P357	P357-H359 VanDerWaalsContact C-N 3.25Å; P357-H359 PolarHBondContact O-N 3.45Å
360	R	42	Very low	36.8	Very low	221 Å²	221	147.3 Å²	147.3	83%	0.834	70%	0.702	S	S	*	*	S	Bend	trans	175.4	-36.2	142.4	-123	175.8	177	-173.4	-2.3	112.3
361	R	33.1	Very low	37	Very low	241 Å²	241	147.8 Å²	147.8	91%	0.909	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-20.5	-160.6	-143.8	171.4	-168.3	155.8	2.1	115.8
362	W	40	Very low	37.3	Very low	142 Å²	142	147.5 Å²	147.5	54%	0.538	71%	0.709	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-31.8	-179.8	-154.5	74.9	0	0	0	112.3	F358 S365 E366	F358-W362 HydrophobicContact CE1-CB 3.99Å; F358-W362 HydrophobicContact CE1-CG 4.3Å; F358-W362 HydrophobicContact CE2-CB 4.49Å; F358-W362 HydrophobicContact CZ-CB 3.63Å; F358-W362 HydrophobicContact CZ-CD2 4.33Å; F358-W362 AromaticContact CZ-CG 3.74Å; F358-W362 HydrophobicContact CZ-CG 3.74Å; W362-S365 PolarHBondContact O-N 3.5Å; W362-S365 PolarHBondContact O-OG 3.35Å; W362-E366 WeakPolarHBondContact CZ3-OE2 3.36Å
363	F	46.2	Very low	37.7	Very low	73 Å²	73	145.3 Å²	145.3	32%	0.32	70%	0.703	S	S	.	*	H	α-helix	trans	-81.3	-18.2	-170.1	-88	-76.7	0	0	0	116.1	S365	F363-S365 PolarHBondContact O-N 3.33Å
364	E	43.9	Very low	37.9	Very low	154 Å²	154	141 Å²	141	72%	0.72	70%	0.697	S	S	*	*	H	α-helix	trans	-66.7	-18.9	169.6	-91.4	167.9	170.2	0	0	112.2
365	S	47.6	Very low	38.3	Very low	70 Å²	70	144.5 Å²	144.5	49%	0.49	70%	0.696	S	S	.	*	H	α-helix	trans	-78.5	-37.1	178.4	81.1	0	0	0	0	113.2	W362 F363 S369	W362-S365 PolarHBondContact O-N 3.5Å; W362-S365 PolarHBondContact O-OG 3.35Å; F363-S365 PolarHBondContact O-N 3.33Å; S365-S369 PolarHBondContact O-N 3.04Å
366	E	48.2	Very low	38.8	Very low	98 Å²	98	140.6 Å²	140.6	46%	0.458	69%	0.69	S	S	.	*	H	α-helix	trans	-74.1	-25.7	179	-119.5	76	-151.8	0	0	113.5	W362 N368 S369	W362-E366 WeakPolarHBondContact CZ3-OE2 3.36Å; E366-N368 VanDerWaalsContact C-N 3.26Å; E366-N368 PolarHBondContact O-N 2.83Å; E366-S369 PolarHBondContact O-OG 3.45Å
367	F	44.8	Very low	39.4	Very low	136 Å²	136	134.8 Å²	134.8	60%	0.596	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-20.6	179.9	-155.5	-95.5	0	0	0	112.5
368	N	34.2	Very low	40.9	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-5.2	177.7	-74.8	-14.1	0	0	0	114	E366 S370	E366-N368 VanDerWaalsContact C-N 3.26Å; E366-N368 PolarHBondContact O-N 2.83Å; N368-S370 VanDerWaalsContact C-N 3.33Å; N368-S370 PolarHBondContact O-N 3.46Å
369	S	38.6	Very low	42.2	Very low	75 Å²	75	131.3 Å²	131.3	52%	0.524	66%	0.656	S	S	.	*			trans	-90.7	69.1	170.8	55.6	0	0	0	0	111	S365 E366	S365-S369 PolarHBondContact O-N 3.04Å; E366-S369 PolarHBondContact O-OG 3.45Å
370	S	34.9	Very low	44.2	Very low	97 Å²	97	131 Å²	131	68%	0.678	66%	0.655	S	S	*	*			trans	-99.7	129.2	157.1	37.5	0	0	0	0	107.2	N368	N368-S370 VanDerWaalsContact C-N 3.33Å; N368-S370 PolarHBondContact O-N 3.46Å
371	E	33	Very low	45.9	Very low	187 Å²	187	128.2 Å²	128.2	87%	0.874	65%	0.646	S	S	*	*			trans	80	111	-163.9	-53.1	178.9	147.9	0	0	110.9
372	E	33.5	Very low	48.2	Very low	184 Å²	184	121.3 Å²	121.3	86%	0.86	63%	0.626	S	S	*	*			cis	-142	140.1	45.6	-63.6	178.3	153.3	0	0	111	S374	E372-S374 VanDerWaalsContact C-N 3.28Å; E372-S374 PolarHBondContact O-N 2.92Å
373	L	36.9	Very low	50.3	Low	152 Å²	152	119.4 Å²	119.4	80%	0.796	63%	0.625	S	S	*	*			trans	-68.7	82.2	174.8	-170.8	71.5	0	0	0	109.4	F375	L373-F375 VanDerWaalsContact C-N 3.29Å; L373-F375 HydrophobicContact CD2-CD2 3.91Å; L373-F375 HydrophobicContact CD2-CE2 3.56Å; L373-F375 HydrophobicContact CG-CD2 3.98Å; L373-F375 HydrophobicContact CG-CE2 4.08Å; L373-F375 PolarHBondContact O-N 3.46Å
374	S	33	Very low	52.1	Low	101 Å²	101	121.7 Å²	121.7	71%	0.706	64%	0.635	S	S	*	*			trans	-71.6	88.6	171.8	60.1	0	0	0	0	109	E372 T376	E372-S374 VanDerWaalsContact C-N 3.28Å; E372-S374 PolarHBondContact O-N 2.92Å; S374-T376 VanDerWaalsContact C-N 3.32Å; S374-T376 PolarHBondContact O-N 3.25Å
375	F	39.9	Very low	54	Low	162 Å²	162	118 Å²	118	71%	0.711	63%	0.625	S	S	*	*			trans	-56.9	98.2	160.3	-96.9	-92.1	0	0	0	107.9	L373 C377	L373-F375 VanDerWaalsContact C-N 3.29Å; L373-F375 HydrophobicContact CD2-CD2 3.91Å; L373-F375 HydrophobicContact CD2-CE2 3.56Å; L373-F375 HydrophobicContact CG-CD2 3.98Å; L373-F375 HydrophobicContact CG-CE2 4.08Å; L373-F375 PolarHBondContact O-N 3.46Å; F375-C377 PolarHBondContact O-N 3.48Å
376	T	39.9	Very low	56	Low	135 Å²	135	117 Å²	117	83%	0.828	62%	0.619	S	S	*	*			trans	-70.2	79.2	162.7	54.1	0	0	0	0	107	S374 S378	S374-T376 VanDerWaalsContact C-N 3.32Å; S374-T376 PolarHBondContact O-N 3.25Å; T376-S378 PolarHBondContact O-N 3.41Å
377	C	46.8	Very low	58.1	Low	55 Å²	55	117.4 Å²	117.4	37%	0.372	62%	0.622	S	S	.	*			trans	-65.4	106.9	179.3	-76.9	0	0	0	0	108.9	F375 N379 I382	F375-C377 PolarHBondContact O-N 3.48Å; C377-N379 PolarHBondContact O-N 3.45Å; C377-I382 HydrophobicContact CB-CD1 4.09Å; C377-I382 HydrophobicContact CB-CG1 3.9Å
378	S	66.1	Low	60.2	Low	76 Å²	76	116.5 Å²	116.5	53%	0.531	62%	0.622	S	S	.	*			trans	-47.2	127.8	160.5	178.6	0	0	0	0	108.5	T376 Q380 Y381	T376-S378 PolarHBondContact O-N 3.41Å; S378-Q380 PolarHBondContact O-N 3.05Å; S378-Y381 PolarHBondContact O-N 3.28Å
379	N	69	Low	62.9	Low	127 Å²	127	112.9 Å²	112.9	68%	0.679	61%	0.607	S	S	*	*	H	α-helix	trans	-44.1	-27.7	-173.8	-81.4	-25	0	0	0	114.1	C377 Y381 I382 I383	C377-N379 PolarHBondContact O-N 3.45Å; N379-Y381 PolarHBondContact O-N 2.88Å; N379-I382 PolarHBondContact O-N 2.97Å; N379-I383 WeakPolarHBondContact O-CG1 3.38Å; N379-I383 PolarHBondContact O-N 3.46Å
380	Q	77.4	Confident	65.5	Low	126 Å²	126	113.7 Å²	113.7	59%	0.589	61%	0.605	S	S	*	*	H	α-helix	trans	-62.3	-39	177.3	-166.2	163	10.5	0	0	113.7	S378 I383 F384	S378-Q380 PolarHBondContact O-N 3.05Å; Q380-I383 PolarHBondContact O-N 3.07Å; Q380-F384 HydrophobicContact CG-CD2 4.03Å; Q380-F384 HydrophobicContact CG-CE2 3.75Å; Q380-F384 WeakPolarHBondContact O-CD2 3.37Å; Q380-F384 PolarHBondContact O-N 3.05Å; Q380-F384 VanDerWaalsContact O-N 3.09Å
381	Y	77.3	Confident	68.3	Low	164 Å²	164	114.1 Å²	114.1	64%	0.643	60%	0.599	S	S	*	*	H	α-helix	trans	-70.6	-35.8	179.1	-81.8	-79.7	0	0	0	112.7	S378 N379 I383 F384 C385	S378-Y381 PolarHBondContact O-N 3.28Å; N379-Y381 PolarHBondContact O-N 2.88Å; Y381-I383 VanDerWaalsContact C-N 3.28Å; Y381-I383 PolarHBondContact O-N 3.24Å; Y381-F384 PolarHBondContact O-N 3.45Å; Y381-C385 PolarHBondContact O-N 2.86Å; Y381-C385 PolarHBondContact O-SG 2.92Å
382	I	82	Confident	71.1	Confident	95 Å²	95	108.4 Å²	108.4	49%	0.487	58%	0.58	S	S	.	*	H	α-helix	trans	-62.4	-42	175.5	-59.4	176.4	0	0	0	109.6	C377 N379 C385 S386	C377-I382 HydrophobicContact CB-CD1 4.09Å; C377-I382 HydrophobicContact CB-CG1 3.9Å; N379-I382 PolarHBondContact O-N 2.97Å; I382-C385 PolarHBondContact O-N 3.43Å; I382-S386 WeakPolarHBondContact O-CB 3.15Å; I382-S386 PolarHBondContact O-N 3.05Å; I382-S386 PolarHBondContact O-OG 3.42Å
383	I	83.1	Confident	74	Confident	103 Å²	103	105.6 Å²	105.6	53%	0.528	57%	0.57	S	S	.	*	H	α-helix	trans	-61.2	-48.7	175.7	-63.2	165.8	0	0	0	109.8	N379 Q380 Y381 C385 S386 M387	N379-I383 WeakPolarHBondContact O-CG1 3.38Å; N379-I383 PolarHBondContact O-N 3.46Å; Q380-I383 PolarHBondContact O-N 3.07Å; Y381-I383 VanDerWaalsContact C-N 3.28Å; Y381-I383 PolarHBondContact O-N 3.24Å; I383-C385 PolarHBondContact O-N 2.87Å; I383-S386 PolarHBondContact O-N 3.46Å; I383-S386 PolarHBondContact O-OG 3.01Å; I383-M387 HydrophobicContact CG2-CG 4.43Å; I383-M387 VanDerWaalsContact O-CG 3.26Å; I383-M387 WeakPolarHBondContact O-CG 3.4Å; I383-M387 PolarHBondContact O-N 3Å
384	F	85	Confident	76.7	Confident	121 Å²	121	103.6 Å²	103.6	53%	0.531	56%	0.559	S	S	.	*	H	α-helix	trans	-61.4	-44.7	178.4	-82.2	-70.2	0	0	0	113.5	Q380 Y381 S386 M387 I388	Q380-F384 HydrophobicContact CG-CD2 4.03Å; Q380-F384 HydrophobicContact CG-CE2 3.75Å; Q380-F384 WeakPolarHBondContact O-CD2 3.37Å; Q380-F384 PolarHBondContact O-N 3.05Å; Q380-F384 VanDerWaalsContact O-N 3.09Å; Y381-F384 PolarHBondContact O-N 3.45Å; F384-S386 VanDerWaalsContact C-N 3.33Å; F384-S386 PolarHBondContact O-N 3.12Å; F384-M387 PolarHBondContact O-N 2.7Å; F384-I388 WeakPolarHBondContact O-CG1 3.36Å; F384-I388 PolarHBondContact O-N 2.83Å
385	C	83.8	Confident	79.6	Confident	76 Å²	76	102.9 Å²	102.9	51%	0.514	55%	0.55	S	S	.	*	H	α-helix	trans	-62.1	-41.4	176.3	-73	0	0	0	0	111.6	Y381 I382 I383 M387 I388 S389	Y381-C385 PolarHBondContact O-N 2.86Å; Y381-C385 PolarHBondContact O-SG 2.92Å; I382-C385 PolarHBondContact O-N 3.43Å; I383-C385 PolarHBondContact O-N 2.87Å; C385-M387 PolarHBondContact O-N 3.45Å; C385-I388 PolarHBondContact O-N 3.01Å; C385-S389 WeakPolarHBondContact O-CB 3.13Å; C385-S389 PolarHBondContact O-N 2.83Å; C385-S389 PolarHBondContact O-OG 2.82Å
386	S	88.8	Confident	82.1	Confident	50 Å²	50	97.5 Å²	97.5	35%	0.35	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-40.1	176.8	72.4	0	0	0	0	112.1	I382 I383 F384 S389 I390	I382-S386 WeakPolarHBondContact O-CB 3.15Å; I382-S386 PolarHBondContact O-N 3.05Å; I382-S386 PolarHBondContact O-OG 3.42Å; I383-S386 PolarHBondContact O-N 3.46Å; I383-S386 PolarHBondContact O-OG 3.01Å; F384-S386 VanDerWaalsContact C-N 3.33Å; F384-S386 PolarHBondContact O-N 3.12Å; S386-S389 WeakPolarHBondContact O-CB 3.46Å; S386-S389 PolarHBondContact O-N 3.38Å; S386-I390 WeakPolarHBondContact O-CD1 3.34Å; S386-I390 VanDerWaalsContact O-CG1 3.23Å; S386-I390 WeakPolarHBondContact O-CG1 3.24Å; S386-I390 PolarHBondContact O-N 2.85Å
387	M	91.5	Very high	84.7	Confident	106 Å²	106	93 Å²	93	52%	0.522	52%	0.516	S	S	.	.	H	α-helix	trans	-64.2	-42.6	177.2	-68.3	-62.3	-72.1	0	0	112.4	I383 F384 C385 I390 L391	I383-M387 HydrophobicContact CG2-CG 4.43Å; I383-M387 VanDerWaalsContact O-CG 3.26Å; I383-M387 WeakPolarHBondContact O-CG 3.4Å; I383-M387 PolarHBondContact O-N 3Å; F384-M387 PolarHBondContact O-N 2.7Å; C385-M387 PolarHBondContact O-N 3.45Å; M387-I390 PolarHBondContact O-N 2.83Å; M387-L391 WeakPolarHBondContact O-CB 3.32Å; M387-L391 PolarHBondContact O-N 2.91Å
388	I	89.9	Confident	86.9	Confident	116 Å²	116	94.2 Å²	94.2	60%	0.595	52%	0.522	S	S	*	.	H	α-helix	trans	-65.6	-40.8	177.1	-65.4	166.4	0	0	0	110.8	F384 C385 I390 L391 S392	F384-I388 WeakPolarHBondContact O-CG1 3.36Å; F384-I388 PolarHBondContact O-N 2.83Å; C385-I388 PolarHBondContact O-N 3.01Å; I388-I390 PolarHBondContact O-N 3.11Å; I388-L391 PolarHBondContact O-N 2.92Å; I388-S392 PolarHBondContact O-N 2.93Å; I388-S392 PolarHBondContact O-OG 3.27Å
389	S	90	Very high	88.1	Confident	62 Å²	62	94.2 Å²	94.2	43%	0.434	52%	0.521	S	S	.	.	H	α-helix	trans	-60.1	-47.6	177.7	-52.1	0	0	0	0	111.1	C385 S386 L391 S392 L393	C385-S389 WeakPolarHBondContact O-CB 3.13Å; C385-S389 PolarHBondContact O-N 2.83Å; C385-S389 PolarHBondContact O-OG 2.82Å; S386-S389 WeakPolarHBondContact O-CB 3.46Å; S386-S389 PolarHBondContact O-N 3.38Å; S389-L391 PolarHBondContact O-N 3.4Å; S389-S392 PolarHBondContact O-N 2.75Å; S389-S392 PolarHBondContact O-OG 3.49Å; S389-L393 WeakPolarHBondContact O-CG 3.38Å; S389-L393 PolarHBondContact O-N 2.81Å; S389-L393 VanDerWaalsContact O-N 3.13Å
390	I	94.5	Very high	89.2	Confident	92 Å²	92	93.5 Å²	93.5	47%	0.472	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-43.9	178.8	-66	162.8	0	0	0	111	S386 M387 I388 S392 L393 L394	S386-I390 WeakPolarHBondContact O-CD1 3.34Å; S386-I390 VanDerWaalsContact O-CG1 3.23Å; S386-I390 WeakPolarHBondContact O-CG1 3.24Å; S386-I390 PolarHBondContact O-N 2.85Å; M387-I390 PolarHBondContact O-N 2.83Å; I388-I390 PolarHBondContact O-N 3.11Å; I390-S392 PolarHBondContact O-N 3.36Å; I390-L393 PolarHBondContact O-N 3.26Å; I390-L394 HydrophobicContact CG2-CD1 4.17Å; I390-L394 WeakPolarHBondContact O-CG 3.37Å; I390-L394 PolarHBondContact O-N 3.46Å
391	L	93.3	Very high	89.8	Confident	107 Å²	107	90.6 Å²	90.6	56%	0.56	51%	0.514	S	S	*	.	H	α-helix	trans	-59.8	-43.7	176.4	-91.3	154.7	0	0	0	112.3	M387 I388 S389 L393 L394 V395	M387-L391 WeakPolarHBondContact O-CB 3.32Å; M387-L391 PolarHBondContact O-N 2.91Å; I388-L391 PolarHBondContact O-N 2.92Å; S389-L391 PolarHBondContact O-N 3.4Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 3.09Å; L391-L394 PolarHBondContact O-N 3.15Å; L391-V395 WeakPolarHBondContact O-CG2 3.44Å; L391-V395 PolarHBondContact O-N 3.26Å
392	S	90.6	Very high	90.4	Very high	67 Å²	67	88 Å²	88	47%	0.469	51%	0.511	S	S	.	.	H	α-helix	trans	-64.1	-37.4	178.5	68.5	0	0	0	0	112.9	I388 S389 I390 V395 A396	I388-S392 PolarHBondContact O-N 2.93Å; I388-S392 PolarHBondContact O-OG 3.27Å; S389-S392 PolarHBondContact O-N 2.75Å; S389-S392 PolarHBondContact O-OG 3.49Å; I390-S392 PolarHBondContact O-N 3.36Å; S392-V395 PolarHBondContact O-N 2.72Å; S392-A396 WeakPolarHBondContact O-CB 3.47Å; S392-A396 PolarHBondContact O-N 3.33Å
393	L	94.4	Very high	90.8	Very high	125 Å²	125	90.4 Å²	90.4	65%	0.654	52%	0.515	S	S	*	.	H	α-helix	trans	-67.6	-38.6	175.4	-71.9	171.7	0	0	0	112.2	S389 I390 L391 A396 G397	S389-L393 WeakPolarHBondContact O-CG 3.38Å; S389-L393 PolarHBondContact O-N 2.81Å; S389-L393 VanDerWaalsContact O-N 3.13Å; I390-L393 PolarHBondContact O-N 3.26Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 3.09Å; L393-A396 PolarHBondContact O-N 3.38Å; L393-G397 PolarHBondContact O-N 3.22Å
394	L	94.3	Very high	91	Very high	109 Å²	109	88.8 Å²	88.8	57%	0.571	51%	0.512	S	S	*	.	H	α-helix	trans	-64.3	-42.2	175.5	-70.2	172.4	0	0	0	111.6	I390 L391 G397 T398	I390-L394 HydrophobicContact CG2-CD1 4.17Å; I390-L394 WeakPolarHBondContact O-CG 3.37Å; I390-L394 PolarHBondContact O-N 3.46Å; L391-L394 PolarHBondContact O-N 3.15Å; L394-G397 PolarHBondContact O-N 3.25Å; L394-T398 WeakPolarHBondContact O-CG2 3.22Å; L394-T398 PolarHBondContact O-N 3.34Å; L394-T398 PolarHBondContact O-OG1 2.88Å
395	V	94.6	Very high	91.1	Very high	86 Å²	86	90.4 Å²	90.4	52%	0.521	52%	0.516	S	S	.	.	H	α-helix	trans	-66.3	-42.7	176.2	175.5	0	0	0	0	111.4	L391 S392 G397 T398 C399	L391-V395 WeakPolarHBondContact O-CG2 3.44Å; L391-V395 PolarHBondContact O-N 3.26Å; S392-V395 PolarHBondContact O-N 2.72Å; V395-G397 VanDerWaalsContact C-N 3.34Å; V395-G397 PolarHBondContact O-N 3.44Å; V395-T398 PolarHBondContact O-N 3.48Å; V395-T398 PolarHBondContact O-OG1 2.8Å; V395-C399 WeakPolarHBondContact O-CB 3.32Å; V395-C399 PolarHBondContact O-N 3.41Å; V395-C399 PolarHBondContact O-SG 3.48Å
396	A	92	Very high	91.1	Very high	50 Å²	50	92.1 Å²	92.1	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-62.7	-41.8	175.8	0	0	0	0	0	111.8	S392 L393 C399 L400	S392-A396 WeakPolarHBondContact O-CB 3.47Å; S392-A396 PolarHBondContact O-N 3.33Å; L393-A396 PolarHBondContact O-N 3.38Å; A396-C399 PolarHBondContact O-N 2.9Å; A396-L400 WeakPolarHBondContact O-CB 3.26Å; A396-L400 WeakPolarHBondContact O-CG 3.5Å; A396-L400 PolarHBondContact O-N 2.94Å
397	G	94	Very high	90.9	Very high	39 Å²	39	97.1 Å²	97.1	40%	0.402	53%	0.529	S	S	.	.	H	α-helix	trans	-62.7	-41.9	176.4	0	0	0	0	0	113	L393 L394 V395 L400 A401	L393-G397 PolarHBondContact O-N 3.22Å; L394-G397 PolarHBondContact O-N 3.25Å; V395-G397 VanDerWaalsContact C-N 3.34Å; V395-G397 PolarHBondContact O-N 3.44Å; G397-L400 PolarHBondContact O-N 3.11Å; G397-A401 WeakPolarHBondContact O-CB 3.43Å; G397-A401 PolarHBondContact O-N 3.39Å
398	T	93	Very high	90.3	Very high	81 Å²	81	99.7 Å²	99.7	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-68.9	-39.9	176.6	61.9	0	0	0	0	111.9	L394 V395 L400 A401 L402	L394-T398 WeakPolarHBondContact O-CG2 3.22Å; L394-T398 PolarHBondContact O-N 3.34Å; L394-T398 PolarHBondContact O-OG1 2.88Å; V395-T398 PolarHBondContact O-N 3.48Å; V395-T398 PolarHBondContact O-OG1 2.8Å; T398-L400 PolarHBondContact O-N 2.93Å; T398-A401 PolarHBondContact O-N 2.8Å; T398-L402 WeakPolarHBondContact O-CB 3.16Å; T398-L402 WeakPolarHBondContact O-CG 3.3Å; T398-L402 PolarHBondContact O-N 2.82Å
399	C	90.7	Very high	89.7	Confident	76 Å²	76	96.8 Å²	96.8	51%	0.514	53%	0.525	S	S	.	.	H	α-helix	trans	-60.9	-42.3	172.9	-78	0	0	0	0	112.4	V395 A396 L402 Y403	V395-C399 WeakPolarHBondContact O-CB 3.32Å; V395-C399 PolarHBondContact O-N 3.41Å; V395-C399 PolarHBondContact O-SG 3.48Å; A396-C399 PolarHBondContact O-N 2.9Å; C399-L402 PolarHBondContact O-N 3.21Å; C399-Y403 WeakPolarHBondContact O-CB 3.37Å; C399-Y403 PolarHBondContact O-N 3.02Å
400	L	92.6	Very high	88.8	Confident	113 Å²	113	97.5 Å²	97.5	59%	0.592	53%	0.529	S	S	*	.	H	α-helix	trans	-66.6	-40.7	176.3	-76	171.1	0	0	0	112.2	A396 G397 T398 Y403 C404	A396-L400 WeakPolarHBondContact O-CB 3.26Å; A396-L400 WeakPolarHBondContact O-CG 3.5Å; A396-L400 PolarHBondContact O-N 2.94Å; G397-L400 PolarHBondContact O-N 3.11Å; T398-L400 PolarHBondContact O-N 2.93Å; L400-Y403 PolarHBondContact O-N 2.89Å; L400-C404 WeakPolarHBondContact O-CB 3.32Å; L400-C404 PolarHBondContact O-N 2.91Å; L400-C404 PolarHBondContact O-SG 3.12Å; L400-C404 VanDerWaalsContact O-SG 3.34Å
401	A	90.6	Very high	87.2	Confident	64 Å²	64	98.3 Å²	98.3	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-43.5	175.4	0	0	0	0	0	111.5	G397 T398 C404 Y405	G397-A401 WeakPolarHBondContact O-CB 3.43Å; G397-A401 PolarHBondContact O-N 3.39Å; T398-A401 PolarHBondContact O-N 2.8Å; A401-C404 PolarHBondContact O-N 3.27Å; A401-Y405 WeakPolarHBondContact O-CB 3.39Å; A401-Y405 PolarHBondContact O-N 3.15Å
402	L	90.4	Very high	85.7	Confident	110 Å²	110	96 Å²	96	58%	0.576	53%	0.53	S	S	*	.	H	α-helix	trans	-64	-43.3	174.5	-72.7	172.3	0	0	0	111.7	T398 C399 C404 Y405 M406	T398-L402 WeakPolarHBondContact O-CB 3.16Å; T398-L402 WeakPolarHBondContact O-CG 3.3Å; T398-L402 PolarHBondContact O-N 2.82Å; C399-L402 PolarHBondContact O-N 3.21Å; L402-C404 PolarHBondContact O-N 2.71Å; L402-Y405 PolarHBondContact O-N 3.15Å; L402-M406 WeakPolarHBondContact O-CB 3.35Å; L402-M406 VanDerWaalsContact O-CG 3.23Å; L402-M406 WeakPolarHBondContact O-CG 3.31Å; L402-M406 PolarHBondContact O-N 3.07Å
403	Y	89.3	Confident	84.1	Confident	146 Å²	146	101.8 Å²	101.8	57%	0.573	54%	0.542	S	S	*	.	H	α-helix	trans	-60.3	-45.7	175.7	179	-97.8	0	0	0	111.7	C399 L400 Y405 M406 R407	C399-Y403 WeakPolarHBondContact O-CB 3.37Å; C399-Y403 PolarHBondContact O-N 3.02Å; L400-Y403 PolarHBondContact O-N 2.89Å; Y403-Y405 VanDerWaalsContact C-N 3.35Å; Y403-Y405 PolarHBondContact O-N 3.43Å; Y403-M406 PolarHBondContact O-N 3.01Å; Y403-R407 VanDerWaalsContact O-CB 3.3Å; Y403-R407 WeakPolarHBondContact O-CB 2.77Å; Y403-R407 PolarHBondContact O-N 3.01Å
404	C	88.2	Confident	82.1	Confident	69 Å²	69	101.8 Å²	101.8	47%	0.466	54%	0.538	S	S	.	.	H	α-helix	trans	-64.2	-38.3	175.8	-75	0	0	0	0	112.4	L400 A401 L402 R407 K408	L400-C404 WeakPolarHBondContact O-CB 3.32Å; L400-C404 PolarHBondContact O-N 2.91Å; L400-C404 PolarHBondContact O-SG 3.12Å; L400-C404 VanDerWaalsContact O-SG 3.34Å; A401-C404 PolarHBondContact O-N 3.27Å; L402-C404 PolarHBondContact O-N 2.71Å; C404-R407 PolarHBondContact O-N 3.06Å; C404-K408 WeakPolarHBondContact O-CG 3.36Å; C404-K408 PolarHBondContact O-N 3.16Å
405	Y	86.4	Confident	80.3	Confident	155 Å²	155	100.4 Å²	100.4	61%	0.608	54%	0.537	S	S	*	.	H	α-helix	trans	-63.2	-49.1	174.4	-177.8	-98.9	0	0	0	111.1	A401 L402 Y403 R407 K408 T409	A401-Y405 WeakPolarHBondContact O-CB 3.39Å; A401-Y405 PolarHBondContact O-N 3.15Å; L402-Y405 PolarHBondContact O-N 3.15Å; Y403-Y405 VanDerWaalsContact C-N 3.35Å; Y403-Y405 PolarHBondContact O-N 3.43Å; Y405-R407 VanDerWaalsContact C-N 3.29Å; Y405-R407 PolarHBondContact O-N 3.11Å; Y405-K408 PolarHBondContact O-N 3.44Å; Y405-T409 HydrophobicContact CD1-CG2 4.31Å; Y405-T409 HydrophobicContact CE1-CG2 3.93Å; Y405-T409 HydrophobicContact CE2-CG2 4.42Å; Y405-T409 WeakPolarHBondContact O-CG2 3.25Å; Y405-T409 PolarHBondContact O-N 3.49Å; Y405-T409 PolarHBondContact O-OG1 3.4Å
406	M	83.3	Confident	78.3	Confident	112 Å²	112	99.2 Å²	99.2	55%	0.552	53%	0.533	S	S	*	.	H	α-helix	trans	-62.4	-36	176.8	-68.7	-62.7	-73.4	0	0	112.3	L402 Y403 T409 C410	L402-M406 WeakPolarHBondContact O-CB 3.35Å; L402-M406 VanDerWaalsContact O-CG 3.23Å; L402-M406 WeakPolarHBondContact O-CG 3.31Å; L402-M406 PolarHBondContact O-N 3.07Å; Y403-M406 PolarHBondContact O-N 3.01Å; M406-T409 WeakPolarHBondContact CA-OG1 3.44Å; M406-T409 PolarHBondContact O-OG1 3.42Å; M406-C410 VanDerWaalsContact O-CB 3.32Å; M406-C410 WeakPolarHBondContact O-CB 3.28Å; M406-C410 PolarHBondContact O-N 3.36Å; M406-C410 PolarHBondContact O-SG 3.36Å; M406-C410 VanDerWaalsContact O-SG 3.33Å
407	R	85	Confident	76.4	Confident	155 Å²	155	101.7 Å²	101.7	59%	0.585	54%	0.539	S	S	*	.	H	α-helix	trans	-67.3	-43.3	175.2	-171.9	176.1	178.4	-173.3	0.2	111.3	Y403 C404 Y405 C410 L411	Y403-R407 VanDerWaalsContact O-CB 3.3Å; Y403-R407 WeakPolarHBondContact O-CB 2.77Å; Y403-R407 PolarHBondContact O-N 3.01Å; C404-R407 PolarHBondContact O-N 3.06Å; Y405-R407 VanDerWaalsContact C-N 3.29Å; Y405-R407 PolarHBondContact O-N 3.11Å; R407-C410 PolarHBondContact O-N 3.47Å; R407-L411 HydrophobicContact CG-CD1 4.17Å; R407-L411 WeakPolarHBondContact O-CB 3.45Å; R407-L411 VanDerWaalsContact O-CG 3.25Å; R407-L411 WeakPolarHBondContact O-CG 3.38Å; R407-L411 PolarHBondContact O-N 3.1Å
408	K	78.4	Confident	74.3	Confident	159 Å²	159	105.9 Å²	105.9	69%	0.691	55%	0.548	S	S	*	.	H	α-helix	trans	-64	-41.9	175.3	-78.4	-174.8	178.4	-176.1	0	112	C404 Y405 L411 A412	C404-K408 WeakPolarHBondContact O-CG 3.36Å; C404-K408 PolarHBondContact O-N 3.16Å; Y405-K408 PolarHBondContact O-N 3.44Å; K408-L411 PolarHBondContact O-N 3.07Å; K408-A412 WeakPolarHBondContact O-CB 3.43Å; K408-A412 PolarHBondContact O-N 3.14Å
409	T	77.7	Confident	72.2	Confident	56 Å²	56	104.6 Å²	104.6	34%	0.344	55%	0.546	S	S	.	.	H	α-helix	trans	-69.5	-36.7	177.5	56.5	0	0	0	0	112.2	Y405 M406 R413	Y405-T409 HydrophobicContact CD1-CG2 4.31Å; Y405-T409 HydrophobicContact CE1-CG2 3.93Å; Y405-T409 HydrophobicContact CE2-CG2 4.42Å; Y405-T409 WeakPolarHBondContact O-CG2 3.25Å; Y405-T409 PolarHBondContact O-N 3.49Å; Y405-T409 PolarHBondContact O-OG1 3.4Å; M406-T409 WeakPolarHBondContact CA-OG1 3.44Å; M406-T409 PolarHBondContact O-OG1 3.42Å; T409-R413 WeakPolarHBondContact O-CB 3Å; T409-R413 PolarHBondContact O-N 3.49Å; T409-R413 VanDerWaalsContact O-N 3.07Å
410	C	71.2	Confident	70.2	Confident	77 Å²	77	104.9 Å²	104.9	52%	0.52	55%	0.545	S	S	.	.	H	α-helix	trans	-64.6	-42.9	171.4	-78	0	0	0	0	112.3	M406 R407 R413 H414	M406-C410 VanDerWaalsContact O-CB 3.32Å; M406-C410 WeakPolarHBondContact O-CB 3.28Å; M406-C410 PolarHBondContact O-N 3.36Å; M406-C410 PolarHBondContact O-SG 3.36Å; M406-C410 VanDerWaalsContact O-SG 3.33Å; R407-C410 PolarHBondContact O-N 3.47Å; C410-R413 PolarHBondContact O-N 3.11Å; C410-R413 VanDerWaalsContact O-N 3.16Å; C410-H414 PolarHBondContact O-N 3.15Å
411	L	61.7	Low	67.8	Low	108 Å²	108	109.3 Å²	109.3	57%	0.565	55%	0.554	S	S	*	*	H	α-helix	trans	-63.9	-41.3	177.6	-74.3	169.6	0	0	0	111.8	R407 K408 R413 H414 S415	R407-L411 HydrophobicContact CG-CD1 4.17Å; R407-L411 WeakPolarHBondContact O-CB 3.45Å; R407-L411 VanDerWaalsContact O-CG 3.25Å; R407-L411 WeakPolarHBondContact O-CG 3.38Å; R407-L411 PolarHBondContact O-N 3.1Å; K408-L411 PolarHBondContact O-N 3.07Å; L411-R413 VanDerWaalsContact C-N 3.26Å; L411-R413 PolarHBondContact O-N 3.32Å; L411-H414 PolarHBondContact O-N 3.45Å; L411-S415 PolarHBondContact O-N 3.16Å; L411-S415 VanDerWaalsContact O-N 3.07Å
412	A	61.9	Low	65.6	Low	60 Å²	60	114.6 Å²	114.6	50%	0.496	56%	0.562	S	S	.	*	H	α-helix	trans	-61.7	-36	174	0	0	0	0	0	111.9	K408 S415 S416	K408-A412 WeakPolarHBondContact O-CB 3.43Å; K408-A412 PolarHBondContact O-N 3.14Å; A412-S415 PolarHBondContact O-OG 2.77Å; A412-S416 PolarHBondContact O-N 2.74Å
413	R	56.9	Low	63.3	Low	187 Å²	187	118.6 Å²	118.6	71%	0.706	57%	0.57	S	S	*	*	H	α-helix	trans	-74	-33.4	177.4	-155.2	162.2	-169.4	163.4	1.9	113	T409 C410 L411 S416 D417	T409-R413 WeakPolarHBondContact O-CB 3Å; T409-R413 PolarHBondContact O-N 3.49Å; T409-R413 VanDerWaalsContact O-N 3.07Å; C410-R413 PolarHBondContact O-N 3.11Å; C410-R413 VanDerWaalsContact O-N 3.16Å; L411-R413 VanDerWaalsContact C-N 3.26Å; L411-R413 PolarHBondContact O-N 3.32Å; R413-S416 PolarHBondContact O-N 3.03Å; R413-S416 PolarHBondContact O-OG 3.35Å; R413-D417 PolarHBondContact O-N 3.31Å
414	H	52.8	Low	61.3	Low	126 Å²	126	119.2 Å²	119.2	58%	0.583	58%	0.577	S	S	*	*	H	α-helix	trans	-68.6	-36.1	174.4	-123.7	-76	0	0	0	112.1	C410 L411 S416 D417 E418	C410-H414 PolarHBondContact O-N 3.15Å; L411-H414 PolarHBondContact O-N 3.45Å; H414-S416 VanDerWaalsContact C-N 3.25Å; H414-S416 PolarHBondContact O-N 3.24Å; H414-D417 PolarHBondContact O-N 2.7Å; H414-E418 PolarHBondContact O-N 2.71Å; H414-E418 VanDerWaalsContact O-N 3.11Å
415	S	55.7	Low	59.2	Low	79 Å²	79	120.8 Å²	120.8	55%	0.552	58%	0.584	S	S	*	*	H	α-helix	trans	-65.7	-26.1	174.3	61.6	0	0	0	0	113.6	L411 A412	L411-S415 PolarHBondContact O-N 3.16Å; L411-S415 VanDerWaalsContact O-N 3.07Å; A412-S415 PolarHBondContact O-OG 2.77Å
416	S	53.1	Low	57.3	Low	62 Å²	62	118.9 Å²	118.9	43%	0.434	59%	0.589	S	S	.	*	H	α-helix	trans	-78.2	-32.7	173	50.8	0	0	0	0	113.3	A412 R413 H414	A412-S416 PolarHBondContact O-N 2.74Å; R413-S416 PolarHBondContact O-N 3.03Å; R413-S416 PolarHBondContact O-OG 3.35Å; H414-S416 VanDerWaalsContact C-N 3.25Å; H414-S416 PolarHBondContact O-N 3.24Å
417	D	51.8	Low	55.5	Low	101 Å²	101	118.5 Å²	118.5	54%	0.54	60%	0.597	S	S	.	*	H	α-helix	trans	-77.8	-31.7	-179.9	-83.7	-14.6	0	0	0	112.9	R413 H414 A419 V420 R421	R413-D417 PolarHBondContact O-N 3.31Å; H414-D417 PolarHBondContact O-N 2.7Å; D417-A419 VanDerWaalsContact C-N 3.35Å; D417-V420 PolarHBondContact O-N 2.88Å; D417-R421 PolarHBondContact O-N 3.11Å; D417-R421 VanDerWaalsContact O-N 3.11Å
418	E	49	Very low	53.6	Low	127 Å²	127	115.8 Å²	115.8	59%	0.593	60%	0.602	S	S	*	*	H	α-helix	trans	-68.9	-33.6	175	-115.1	168	-178.3	0	0	112.5	H414 V420 R421 Y422	H414-E418 PolarHBondContact O-N 2.71Å; H414-E418 VanDerWaalsContact O-N 3.11Å; E418-V420 VanDerWaalsContact C-N 3.31Å; E418-V420 PolarHBondContact O-N 2.94Å; E418-R421 PolarHBondContact O-N 2.92Å; E418-Y422 PolarHBondContact O-N 3.06Å
419	A	49.1	Very low	51.8	Low	54 Å²	54	114.1 Å²	114.1	45%	0.446	61%	0.605	S	S	.	*	H	α-helix	trans	-63.1	-37.7	172.3	0	0	0	0	0	111.5	D417 Y423	D417-A419 VanDerWaalsContact C-N 3.35Å; A419-Y423 WeakPolarHBondContact O-CD2 3.43Å
420	V	49.8	Very low	50	Low	83 Å²	83	119.1 Å²	119.1	50%	0.503	63%	0.629	S	S	.	*	H	α-helix	trans	-74.5	-34.4	179.6	179.8	0	0	0	0	111.9	D417 E418 F424	D417-V420 PolarHBondContact O-N 2.88Å; E418-V420 VanDerWaalsContact C-N 3.31Å; E418-V420 PolarHBondContact O-N 2.94Å; V420-F424 HydrophobicContact CG1-CE2 4.33Å; V420-F424 WeakPolarHBondContact O-CD2 3.43Å
421	R	42.4	Very low	48.5	Very low	205 Å²	205	124.2 Å²	124.2	77%	0.774	65%	0.646	S	S	*	*	H	α-helix	trans	-71	-29.3	178.6	-96.1	-176.1	174.1	171.7	-0.2	114.2	D417 E418 Y423	D417-R421 PolarHBondContact O-N 3.11Å; D417-R421 VanDerWaalsContact O-N 3.11Å; E418-R421 PolarHBondContact O-N 2.92Å; R421-Y423 VanDerWaalsContact C-N 3.35Å
422	Y	42.9	Very low	47.6	Very low	175 Å²	175	127.1 Å²	127.1	69%	0.686	66%	0.661	S	S	*	*	H	α-helix	trans	-73.5	-24	178.9	-110.3	-84.8	0	0	0	113.7	E418	E418-Y422 PolarHBondContact O-N 3.06Å
423	Y	43.4	Very low	46.6	Very low	194 Å²	194	131 Å²	131	76%	0.761	68%	0.679	S	S	*	*	H	α-helix	trans	-77.4	-17.7	178.5	-81.6	-73.7	0	0	0	114.6	A419 R421	A419-Y423 WeakPolarHBondContact O-CD2 3.43Å; R421-Y423 VanDerWaalsContact C-N 3.35Å
424	F	46.8	Very low	45.7	Very low	160 Å²	160	132.3 Å²	132.3	70%	0.702	69%	0.689	S	S	*	*	S	Bend	trans	-102.2	-2.9	-175	-75.8	-72.7	0	0	0	115.6	V420	V420-F424 HydrophobicContact CG1-CE2 4.33Å; V420-F424 WeakPolarHBondContact O-CD2 3.43Å
425	T	44.9	Very low	45	Very low	102 Å²	102	138 Å²	138	63%	0.626	71%	0.706	S	S	*	*	S	Bend	trans	-110.2	-4.6	-174.6	52.3	0	0	0	0	115.2
426	T	45.3	Very low	44.3	Very low	115 Å²	115	139.5 Å²	139.5	71%	0.706	72%	0.722	S	S	*	*	S	Bend	trans	-108.2	10	-177	62.8	0	0	0	0	115.4
427	S	44.8	Very low	43.6	Very low	103 Å²	103	143.8 Å²	143.8	72%	0.72	78%	0.777	S	S	*	*	S	Bend	trans	-119.1	6.2	-175.3	64.8	0	0	0	0	117.1
428	S	45.1	Very low	43.2	Very low	99 Å²	99	146 Å²	146	69%	0.692	79%	0.789	S	S	*	*	S	Bend	trans	-126.3	7.1	-170.9	69.6	0	0	0	0	118.7
429	V	40.6	Very low	42.9	Very low	124 Å²	124	146.9 Å²	146.9	75%	0.752	80%	0.799	S	S	*	*	S	Bend	trans	-115.4	-11.9	-175.2	-172.1	0	0	0	0	115.8
430	D	40.3	Very low	42.5	Very low	161 Å²	161	152.1 Å²	152.1	86%	0.861	82%	0.819	S	S	*	*	S	Bend	trans	-100.3	20.6	-173.4	-92	-6.4	0	0	0	117.2
431	Q	40.1	Very low	42.1	Very low	184 Å²	184	156.2 Å²	156.2	86%	0.86	84%	0.837	S	S	*	*	S	Bend	trans	-133.2	54.6	173.4	-74.1	-146.7	-6.7	0	0	115.1
432	L	42.2	Very low	42.1	Very low	169 Å²	169	153.1 Å²	153.1	89%	0.885	84%	0.841	S	S	*	*	S	Bend	trans	-139	17.9	166.9	-85.9	176.7	0	0	0	116.8
433	T	42.5	Very low	42.1	Very low	142 Å²	142	151.7 Å²	151.7	87%	0.871	85%	0.851	S	S	*	*			trans	-116.2	33.4	175.8	48	0	0	0	0	115.2
434	K	37.4	Very low	42	Very low	213 Å²	213	148.6 Å²	148.6	93%	0.926	86%	0.858	S	S	*	*			trans	-117.6	35.9	167.1	-87.2	-170.6	177.4	-179.8	0	114.5
435	R	37.4	Very low	41.6	Very low	247 Å²	247	147.8 Å²	147.8	93%	0.932	87%	0.87	S	S	*	*	S	Bend	trans	-133.1	80.7	164.9	-100.1	-175.2	176.7	175.7	-0.4	110.4
436	A	40.2	Very low	41.3	Very low	109 Å²	109	151.6 Å²	151.6	90%	0.901	89%	0.89	S	S	*	*			trans	177.4	96.7	152.2	0	0	0	0	0	107.5
437	G	39.6	Very low	40.9	Very low	153 Å²	153	154.9 Å²	154.9	100%	1.577	91%	0.907	S	S	*	*			trans	163.5	0	-177	0	0	0	0	0	108.4

Retrieved 437 of 437 residues in 73.7 ms (Link to these results)

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