A0A077Z631_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z631, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 188 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	39.9	Very low	41.3	Very low	232 Å²	232	153 Å²	153	100%	1.143	80%	0.803	S	S	*	*				0	114	0	-66.8	166.9	63.7	0	0	104.9
2	E	45.6	Very low	41.1	Very low	170 Å²	170	150.4 Å²	150.4	79%	0.794	81%	0.805	S	S	*	*			cis	-145.4	135.6	27.3	-65.5	175	142.8	0	0	107.5
3	L	34.2	Very low	40.8	Very low	172 Å²	172	149.5 Å²	149.5	90%	0.901	79%	0.792	S	S	*	*			trans	-119.6	69.2	177.2	-150.9	107.6	0	0	0	107.2
4	T	43.7	Very low	40.5	Very low	109 Å²	109	145.5 Å²	145.5	67%	0.669	78%	0.782	S	S	*	*			trans	-145.3	91	-178.4	43.3	0	0	0	0	110.4
5	T	43.1	Very low	40.4	Very low	144 Å²	144	145.1 Å²	145.1	88%	0.883	78%	0.778	S	S	*	*			trans	-151.6	91.9	143	-59.2	0	0	0	0	107
6	F	43.7	Very low	40.5	Very low	173 Å²	173	143.1 Å²	143.1	76%	0.759	77%	0.773	S	S	*	*			trans	-78.9	129.8	167	-92.3	-104	0	0	0	108.8
7	I	43.5	Very low	40.2	Very low	123 Å²	123	144.5 Å²	144.5	63%	0.631	78%	0.78	S	S	*	*			trans	52.3	100.6	134	-53.1	-175.7	0	0	0	116.4	P9	I7-P9 VanDerWaalsContact CG2-CD 3.42Å; I7-P9 HydrophobicContact CG2-CG 3.66Å
8	L	38.9	Very low	40.2	Very low	165 Å²	165	139.4 Å²	139.4	86%	0.864	76%	0.761	S	S	*	*			trans	-117.8	99.4	136.5	-135.8	76.9	0	0	0	106	L10	L8-L10 PolarHBondContact O-N 3.33Å
9	P	40.2	Very low	40.2	Very low	95 Å²	95	138.9 Å²	138.9	62%	0.617	76%	0.757	S	S	*	*			trans	-65.7	123.9	170.6	9.8	8.1	0	0	0	104.2	I7 L11	I7-P9 VanDerWaalsContact CG2-CD 3.42Å; I7-P9 HydrophobicContact CG2-CG 3.66Å; P9-L11 VanDerWaalsContact C-N 3.27Å; P9-L11 PolarHBondContact O-N 2.99Å
10	L	41.3	Very low	40.5	Very low	173 Å²	173	140.4 Å²	140.4	91%	0.906	76%	0.764	S	S	*	*			trans	-42.5	95.4	-178.8	-154.6	74.7	0	0	0	108.8	L8 C12	L8-L10 PolarHBondContact O-N 3.33Å; L10-C12 PolarHBondContact O-N 3.47Å
11	L	40.2	Very low	40.8	Very low	127 Å²	127	138 Å²	138	67%	0.665	75%	0.754	S	S	*	*			trans	-54.4	135	-179.3	-166.3	78.8	0	0	0	105.1	P9 H13	P9-L11 VanDerWaalsContact C-N 3.27Å; P9-L11 PolarHBondContact O-N 2.99Å; L11-H13 VanDerWaalsContact C-N 3.25Å; L11-H13 PolarHBondContact O-N 3.2Å; L11-H13 PolarHBondContact O-ND1 3.49Å
12	C	38.9	Very low	41.6	Very low	122 Å²	122	130 Å²	130	82%	0.824	73%	0.726	S	S	*	*			trans	-51.5	87	-177	-144.5	0	0	0	0	110.4	L10 S14	L10-C12 PolarHBondContact O-N 3.47Å; C12-S14 PolarHBondContact O-N 3.04Å
13	H	37.8	Very low	42.4	Very low	139 Å²	139	126.8 Å²	126.8	64%	0.644	72%	0.717	S	S	*	*			trans	-97	37.4	172.5	-67.9	91.1	0	0	0	109.3	L11 L15	L11-H13 VanDerWaalsContact C-N 3.25Å; L11-H13 PolarHBondContact O-N 3.2Å; L11-H13 PolarHBondContact O-ND1 3.49Å; H13-L15 PolarHBondContact O-N 3.49Å
14	S	35.9	Very low	44.4	Very low	93 Å²	93	120.6 Å²	120.6	65%	0.65	69%	0.687	S	S	*	*			trans	-73.5	75.3	149.6	-166	0	0	0	0	106.1	C12 V16	C12-S14 PolarHBondContact O-N 3.04Å; S14-V16 PolarHBondContact O-N 3.24Å
15	L	39.8	Very low	46.3	Very low	139 Å²	139	117.6 Å²	117.6	73%	0.728	67%	0.671	S	S	*	*			trans	-54.9	93.9	149.9	-83.2	151.2	0	0	0	104.1	H13 N17	H13-L15 PolarHBondContact O-N 3.49Å; L15-N17 VanDerWaalsContact C-N 3.31Å; L15-N17 PolarHBondContact O-N 2.78Å
16	V	42	Very low	48.4	Very low	114 Å²	114	114.8 Å²	114.8	69%	0.691	65%	0.648	S	S	*	*			trans	-56.3	107	167	177.6	0	0	0	0	104.2	S14 A18	S14-V16 PolarHBondContact O-N 3.24Å; V16-A18 HydrophobicContact CG1-CB 3.9Å; V16-A18 PolarHBondContact O-N 3.4Å
17	N	35.3	Very low	50.6	Low	166 Å²	166	112.2 Å²	112.2	89%	0.888	64%	0.638	S	S	*	*			trans	-65.2	70.1	161.8	-79	-36.4	0	0	0	106.2	L15 D19	L15-N17 VanDerWaalsContact C-N 3.31Å; L15-N17 PolarHBondContact O-N 2.78Å; N17-D19 PolarHBondContact O-N 3.24Å
18	A	39.4	Very low	52.7	Low	54 Å²	54	109 Å²	109	45%	0.446	62%	0.622	S	S	.	*			trans	-73.2	122.6	172.7	0	0	0	0	0	105.7	V16 V23	V16-A18 HydrophobicContact CG1-CB 3.9Å; V16-A18 PolarHBondContact O-N 3.4Å; A18-V23 HydrophobicContact CB-CG2 4.26Å
19	D	40.9	Very low	55.3	Low	129 Å²	129	103 Å²	103	69%	0.69	59%	0.59	S	S	*	*			trans	-36.7	150.6	165.1	-162.7	-1.5	0	0	0	111.1	N17 T21	N17-D19 PolarHBondContact O-N 3.24Å; D19-T21 PolarHBondContact O-N 2.75Å; D19-T21 VanDerWaalsContact O-O 3.13Å; D19-T21 PolarHBondContact O-OG1 3.42Å
20	N	44.9	Very low	57.7	Low	168 Å²	168	100.7 Å²	100.7	90%	0.898	57%	0.574	S	S	*	*	S	Bend	trans	-61.8	9.9	-173.1	-113.8	43.4	0	0	0	114.6	A22	N20-A22 PolarHBondContact O-N 3.04Å
21	T	48.4	Very low	60.3	Low	90 Å²	90	93.1 Å²	93.1	55%	0.552	54%	0.538	S	S	*	.	S	Bend	trans	-63.3	111.3	160.2	56.6	0	0	0	0	107.7	D19 V23	D19-T21 PolarHBondContact O-N 2.75Å; D19-T21 VanDerWaalsContact O-O 3.13Å; D19-T21 PolarHBondContact O-OG1 3.42Å; T21-V23 VanDerWaalsContact C-N 3.29Å; T21-V23 PolarHBondContact O-N 2.93Å
22	A	55.6	Low	62.9	Low	66 Å²	66	90.7 Å²	90.7	55%	0.545	53%	0.526	S	S	.	.			trans	-58.4	96.2	172.7	0	0	0	0	0	108.3	N20	N20-A22 PolarHBondContact O-N 3.04Å
23	V	63	Low	65.7	Low	101 Å²	101	85.1 Å²	85.1	61%	0.612	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-67.4	128.9	177.2	-179.9	0	0	0	0	106.6	A18 T21 S25	A18-V23 HydrophobicContact CB-CG2 4.26Å; T21-V23 VanDerWaalsContact C-N 3.29Å; T21-V23 PolarHBondContact O-N 2.93Å; V23-S25 PolarHBondContact O-N 3.34Å
24	P	76.1	Confident	68.6	Low	42 Å²	42	82 Å²	82	27%	0.273	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-60.3	136.7	-179.6	25	-34.7	0	0	0	110.1	Q26 T120 L121 F122	P24-Q26 PolarHBondContact O-N 2.89Å; P24-T120 HydrophobicContact CB-CG2 3.73Å; P24-T120 HydrophobicContact CG-CG2 4.18Å; P24-L121 CarbonylContact C-O 3.55Å; P24-L121 WeakPolarHBondContact CA-O 3.35Å; P24-L121 WeakPolarHBondContact CB-O 3.41Å; P24-F122 HydrophobicContact CB-CD1 3.54Å; P24-F122 HydrophobicContact CB-CE1 3.64Å; P24-F122 HydrophobicContact CB-CG 4.24Å; P24-F122 HydrophobicContact CB-CZ 4.4Å; P24-F122 HydrophobicContact CG-CD1 4.08Å; P24-F122 HydrophobicContact CG-CE1 3.8Å
25	S	83.8	Confident	71.6	Confident	47 Å²	47	79.6 Å²	79.6	33%	0.329	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.8	177.7	67.5	0	0	0	0	108.8	V23 L121	V23-S25 PolarHBondContact O-N 3.34Å; S25-L121 PolarHBondContact N-O 2.84Å; S25-L121 PolarHBondContact O-N 3.39Å
26	Q	87.7	Confident	74.3	Confident	85 Å²	85	75 Å²	75	40%	0.397	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.3	178.3	-176.4	174.7	74.2	0	0	111.2	P24 I28 I119 T120 H147	P24-Q26 PolarHBondContact O-N 2.89Å; Q26-I28 HydrophobicContact CG-CG1 4.36Å; Q26-I119 CarbonylContact C-O 3.6Å; Q26-I119 WeakPolarHBondContact CA-O 3.35Å; Q26-T120 PolarHBondContact NE2-OG1 3.25Å; Q26-T120 VanDerWaalsContact NE2-OG1 3.12Å; Q26-H147 VanDerWaalsContact CD-NE2 3.29Å; Q26-H147 PolarHBondContact NE2-CE1 2.86Å; Q26-H147 PolarHBondContact NE2-NE2 2.82Å; Q26-H147 VanDerWaalsContact NE2-NE2 3.14Å; Q26-H147 PolarHBondContact OE1-NE2 3.34Å
27	Q	88.8	Confident	77	Confident	119 Å²	119	73.8 Å²	73.8	56%	0.556	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126	132.1	169.9	-175.7	175.6	18.7	0	0	109	I29 A118 I119	Q27-I29 HydrophobicContact CG-CG1 4.18Å; Q27-A118 CarbonylContact O-C 3.54Å; Q27-A118 WeakPolarHBondContact O-CA 3.2Å; Q27-I119 PolarHBondContact N-O 3.3Å; Q27-I119 PolarHBondContact O-N 2.93Å
28	I	88.8	Confident	80	Confident	56 Å²	56	67.5 Å²	67.5	29%	0.287	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.3	173.3	-56.8	176.4	0	0	0	108.3	Q26 F116 F117 A118 W148 A151	Q26-I28 HydrophobicContact CG-CG1 4.36Å; I28-F116 HydrophobicContact CG2-CB 4.39Å; I28-F116 HydrophobicContact CG2-CD1 4.14Å; I28-F117 WeakPolarHBondContact CA-O 3.48Å; I28-A118 HydrophobicContact CG1-CB 4.13Å; I28-W148 HydrophobicContact CG2-CE3 4.4Å; I28-W148 HydrophobicContact CG2-CZ3 4.06Å; I28-A151 HydrophobicContact CD1-CB 4.31Å; I28-A151 HydrophobicContact CG2-CB 3.76Å
29	I	91.8	Very high	82.8	Confident	39 Å²	39	67 Å²	67	20%	0.2	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.7	179	-58.3	175.3	0	0	0	107.5	Q27 F41 F116 F117 I119	Q27-I29 HydrophobicContact CG-CG1 4.18Å; I29-F41 HydrophobicContact CD1-CD1 3.94Å; I29-F41 HydrophobicContact CD1-CE1 3.69Å; I29-F41 HydrophobicContact CG2-CE1 4.03Å; I29-F41 HydrophobicContact CG2-CZ 4.21Å; I29-F116 CarbonylContact O-C 3.54Å; I29-F116 WeakPolarHBondContact O-CA 3.29Å; I29-F117 HydrophobicContact CB-CB 4.44Å; I29-F117 HydrophobicContact CD1-CD1 4.5Å; I29-F117 PolarHBondContact N-O 3.01Å; I29-F117 PolarHBondContact O-N 3.46Å; I29-I119 HydrophobicContact CD1-CD1 4.13Å
30	T	92.1	Very high	85.6	Confident	45 Å²	45	65.2 Å²	65.2	28%	0.276	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	144.7	168.2	176.9	0	0	0	0	108.9	Y115 D155	T30-Y115 WeakPolarHBondContact CA-O 3.45Å; T30-D155 WeakPolarHBondContact CB-OD1 3.44Å; T30-D155 HydrophobicContact CG2-CB 4.48Å; T30-D155 WeakPolarHBondContact CG2-OD1 3.49Å; T30-D155 VanDerWaalsContact OG1-CG 3.28Å; T30-D155 PolarHBondContact OG1-OD1 2.96Å
31	G	94.2	Very high	88.1	Confident	15 Å²	15	59.2 Å²	59.2	16%	0.155	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	164.3	177.6	0	0	0	0	0	114	R114 Y115	G31-R114 WeakPolarHBondContact O-CA 3.24Å; G31-Y115 PolarHBondContact N-O 3.4Å; G31-Y115 VanDerWaalsContact O-CD1 3.22Å; G31-Y115 WeakPolarHBondContact O-CD1 3.31Å; G31-Y115 WeakPolarHBondContact O-CE1 3.5Å; G31-Y115 PolarHBondContact O-N 3.41Å
32	D	96.1	Very high	90.5	Very high	75 Å²	75	61 Å²	61	40%	0.401	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.2	177.8	-71.8	5.3	0	0	0	108.7	L112 S113 R114	D32-L112 HydrophobicContact CB-CD1 3.91Å; D32-S113 CarbonylContact C-O 3.56Å; D32-S113 WeakPolarHBondContact CA-O 3.19Å; D32-R114 WeakPolarHBondContact OD1-CB 3.43Å; D32-R114 WeakPolarHBondContact OD1-CD 3.39Å; D32-R114 WeakPolarHBondContact OD1-CG 3.39Å; D32-R114 IonicContact OD1-NE 3.1Å; D32-R114 IonicContact OD2-CZ 3.85Å; D32-R114 IonicContact OD2-NE 3.98Å; D32-R114 PolarHBondContact OD2-NE 3.05Å; D32-R114 VanDerWaalsContact OD2-NE 3.1Å; D32-R114 IonicContact OD2-NH2 3.74Å
33	V	97.9	Very high	92.4	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.03	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	126.2	172.4	63.3	0	0	0	0	109.8	N37 A60 I104 S113 Y115	V33-N37 HydrophobicContact CG2-CB 4.49Å; V33-N37 WeakPolarHBondContact CG2-O 3.3Å; V33-A60 HydrophobicContact CG1-CB 4.1Å; V33-I104 HydrophobicContact CG1-CG2 4.39Å; V33-S113 PolarHBondContact N-O 3.39Å; V33-S113 PolarHBondContact O-N 3.18Å; V33-Y115 HydrophobicContact CB-CE1 4.22Å; V33-Y115 HydrophobicContact CG1-CD1 4.2Å; V33-Y115 HydrophobicContact CG1-CE1 4Å
34	V	98.1	Very high	94	Very high	75 Å²	75	56.9 Å²	56.9	46%	0.455	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	156.1	177.6	-62.8	0	0	0	0	111	G36 N37 E111 L112	V34-G36 PolarHBondContact O-N 3.48Å; V34-N37 HydrophobicContact CG2-CB 3.62Å; V34-N37 WeakPolarHBondContact O-CB 3.2Å; V34-N37 PolarHBondContact O-N 2.96Å; V34-N37 VanDerWaalsContact O-N 3.08Å; V34-E111 WeakPolarHBondContact CA-O 3.45Å; V34-L112 HydrophobicContact CG1-CD1 4.04Å
35	A	98.2	Very high	94.8	Very high	41 Å²	41	58.9 Å²	58.9	34%	0.339	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-48.8	129.8	179.1	0	0	0	0	0	112.6	N37 H110 E111	A35-N37 PolarHBondContact O-N 2.92Å; A35-H110 WeakPolarHBondContact CB-O 3.38Å; A35-E111 PolarHBondContact N-O 3.33Å
36	G	97.3	Very high	95.2	Very high	42 Å²	42	60.7 Å²	60.7	43%	0.433	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	5.5	176.9	0	0	0	0	0	115	V34 G106	V34-G36 PolarHBondContact O-N 3.48Å; G36-G106 PolarHBondContact N-O 3.34Å
37	N	98.4	Very high	95.5	Very high	90 Å²	90	57.3 Å²	57.3	48%	0.481	32%	0.319	S	S	.	.			trans	-115.1	172.4	-179.2	-155	0.2	0	0	0	112	V33 V34 A35 Y105 G106	V33-N37 HydrophobicContact CG2-CB 4.49Å; V33-N37 WeakPolarHBondContact CG2-O 3.3Å; V34-N37 HydrophobicContact CG2-CB 3.62Å; V34-N37 WeakPolarHBondContact O-CB 3.2Å; V34-N37 PolarHBondContact O-N 2.96Å; V34-N37 VanDerWaalsContact O-N 3.08Å; A35-N37 PolarHBondContact O-N 2.92Å; N37-Y105 WeakPolarHBondContact O-CA 3.31Å; N37-Y105 VanDerWaalsContact O-CD2 3.29Å; N37-Y105 WeakPolarHBondContact O-CD2 3.38Å; N37-G106 PolarHBondContact O-N 2.83Å
38	Y	98.5	Very high	95.9	Very high	34 Å²	34	51.6 Å²	51.6	13%	0.133	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	145.5	-174.4	-69.6	-96.5	0	0	0	113	Y40 Y63 F73 I104 Y105	Y38-Y40 WeakPolarHBondContact CB-OH 3.34Å; Y38-Y40 HydrophobicContact CD1-CE1 4.2Å; Y38-Y40 HydrophobicContact CG-CE1 4.29Å; Y38-Y40 HydrophobicContact CG-CE2 4.38Å; Y38-Y40 AromaticContact CG-CZ 3.77Å; Y38-Y63 HydrophobicContact CE1-CD2 4.34Å; Y38-F73 WeakPolarHBondContact OH-CD1 3.35Å; Y38-F73 PolarHBondContact OH-N 3.48Å; Y38-I104 CarbonylContact C-O 3.53Å; Y38-I104 VanDerWaalsContact CA-O 3.23Å; Y38-I104 WeakPolarHBondContact CA-O 3.47Å; Y38-Y105 HydrophobicContact CD1-CD2 4.02Å; Y38-Y105 HydrophobicContact CD1-CG 4.36Å; Y38-Y105 AromaticContact CD2-CD2 3.84Å; Y38-Y105 HydrophobicContact CD2-CD2 3.84Å; Y38-Y105 HydrophobicContact CD2-CE2 4.36Å; Y38-Y105 VanDerWaalsContact CE1-CB 3.46Å; Y38-Y105 AromaticContact CE1-CD2 3.56Å; Y38-Y105 HydrophobicContact CE1-CD2 3.56Å; Y38-Y105 AromaticContact CE1-CG 3.77Å; Y38-Y105 HydrophobicContact CE1-CG 3.77Å; Y38-Y105 AromaticContact CE2-CD2 3.35Å; Y38-Y105 HydrophobicContact CE2-CD2 3.35Å; Y38-Y105 AromaticContact CE2-CE2 3.67Å; Y38-Y105 HydrophobicContact CE2-CE2 3.67Å; Y38-Y105 HydrophobicContact CE2-CG 4.34Å; Y38-Y105 HydrophobicContact CG-CD2 4.14Å; Y38-Y105 AromaticContact CZ-CD2 3.18Å; Y38-Y105 AromaticContact CZ-CE2 3.76Å; Y38-Y105 AromaticContact CZ-CG 3.74Å; Y38-Y105 WeakPolarHBondContact OH-CD2 3.49Å
39	T	98.4	Very high	96.2	Very high	43 Å²	43	49 Å²	49	26%	0.264	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.5	162.2	-58.3	0	0	0	0	109	F41 I104	T39-F41 HydrophobicContact CG2-CD2 4.49Å; T39-F41 HydrophobicContact CG2-CE2 3.56Å; T39-F41 HydrophobicContact CG2-CZ 3.65Å; T39-I104 PolarHBondContact N-O 3.25Å; T39-I104 PolarHBondContact O-N 2.83Å
40	Y	98.5	Very high	96.4	Very high	91 Å²	91	47.1 Å²	47.1	36%	0.357	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.6	-174.4	-62.8	-74.2	0	0	0	113.2	Y38 T70 P71 V102	Y38-Y40 WeakPolarHBondContact CB-OH 3.34Å; Y38-Y40 HydrophobicContact CD1-CE1 4.2Å; Y38-Y40 HydrophobicContact CG-CE1 4.29Å; Y38-Y40 HydrophobicContact CG-CE2 4.38Å; Y38-Y40 AromaticContact CG-CZ 3.77Å; Y40-T70 HydrophobicContact CD1-CG2 4.39Å; Y40-T70 HydrophobicContact CD2-CG2 4.27Å; Y40-T70 VanDerWaalsContact CE1-CA 3.46Å; Y40-T70 HydrophobicContact CE1-CG2 4.27Å; Y40-T70 HydrophobicContact CE2-CG2 4.15Å; Y40-T70 HydrophobicContact CG-CG2 4.38Å; Y40-P71 WeakPolarHBondContact CE1-O 3.46Å; Y40-V102 CarbonylContact C-O 3.59Å; Y40-V102 VanDerWaalsContact CA-O 3.24Å; Y40-V102 WeakPolarHBondContact CA-O 3.29Å
41	F	98.3	Very high	96.6	Very high	43 Å²	43	45 Å²	45	19%	0.189	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	155.8	175.7	-56.2	-93.2	0	0	0	111.2	I29 T39 V102 I104 F117	I29-F41 HydrophobicContact CD1-CD1 3.94Å; I29-F41 HydrophobicContact CD1-CE1 3.69Å; I29-F41 HydrophobicContact CG2-CE1 4.03Å; I29-F41 HydrophobicContact CG2-CZ 4.21Å; T39-F41 HydrophobicContact CG2-CD2 4.49Å; T39-F41 HydrophobicContact CG2-CE2 3.56Å; T39-F41 HydrophobicContact CG2-CZ 3.65Å; F41-V102 HydrophobicContact CB-CB 4.21Å; F41-V102 PolarHBondContact N-O 2.93Å; F41-V102 PolarHBondContact O-N 2.79Å; F41-I104 HydrophobicContact CD2-CD1 4.17Å; F41-I104 HydrophobicContact CD2-CG1 4.46Å; F41-I104 HydrophobicContact CE2-CD1 3.6Å; F41-I104 HydrophobicContact CE2-CG1 4.18Å; F41-I104 HydrophobicContact CZ-CD1 4.49Å; F41-F117 HydrophobicContact CB-CE1 4.48Å; F41-F117 HydrophobicContact CD2-CD1 4.18Å; F41-F117 HydrophobicContact CD2-CE1 4Å; F41-F117 HydrophobicContact CE2-CD1 4.16Å; F41-F117 HydrophobicContact CE2-CE1 4.45Å; F41-F117 HydrophobicContact CG-CD1 4.44Å; F41-F117 HydrophobicContact CG-CE1 4.11Å; F41-F117 HydrophobicContact CZ-CD1 4.38Å
42	K	98	Very high	96.5	Very high	126 Å²	126	44.7 Å²	44.7	55%	0.548	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	115.4	175.2	-174.9	-170.6	-177.1	-173.4	0	110.2	S44 P99 L100 Y101	K42-S44 VanDerWaalsContact CE-OG 3.31Å; K42-S44 WeakPolarHBondContact CE-OG 3.29Å; K42-P99 HydrophobicContact CD-CB 4.3Å; K42-P99 VanDerWaalsContact CE-CB 3.43Å; K42-P99 HydrophobicContact CG-CB 3.83Å; K42-L100 CarbonylContact C-O 3.54Å; K42-L100 WeakPolarHBondContact CA-O 3.41Å; K42-Y101 HydrophobicContact CB-CD1 4.42Å; K42-Y101 HydrophobicContact CD-CE1 4.05Å; K42-Y101 HydrophobicContact CG-CD1 4.09Å; K42-Y101 HydrophobicContact CG-CE1 3.96Å
43	I	97.1	Very high	96.4	Very high	13 Å²	13	41.1 Å²	41.1	7%	0.067	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	101	176.8	-52.7	168.3	0	0	0	107.7	L51 P99 L100 V102 I119 L121	I43-L51 HydrophobicContact CD1-CD1 4.13Å; I43-L51 HydrophobicContact CD1-CD2 3.55Å; I43-P99 CarbonylContact O-C 3.09Å; I43-P99 WeakPolarHBondContact O-CA 3.24Å; I43-L100 HydrophobicContact CB-CB 4.17Å; I43-L100 HydrophobicContact CB-CD1 4.43Å; I43-L100 HydrophobicContact CD1-CD1 4.47Å; I43-L100 PolarHBondContact N-O 2.87Å; I43-L100 PolarHBondContact O-N 3.02Å; I43-V102 HydrophobicContact CD1-CG2 4.08Å; I43-I119 HydrophobicContact CD1-CD1 4.01Å; I43-I119 HydrophobicContact CD1-CG1 4.18Å; I43-I119 HydrophobicContact CD1-CG2 3.76Å; I43-I119 HydrophobicContact CG1-CD1 4.25Å; I43-I119 HydrophobicContact CG1-CG2 4.45Å; I43-L121 HydrophobicContact CG2-CD1 4.36Å; I43-L121 HydrophobicContact CG2-CD2 4.13Å
44	S	95.8	Very high	96.1	Very high	68 Å²	68	42.2 Å²	42.2	48%	0.476	24%	0.238	S	C	.	.			trans	-91.3	-17.2	-177.6	-55.3	0	0	0	0	113.2	K42	K42-S44 VanDerWaalsContact CE-OG 3.31Å; K42-S44 WeakPolarHBondContact CE-OG 3.29Å
45	K	93.8	Very high	95.9	Very high	84 Å²	84	39.8 Å²	39.8	37%	0.365	23%	0.225	S	C	.	.			trans	-69.8	132.7	-176.4	-163.9	173	179.7	-161.4	0	110	R98 L121 E123	K45-R98 PolarHBondContact O-NE 3.09Å; K45-L121 HydrophobicContact CB-CD1 3.86Å; K45-L121 HydrophobicContact CD-CD1 3.77Å; K45-L121 HydrophobicContact CG-CD1 4.14Å; K45-E123 WeakPolarHBondContact CE-OE1 3.29Å; K45-E123 WeakPolarHBondContact CE-OE2 3.37Å; K45-E123 IonicContact NZ-OE1 2.58Å; K45-E123 PolarHBondContact NZ-OE1 2.86Å; K45-E123 IonicContact NZ-OE2 3.62Å
46	P	92.2	Very high	95.5	Very high	86 Å²	86	41 Å²	41	56%	0.558	22%	0.221	S	C	*	.			trans	-73.4	174.9	177.9	33.1	-36.7	0	0	0	111.6
47	G	93.3	Very high	95.3	Very high	13 Å²	13	43.2 Å²	43.2	13%	0.134	22%	0.22	C	C	.	.	S	Bend	trans	113.9	175.8	-178.4	0	0	0	0	0	112.2	R98 F122	G47-R98 PolarHBondContact O-NH2 2.65Å; G47-F122 CarbonylContact C-O 3.59Å; G47-F122 WeakPolarHBondContact CA-O 3.28Å
48	A	96.7	Very high	95.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	152.6	168.7	0	0	0	0	0	109	L92 L121 F122 G127 D128 L131	A48-L92 CarbonylContact C-O 3.49Å; A48-L92 WeakPolarHBondContact CA-O 3.43Å; A48-L121 WeakPolarHBondContact O-CA 3.44Å; A48-F122 HydrophobicContact CB-CB 4.21Å; A48-F122 HydrophobicContact CB-CD2 4.45Å; A48-F122 PolarHBondContact N-O 3.31Å; A48-F122 PolarHBondContact O-N 2.83Å; A48-G127 WeakPolarHBondContact CB-O 3.37Å; A48-D128 VanDerWaalsContact CB-OD1 3.31Å; A48-D128 WeakPolarHBondContact CB-OD1 3.36Å; A48-L131 HydrophobicContact CB-CB 3.94Å; A48-L131 HydrophobicContact CB-CD2 3.79Å; A48-L131 HydrophobicContact CB-CG 4.47Å
49	A	96.6	Very high	95	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	137.6	-177.4	0	0	0	0	0	111.5	L92 L100 T120 L121	A49-L92 HydrophobicContact CB-CB 4.33Å; A49-L92 PolarHBondContact N-O 3.3Å; A49-L92 PolarHBondContact O-N 2.95Å; A49-L100 HydrophobicContact CB-CD1 4.3Å; A49-T120 CarbonylContact C-O 3.58Å; A49-T120 VanDerWaalsContact CA-O 3.3Å; A49-T120 WeakPolarHBondContact CA-O 3.33Å; A49-L121 HydrophobicContact CB-CD2 3.59Å
50	A	95.2	Very high	94.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	125.1	162.8	0	0	0	0	0	108.7	T120 F122 L131 W134	A50-T120 PolarHBondContact N-O 3.04Å; A50-T120 PolarHBondContact O-N 3.46Å; A50-F122 HydrophobicContact CB-CE2 4.06Å; A50-L131 HydrophobicContact CB-CD1 3.68Å; A50-W134 HydrophobicContact CB-CD2 4.5Å; A50-W134 HydrophobicContact CB-CE3 3.69Å; A50-W134 HydrophobicContact CB-CH2 3.69Å; A50-W134 HydrophobicContact CB-CZ2 4.47Å; A50-W134 HydrophobicContact CB-CZ3 3.25Å
51	L	95.6	Very high	94.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	115.9	178.3	-58	-170.9	0	0	0	108.1	I43 L62 I64 H89 V90 L92 V102 F117 I119	I43-L51 HydrophobicContact CD1-CD1 4.13Å; I43-L51 HydrophobicContact CD1-CD2 3.55Å; L51-L62 HydrophobicContact CB-CD2 4.06Å; L51-I64 HydrophobicContact CD1-CD1 3.73Å; L51-I64 HydrophobicContact CD1-CG1 4Å; L51-H89 WeakPolarHBondContact O-CA 3.48Å; L51-V90 PolarHBondContact N-O 3.28Å; L51-V90 PolarHBondContact O-N 3.08Å; L51-L92 HydrophobicContact CD1-CD1 3.96Å; L51-L92 HydrophobicContact CG-CD1 4.37Å; L51-V102 HydrophobicContact CD1-CG2 3.97Å; L51-F117 HydrophobicContact CB-CE2 4.02Å; L51-F117 HydrophobicContact CB-CZ 4.45Å; L51-F117 HydrophobicContact CD1-CZ 4.42Å; L51-F117 HydrophobicContact CD2-CE2 4.48Å; L51-F117 HydrophobicContact CD2-CZ 4.22Å; L51-I119 HydrophobicContact CD2-CB 4.21Å; L51-I119 HydrophobicContact CD2-CG1 4.08Å; L51-I119 HydrophobicContact CD2-CG2 3.82Å
52	V	93	Very high	94.9	Very high	10 Å²	10	31.8 Å²	31.8	6%	0.061	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127	-179.5	-169.4	0	0	0	0	109.9	V87 D88 F117 A118 W134 W148	V52-V87 HydrophobicContact CG1-CG1 3.34Å; V52-D88 CarbonylContact C-O 3.57Å; V52-D88 WeakPolarHBondContact CA-O 3.19Å; V52-F117 CarbonylContact O-C 3.59Å; V52-F117 WeakPolarHBondContact O-CA 3.29Å; V52-F117 WeakPolarHBondContact O-CD2 3.5Å; V52-A118 HydrophobicContact CB-CB 4.46Å; V52-A118 PolarHBondContact N-O 3.37Å; V52-A118 PolarHBondContact O-N 3.19Å; V52-W134 HydrophobicContact CG2-CH2 3.61Å; V52-W134 HydrophobicContact CG2-CZ2 4.39Å; V52-W148 HydrophobicContact CB-CH2 4.11Å; V52-W148 HydrophobicContact CB-CZ2 3.97Å; V52-W148 HydrophobicContact CG1-CH2 4.14Å; V52-W148 HydrophobicContact CG1-CZ2 3.59Å
53	L	94	Very high	94.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.2	177.4	177.7	67.8	0	0	0	108.9	A60 L62 D88 I104 Y115 F116 F117	L53-A60 HydrophobicContact CD2-CB 4.14Å; L53-A60 VanDerWaalsContact CD2-O 3.24Å; L53-A60 WeakPolarHBondContact CD2-O 3.43Å; L53-L62 HydrophobicContact CD2-CB 4.06Å; L53-L62 HydrophobicContact CD2-CD1 4.48Å; L53-D88 HydrophobicContact CB-CB 4.02Å; L53-D88 PolarHBondContact N-O 2.99Å; L53-D88 PolarHBondContact O-N 3.24Å; L53-I104 HydrophobicContact CD1-CD1 3.86Å; L53-I104 HydrophobicContact CD1-CG2 4.28Å; L53-I104 HydrophobicContact CD2-CG1 4.44Å; L53-I104 HydrophobicContact CD2-CG2 3.91Å; L53-Y115 HydrophobicContact CD1-CD2 3.43Å; L53-Y115 VanDerWaalsContact CD1-CD2 3.43Å; L53-Y115 HydrophobicContact CD1-CE2 4.24Å; L53-Y115 HydrophobicContact CD1-CG 3.6Å; L53-F116 CarbonylContact C-O 3.54Å; L53-F116 WeakPolarHBondContact CA-O 3.25Å; L53-F117 HydrophobicContact CB-CD2 4.42Å; L53-F117 HydrophobicContact CD1-CB 4.16Å; L53-F117 HydrophobicContact CD1-CD2 4.46Å
54	L	92	Very high	95	Very high	28 Å²	28	25.9 Å²	25.9	15%	0.147	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	109.9	175.1	170.3	63.8	0	0	0	108.9	Y56 V87 Y115 F116 W148 Y152	L54-Y56 PolarHBondContact O-N 3.28Å; L54-V87 HydrophobicContact CD1-CG2 3.89Å; L54-Y115 CarbonylContact O-C 3.54Å; L54-Y115 WeakPolarHBondContact O-CA 3.46Å; L54-Y115 WeakPolarHBondContact O-CB 3.14Å; L54-F116 HydrophobicContact CD2-CD2 4.39Å; L54-F116 PolarHBondContact N-O 3.32Å; L54-F116 PolarHBondContact O-N 2.94Å; L54-W148 HydrophobicContact CB-CZ2 4.49Å; L54-W148 HydrophobicContact CD2-CB 3.95Å; L54-W148 HydrophobicContact CD2-CD2 3.94Å; L54-W148 HydrophobicContact CD2-CG 3.56Å; L54-Y152 HydrophobicContact CD2-CE2 3.96Å; L54-Y152 WeakPolarHBondContact CD2-OH 3.39Å
55	S	92.5	Very high	95.1	Very high	24 Å²	24	22.7 Å²	22.7	17%	0.168	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	108.8	170.4	-59.1	0	0	0	0	109.3	A60 R114	S55-A60 WeakPolarHBondContact OG-CB 3.49Å; S55-A60 PolarHBondContact OG-N 3.31Å; S55-A60 PolarHBondContact OG-O 3Å; S55-R114 CarbonylContact C-O 3.51Å; S55-R114 WeakPolarHBondContact CA-O 3.31Å
56	Y	90.4	Very high	95.3	Very high	65 Å²	65	19.5 Å²	19.5	26%	0.255	11%	0.113	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-13.8	179.5	65.2	-95.9	0	0	0	113.7	L54 R114 Y115 F116 Y152 D155	L54-Y56 PolarHBondContact O-N 3.28Å; Y56-R114 HydrophobicContact CD1-CB 4.26Å; Y56-R114 VanDerWaalsContact CD1-O 3.26Å; Y56-R114 WeakPolarHBondContact CD1-O 3.44Å; Y56-R114 HydrophobicContact CD2-CB 4.02Å; Y56-R114 VanDerWaalsContact CE1-C 3.42Å; Y56-R114 HydrophobicContact CE1-CB 3.73Å; Y56-R114 HydrophobicContact CE2-CB 3.47Å; Y56-R114 VanDerWaalsContact CE2-CB 3.47Å; Y56-R114 HydrophobicContact CE2-CG 4.3Å; Y56-R114 HydrophobicContact CG-CB 4.4Å; Y56-R114 PolarHBondContact N-O 3.13Å; Y56-Y115 VanDerWaalsContact CE1-N 3.25Å; Y56-F116 AromaticContact CD1-CD2 3.54Å; Y56-F116 HydrophobicContact CD1-CD2 3.54Å; Y56-F116 AromaticContact CD1-CE2 3.3Å; Y56-F116 HydrophobicContact CD1-CE2 3.3Å; Y56-F116 HydrophobicContact CD1-CZ 4.21Å; Y56-F116 AromaticContact CE1-CD2 3.81Å; Y56-F116 HydrophobicContact CE1-CD2 3.81Å; Y56-F116 AromaticContact CE1-CE2 3.35Å; Y56-F116 HydrophobicContact CE1-CE2 3.35Å; Y56-F116 AromaticContact CE1-CZ 3.81Å; Y56-F116 HydrophobicContact CE1-CZ 3.81Å; Y56-F116 HydrophobicContact CG-CE2 4.06Å; Y56-Y152 WeakPolarHBondContact CB-OH 3.44Å; Y56-Y152 HydrophobicContact CD1-CE1 4.06Å; Y56-Y152 AromaticContact CD2-CE1 3.96Å; Y56-Y152 HydrophobicContact CD2-CE1 3.96Å; Y56-Y152 AromaticContact CG-CE1 3.62Å; Y56-Y152 HydrophobicContact CG-CE1 3.62Å; Y56-D155 PolarHBondContact OH-OD2 3.05Å
57	E	93	Very high	95.6	Very high	89 Å²	89	20.1 Å²	20.1	42%	0.416	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	143.3	164.3	-174.2	175.8	168.5	0	0	107.7	S113 R114	E57-S113 CarbonylContact O-C 3.47Å; E57-S113 WeakPolarHBondContact O-CA 3.32Å; E57-R114 HydrophobicContact CB-CB 4.05Å; E57-R114 HydrophobicContact CB-CG 4.1Å; E57-R114 PolarHBondContact N-O 3.38Å; E57-R114 PolarHBondContact O-N 2.93Å; E57-R114 IonicContact OE1-NH1 2.66Å; E57-R114 PolarHBondContact OE1-NH1 3.22Å; E57-R114 WeakPolarHBondContact OE2-CD 3.46Å; E57-R114 IonicContact OE2-CZ 3.67Å; E57-R114 IonicContact OE2-NE 3.25Å; E57-R114 IonicContact OE2-NH1 2.63Å; E57-R114 PolarHBondContact OE2-NH1 3.03Å
58	G	94.6	Very high	95.8	Very high	29 Å²	29	21.1 Å²	21.1	30%	0.299	12%	0.119	S	C	.	.	S	Bend	trans	68.7	-148.3	-176.2	0	0	0	0	0	113.2
59	D	95.9	Very high	95.9	Very high	24 Å²	24	24.5 Å²	24.5	13%	0.128	14%	0.141	C	C	.	.			trans	-149.8	109.8	-176.9	-168.7	16.1	0	0	0	107.9	H107 H110 S113	D59-H107 HydrophobicContact CB-CB 3.99Å; D59-H107 VanDerWaalsContact O-CB 3.31Å; D59-H107 WeakPolarHBondContact O-CB 3.11Å; D59-H107 PolarHBondContact O-N 3.1Å; D59-H110 WeakPolarHBondContact CB-ND1 3.43Å; D59-S113 VanDerWaalsContact C-OG 3.22Å; D59-S113 PolarHBondContact N-OG 3.45Å; D59-S113 PolarHBondContact O-OG 2.93Å
60	A	96.7	Very high	95.9	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130	178.7	0	0	0	0	0	109.8	V33 L53 S55 D88 I104 Y105 Y115	V33-A60 HydrophobicContact CG1-CB 4.1Å; L53-A60 HydrophobicContact CD2-CB 4.14Å; L53-A60 VanDerWaalsContact CD2-O 3.24Å; L53-A60 WeakPolarHBondContact CD2-O 3.43Å; S55-A60 WeakPolarHBondContact OG-CB 3.49Å; S55-A60 PolarHBondContact OG-N 3.31Å; S55-A60 PolarHBondContact OG-O 3Å; A60-D88 VanDerWaalsContact O-OD2 3.1Å; A60-I104 HydrophobicContact CB-CG2 3.9Å; A60-Y105 CarbonylContact C-O 3.48Å; A60-Y105 WeakPolarHBondContact CA-O 3.22Å; A60-Y115 HydrophobicContact CB-CD1 4.24Å
61	D	97.8	Very high	96.1	Very high	8 Å²	8	28 Å²	28	4%	0.043	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	149.9	-177.1	-58.6	-53.9	0	0	0	111.4	Y63 A83 I104 Y105 H107	D61-Y63 HydrophobicContact CB-CD2 4.46Å; D61-Y63 HydrophobicContact CB-CE2 3.59Å; D61-A83 HydrophobicContact CB-CB 3.83Å; D61-A83 WeakPolarHBondContact OD1-CA 3.46Å; D61-A83 VanDerWaalsContact OD1-CB 3.29Å; D61-A83 WeakPolarHBondContact OD1-CB 3.2Å; D61-I104 CarbonylContact O-C 3.6Å; D61-I104 VanDerWaalsContact O-CA 3.31Å; D61-I104 WeakPolarHBondContact O-CA 3.27Å; D61-Y105 HydrophobicContact CB-CD1 4.5Å; D61-Y105 PolarHBondContact N-O 2.88Å; D61-Y105 PolarHBondContact O-N 2.98Å; D61-H107 IonicContact OD2-CD2 3.8Å
62	L	98.1	Very high	96.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126	-177.4	-170	67	0	0	0	112.2	L51 L53 I64 Q81 S82 D88 V90 V102 I104 F117	L51-L62 HydrophobicContact CB-CD2 4.06Å; L53-L62 HydrophobicContact CD2-CB 4.06Å; L53-L62 HydrophobicContact CD2-CD1 4.48Å; L62-I64 HydrophobicContact CD2-CD1 4.05Å; L62-I64 HydrophobicContact CG-CD1 4.15Å; L62-I64 HydrophobicContact CG-CG1 4.32Å; L62-Q81 CarbonylContact O-C 3.57Å; L62-Q81 WeakPolarHBondContact O-CA 3.29Å; L62-Q81 WeakPolarHBondContact O-CB 3.15Å; L62-S82 PolarHBondContact N-O 2.95Å; L62-S82 PolarHBondContact O-N 3.4Å; L62-D88 HydrophobicContact CB-CB 4.39Å; L62-V90 HydrophobicContact CD2-CB 4.5Å; L62-V90 HydrophobicContact CD2-CG2 4.07Å; L62-V102 HydrophobicContact CD1-CG1 3.36Å; L62-V102 HydrophobicContact CG-CG1 4.43Å; L62-I104 HydrophobicContact CD1-CG1 3.94Å; L62-F117 HydrophobicContact CD1-CE2 4.04Å; L62-F117 HydrophobicContact CD1-CZ 4.41Å
63	Y	98.6	Very high	96.3	Very high	15 Å²	15	34.8 Å²	34.8	6%	0.059	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.7	175.9	-59.2	-85.2	0	0	0	111	Y38 D61 F73 H78 Q81 V102 G103 Y105	Y38-Y63 HydrophobicContact CE1-CD2 4.34Å; D61-Y63 HydrophobicContact CB-CD2 4.46Å; D61-Y63 HydrophobicContact CB-CE2 3.59Å; Y63-F73 HydrophobicContact CE1-CB 3.95Å; Y63-F73 HydrophobicContact CE2-CB 4.2Å; Y63-F73 WeakPolarHBondContact OH-CB 3.48Å; Y63-H78 AromaticContact CD1-CE1 3.81Å; Y63-H78 AromaticContact CD1-CG 4Å; Y63-H78 AromaticContact CD1-ND1 3.61Å; Y63-Q81 HydrophobicContact CD1-CB 3.77Å; Y63-Q81 HydrophobicContact CE1-CB 4.08Å; Y63-V102 CarbonylContact O-C 3.53Å; Y63-V102 WeakPolarHBondContact O-CA 3.35Å; Y63-G103 PolarHBondContact N-O 2.89Å; Y63-G103 PolarHBondContact O-N 2.91Å; Y63-Y105 HydrophobicContact CE2-CD1 4.36Å; Y63-Y105 HydrophobicContact CE2-CG 4.38Å
64	I	98.6	Very high	96.4	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	135.2	-173.2	-55.2	143.1	0	0	0	111	L51 L62 H78 Q79 F80 V90 L92 L100 Y101 V102	L51-I64 HydrophobicContact CD1-CD1 3.73Å; L51-I64 HydrophobicContact CD1-CG1 4Å; L62-I64 HydrophobicContact CD2-CD1 4.05Å; L62-I64 HydrophobicContact CG-CD1 4.15Å; L62-I64 HydrophobicContact CG-CG1 4.32Å; I64-H78 WeakPolarHBondContact O-CB 3.46Å; I64-Q79 PolarHBondContact O-N 2.89Å; I64-F80 HydrophobicContact CB-CB 4.21Å; I64-F80 HydrophobicContact CB-CD2 4.4Å; I64-F80 HydrophobicContact CD1-CB 4.33Å; I64-F80 HydrophobicContact CG2-CD2 4.23Å; I64-F80 PolarHBondContact N-O 3.34Å; I64-F80 PolarHBondContact O-N 3.38Å; I64-F80 VanDerWaalsContact O-N 3.12Å; I64-V90 HydrophobicContact CD1-CB 3.66Å; I64-V90 HydrophobicContact CD1-CG1 3.64Å; I64-V90 HydrophobicContact CD1-CG2 3.79Å; I64-L92 HydrophobicContact CD1-CD1 4.41Å; I64-L92 HydrophobicContact CG2-CD1 4.14Å; I64-L100 HydrophobicContact CG2-CB 4.33Å; I64-Y101 CarbonylContact C-O 3.55Å; I64-Y101 VanDerWaalsContact CA-O 3.29Å; I64-Y101 WeakPolarHBondContact CA-O 3.17Å; I64-V102 HydrophobicContact CG1-CG1 4.25Å; I64-V102 HydrophobicContact CG1-CG2 4.23Å
65	S	98.5	Very high	96.4	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.007	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.4	177.9	-170.6	0	0	0	0	110.9	T67 T68 D77 Y101	S65-T67 PolarHBondContact OG-N 3.27Å; S65-T67 PolarHBondContact OG-OG1 3.46Å; S65-T68 WeakPolarHBondContact OG-CB 3.05Å; S65-T68 PolarHBondContact OG-N 3.41Å; S65-D77 VanDerWaalsContact CB-O 3.29Å; S65-D77 WeakPolarHBondContact CB-O 3.27Å; S65-D77 PolarHBondContact OG-O 3.43Å; S65-Y101 PolarHBondContact N-O 2.9Å; S65-Y101 WeakPolarHBondContact O-CB 3.49Å; S65-Y101 PolarHBondContact O-N 3.48Å
66	T	97.9	Very high	96.6	Very high	17 Å²	17	48.2 Å²	48.2	10%	0.104	27%	0.267	C	S	.	.	S	Bend	trans	-96.3	-9.5	170.6	70.3	0	0	0	0	112.8	Q79 I96 S97 L100	T66-Q79 PolarHBondContact OG1-NE2 3.42Å; T66-Q79 PolarHBondContact OG1-OE1 3.05Å; T66-I96 HydrophobicContact CG2-CG2 3.5Å; T66-S97 WeakPolarHBondContact CB-OG 3.49Å; T66-S97 VanDerWaalsContact CG2-O 3.27Å; T66-S97 WeakPolarHBondContact CG2-O 3.5Å; T66-S97 WeakPolarHBondContact CG2-OG 3.13Å; T66-S97 PolarHBondContact OG1-OG 2.82Å; T66-S97 VanDerWaalsContact OG1-OG 3.05Å; T66-L100 HydrophobicContact CG2-CD2 4.05Å
67	T	97.6	Very high	96.8	Very high	99 Å²	99	47.4 Å²	47.4	61%	0.607	27%	0.268	S	S	*	.	S	Bend	trans	-118.1	-38.8	-174.6	53	0	0	0	0	113	S65 P69	S65-T67 PolarHBondContact OG-N 3.27Å; S65-T67 PolarHBondContact OG-OG1 3.46Å; T67-P69 WeakPolarHBondContact O-CD 3.42Å
68	T	98.3	Very high	97	Very high	34 Å²	34	44.3 Å²	44.3	21%	0.209	25%	0.253	C	S	.	.			trans	-95	114.9	-173.5	-55.6	0	0	0	0	109.3	S65 T70 P71 D77 Y101	S65-T68 WeakPolarHBondContact OG-CB 3.05Å; S65-T68 PolarHBondContact OG-N 3.41Å; T68-T70 PolarHBondContact O-N 2.75Å; T68-P71 WeakPolarHBondContact O-CD 3.37Å; T68-D77 VanDerWaalsContact CB-O 3.27Å; T68-D77 WeakPolarHBondContact CB-O 3.46Å; T68-D77 HydrophobicContact CG2-CB 4.34Å; T68-D77 PolarHBondContact OG1-O 3.41Å; T68-Y101 WeakPolarHBondContact O-CB 3.46Å
69	P	98.2	Very high	97.1	Very high	72 Å²	72	47.6 Å²	47.6	47%	0.468	26%	0.261	S	S	.	.	S	Bend	trans	-65.2	-21.9	-175.5	-25.8	37.1	0	0	0	115.5	T67 Y101	T67-P69 WeakPolarHBondContact O-CD 3.42Å; P69-Y101 VanDerWaalsContact CA-CD1 3.47Å; P69-Y101 VanDerWaalsContact CA-CG 3.47Å; P69-Y101 HydrophobicContact CB-CD1 3.99Å; P69-Y101 HydrophobicContact CB-CE1 3.83Å; P69-Y101 HydrophobicContact CB-CG 4.41Å; P69-Y101 HydrophobicContact CG-CE1 4.24Å; P69-Y101 HydrophobicContact CG-CE2 4.33Å
70	T	98.3	Very high	97.2	Very high	73 Å²	73	49.1 Å²	49.1	45%	0.448	27%	0.266	S	S	.	.	S	Bend	trans	-130.1	70.2	-178.4	53.5	0	0	0	0	109.2	Y40 T68	Y40-T70 HydrophobicContact CD1-CG2 4.39Å; Y40-T70 HydrophobicContact CD2-CG2 4.27Å; Y40-T70 VanDerWaalsContact CE1-CA 3.46Å; Y40-T70 HydrophobicContact CE1-CG2 4.27Å; Y40-T70 HydrophobicContact CE2-CG2 4.15Å; Y40-T70 HydrophobicContact CG-CG2 4.38Å; T68-T70 PolarHBondContact O-N 2.75Å
71	P	98.2	Very high	97.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.287	C	S	.	.			trans	-64.6	137.1	-178.4	28.7	-34.5	0	0	0	110.5	Y40 T68 D77 H78	Y40-P71 WeakPolarHBondContact CE1-O 3.46Å; T68-P71 WeakPolarHBondContact O-CD 3.37Å; P71-D77 WeakPolarHBondContact CB-O 3.09Å; P71-H78 HydrophobicContact CB-CB 4.12Å
72	T	97.5	Very high	97.1	Very high	32 Å²	32	54.1 Å²	54.1	20%	0.196	29%	0.291	C	S	.	.			trans	-115.6	-178.3	178.7	78.4	0	0	0	0	110.5	S74 D77 H78	T72-S74 PolarHBondContact O-N 3.04Å; T72-S74 VanDerWaalsContact OG1-CB 3.27Å; T72-S74 WeakPolarHBondContact OG1-CB 3.22Å; T72-S74 PolarHBondContact OG1-N 3.49Å; T72-S74 VanDerWaalsContact OG1-N 3.09Å; T72-D77 PolarHBondContact OG1-OD2 3.33Å; T72-H78 PolarHBondContact O-ND1 3.48Å
73	F	95.2	Very high	96.8	Very high	120 Å²	120	56.2 Å²	56.2	53%	0.526	31%	0.308	S	S	.	.	S	Bend	trans	-65.4	-13	172.2	69.4	-109.6	0	0	0	112.9	Y38 Y63 L75 Y105	Y38-F73 WeakPolarHBondContact OH-CD1 3.35Å; Y38-F73 PolarHBondContact OH-N 3.48Å; Y63-F73 HydrophobicContact CE1-CB 3.95Å; Y63-F73 HydrophobicContact CE2-CB 4.2Å; Y63-F73 WeakPolarHBondContact OH-CB 3.48Å; F73-L75 PolarHBondContact O-N 3.34Å; F73-Y105 HydrophobicContact CD1-CE1 4.4Å
74	S	96.1	Very high	96.2	Very high	46 Å²	46	58.6 Å²	58.6	32%	0.322	33%	0.325	S	S	.	.	S	Bend	trans	-60.9	131.6	175.2	-173.4	0	0	0	0	110.4	T72 D76 D77 H78	T72-S74 PolarHBondContact O-N 3.04Å; T72-S74 VanDerWaalsContact OG1-CB 3.27Å; T72-S74 WeakPolarHBondContact OG1-CB 3.22Å; T72-S74 PolarHBondContact OG1-N 3.49Å; T72-S74 VanDerWaalsContact OG1-N 3.09Å; S74-D76 PolarHBondContact O-N 2.93Å; S74-D76 VanDerWaalsContact O-N 3.13Å; S74-D77 WeakPolarHBondContact CB-OD2 3.31Å; S74-D77 PolarHBondContact O-N 3.47Å; S74-H78 PolarHBondContact O-CE1 3.01Å; S74-H78 PolarHBondContact O-ND1 2.89Å
75	L	92.6	Very high	94.9	Very high	138 Å²	138	64.6 Å²	64.6	72%	0.723	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.8	-175	-64.7	175.8	0	0	0	113.7	F73	F73-L75 PolarHBondContact O-N 3.34Å
76	D	95.9	Very high	94	Very high	150 Å²	150	66.2 Å²	66.2	80%	0.802	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.3	179.9	-63.5	-39.8	0	0	0	113	S74	S74-D76 PolarHBondContact O-N 2.93Å; S74-D76 VanDerWaalsContact O-N 3.13Å
77	D	95.5	Very high	93.5	Very high	49 Å²	49	69.1 Å²	69.1	26%	0.262	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-15.1	-173	-71.8	-16.6	0	0	0	113.2	S65 T68 P71 T72 S74	S65-D77 VanDerWaalsContact CB-O 3.29Å; S65-D77 WeakPolarHBondContact CB-O 3.27Å; S65-D77 PolarHBondContact OG-O 3.43Å; T68-D77 VanDerWaalsContact CB-O 3.27Å; T68-D77 WeakPolarHBondContact CB-O 3.46Å; T68-D77 HydrophobicContact CG2-CB 4.34Å; T68-D77 PolarHBondContact OG1-O 3.41Å; P71-D77 WeakPolarHBondContact CB-O 3.09Å; T72-D77 PolarHBondContact OG1-OD2 3.33Å; S74-D77 WeakPolarHBondContact CB-OD2 3.31Å; S74-D77 PolarHBondContact O-N 3.47Å
78	H	96.8	Very high	93.3	Very high	23 Å²	23	64.4 Å²	64.4	11%	0.106	37%	0.371	C	S	.	.			trans	-135.4	158	-176.6	67.8	-95.9	0	0	0	112.2	Y63 I64 P71 T72 S74 Q81	Y63-H78 AromaticContact CD1-CE1 3.81Å; Y63-H78 AromaticContact CD1-CG 4Å; Y63-H78 AromaticContact CD1-ND1 3.61Å; I64-H78 WeakPolarHBondContact O-CB 3.46Å; P71-H78 HydrophobicContact CB-CB 4.12Å; T72-H78 PolarHBondContact O-ND1 3.48Å; S74-H78 PolarHBondContact O-CE1 3.01Å; S74-H78 PolarHBondContact O-ND1 2.89Å; H78-Q81 PolarHBondContact CE1-OE1 3.09Å; H78-Q81 PolarHBondContact NE2-OE1 2.9Å
79	Q	97.1	Very high	93	Very high	99 Å²	99	65 Å²	65	46%	0.463	37%	0.371	S	S	.	.	S	Bend	trans	-110.3	-22.6	176	-68	158.1	-54.8	0	0	111.7	I64 T66	I64-Q79 PolarHBondContact O-N 2.89Å; T66-Q79 PolarHBondContact OG1-NE2 3.42Å; T66-Q79 PolarHBondContact OG1-OE1 3.05Å
80	F	97.8	Very high	92.8	Very high	56 Å²	56	62.1 Å²	62.1	25%	0.246	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	146.4	179	-41.3	-88.7	0	0	0	108.9	I64 V90 L92 I96	I64-F80 HydrophobicContact CB-CB 4.21Å; I64-F80 HydrophobicContact CB-CD2 4.4Å; I64-F80 HydrophobicContact CD1-CB 4.33Å; I64-F80 HydrophobicContact CG2-CD2 4.23Å; I64-F80 PolarHBondContact N-O 3.34Å; I64-F80 PolarHBondContact O-N 3.38Å; I64-F80 VanDerWaalsContact O-N 3.12Å; F80-V90 HydrophobicContact CB-CG1 3.9Å; F80-L92 HydrophobicContact CB-CD2 4.28Å; F80-L92 HydrophobicContact CD1-CD2 3.76Å; F80-L92 HydrophobicContact CD2-CD2 3.57Å; F80-L92 HydrophobicContact CE1-CD2 3.92Å; F80-L92 HydrophobicContact CE2-CD2 3.75Å; F80-L92 HydrophobicContact CG-CD2 3.58Å; F80-L92 HydrophobicContact CZ-CD2 3.93Å; F80-I96 HydrophobicContact CE1-CD1 4.42Å; F80-I96 HydrophobicContact CE2-CG2 4.04Å; F80-I96 HydrophobicContact CZ-CD1 3.75Å; F80-I96 HydrophobicContact CZ-CG1 4.13Å; F80-I96 HydrophobicContact CZ-CG2 4.2Å
81	Q	97	Very high	92.7	Very high	94 Å²	94	62.2 Å²	62.2	44%	0.439	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	156.4	177	58.5	163.4	52.2	0	0	110.9	L62 Y63 H78	L62-Q81 CarbonylContact O-C 3.57Å; L62-Q81 WeakPolarHBondContact O-CA 3.29Å; L62-Q81 WeakPolarHBondContact O-CB 3.15Å; Y63-Q81 HydrophobicContact CD1-CB 3.77Å; Y63-Q81 HydrophobicContact CE1-CB 4.08Å; H78-Q81 PolarHBondContact CE1-OE1 3.09Å; H78-Q81 PolarHBondContact NE2-OE1 2.9Å
82	S	95.9	Very high	92.7	Very high	18 Å²	18	62.2 Å²	62.2	13%	0.126	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	122.3	160.7	-173.1	0	0	0	0	106.9	L62 D88 H89	L62-S82 PolarHBondContact N-O 2.95Å; L62-S82 PolarHBondContact O-N 3.4Å; S82-D88 WeakPolarHBondContact CB-OD1 3.18Å; S82-D88 WeakPolarHBondContact OG-CA 3.47Å; S82-D88 WeakPolarHBondContact OG-CB 3.23Å; S82-D88 PolarHBondContact OG-OD1 2.63Å; S82-H89 PolarHBondContact OG-N 2.8Å
83	A	91.9	Very high	92.6	Very high	44 Å²	44	63.1 Å²	63.1	36%	0.364	35%	0.354	S	S	.	.			trans	-137.6	71.9	-174.9	0	0	0	0	0	108.6	D61 D88	D61-A83 HydrophobicContact CB-CB 3.83Å; D61-A83 WeakPolarHBondContact OD1-CA 3.46Å; D61-A83 VanDerWaalsContact OD1-CB 3.29Å; D61-A83 WeakPolarHBondContact OD1-CB 3.2Å; A83-D88 PolarHBondContact N-OD1 3.5Å
84	T	85.8	Confident	92.7	Very high	65 Å²	65	59.9 Å²	59.9	40%	0.399	35%	0.347	S	S	.	.			trans	-122.7	150.7	-172.5	68.4	0	0	0	0	110.2	G86 D88	T84-G86 PolarHBondContact O-N 3Å; T84-D88 WeakPolarHBondContact CB-OD1 3.38Å; T84-D88 PolarHBondContact N-OD1 3.36Å; T84-D88 PolarHBondContact OG1-OD1 3.32Å
85	C	71.1	Confident	92.6	Very high	126 Å²	126	63.1 Å²	63.1	85%	0.851	37%	0.365	S	S	*	.	S	Bend	trans	-73.1	25.8	178.2	63.3	0	0	0	0	113.9
86	G	78.7	Confident	92.8	Very high	36 Å²	36	58.1 Å²	58.1	37%	0.371	34%	0.338	S	S	.	.	S	Bend	trans	-143.1	-143.4	-172.3	0	0	0	0	0	111.2	T84 D88	T84-G86 PolarHBondContact O-N 3Å; G86-D88 PolarHBondContact O-N 3.08Å
87	V	87.8	Confident	92.8	Very high	77 Å²	77	54.1 Å²	54.1	47%	0.467	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	118.1	173.4	179.6	0	0	0	0	108.3	V52 L54	V52-V87 HydrophobicContact CG1-CG1 3.34Å; L54-V87 HydrophobicContact CD1-CG2 3.89Å
88	D	93.1	Very high	92.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	130.4	174.2	-78.7	-50.6	0	0	0	110.3	V52 L53 A60 L62 S82 A83 T84 G86	V52-D88 CarbonylContact C-O 3.57Å; V52-D88 WeakPolarHBondContact CA-O 3.19Å; L53-D88 HydrophobicContact CB-CB 4.02Å; L53-D88 PolarHBondContact N-O 2.99Å; L53-D88 PolarHBondContact O-N 3.24Å; A60-D88 VanDerWaalsContact O-OD2 3.1Å; L62-D88 HydrophobicContact CB-CB 4.39Å; S82-D88 WeakPolarHBondContact CB-OD1 3.18Å; S82-D88 WeakPolarHBondContact OG-CA 3.47Å; S82-D88 WeakPolarHBondContact OG-CB 3.23Å; S82-D88 PolarHBondContact OG-OD1 2.63Å; A83-D88 PolarHBondContact N-OD1 3.5Å; T84-D88 WeakPolarHBondContact CB-OD1 3.38Å; T84-D88 PolarHBondContact N-OD1 3.36Å; T84-D88 PolarHBondContact OG1-OD1 3.32Å; G86-D88 PolarHBondContact O-N 3.08Å
89	H	92	Very high	92.9	Very high	46 Å²	46	54.7 Å²	54.7	21%	0.213	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	128.5	-172.3	178.9	-144	0	0	0	111	L51 S82 E91 W134	L51-H89 WeakPolarHBondContact O-CA 3.48Å; S82-H89 PolarHBondContact OG-N 2.8Å; H89-E91 WeakPolarHBondContact CE1-CG 3.49Å; H89-E91 IonicContact CE1-OE1 3.05Å; H89-E91 PolarHBondContact CE1-OE1 3.23Å; H89-E91 IonicContact ND1-OE1 3.77Å; H89-E91 WeakPolarHBondContact NE2-CG 3.38Å; H89-E91 IonicContact NE2-OE1 3.91Å; H89-W134 AromaticContact CE1-CZ3 3.92Å; H89-W134 AromaticContact NE2-CZ3 3.43Å; H89-W134 WeakPolarHBondContact NE2-CZ3 3.4Å
90	V	95.6	Very high	93	Very high	13 Å²	13	50 Å²	50	8%	0.079	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.4	174	-177.1	0	0	0	0	110.4	L51 L62 I64 F80 L92	L51-V90 PolarHBondContact N-O 3.28Å; L51-V90 PolarHBondContact O-N 3.08Å; L62-V90 HydrophobicContact CD2-CB 4.5Å; L62-V90 HydrophobicContact CD2-CG2 4.07Å; I64-V90 HydrophobicContact CD1-CB 3.66Å; I64-V90 HydrophobicContact CD1-CG1 3.64Å; I64-V90 HydrophobicContact CD1-CG2 3.79Å; F80-V90 HydrophobicContact CB-CG1 3.9Å; V90-L92 HydrophobicContact CG1-CD2 3.9Å; V90-L92 HydrophobicContact CG1-CG 4.01Å
91	E	95.3	Very high	93	Very high	75 Å²	75	49.5 Å²	49.5	35%	0.35	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127.8	174.4	-63.9	170.5	-145.8	0	0	109.7	H89 L131 A135	H89-E91 WeakPolarHBondContact CE1-CG 3.49Å; H89-E91 IonicContact CE1-OE1 3.05Å; H89-E91 PolarHBondContact CE1-OE1 3.23Å; H89-E91 IonicContact ND1-OE1 3.77Å; H89-E91 WeakPolarHBondContact NE2-CG 3.38Å; H89-E91 IonicContact NE2-OE1 3.91Å; E91-L131 HydrophobicContact CB-CD1 4.31Å; E91-L131 HydrophobicContact CB-CD2 4.2Å; E91-L131 HydrophobicContact CB-CG 4.48Å; E91-L131 HydrophobicContact CG-CD1 4.2Å; E91-A135 VanDerWaalsContact CD-CB 3.41Å; E91-A135 HydrophobicContact CG-CB 4.41Å; E91-A135 WeakPolarHBondContact OE1-CB 3.5Å
92	L	97.5	Very high	93.1	Very high	0 Å²	0	45 Å²	45	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	110.4	-175.4	-62.6	168.1	0	0	0	109.1	A48 A49 L51 I64 F80 V90 I96 L100	A48-L92 CarbonylContact C-O 3.49Å; A48-L92 WeakPolarHBondContact CA-O 3.43Å; A49-L92 HydrophobicContact CB-CB 4.33Å; A49-L92 PolarHBondContact N-O 3.3Å; A49-L92 PolarHBondContact O-N 2.95Å; L51-L92 HydrophobicContact CD1-CD1 3.96Å; L51-L92 HydrophobicContact CG-CD1 4.37Å; I64-L92 HydrophobicContact CD1-CD1 4.41Å; I64-L92 HydrophobicContact CG2-CD1 4.14Å; F80-L92 HydrophobicContact CB-CD2 4.28Å; F80-L92 HydrophobicContact CD1-CD2 3.76Å; F80-L92 HydrophobicContact CD2-CD2 3.57Å; F80-L92 HydrophobicContact CE1-CD2 3.92Å; F80-L92 HydrophobicContact CE2-CD2 3.75Å; F80-L92 HydrophobicContact CG-CD2 3.58Å; F80-L92 HydrophobicContact CZ-CD2 3.93Å; V90-L92 HydrophobicContact CG1-CD2 3.9Å; V90-L92 HydrophobicContact CG1-CG 4.01Å; L92-I96 HydrophobicContact CB-CG1 4.42Å; L92-I96 HydrophobicContact CD2-CG1 4.48Å; L92-L100 HydrophobicContact CD1-CD1 3.45Å; L92-L100 VanDerWaalsContact CD1-CD1 3.45Å; L92-L100 HydrophobicContact CD1-CD2 4.04Å; L92-L100 HydrophobicContact CD1-CG 4.31Å
93	P	96.7	Very high	93.2	Very high	50 Å²	50	44.1 Å²	44.1	33%	0.325	27%	0.271	S	S	.	.			trans	-63.9	161.3	178.5	24.8	-31.7	0	0	0	111.6	T95 I96 D128	P93-T95 PolarHBondContact O-N 3.38Å; P93-T95 VanDerWaalsContact O-N 3.09Å; P93-I96 HydrophobicContact CG-CD1 4.2Å; P93-I96 HydrophobicContact CG-CG1 3.91Å; P93-I96 WeakPolarHBondContact O-CB 3.42Å; P93-I96 WeakPolarHBondContact O-CG1 3.1Å; P93-I96 PolarHBondContact O-N 3.45Å; P93-D128 WeakPolarHBondContact CA-OD1 3.15Å; P93-D128 WeakPolarHBondContact CB-OD1 3.45Å
94	S	95.8	Very high	93.5	Very high	53 Å²	53	42 Å²	42	37%	0.371	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-24.1	179.8	73.3	0	0	0	0	113.2	I96 D128	S94-I96 PolarHBondContact O-N 3.35Å; S94-D128 WeakPolarHBondContact CB-OD1 3.45Å; S94-D128 WeakPolarHBondContact CB-OD2 3.48Å; S94-D128 PolarHBondContact N-OD1 2.97Å; S94-D128 PolarHBondContact OG-OD1 3.2Å; S94-D128 PolarHBondContact OG-OD2 2.86Å
95	T	95.6	Very high	94.1	Very high	114 Å²	114	40 Å²	40	70%	0.699	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.3	177	56.9	0	0	0	0	113.7	P93 S97	P93-T95 PolarHBondContact O-N 3.38Å; P93-T95 VanDerWaalsContact O-N 3.09Å; T95-S97 PolarHBondContact O-N 2.93Å
96	I	97	Very high	95.4	Very high	33 Å²	33	34 Å²	34	17%	0.169	20%	0.198	C	C	.	.	S	Bend	trans	-70.3	125.6	177.7	-57.9	-49.4	0	0	0	110	T66 F80 L92 P93 S94 R98 L100	T66-I96 HydrophobicContact CG2-CG2 3.5Å; F80-I96 HydrophobicContact CE1-CD1 4.42Å; F80-I96 HydrophobicContact CE2-CG2 4.04Å; F80-I96 HydrophobicContact CZ-CD1 3.75Å; F80-I96 HydrophobicContact CZ-CG1 4.13Å; F80-I96 HydrophobicContact CZ-CG2 4.2Å; L92-I96 HydrophobicContact CB-CG1 4.42Å; L92-I96 HydrophobicContact CD2-CG1 4.48Å; P93-I96 HydrophobicContact CG-CD1 4.2Å; P93-I96 HydrophobicContact CG-CG1 3.91Å; P93-I96 WeakPolarHBondContact O-CB 3.42Å; P93-I96 WeakPolarHBondContact O-CG1 3.1Å; P93-I96 PolarHBondContact O-N 3.45Å; S94-I96 PolarHBondContact O-N 3.35Å; I96-R98 PolarHBondContact O-NH1 3.04Å; I96-L100 HydrophobicContact CG2-CD2 3.74Å
97	S	96	Very high	96.3	Very high	66 Å²	66	35.7 Å²	35.7	46%	0.462	20%	0.196	S	C	.	.			trans	-56.4	147.3	-179.5	55.6	0	0	0	0	112.5	T66 T95	T66-S97 WeakPolarHBondContact CB-OG 3.49Å; T66-S97 VanDerWaalsContact CG2-O 3.27Å; T66-S97 WeakPolarHBondContact CG2-O 3.5Å; T66-S97 WeakPolarHBondContact CG2-OG 3.13Å; T66-S97 PolarHBondContact OG1-OG 2.82Å; T66-S97 VanDerWaalsContact OG1-OG 3.05Å; T95-S97 PolarHBondContact O-N 2.93Å
98	R	95.9	Very high	96.6	Very high	55 Å²	55	35.7 Å²	35.7	21%	0.208	20%	0.198	C	C	.	.	S	Bend	trans	-107.2	153.9	173.9	-66.7	-55.1	-167.9	-95.6	10.3	111.3	K45 G47 I96	K45-R98 PolarHBondContact O-NE 3.09Å; G47-R98 PolarHBondContact O-NH2 2.65Å; I96-R98 PolarHBondContact O-NH1 3.04Å
99	P	97.7	Very high	96.8	Very high	29 Å²	29	39.3 Å²	39.3	19%	0.188	22%	0.223	C	C	.	.	P	Polyproline II helix	cis	-74.1	155.3	-0.3	33	-37.3	0	0	0	113.1	K42 I43 Y101	K42-P99 HydrophobicContact CD-CB 4.3Å; K42-P99 VanDerWaalsContact CE-CB 3.43Å; K42-P99 HydrophobicContact CG-CB 3.83Å; I43-P99 CarbonylContact O-C 3.09Å; I43-P99 WeakPolarHBondContact O-CA 3.24Å; P99-Y101 HydrophobicContact CG-CD2 4.37Å; P99-Y101 HydrophobicContact CG-CE1 4.08Å; P99-Y101 HydrophobicContact CG-CE2 3.61Å; P99-Y101 VanDerWaalsContact CG-CZ 3.45Å; P99-Y101 WeakPolarHBondContact CG-OH 3.45Å
100	L	98.3	Very high	96.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.1	162	-51.7	171.3	0	0	0	107.8	K42 I43 A49 I64 T66 L92 I96	K42-L100 CarbonylContact C-O 3.54Å; K42-L100 WeakPolarHBondContact CA-O 3.41Å; I43-L100 HydrophobicContact CB-CB 4.17Å; I43-L100 HydrophobicContact CB-CD1 4.43Å; I43-L100 HydrophobicContact CD1-CD1 4.47Å; I43-L100 PolarHBondContact N-O 2.87Å; I43-L100 PolarHBondContact O-N 3.02Å; A49-L100 HydrophobicContact CB-CD1 4.3Å; I64-L100 HydrophobicContact CG2-CB 4.33Å; T66-L100 HydrophobicContact CG2-CD2 4.05Å; L92-L100 HydrophobicContact CD1-CD1 3.45Å; L92-L100 VanDerWaalsContact CD1-CD1 3.45Å; L92-L100 HydrophobicContact CD1-CD2 4.04Å; L92-L100 HydrophobicContact CD1-CG 4.31Å; I96-L100 HydrophobicContact CG2-CD2 3.74Å
101	Y	98.7	Very high	97	Very high	45 Å²	45	48.5 Å²	48.5	18%	0.176	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	128.6	168.1	-60.1	-74.9	0	0	0	108.2	K42 I64 S65 T68 P69 P99	K42-Y101 HydrophobicContact CB-CD1 4.42Å; K42-Y101 HydrophobicContact CD-CE1 4.05Å; K42-Y101 HydrophobicContact CG-CD1 4.09Å; K42-Y101 HydrophobicContact CG-CE1 3.96Å; I64-Y101 CarbonylContact C-O 3.55Å; I64-Y101 VanDerWaalsContact CA-O 3.29Å; I64-Y101 WeakPolarHBondContact CA-O 3.17Å; S65-Y101 PolarHBondContact N-O 2.9Å; S65-Y101 WeakPolarHBondContact O-CB 3.49Å; S65-Y101 PolarHBondContact O-N 3.48Å; T68-Y101 WeakPolarHBondContact O-CB 3.46Å; P69-Y101 VanDerWaalsContact CA-CD1 3.47Å; P69-Y101 VanDerWaalsContact CA-CG 3.47Å; P69-Y101 HydrophobicContact CB-CD1 3.99Å; P69-Y101 HydrophobicContact CB-CE1 3.83Å; P69-Y101 HydrophobicContact CB-CG 4.41Å; P69-Y101 HydrophobicContact CG-CE1 4.24Å; P69-Y101 HydrophobicContact CG-CE2 4.33Å; P99-Y101 HydrophobicContact CG-CD2 4.37Å; P99-Y101 HydrophobicContact CG-CE1 4.08Å; P99-Y101 HydrophobicContact CG-CE2 3.61Å; P99-Y101 VanDerWaalsContact CG-CZ 3.45Å; P99-Y101 WeakPolarHBondContact CG-OH 3.45Å
102	V	98.7	Very high	97.1	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131	-175.6	-174.7	0	0	0	0	108	Y40 F41 I43 L51 L62 Y63 I64 I104 F117	Y40-V102 CarbonylContact C-O 3.59Å; Y40-V102 VanDerWaalsContact CA-O 3.24Å; Y40-V102 WeakPolarHBondContact CA-O 3.29Å; F41-V102 HydrophobicContact CB-CB 4.21Å; F41-V102 PolarHBondContact N-O 2.93Å; F41-V102 PolarHBondContact O-N 2.79Å; I43-V102 HydrophobicContact CD1-CG2 4.08Å; L51-V102 HydrophobicContact CD1-CG2 3.97Å; L62-V102 HydrophobicContact CD1-CG1 3.36Å; L62-V102 HydrophobicContact CG-CG1 4.43Å; Y63-V102 CarbonylContact O-C 3.53Å; Y63-V102 WeakPolarHBondContact O-CA 3.35Å; I64-V102 HydrophobicContact CG1-CG1 4.25Å; I64-V102 HydrophobicContact CG1-CG2 4.23Å; V102-I104 HydrophobicContact CG1-CG1 4.48Å; V102-F117 HydrophobicContact CG1-CE1 4.38Å; V102-F117 HydrophobicContact CG1-CZ 3.95Å
103	G	98.6	Very high	97	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.2	169.2	0	0	0	0	0	109.2	Y63	Y63-G103 PolarHBondContact N-O 2.89Å; Y63-G103 PolarHBondContact O-N 2.91Å
104	I	98.6	Very high	97	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	120.1	170.2	-61.3	-179.1	0	0	0	107.1	V33 Y38 T39 F41 L53 A60 D61 L62 V102 Y115 F117	V33-I104 HydrophobicContact CG1-CG2 4.39Å; Y38-I104 CarbonylContact C-O 3.53Å; Y38-I104 VanDerWaalsContact CA-O 3.23Å; Y38-I104 WeakPolarHBondContact CA-O 3.47Å; T39-I104 PolarHBondContact N-O 3.25Å; T39-I104 PolarHBondContact O-N 2.83Å; F41-I104 HydrophobicContact CD2-CD1 4.17Å; F41-I104 HydrophobicContact CD2-CG1 4.46Å; F41-I104 HydrophobicContact CE2-CD1 3.6Å; F41-I104 HydrophobicContact CE2-CG1 4.18Å; F41-I104 HydrophobicContact CZ-CD1 4.49Å; L53-I104 HydrophobicContact CD1-CD1 3.86Å; L53-I104 HydrophobicContact CD1-CG2 4.28Å; L53-I104 HydrophobicContact CD2-CG1 4.44Å; L53-I104 HydrophobicContact CD2-CG2 3.91Å; A60-I104 HydrophobicContact CB-CG2 3.9Å; D61-I104 CarbonylContact O-C 3.6Å; D61-I104 VanDerWaalsContact O-CA 3.31Å; D61-I104 WeakPolarHBondContact O-CA 3.27Å; L62-I104 HydrophobicContact CD1-CG1 3.94Å; V102-I104 HydrophobicContact CG1-CG1 4.48Å; I104-Y115 HydrophobicContact CD1-CD2 4.11Å; I104-Y115 HydrophobicContact CD1-CE2 3.52Å; I104-Y115 HydrophobicContact CG2-CD1 4.07Å; I104-Y115 HydrophobicContact CG2-CE1 3.79Å; I104-Y115 HydrophobicContact CG2-CE2 4.49Å; I104-F117 HydrophobicContact CD1-CB 4.05Å; I104-F117 HydrophobicContact CD1-CD1 3.91Å; I104-F117 HydrophobicContact CD1-CD2 4.26Å; I104-F117 HydrophobicContact CD1-CE1 4.42Å; I104-F117 HydrophobicContact CD1-CG 3.82Å
105	Y	98.3	Very high	96.8	Very high	21 Å²	21	45.8 Å²	45.8	8%	0.082	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.2	-173.3	177.9	-123.3	0	0	0	111.4	N37 Y38 A60 D61 Y63 F73 H107 P108	N37-Y105 WeakPolarHBondContact O-CA 3.31Å; N37-Y105 VanDerWaalsContact O-CD2 3.29Å; N37-Y105 WeakPolarHBondContact O-CD2 3.38Å; Y38-Y105 HydrophobicContact CD1-CD2 4.02Å; Y38-Y105 HydrophobicContact CD1-CG 4.36Å; Y38-Y105 AromaticContact CD2-CD2 3.84Å; Y38-Y105 HydrophobicContact CD2-CD2 3.84Å; Y38-Y105 HydrophobicContact CD2-CE2 4.36Å; Y38-Y105 VanDerWaalsContact CE1-CB 3.46Å; Y38-Y105 AromaticContact CE1-CD2 3.56Å; Y38-Y105 HydrophobicContact CE1-CD2 3.56Å; Y38-Y105 AromaticContact CE1-CG 3.77Å; Y38-Y105 HydrophobicContact CE1-CG 3.77Å; Y38-Y105 AromaticContact CE2-CD2 3.35Å; Y38-Y105 HydrophobicContact CE2-CD2 3.35Å; Y38-Y105 AromaticContact CE2-CE2 3.67Å; Y38-Y105 HydrophobicContact CE2-CE2 3.67Å; Y38-Y105 HydrophobicContact CE2-CG 4.34Å; Y38-Y105 HydrophobicContact CG-CD2 4.14Å; Y38-Y105 AromaticContact CZ-CD2 3.18Å; Y38-Y105 AromaticContact CZ-CE2 3.76Å; Y38-Y105 AromaticContact CZ-CG 3.74Å; Y38-Y105 WeakPolarHBondContact OH-CD2 3.49Å; A60-Y105 CarbonylContact C-O 3.48Å; A60-Y105 WeakPolarHBondContact CA-O 3.22Å; D61-Y105 HydrophobicContact CB-CD1 4.5Å; D61-Y105 PolarHBondContact N-O 2.88Å; D61-Y105 PolarHBondContact O-N 2.98Å; Y63-Y105 HydrophobicContact CE2-CD1 4.36Å; Y63-Y105 HydrophobicContact CE2-CG 4.38Å; F73-Y105 HydrophobicContact CD1-CE1 4.4Å; Y105-H107 PolarHBondContact O-N 2.85Å; Y105-P108 HydrophobicContact CE1-CG 4.5Å; Y105-P108 WeakPolarHBondContact OH-CD 3Å; Y105-P108 WeakPolarHBondContact OH-CG 3.26Å
106	G	98.1	Very high	96.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	114.3	169.8	0	0	0	0	0	111.2	G36 N37	G36-G106 PolarHBondContact N-O 3.34Å; N37-G106 PolarHBondContact O-N 2.83Å
107	H	96.2	Very high	96.5	Very high	72 Å²	72	38.9 Å²	38.9	33%	0.333	20%	0.199	S	C	.	.			trans	-63	133.2	-178.8	-170.2	-89.9	0	0	0	111.2	D59 D61 Y105 S109 H110	D59-H107 HydrophobicContact CB-CB 3.99Å; D59-H107 VanDerWaalsContact O-CB 3.31Å; D59-H107 WeakPolarHBondContact O-CB 3.11Å; D59-H107 PolarHBondContact O-N 3.1Å; D61-H107 IonicContact OD2-CD2 3.8Å; Y105-H107 PolarHBondContact O-N 2.85Å; H107-S109 PolarHBondContact ND1-N 3.23Å; H107-S109 PolarHBondContact ND1-OG 3.45Å; H107-S109 PolarHBondContact O-N 3.02Å; H107-H110 PolarHBondContact O-N 2.95Å
108	P	96.1	Very high	96.4	Very high	77 Å²	77	35.8 Å²	35.8	50%	0.5	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.1	-172	-28.1	36.7	0	0	0	116.4	Y105 H110	Y105-P108 HydrophobicContact CE1-CG 4.5Å; Y105-P108 WeakPolarHBondContact OH-CD 3Å; Y105-P108 WeakPolarHBondContact OH-CG 3.26Å; P108-H110 PolarHBondContact O-N 3.44Å
109	S	95.6	Very high	96.3	Very high	76 Å²	76	33.7 Å²	33.7	53%	0.531	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-11.6	177.2	63.7	0	0	0	0	113.6	H107	H107-S109 PolarHBondContact ND1-N 3.23Å; H107-S109 PolarHBondContact ND1-OG 3.45Å; H107-S109 PolarHBondContact O-N 3.02Å
110	H	95.3	Very high	96.1	Very high	74 Å²	74	32.4 Å²	32.4	34%	0.343	16%	0.162	S	C	.	.	S	Bend	trans	-124.2	124.3	179	-59.6	101.2	0	0	0	108.7	A35 D59 H107 P108 L112	A35-H110 WeakPolarHBondContact CB-O 3.38Å; D59-H110 WeakPolarHBondContact CB-ND1 3.43Å; H107-H110 PolarHBondContact O-N 2.95Å; P108-H110 PolarHBondContact O-N 3.44Å; H110-L112 PolarHBondContact O-N 3.16Å
111	E	97.2	Very high	95.9	Very high	179 Å²	179	33 Å²	33	84%	0.836	17%	0.165	S	C	*	.	S	Bend	trans	-60.1	-33.5	-177.8	-68	-174.5	172.8	0	0	112.2	V34 A35	V34-E111 WeakPolarHBondContact CA-O 3.45Å; A35-E111 PolarHBondContact N-O 3.33Å
112	L	97.1	Very high	95.7	Very high	43 Å²	43	31 Å²	31	23%	0.225	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	137.1	177.2	-178.3	63	0	0	0	109.2	D32 V34 H110 R114	D32-L112 HydrophobicContact CB-CD1 3.91Å; V34-L112 HydrophobicContact CG1-CD1 4.04Å; H110-L112 PolarHBondContact O-N 3.16Å; L112-R114 HydrophobicContact CD2-CG 4.31Å; L112-R114 HydrophobicContact CG-CG 4.33Å
113	S	96.4	Very high	95.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.7	168.3	-54.1	0	0	0	0	109.2	D32 V33 E57 D59	D32-S113 CarbonylContact C-O 3.56Å; D32-S113 WeakPolarHBondContact CA-O 3.19Å; V33-S113 PolarHBondContact N-O 3.39Å; V33-S113 PolarHBondContact O-N 3.18Å; E57-S113 CarbonylContact O-C 3.47Å; E57-S113 WeakPolarHBondContact O-CA 3.32Å; D59-S113 VanDerWaalsContact C-OG 3.22Å; D59-S113 PolarHBondContact N-OG 3.45Å; D59-S113 PolarHBondContact O-OG 2.93Å
114	R	95.2	Very high	94.6	Very high	74 Å²	74	38 Å²	38	28%	0.279	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136	175.2	-52.5	-164.2	157.4	95.5	1.4	109.7	G31 D32 S55 Y56 E57 L112	G31-R114 WeakPolarHBondContact O-CA 3.24Å; D32-R114 WeakPolarHBondContact OD1-CB 3.43Å; D32-R114 WeakPolarHBondContact OD1-CD 3.39Å; D32-R114 WeakPolarHBondContact OD1-CG 3.39Å; D32-R114 IonicContact OD1-NE 3.1Å; D32-R114 IonicContact OD2-CZ 3.85Å; D32-R114 IonicContact OD2-NE 3.98Å; D32-R114 PolarHBondContact OD2-NE 3.05Å; D32-R114 VanDerWaalsContact OD2-NE 3.1Å; D32-R114 IonicContact OD2-NH2 3.74Å; S55-R114 CarbonylContact C-O 3.51Å; S55-R114 WeakPolarHBondContact CA-O 3.31Å; Y56-R114 HydrophobicContact CD1-CB 4.26Å; Y56-R114 VanDerWaalsContact CD1-O 3.26Å; Y56-R114 WeakPolarHBondContact CD1-O 3.44Å; Y56-R114 HydrophobicContact CD2-CB 4.02Å; Y56-R114 VanDerWaalsContact CE1-C 3.42Å; Y56-R114 HydrophobicContact CE1-CB 3.73Å; Y56-R114 HydrophobicContact CE2-CB 3.47Å; Y56-R114 VanDerWaalsContact CE2-CB 3.47Å; Y56-R114 HydrophobicContact CE2-CG 4.3Å; Y56-R114 HydrophobicContact CG-CB 4.4Å; Y56-R114 PolarHBondContact N-O 3.13Å; E57-R114 HydrophobicContact CB-CB 4.05Å; E57-R114 HydrophobicContact CB-CG 4.1Å; E57-R114 PolarHBondContact N-O 3.38Å; E57-R114 PolarHBondContact O-N 2.93Å; E57-R114 IonicContact OE1-NH1 2.66Å; E57-R114 PolarHBondContact OE1-NH1 3.22Å; E57-R114 WeakPolarHBondContact OE2-CD 3.46Å; E57-R114 IonicContact OE2-CZ 3.67Å; E57-R114 IonicContact OE2-NE 3.25Å; E57-R114 IonicContact OE2-NH1 2.63Å; E57-R114 PolarHBondContact OE2-NH1 3.03Å; L112-R114 HydrophobicContact CD2-CG 4.31Å; L112-R114 HydrophobicContact CG-CG 4.33Å
115	Y	92.7	Very high	94	Very high	3 Å²	3	46.3 Å²	46.3	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	155.3	-168.5	64.7	-97.6	0	0	0	114.7	T30 G31 V33 L53 L54 Y56 A60 I104 F117	T30-Y115 WeakPolarHBondContact CA-O 3.45Å; G31-Y115 PolarHBondContact N-O 3.4Å; G31-Y115 VanDerWaalsContact O-CD1 3.22Å; G31-Y115 WeakPolarHBondContact O-CD1 3.31Å; G31-Y115 WeakPolarHBondContact O-CE1 3.5Å; G31-Y115 PolarHBondContact O-N 3.41Å; V33-Y115 HydrophobicContact CB-CE1 4.22Å; V33-Y115 HydrophobicContact CG1-CD1 4.2Å; V33-Y115 HydrophobicContact CG1-CE1 4Å; L53-Y115 HydrophobicContact CD1-CD2 3.43Å; L53-Y115 VanDerWaalsContact CD1-CD2 3.43Å; L53-Y115 HydrophobicContact CD1-CE2 4.24Å; L53-Y115 HydrophobicContact CD1-CG 3.6Å; L54-Y115 CarbonylContact O-C 3.54Å; L54-Y115 WeakPolarHBondContact O-CA 3.46Å; L54-Y115 WeakPolarHBondContact O-CB 3.14Å; Y56-Y115 VanDerWaalsContact CE1-N 3.25Å; A60-Y115 HydrophobicContact CB-CD1 4.24Å; I104-Y115 HydrophobicContact CD1-CD2 4.11Å; I104-Y115 HydrophobicContact CD1-CE2 3.52Å; I104-Y115 HydrophobicContact CG2-CD1 4.07Å; I104-Y115 HydrophobicContact CG2-CE1 3.79Å; I104-Y115 HydrophobicContact CG2-CE2 4.49Å; Y115-F117 HydrophobicContact CD2-CB 3.99Å; Y115-F117 HydrophobicContact CE2-CB 3.98Å
116	F	92.8	Very high	93.6	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.3	158.1	-63.6	-77	0	0	0	109.7	I28 I29 L53 L54 Y56 W148 A151 Y152 D155	I28-F116 HydrophobicContact CG2-CB 4.39Å; I28-F116 HydrophobicContact CG2-CD1 4.14Å; I29-F116 CarbonylContact O-C 3.54Å; I29-F116 WeakPolarHBondContact O-CA 3.29Å; L53-F116 CarbonylContact C-O 3.54Å; L53-F116 WeakPolarHBondContact CA-O 3.25Å; L54-F116 HydrophobicContact CD2-CD2 4.39Å; L54-F116 PolarHBondContact N-O 3.32Å; L54-F116 PolarHBondContact O-N 2.94Å; Y56-F116 AromaticContact CD1-CD2 3.54Å; Y56-F116 HydrophobicContact CD1-CD2 3.54Å; Y56-F116 AromaticContact CD1-CE2 3.3Å; Y56-F116 HydrophobicContact CD1-CE2 3.3Å; Y56-F116 HydrophobicContact CD1-CZ 4.21Å; Y56-F116 AromaticContact CE1-CD2 3.81Å; Y56-F116 HydrophobicContact CE1-CD2 3.81Å; Y56-F116 AromaticContact CE1-CE2 3.35Å; Y56-F116 HydrophobicContact CE1-CE2 3.35Å; Y56-F116 AromaticContact CE1-CZ 3.81Å; Y56-F116 HydrophobicContact CE1-CZ 3.81Å; Y56-F116 HydrophobicContact CG-CE2 4.06Å; F116-W148 HydrophobicContact CB-CD2 4.44Å; F116-W148 HydrophobicContact CB-CE3 3.48Å; F116-W148 VanDerWaalsContact CB-CE3 3.48Å; F116-W148 HydrophobicContact CB-CH2 4.42Å; F116-W148 HydrophobicContact CB-CZ3 3.47Å; F116-W148 VanDerWaalsContact CB-CZ3 3.47Å; F116-W148 HydrophobicContact CG-CE3 4.07Å; F116-W148 HydrophobicContact CG-CZ3 4.47Å; F116-A151 HydrophobicContact CD1-CB 3.56Å; F116-A151 VanDerWaalsContact CE1-C 3.42Å; F116-A151 HydrophobicContact CE1-CB 3.65Å; F116-A151 WeakPolarHBondContact CE1-O 3.16Å; F116-A151 HydrophobicContact CG-CB 4.28Å; F116-A151 HydrophobicContact CZ-CB 4.47Å; F116-Y152 HydrophobicContact CD2-CD1 4.4Å; F116-Y152 HydrophobicContact CD2-CD2 4.34Å; F116-Y152 HydrophobicContact CD2-CE1 4.12Å; F116-Y152 AromaticContact CD2-CE2 3.99Å; F116-Y152 HydrophobicContact CD2-CE2 3.99Å; F116-Y152 AromaticContact CD2-CZ 3.87Å; F116-Y152 AromaticContact CE2-CD1 3.29Å; F116-Y152 HydrophobicContact CE2-CD1 3.29Å; F116-Y152 AromaticContact CE2-CD2 3.81Å; F116-Y152 HydrophobicContact CE2-CD2 3.81Å; F116-Y152 AromaticContact CE2-CE1 3.28Å; F116-Y152 HydrophobicContact CE2-CE1 3.28Å; F116-Y152 AromaticContact CE2-CE2 3.75Å; F116-Y152 HydrophobicContact CE2-CE2 3.75Å; F116-Y152 AromaticContact CE2-CG 3.57Å; F116-Y152 HydrophobicContact CE2-CG 3.57Å; F116-Y152 AromaticContact CE2-CZ 3.48Å; F116-Y152 VanDerWaalsContact CE2-CZ 3.48Å; F116-Y152 AromaticContact CZ-CD1 3.67Å; F116-Y152 HydrophobicContact CZ-CD1 3.67Å; F116-Y152 HydrophobicContact CZ-CD2 4.33Å; F116-Y152 HydrophobicContact CZ-CE1 4.13Å; F116-Y152 AromaticContact CZ-CG 3.78Å; F116-Y152 HydrophobicContact CZ-CG 3.78Å; F116-D155 HydrophobicContact CE1-CB 4.1Å; F116-D155 HydrophobicContact CZ-CB 4.16Å
117	F	94.1	Very high	93.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	105.5	176.5	-179.6	-138.2	0	0	0	109.3	I28 I29 F41 L51 V52 L53 L62 V102 I104 Y115 I119	I28-F117 WeakPolarHBondContact CA-O 3.48Å; I29-F117 HydrophobicContact CB-CB 4.44Å; I29-F117 HydrophobicContact CD1-CD1 4.5Å; I29-F117 PolarHBondContact N-O 3.01Å; I29-F117 PolarHBondContact O-N 3.46Å; F41-F117 HydrophobicContact CB-CE1 4.48Å; F41-F117 HydrophobicContact CD2-CD1 4.18Å; F41-F117 HydrophobicContact CD2-CE1 4Å; F41-F117 HydrophobicContact CE2-CD1 4.16Å; F41-F117 HydrophobicContact CE2-CE1 4.45Å; F41-F117 HydrophobicContact CG-CD1 4.44Å; F41-F117 HydrophobicContact CG-CE1 4.11Å; F41-F117 HydrophobicContact CZ-CD1 4.38Å; L51-F117 HydrophobicContact CB-CE2 4.02Å; L51-F117 HydrophobicContact CB-CZ 4.45Å; L51-F117 HydrophobicContact CD1-CZ 4.42Å; L51-F117 HydrophobicContact CD2-CE2 4.48Å; L51-F117 HydrophobicContact CD2-CZ 4.22Å; V52-F117 CarbonylContact O-C 3.59Å; V52-F117 WeakPolarHBondContact O-CA 3.29Å; V52-F117 WeakPolarHBondContact O-CD2 3.5Å; L53-F117 HydrophobicContact CB-CD2 4.42Å; L53-F117 HydrophobicContact CD1-CB 4.16Å; L53-F117 HydrophobicContact CD1-CD2 4.46Å; L62-F117 HydrophobicContact CD1-CE2 4.04Å; L62-F117 HydrophobicContact CD1-CZ 4.41Å; V102-F117 HydrophobicContact CG1-CE1 4.38Å; V102-F117 HydrophobicContact CG1-CZ 3.95Å; I104-F117 HydrophobicContact CD1-CB 4.05Å; I104-F117 HydrophobicContact CD1-CD1 3.91Å; I104-F117 HydrophobicContact CD1-CD2 4.26Å; I104-F117 HydrophobicContact CD1-CE1 4.42Å; I104-F117 HydrophobicContact CD1-CG 3.82Å; Y115-F117 HydrophobicContact CD2-CB 3.99Å; Y115-F117 HydrophobicContact CE2-CB 3.98Å; F117-I119 HydrophobicContact CD1-CD1 4.11Å; F117-I119 HydrophobicContact CD1-CG1 4.08Å; F117-I119 HydrophobicContact CE1-CD1 3.6Å; F117-I119 HydrophobicContact CE1-CG1 3.62Å; F117-I119 HydrophobicContact CE2-CG1 4.27Å; F117-I119 HydrophobicContact CZ-CD1 4.14Å; F117-I119 HydrophobicContact CZ-CG1 3.71Å
118	A	92.5	Very high	93.3	Very high	1 Å²	1	49 Å²	49	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.1	173	0	0	0	0	0	111	Q27 I28 V52 W148	Q27-A118 CarbonylContact O-C 3.54Å; Q27-A118 WeakPolarHBondContact O-CA 3.2Å; I28-A118 HydrophobicContact CG1-CB 4.13Å; V52-A118 HydrophobicContact CB-CB 4.46Å; V52-A118 PolarHBondContact N-O 3.37Å; V52-A118 PolarHBondContact O-N 3.19Å; A118-W148 HydrophobicContact CB-CH2 3.24Å; A118-W148 HydrophobicContact CB-CZ2 4.22Å; A118-W148 HydrophobicContact CB-CZ3 3.64Å
119	I	94	Very high	93.2	Very high	12 Å²	12	49.8 Å²	49.8	6%	0.062	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	108.4	173.1	-56.1	167.7	0	0	0	106.3	Q26 Q27 I29 I43 L51 F117 L121	Q26-I119 CarbonylContact C-O 3.6Å; Q26-I119 WeakPolarHBondContact CA-O 3.35Å; Q27-I119 PolarHBondContact N-O 3.3Å; Q27-I119 PolarHBondContact O-N 2.93Å; I29-I119 HydrophobicContact CD1-CD1 4.13Å; I43-I119 HydrophobicContact CD1-CD1 4.01Å; I43-I119 HydrophobicContact CD1-CG1 4.18Å; I43-I119 HydrophobicContact CD1-CG2 3.76Å; I43-I119 HydrophobicContact CG1-CD1 4.25Å; I43-I119 HydrophobicContact CG1-CG2 4.45Å; L51-I119 HydrophobicContact CD2-CB 4.21Å; L51-I119 HydrophobicContact CD2-CG1 4.08Å; L51-I119 HydrophobicContact CD2-CG2 3.82Å; F117-I119 HydrophobicContact CD1-CD1 4.11Å; F117-I119 HydrophobicContact CD1-CG1 4.08Å; F117-I119 HydrophobicContact CE1-CD1 3.6Å; F117-I119 HydrophobicContact CE1-CG1 3.62Å; F117-I119 HydrophobicContact CE2-CG1 4.27Å; F117-I119 HydrophobicContact CZ-CD1 4.14Å; F117-I119 HydrophobicContact CZ-CG1 3.71Å; I119-L121 HydrophobicContact CG2-CD2 4.2Å; I119-L121 HydrophobicContact CG2-CG 4.19Å
120	T	93.3	Very high	93.1	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.012	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.5	172.5	-52.4	0	0	0	0	108.9	P24 Q26 A49 A50 F122	P24-T120 HydrophobicContact CB-CG2 3.73Å; P24-T120 HydrophobicContact CG-CG2 4.18Å; Q26-T120 PolarHBondContact NE2-OG1 3.25Å; Q26-T120 VanDerWaalsContact NE2-OG1 3.12Å; A49-T120 CarbonylContact C-O 3.58Å; A49-T120 VanDerWaalsContact CA-O 3.3Å; A49-T120 WeakPolarHBondContact CA-O 3.33Å; A50-T120 PolarHBondContact N-O 3.04Å; A50-T120 PolarHBondContact O-N 3.46Å; T120-F122 HydrophobicContact CG2-CD2 4.43Å; T120-F122 HydrophobicContact CG2-CE1 4Å; T120-F122 HydrophobicContact CG2-CE2 3.68Å; T120-F122 HydrophobicContact CG2-CZ 3.43Å; T120-F122 VanDerWaalsContact CG2-CZ 3.43Å
121	L	94.6	Very high	93.1	Very high	12 Å²	12	45.7 Å²	45.7	6%	0.063	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131	177.5	-58.3	174.6	0	0	0	110.6	P24 S25 I43 K45 A48 A49 I119	P24-L121 CarbonylContact C-O 3.55Å; P24-L121 WeakPolarHBondContact CA-O 3.35Å; P24-L121 WeakPolarHBondContact CB-O 3.41Å; S25-L121 PolarHBondContact N-O 2.84Å; S25-L121 PolarHBondContact O-N 3.39Å; I43-L121 HydrophobicContact CG2-CD1 4.36Å; I43-L121 HydrophobicContact CG2-CD2 4.13Å; K45-L121 HydrophobicContact CB-CD1 3.86Å; K45-L121 HydrophobicContact CD-CD1 3.77Å; K45-L121 HydrophobicContact CG-CD1 4.14Å; A48-L121 WeakPolarHBondContact O-CA 3.44Å; A49-L121 HydrophobicContact CB-CD2 3.59Å; I119-L121 HydrophobicContact CG2-CD2 4.2Å; I119-L121 HydrophobicContact CG2-CG 4.19Å
122	F	94.3	Very high	92.8	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.013	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	108.9	178.5	-51.1	-93.9	0	0	0	108.3	P24 G47 A48 A50 T120 G127 E130 L131 W134	P24-F122 HydrophobicContact CB-CD1 3.54Å; P24-F122 HydrophobicContact CB-CE1 3.64Å; P24-F122 HydrophobicContact CB-CG 4.24Å; P24-F122 HydrophobicContact CB-CZ 4.4Å; P24-F122 HydrophobicContact CG-CD1 4.08Å; P24-F122 HydrophobicContact CG-CE1 3.8Å; G47-F122 CarbonylContact C-O 3.59Å; G47-F122 WeakPolarHBondContact CA-O 3.28Å; A48-F122 HydrophobicContact CB-CB 4.21Å; A48-F122 HydrophobicContact CB-CD2 4.45Å; A48-F122 PolarHBondContact N-O 3.31Å; A48-F122 PolarHBondContact O-N 2.83Å; A50-F122 HydrophobicContact CB-CE2 4.06Å; T120-F122 HydrophobicContact CG2-CD2 4.43Å; T120-F122 HydrophobicContact CG2-CE1 4Å; T120-F122 HydrophobicContact CG2-CE2 3.68Å; T120-F122 HydrophobicContact CG2-CZ 3.43Å; T120-F122 VanDerWaalsContact CG2-CZ 3.43Å; F122-G127 VanDerWaalsContact CB-O 3.31Å; F122-G127 WeakPolarHBondContact CB-O 3.41Å; F122-E130 HydrophobicContact CB-CB 4.28Å; F122-E130 HydrophobicContact CD1-CB 3.59Å; F122-E130 HydrophobicContact CE1-CB 4.31Å; F122-E130 HydrophobicContact CG-CB 4.24Å; F122-L131 HydrophobicContact CD2-CB 3.87Å; F122-L131 HydrophobicContact CD2-CD1 3.99Å; F122-L131 HydrophobicContact CE2-CB 4.08Å; F122-L131 HydrophobicContact CE2-CD1 3.55Å; F122-L131 HydrophobicContact CE2-CG 4.44Å; F122-L131 HydrophobicContact CG-CB 4.31Å; F122-L131 HydrophobicContact CZ-CD1 4.34Å; F122-W134 HydrophobicContact CE1-CB 3.76Å; F122-W134 HydrophobicContact CE1-CG 4.02Å; F122-W134 HydrophobicContact CZ-CB 3.6Å; F122-W134 AromaticContact CZ-CD2 3.88Å; F122-W134 HydrophobicContact CZ-CD2 3.88Å; F122-W134 HydrophobicContact CZ-CE3 4.28Å; F122-W134 AromaticContact CZ-CG 3.56Å; F122-W134 HydrophobicContact CZ-CG 3.56Å
123	E	87.7	Confident	92.5	Very high	89 Å²	89	45 Å²	45	42%	0.416	24%	0.242	S	C	.	.			trans	-100.7	156.7	-174.7	-70.3	179.6	-96.6	0	0	112.1	K45	K45-E123 WeakPolarHBondContact CE-OE1 3.29Å; K45-E123 WeakPolarHBondContact CE-OE2 3.37Å; K45-E123 IonicContact NZ-OE1 2.58Å; K45-E123 PolarHBondContact NZ-OE1 2.86Å; K45-E123 IonicContact NZ-OE2 3.62Å
124	G	86.7	Confident	92.1	Very high	59 Å²	59	47 Å²	47	61%	0.608	25%	0.25	S	C	*	.	S	Bend	trans	89.1	179	178.6	0	0	0	0	0	113.7	N126 G127	G124-N126 PolarHBondContact O-N 2.87Å; G124-N126 VanDerWaalsContact O-N 3.17Å; G124-G127 PolarHBondContact O-N 2.88Å
125	D	85.7	Confident	91.7	Very high	174 Å²	174	43.6 Å²	43.6	93%	0.93	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-24.1	-168.9	-63.6	-20.6	0	0	0	113.6
126	N	90.5	Very high	91.4	Very high	100 Å²	100	47.5 Å²	47.5	54%	0.535	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	3.9	179	-73.9	-20	0	0	0	113.8	G124 D128 N129 E130	G124-N126 PolarHBondContact O-N 2.87Å; G124-N126 VanDerWaalsContact O-N 3.17Å; N126-D128 PolarHBondContact O-N 3.44Å; N126-D128 VanDerWaalsContact O-N 3.13Å; N126-N129 WeakPolarHBondContact O-CB 3.4Å; N126-N129 PolarHBondContact O-N 3.06Å; N126-E130 PolarHBondContact O-N 2.74Å
127	G	92.3	Very high	91	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-56.1	-35.6	-171.1	0	0	0	0	0	114.1	A48 F122 G124 E130 L131	A48-G127 WeakPolarHBondContact CB-O 3.37Å; F122-G127 VanDerWaalsContact CB-O 3.31Å; F122-G127 WeakPolarHBondContact CB-O 3.41Å; G124-G127 PolarHBondContact O-N 2.88Å; G127-E130 PolarHBondContact O-N 3.2Å; G127-L131 WeakPolarHBondContact O-CB 3.32Å; G127-L131 PolarHBondContact O-N 3.37Å
128	D	95.6	Very high	90.2	Very high	48 Å²	48	56 Å²	56	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-67.9	-37.1	176.1	-71.8	-35.7	0	0	0	112.8	A48 P93 S94 N126 V132	A48-D128 VanDerWaalsContact CB-OD1 3.31Å; A48-D128 WeakPolarHBondContact CB-OD1 3.36Å; P93-D128 WeakPolarHBondContact CA-OD1 3.15Å; P93-D128 WeakPolarHBondContact CB-OD1 3.45Å; S94-D128 WeakPolarHBondContact CB-OD1 3.45Å; S94-D128 WeakPolarHBondContact CB-OD2 3.48Å; S94-D128 PolarHBondContact N-OD1 2.97Å; S94-D128 PolarHBondContact OG-OD1 3.2Å; S94-D128 PolarHBondContact OG-OD2 2.86Å; N126-D128 PolarHBondContact O-N 3.44Å; N126-D128 VanDerWaalsContact O-N 3.13Å; D128-V132 WeakPolarHBondContact O-CG2 3.35Å; D128-V132 PolarHBondContact O-N 3.25Å; D128-V132 VanDerWaalsContact O-N 3.14Å
129	N	94.7	Very high	89.5	Confident	94 Å²	94	61 Å²	61	50%	0.503	32%	0.321	S	S	.	.	H	α-helix	trans	-70.1	-39.3	176.2	-63.6	-39.3	0	0	0	110.8	N126 V132 H133	N126-N129 WeakPolarHBondContact O-CB 3.4Å; N126-N129 PolarHBondContact O-N 3.06Å; N129-V132 PolarHBondContact O-N 2.9Å; N129-H133 PolarHBondContact O-CD2 2.89Å; N129-H133 PolarHBondContact O-N 3Å
130	E	93	Very high	88.7	Confident	57 Å²	57	67 Å²	67	27%	0.266	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-40.3	175.8	-67.1	-179.9	-174.2	0	0	111.9	F122 N126 G127 V132 H133 W134	F122-E130 HydrophobicContact CB-CB 4.28Å; F122-E130 HydrophobicContact CD1-CB 3.59Å; F122-E130 HydrophobicContact CE1-CB 4.31Å; F122-E130 HydrophobicContact CG-CB 4.24Å; N126-E130 PolarHBondContact O-N 2.74Å; G127-E130 PolarHBondContact O-N 3.2Å; E130-V132 PolarHBondContact O-N 2.93Å; E130-H133 PolarHBondContact O-N 2.66Å; E130-W134 VanDerWaalsContact O-CB 3.29Å; E130-W134 WeakPolarHBondContact O-CB 3.32Å; E130-W134 PolarHBondContact O-N 2.81Å
131	L	94	Very high	87.7	Confident	7 Å²	7	70 Å²	70	4%	0.037	37%	0.368	C	S	.	.	H	α-helix	trans	-56.8	-49.3	172.9	172.7	63.3	0	0	0	111	A48 A50 E91 F122 G127 H133 W134 A135	A48-L131 HydrophobicContact CB-CB 3.94Å; A48-L131 HydrophobicContact CB-CD2 3.79Å; A48-L131 HydrophobicContact CB-CG 4.47Å; A50-L131 HydrophobicContact CB-CD1 3.68Å; E91-L131 HydrophobicContact CB-CD1 4.31Å; E91-L131 HydrophobicContact CB-CD2 4.2Å; E91-L131 HydrophobicContact CB-CG 4.48Å; E91-L131 HydrophobicContact CG-CD1 4.2Å; F122-L131 HydrophobicContact CD2-CB 3.87Å; F122-L131 HydrophobicContact CD2-CD1 3.99Å; F122-L131 HydrophobicContact CE2-CB 4.08Å; F122-L131 HydrophobicContact CE2-CD1 3.55Å; F122-L131 HydrophobicContact CE2-CG 4.44Å; F122-L131 HydrophobicContact CG-CB 4.31Å; F122-L131 HydrophobicContact CZ-CD1 4.34Å; G127-L131 WeakPolarHBondContact O-CB 3.32Å; G127-L131 PolarHBondContact O-N 3.37Å; L131-H133 PolarHBondContact O-N 2.85Å; L131-W134 PolarHBondContact O-N 2.92Å; L131-A135 WeakPolarHBondContact O-CB 3.31Å; L131-A135 PolarHBondContact O-N 3.16Å
132	V	92.3	Very high	86.3	Confident	74 Å²	74	74.6 Å²	74.6	45%	0.448	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-46.5	178.7	171.6	0	0	0	0	111.2	D128 N129 E130 W134 A135 D136	D128-V132 WeakPolarHBondContact O-CG2 3.35Å; D128-V132 PolarHBondContact O-N 3.25Å; D128-V132 VanDerWaalsContact O-N 3.14Å; N129-V132 PolarHBondContact O-N 2.9Å; E130-V132 PolarHBondContact O-N 2.93Å; V132-W134 VanDerWaalsContact C-N 3.31Å; V132-W134 PolarHBondContact O-N 3.45Å; V132-A135 WeakPolarHBondContact O-CB 3.31Å; V132-A135 PolarHBondContact O-N 2.91Å; V132-D136 PolarHBondContact O-N 2.8Å
133	H	90.5	Very high	84.3	Confident	133 Å²	133	78.5 Å²	78.5	62%	0.616	43%	0.432	S	S	*	.	H	α-helix	trans	-62.9	-38	177.9	-74.9	-46.1	0	0	0	112.9	N129 E130 L131 Y137	N129-H133 PolarHBondContact O-CD2 2.89Å; N129-H133 PolarHBondContact O-N 3Å; E130-H133 PolarHBondContact O-N 2.66Å; L131-H133 PolarHBondContact O-N 2.85Å; H133-Y137 PolarHBondContact O-N 2.88Å; H133-Y137 VanDerWaalsContact O-N 3.09Å
134	W	86.8	Confident	82.7	Confident	43 Å²	43	78.5 Å²	78.5	16%	0.163	43%	0.432	C	S	.	.	H	α-helix	trans	-67.5	-42.5	175.3	178.2	91.4	0	0	0	111.3	A50 V52 H89 F122 E130 L131 V132 D136 Y137 I138	A50-W134 HydrophobicContact CB-CD2 4.5Å; A50-W134 HydrophobicContact CB-CE3 3.69Å; A50-W134 HydrophobicContact CB-CH2 3.69Å; A50-W134 HydrophobicContact CB-CZ2 4.47Å; A50-W134 HydrophobicContact CB-CZ3 3.25Å; V52-W134 HydrophobicContact CG2-CH2 3.61Å; V52-W134 HydrophobicContact CG2-CZ2 4.39Å; H89-W134 AromaticContact CE1-CZ3 3.92Å; H89-W134 AromaticContact NE2-CZ3 3.43Å; H89-W134 WeakPolarHBondContact NE2-CZ3 3.4Å; F122-W134 HydrophobicContact CE1-CB 3.76Å; F122-W134 HydrophobicContact CE1-CG 4.02Å; F122-W134 HydrophobicContact CZ-CB 3.6Å; F122-W134 AromaticContact CZ-CD2 3.88Å; F122-W134 HydrophobicContact CZ-CD2 3.88Å; F122-W134 HydrophobicContact CZ-CE3 4.28Å; F122-W134 AromaticContact CZ-CG 3.56Å; F122-W134 HydrophobicContact CZ-CG 3.56Å; E130-W134 VanDerWaalsContact O-CB 3.29Å; E130-W134 WeakPolarHBondContact O-CB 3.32Å; E130-W134 PolarHBondContact O-N 2.81Å; L131-W134 PolarHBondContact O-N 2.92Å; V132-W134 VanDerWaalsContact C-N 3.31Å; V132-W134 PolarHBondContact O-N 3.45Å; W134-D136 PolarHBondContact O-N 3.46Å; W134-Y137 WeakPolarHBondContact O-CB 3.39Å; W134-Y137 PolarHBondContact O-N 2.8Å; W134-Y137 VanDerWaalsContact O-N 3.16Å; W134-I138 HydrophobicContact CD2-CG1 4.06Å; W134-I138 HydrophobicContact CE3-CG1 4.2Å; W134-I138 HydrophobicContact CH2-CD1 4.42Å; W134-I138 HydrophobicContact CH2-CG1 3.73Å; W134-I138 HydrophobicContact CZ2-CD1 3.9Å; W134-I138 HydrophobicContact CZ2-CG1 3.6Å; W134-I138 HydrophobicContact CZ3-CG1 4.02Å; W134-I138 WeakPolarHBondContact O-CG1 3.47Å; W134-I138 PolarHBondContact O-N 2.87Å
135	A	87.1	Confident	80.8	Confident	2 Å²	2	79 Å²	79	2%	0.017	43%	0.425	C	S	.	.	H	α-helix	trans	-60.9	-44.5	176.2	0	0	0	0	0	111.9	E91 L131 V132 Y137 I138 N139	E91-A135 VanDerWaalsContact CD-CB 3.41Å; E91-A135 HydrophobicContact CG-CB 4.41Å; E91-A135 WeakPolarHBondContact OE1-CB 3.5Å; L131-A135 WeakPolarHBondContact O-CB 3.31Å; L131-A135 PolarHBondContact O-N 3.16Å; V132-A135 WeakPolarHBondContact O-CB 3.31Å; V132-A135 PolarHBondContact O-N 2.91Å; A135-Y137 VanDerWaalsContact C-N 3.3Å; A135-Y137 PolarHBondContact O-N 3.22Å; A135-I138 PolarHBondContact O-N 2.59Å; A135-N139 WeakPolarHBondContact O-CB 3.35Å; A135-N139 VanDerWaalsContact O-CG 3.29Å; A135-N139 PolarHBondContact O-N 2.82Å; A135-N139 PolarHBondContact O-ND2 2.81Å; A135-N139 VanDerWaalsContact O-ND2 3.1Å
136	D	88.1	Confident	79.3	Confident	84 Å²	84	75.5 Å²	75.5	45%	0.449	41%	0.406	S	S	.	.	H	α-helix	trans	-58.2	-43.1	173.6	-75	-21.4	0	0	0	111.5	V132 W134 I138 N139 L140	V132-D136 PolarHBondContact O-N 2.8Å; W134-D136 PolarHBondContact O-N 3.46Å; D136-I138 PolarHBondContact O-N 2.88Å; D136-N139 PolarHBondContact O-N 2.79Å; D136-L140 WeakPolarHBondContact O-CB 3.43Å; D136-L140 WeakPolarHBondContact O-CG 3.34Å; D136-L140 PolarHBondContact O-N 2.88Å
137	Y	82.5	Confident	77.9	Confident	130 Å²	130	73.7 Å²	73.7	51%	0.51	39%	0.394	S	S	.	.	H	α-helix	trans	-61	-43.1	177.4	172.5	-98.3	0	0	0	112.5	H133 W134 A135 N141	H133-Y137 PolarHBondContact O-N 2.88Å; H133-Y137 VanDerWaalsContact O-N 3.09Å; W134-Y137 WeakPolarHBondContact O-CB 3.39Å; W134-Y137 PolarHBondContact O-N 2.8Å; W134-Y137 VanDerWaalsContact O-N 3.16Å; A135-Y137 VanDerWaalsContact C-N 3.3Å; A135-Y137 PolarHBondContact O-N 3.22Å; Y137-N141 PolarHBondContact O-N 3.4Å; Y137-N141 PolarHBondContact O-ND2 3.12Å
138	I	78.4	Confident	76.6	Confident	52 Å²	52	74.9 Å²	74.9	27%	0.267	40%	0.398	S	S	.	.	H	α-helix	trans	-67.5	-44.3	177.4	-63.5	-61.1	0	0	0	111.1	W134 A135 D136 L140 N141 P142	W134-I138 HydrophobicContact CD2-CG1 4.06Å; W134-I138 HydrophobicContact CE3-CG1 4.2Å; W134-I138 HydrophobicContact CH2-CD1 4.42Å; W134-I138 HydrophobicContact CH2-CG1 3.73Å; W134-I138 HydrophobicContact CZ2-CD1 3.9Å; W134-I138 HydrophobicContact CZ2-CG1 3.6Å; W134-I138 HydrophobicContact CZ3-CG1 4.02Å; W134-I138 WeakPolarHBondContact O-CG1 3.47Å; W134-I138 PolarHBondContact O-N 2.87Å; A135-I138 PolarHBondContact O-N 2.59Å; D136-I138 PolarHBondContact O-N 2.88Å; I138-L140 VanDerWaalsContact C-N 3.28Å; I138-L140 PolarHBondContact O-N 2.83Å; I138-N141 CarbonylContact O-C 3.59Å; I138-N141 PolarHBondContact O-N 3.31Å; I138-P142 VanDerWaalsContact O-N 3.15Å
139	N	77.1	Confident	75.2	Confident	106 Å²	106	76.1 Å²	76.1	57%	0.567	41%	0.405	S	S	*	.	H	α-helix	trans	-63.7	-33.3	179.4	-73.7	-36.5	0	0	0	112.8	A135 D136 N141	A135-N139 WeakPolarHBondContact O-CB 3.35Å; A135-N139 VanDerWaalsContact O-CG 3.29Å; A135-N139 PolarHBondContact O-N 2.82Å; A135-N139 PolarHBondContact O-ND2 2.81Å; A135-N139 VanDerWaalsContact O-ND2 3.1Å; D136-N139 PolarHBondContact O-N 2.79Å; N139-N141 VanDerWaalsContact C-N 3.35Å
140	L	78	Confident	73.8	Confident	136 Å²	136	75.1 Å²	75.1	71%	0.712	41%	0.405	S	S	*	.	H	α-helix	trans	-76.5	-23.1	175.2	-69.8	170.4	0	0	0	112.8	D136 I138 P142	D136-L140 WeakPolarHBondContact O-CB 3.43Å; D136-L140 WeakPolarHBondContact O-CG 3.34Å; D136-L140 PolarHBondContact O-N 2.88Å; I138-L140 VanDerWaalsContact C-N 3.28Å; I138-L140 PolarHBondContact O-N 2.83Å; L140-P142 VanDerWaalsContact C-CD 3.41Å
141	N	72.7	Confident	72.3	Confident	65 Å²	65	72.8 Å²	72.8	35%	0.348	40%	0.395	S	S	.	.			trans	-128.4	59	-178.4	-54.9	-75.1	0	0	0	111.5	Y137 I138 N139 A143 E144	Y137-N141 PolarHBondContact O-N 3.4Å; Y137-N141 PolarHBondContact O-ND2 3.12Å; I138-N141 CarbonylContact O-C 3.59Å; I138-N141 PolarHBondContact O-N 3.31Å; N139-N141 VanDerWaalsContact C-N 3.35Å; N141-A143 PolarHBondContact O-N 2.78Å; N141-A143 VanDerWaalsContact O-N 3.15Å; N141-E144 HydrophobicContact CB-CG 3.97Å; N141-E144 PolarHBondContact O-N 2.87Å
142	P	63.9	Low	70.8	Confident	110 Å²	110	75.6 Å²	75.6	71%	0.714	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-20.9	-175.2	28.7	-35.7	0	0	0	112.4	I138 L140	I138-P142 VanDerWaalsContact O-N 3.15Å; L140-P142 VanDerWaalsContact C-CD 3.41Å
143	A	53.1	Low	69.5	Low	84 Å²	84	75 Å²	75	69%	0.694	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	31.8	-173.8	0	0	0	0	0	113	N141 P145	N141-A143 PolarHBondContact O-N 2.78Å; N141-A143 VanDerWaalsContact O-N 3.15Å; A143-P145 WeakPolarHBondContact O-CD 3.09Å
144	E	54	Low	68.3	Low	89 Å²	89	74.1 Å²	74.1	42%	0.416	41%	0.405	S	S	.	.			trans	-99	82.3	171	-75.6	-81.6	147.3	0	0	110.6	N141 N146	N141-E144 HydrophobicContact CB-CG 3.97Å; N141-E144 PolarHBondContact O-N 2.87Å; E144-N146 PolarHBondContact O-N 3.17Å; E144-N146 PolarHBondContact OE2-ND2 2.98Å
145	P	47.4	Very low	67.4	Low	71 Å²	71	73.7 Å²	73.7	46%	0.461	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-19.4	167.1	-15.2	18.3	0	0	0	112.7	A143 H147 W148 N149	A143-P145 WeakPolarHBondContact O-CD 3.09Å; P145-H147 PolarHBondContact O-N 2.9Å; P145-W148 CarbonylContact O-C 3.54Å; P145-W148 PolarHBondContact O-N 2.8Å; P145-N149 PolarHBondContact O-N 2.84Å; P145-N149 PolarHBondContact O-ND2 2.81Å; P145-N149 PolarHBondContact O-OD1 2.86Å
146	N	54	Low	66.2	Low	99 Å²	99	78.9 Å²	78.9	53%	0.529	43%	0.434	S	S	.	.	H	α-helix	trans	-51.5	-34.5	-175.5	-66.3	-21.2	0	0	0	113.1	E144 N149	E144-N146 PolarHBondContact O-N 3.17Å; E144-N146 PolarHBondContact OE2-ND2 2.98Å; N146-N149 WeakPolarHBondContact CA-ND2 3.35Å; N146-N149 PolarHBondContact OD1-ND2 3.2Å
147	H	61.3	Low	65.1	Low	63 Å²	63	76 Å²	76	29%	0.292	42%	0.424	S	S	.	.	H	α-helix	trans	-67.4	-36.7	177.7	-176.3	-124.9	0	0	0	112.7	Q26 P145 S150	Q26-H147 VanDerWaalsContact CD-NE2 3.29Å; Q26-H147 PolarHBondContact NE2-CE1 2.86Å; Q26-H147 PolarHBondContact NE2-NE2 2.82Å; Q26-H147 VanDerWaalsContact NE2-NE2 3.14Å; Q26-H147 PolarHBondContact OE1-NE2 3.34Å; P145-H147 PolarHBondContact O-N 2.9Å; H147-S150 PolarHBondContact O-OG 3.45Å
148	W	64.4	Low	64.3	Low	25 Å²	25	75.1 Å²	75.1	10%	0.095	42%	0.423	C	S	.	.	H	α-helix	trans	-90.6	-23.6	179.1	-55.3	107.8	0	0	0	113.2	I28 V52 L54 F116 A118 P145 S150 A151 Y152	I28-W148 HydrophobicContact CG2-CE3 4.4Å; I28-W148 HydrophobicContact CG2-CZ3 4.06Å; V52-W148 HydrophobicContact CB-CH2 4.11Å; V52-W148 HydrophobicContact CB-CZ2 3.97Å; V52-W148 HydrophobicContact CG1-CH2 4.14Å; V52-W148 HydrophobicContact CG1-CZ2 3.59Å; L54-W148 HydrophobicContact CB-CZ2 4.49Å; L54-W148 HydrophobicContact CD2-CB 3.95Å; L54-W148 HydrophobicContact CD2-CD2 3.94Å; L54-W148 HydrophobicContact CD2-CG 3.56Å; F116-W148 HydrophobicContact CB-CD2 4.44Å; F116-W148 HydrophobicContact CB-CE3 3.48Å; F116-W148 VanDerWaalsContact CB-CE3 3.48Å; F116-W148 HydrophobicContact CB-CH2 4.42Å; F116-W148 HydrophobicContact CB-CZ3 3.47Å; F116-W148 VanDerWaalsContact CB-CZ3 3.47Å; F116-W148 HydrophobicContact CG-CE3 4.07Å; F116-W148 HydrophobicContact CG-CZ3 4.47Å; A118-W148 HydrophobicContact CB-CH2 3.24Å; A118-W148 HydrophobicContact CB-CZ2 4.22Å; A118-W148 HydrophobicContact CB-CZ3 3.64Å; P145-W148 CarbonylContact O-C 3.54Å; P145-W148 PolarHBondContact O-N 2.8Å; W148-S150 PolarHBondContact O-N 2.9Å; W148-S150 VanDerWaalsContact O-N 3.17Å; W148-A151 CarbonylContact O-C 3.6Å; W148-A151 WeakPolarHBondContact O-CA 3.27Å; W148-A151 WeakPolarHBondContact O-CB 2.84Å; W148-A151 PolarHBondContact O-N 2.67Å; W148-Y152 HydrophobicContact CB-CD2 3.87Å; W148-Y152 HydrophobicContact CB-CE2 3.66Å; W148-Y152 WeakPolarHBondContact O-CD2 3.12Å; W148-Y152 PolarHBondContact O-N 3.32Å
149	N	65.5	Low	63.9	Low	74 Å²	74	76.2 Å²	76.2	40%	0.396	44%	0.435	S	S	.	.	H	α-helix	trans	-55.2	-37.1	-177.5	-74.5	-17.8	0	0	0	112.5	P145 N146 A153	P145-N149 PolarHBondContact O-N 2.84Å; P145-N149 PolarHBondContact O-ND2 2.81Å; P145-N149 PolarHBondContact O-OD1 2.86Å; N146-N149 WeakPolarHBondContact CA-ND2 3.35Å; N146-N149 PolarHBondContact OD1-ND2 3.2Å; N149-A153 WeakPolarHBondContact O-CB 3.37Å; N149-A153 PolarHBondContact O-N 3.06Å
150	S	65.5	Low	63.6	Low	74 Å²	74	77.7 Å²	77.7	52%	0.517	44%	0.436	S	S	.	.	H	α-helix	trans	-66.3	-40.6	173.7	55.6	0	0	0	0	111.9	H147 W148 A153 E154	H147-S150 PolarHBondContact O-OG 3.45Å; W148-S150 PolarHBondContact O-N 2.9Å; W148-S150 VanDerWaalsContact O-N 3.17Å; S150-A153 PolarHBondContact O-N 2.8Å; S150-E154 VanDerWaalsContact O-CB 3.31Å; S150-E154 WeakPolarHBondContact O-CB 3.39Å; S150-E154 PolarHBondContact O-N 3.19Å
151	A	61.6	Low	63.4	Low	7 Å²	7	77.7 Å²	77.7	6%	0.058	43%	0.431	C	S	.	.	H	α-helix	trans	-67.9	-42.3	177	0	0	0	0	0	112	I28 F116 W148 E154 D155	I28-A151 HydrophobicContact CD1-CB 4.31Å; I28-A151 HydrophobicContact CG2-CB 3.76Å; F116-A151 HydrophobicContact CD1-CB 3.56Å; F116-A151 VanDerWaalsContact CE1-C 3.42Å; F116-A151 HydrophobicContact CE1-CB 3.65Å; F116-A151 WeakPolarHBondContact CE1-O 3.16Å; F116-A151 HydrophobicContact CG-CB 4.28Å; F116-A151 HydrophobicContact CZ-CB 4.47Å; W148-A151 CarbonylContact O-C 3.6Å; W148-A151 WeakPolarHBondContact O-CA 3.27Å; W148-A151 WeakPolarHBondContact O-CB 2.84Å; W148-A151 PolarHBondContact O-N 2.67Å; A151-E154 PolarHBondContact O-N 3.34Å; A151-D155 WeakPolarHBondContact O-CB 3.43Å; A151-D155 PolarHBondContact O-N 3.49Å
152	Y	63.2	Low	63.3	Low	66 Å²	66	77.1 Å²	77.1	26%	0.259	43%	0.432	S	S	.	.	H	α-helix	trans	-56.6	-51.6	170.5	-78.7	-80.6	0	0	0	111.3	L54 Y56 F116 W148 E154 D155 D156	L54-Y152 HydrophobicContact CD2-CE2 3.96Å; L54-Y152 WeakPolarHBondContact CD2-OH 3.39Å; Y56-Y152 WeakPolarHBondContact CB-OH 3.44Å; Y56-Y152 HydrophobicContact CD1-CE1 4.06Å; Y56-Y152 AromaticContact CD2-CE1 3.96Å; Y56-Y152 HydrophobicContact CD2-CE1 3.96Å; Y56-Y152 AromaticContact CG-CE1 3.62Å; Y56-Y152 HydrophobicContact CG-CE1 3.62Å; F116-Y152 HydrophobicContact CD2-CD1 4.4Å; F116-Y152 HydrophobicContact CD2-CD2 4.34Å; F116-Y152 HydrophobicContact CD2-CE1 4.12Å; F116-Y152 AromaticContact CD2-CE2 3.99Å; F116-Y152 HydrophobicContact CD2-CE2 3.99Å; F116-Y152 AromaticContact CD2-CZ 3.87Å; F116-Y152 AromaticContact CE2-CD1 3.29Å; F116-Y152 HydrophobicContact CE2-CD1 3.29Å; F116-Y152 AromaticContact CE2-CD2 3.81Å; F116-Y152 HydrophobicContact CE2-CD2 3.81Å; F116-Y152 AromaticContact CE2-CE1 3.28Å; F116-Y152 HydrophobicContact CE2-CE1 3.28Å; F116-Y152 AromaticContact CE2-CE2 3.75Å; F116-Y152 HydrophobicContact CE2-CE2 3.75Å; F116-Y152 AromaticContact CE2-CG 3.57Å; F116-Y152 HydrophobicContact CE2-CG 3.57Å; F116-Y152 AromaticContact CE2-CZ 3.48Å; F116-Y152 VanDerWaalsContact CE2-CZ 3.48Å; F116-Y152 AromaticContact CZ-CD1 3.67Å; F116-Y152 HydrophobicContact CZ-CD1 3.67Å; F116-Y152 HydrophobicContact CZ-CD2 4.33Å; F116-Y152 HydrophobicContact CZ-CE1 4.13Å; F116-Y152 AromaticContact CZ-CG 3.78Å; F116-Y152 HydrophobicContact CZ-CG 3.78Å; W148-Y152 HydrophobicContact CB-CD2 3.87Å; W148-Y152 HydrophobicContact CB-CE2 3.66Å; W148-Y152 WeakPolarHBondContact O-CD2 3.12Å; W148-Y152 PolarHBondContact O-N 3.32Å; Y152-E154 VanDerWaalsContact C-N 3.29Å; Y152-E154 PolarHBondContact O-N 2.9Å; Y152-D155 PolarHBondContact O-N 2.94Å; Y152-D156 WeakPolarHBondContact O-CB 3.39Å; Y152-D156 PolarHBondContact O-N 2.88Å
153	A	63.5	Low	64	Low	63 Å²	63	75.7 Å²	75.7	52%	0.521	42%	0.421	S	S	.	.	H	α-helix	trans	-63.9	-35.2	-179.6	0	0	0	0	0	112.6	N149 S150 G157	N149-A153 WeakPolarHBondContact O-CB 3.37Å; N149-A153 PolarHBondContact O-N 3.06Å; S150-A153 PolarHBondContact O-N 2.8Å; A153-G157 PolarHBondContact O-N 2.96Å
154	E	66.3	Low	65.4	Low	113 Å²	113	76.2 Å²	76.2	53%	0.528	41%	0.412	S	S	.	.	H	α-helix	trans	-69.3	-40.9	175.7	-170.1	-177.1	159	0	0	111.9	S150 A151 Y152 G157 K158	S150-E154 VanDerWaalsContact O-CB 3.31Å; S150-E154 WeakPolarHBondContact O-CB 3.39Å; S150-E154 PolarHBondContact O-N 3.19Å; A151-E154 PolarHBondContact O-N 3.34Å; Y152-E154 VanDerWaalsContact C-N 3.29Å; Y152-E154 PolarHBondContact O-N 2.9Å; E154-G157 PolarHBondContact O-N 2.93Å; E154-K158 HydrophobicContact CG-CD 4.43Å; E154-K158 VanDerWaalsContact O-CG 3.31Å; E154-K158 WeakPolarHBondContact O-CG 3.43Å; E154-K158 PolarHBondContact O-N 2.93Å; E154-K158 WeakPolarHBondContact OE1-CE 3.41Å; E154-K158 IonicContact OE1-NZ 3.51Å; E154-K158 PolarHBondContact OE1-NZ 2.78Å
155	D	67.7	Low	66.7	Low	35 Å²	35	77.4 Å²	77.4	19%	0.187	42%	0.421	C	S	.	.	H	α-helix	trans	-64.5	-49.7	176.2	-171.2	60.3	0	0	0	111.8	T30 Y56 F116 A151 Y152 G157 K158 S159	T30-D155 WeakPolarHBondContact CB-OD1 3.44Å; T30-D155 HydrophobicContact CG2-CB 4.48Å; T30-D155 WeakPolarHBondContact CG2-OD1 3.49Å; T30-D155 VanDerWaalsContact OG1-CG 3.28Å; T30-D155 PolarHBondContact OG1-OD1 2.96Å; Y56-D155 PolarHBondContact OH-OD2 3.05Å; F116-D155 HydrophobicContact CE1-CB 4.1Å; F116-D155 HydrophobicContact CZ-CB 4.16Å; A151-D155 WeakPolarHBondContact O-CB 3.43Å; A151-D155 PolarHBondContact O-N 3.49Å; Y152-D155 PolarHBondContact O-N 2.94Å; D155-G157 VanDerWaalsContact C-N 3.27Å; D155-G157 PolarHBondContact O-N 3.35Å; D155-K158 PolarHBondContact O-N 3.04Å; D155-K158 VanDerWaalsContact O-N 3.16Å; D155-S159 PolarHBondContact O-N 3.14Å
156	D	62.6	Low	68.3	Low	111 Å²	111	79.1 Å²	79.1	59%	0.594	42%	0.422	S	S	*	.	H	α-helix	trans	-57.4	-42.5	174.6	-78.2	-24.6	0	0	0	111.4	Y152 S159 F160	Y152-D156 WeakPolarHBondContact O-CB 3.39Å; Y152-D156 PolarHBondContact O-N 2.88Å; D156-S159 PolarHBondContact O-N 3.16Å; D156-F160 PolarHBondContact O-N 3.49Å
157	G	64.5	Low	69.8	Low	23 Å²	23	78.3 Å²	78.3	24%	0.237	42%	0.417	C	S	.	.	H	α-helix	trans	-61.2	-48.5	175.7	0	0	0	0	0	112.3	A153 E154 D155 S159 F160 F161	A153-G157 PolarHBondContact O-N 2.96Å; E154-G157 PolarHBondContact O-N 2.93Å; D155-G157 VanDerWaalsContact C-N 3.27Å; D155-G157 PolarHBondContact O-N 3.35Å; G157-S159 VanDerWaalsContact C-N 3.33Å; G157-S159 PolarHBondContact O-N 3.34Å; G157-F160 PolarHBondContact O-N 2.67Å; G157-F161 WeakPolarHBondContact O-CD2 3.37Å; G157-F161 PolarHBondContact O-N 3.33Å
158	K	64.8	Low	71.1	Confident	112 Å²	112	77.2 Å²	77.2	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-60.4	-42.2	178.1	-76.8	170.3	-176.7	162.4	0	111.9	E154 D155 F161 S162	E154-K158 HydrophobicContact CG-CD 4.43Å; E154-K158 VanDerWaalsContact O-CG 3.31Å; E154-K158 WeakPolarHBondContact O-CG 3.43Å; E154-K158 PolarHBondContact O-N 2.93Å; E154-K158 WeakPolarHBondContact OE1-CE 3.41Å; E154-K158 IonicContact OE1-NZ 3.51Å; E154-K158 PolarHBondContact OE1-NZ 2.78Å; D155-K158 PolarHBondContact O-N 3.04Å; D155-K158 VanDerWaalsContact O-N 3.16Å; K158-F161 PolarHBondContact O-N 2.74Å; K158-S162 WeakPolarHBondContact O-CB 3.36Å; K158-S162 PolarHBondContact O-N 3.15Å
159	S	70.7	Confident	72.2	Confident	74 Å²	74	81.9 Å²	81.9	52%	0.517	45%	0.445	S	S	.	.	H	α-helix	trans	-58.7	-48.7	174.8	-179	0	0	0	0	111.3	D155 D156 G157 F161 S162 V163	D155-S159 PolarHBondContact O-N 3.14Å; D156-S159 PolarHBondContact O-N 3.16Å; G157-S159 VanDerWaalsContact C-N 3.33Å; G157-S159 PolarHBondContact O-N 3.34Å; S159-F161 PolarHBondContact O-N 2.94Å; S159-S162 WeakPolarHBondContact O-CB 3.36Å; S159-S162 PolarHBondContact O-N 2.9Å; S159-V163 PolarHBondContact O-N 2.81Å; S159-V163 VanDerWaalsContact O-N 3.08Å
160	F	71.1	Confident	73.5	Confident	137 Å²	137	83.5 Å²	83.5	60%	0.601	45%	0.453	S	S	*	.	H	α-helix	trans	-62	-45.6	177.8	-178.6	-97.7	0	0	0	113.2	D156 G157 S162 V163 L164	D156-F160 PolarHBondContact O-N 3.49Å; G157-F160 PolarHBondContact O-N 2.67Å; F160-S162 VanDerWaalsContact C-N 3.32Å; F160-S162 PolarHBondContact O-N 3.05Å; F160-V163 PolarHBondContact O-N 3.4Å; F160-L164 PolarHBondContact O-N 3.38Å
161	F	73	Confident	74.7	Confident	136 Å²	136	86.8 Å²	86.8	60%	0.596	46%	0.458	S	S	*	.	H	α-helix	trans	-63.8	-36.9	176.9	-80.1	-69	0	0	0	112.4	G157 K158 S159 L164 L165	G157-F161 WeakPolarHBondContact O-CD2 3.37Å; G157-F161 PolarHBondContact O-N 3.33Å; K158-F161 PolarHBondContact O-N 2.74Å; S159-F161 PolarHBondContact O-N 2.94Å; F161-L164 PolarHBondContact O-N 3.48Å; F161-L165 WeakPolarHBondContact O-CB 3.3Å; F161-L165 PolarHBondContact O-N 3.09Å
162	S	71.3	Confident	76.1	Confident	54 Å²	54	89.7 Å²	89.7	38%	0.378	48%	0.478	S	S	.	.	H	α-helix	trans	-60	-49	174.3	179.9	0	0	0	0	110.9	K158 S159 F160 L164 L165 H166	K158-S162 WeakPolarHBondContact O-CB 3.36Å; K158-S162 PolarHBondContact O-N 3.15Å; S159-S162 WeakPolarHBondContact O-CB 3.36Å; S159-S162 PolarHBondContact O-N 2.9Å; F160-S162 VanDerWaalsContact C-N 3.32Å; F160-S162 PolarHBondContact O-N 3.05Å; S162-L164 VanDerWaalsContact C-N 3.32Å; S162-L164 PolarHBondContact O-N 2.67Å; S162-L165 WeakPolarHBondContact O-CB 3.36Å; S162-L165 PolarHBondContact O-N 2.82Å; S162-H166 PolarHBondContact O-N 2.91Å; S162-H166 PolarHBondContact O-ND1 3.06Å; S162-H166 PolarHBondContact OG-CE1 2.58Å; S162-H166 PolarHBondContact OG-ND1 2.87Å
163	V	79.3	Confident	77.4	Confident	79 Å²	79	89.4 Å²	89.4	48%	0.479	49%	0.489	S	S	.	.	H	α-helix	trans	-59.8	-42.6	177.2	173.5	0	0	0	0	111.4	S159 F160 L165 H166 I167	S159-V163 PolarHBondContact O-N 2.81Å; S159-V163 VanDerWaalsContact O-N 3.08Å; F160-V163 PolarHBondContact O-N 3.4Å; V163-L165 PolarHBondContact O-N 3.01Å; V163-H166 PolarHBondContact O-N 3.12Å; V163-I167 HydrophobicContact CG1-CD1 3.78Å; V163-I167 HydrophobicContact CG1-CG1 4.39Å; V163-I167 VanDerWaalsContact O-CG1 3.32Å; V163-I167 WeakPolarHBondContact O-CG1 3.11Å; V163-I167 PolarHBondContact O-N 3.33Å
164	L	81.2	Confident	78.9	Confident	96 Å²	96	90 Å²	90	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-41.6	178.1	-172.8	71.3	0	0	0	112.3	F160 F161 S162 I167 G168	F160-L164 PolarHBondContact O-N 3.38Å; F161-L164 PolarHBondContact O-N 3.48Å; S162-L164 VanDerWaalsContact C-N 3.32Å; S162-L164 PolarHBondContact O-N 2.67Å; L164-I167 PolarHBondContact O-N 3.39Å; L164-G168 PolarHBondContact O-N 2.88Å
165	L	81.4	Confident	80.1	Confident	114 Å²	114	89.6 Å²	89.6	60%	0.597	49%	0.485	S	S	*	.	H	α-helix	trans	-59.9	-50	174.5	-96.7	151.5	0	0	0	111.2	F161 S162 V163 I167 G168 E169	F161-L165 WeakPolarHBondContact O-CB 3.3Å; F161-L165 PolarHBondContact O-N 3.09Å; S162-L165 WeakPolarHBondContact O-CB 3.36Å; S162-L165 PolarHBondContact O-N 2.82Å; V163-L165 PolarHBondContact O-N 3.01Å; L165-I167 VanDerWaalsContact C-N 3.35Å; L165-I167 PolarHBondContact O-N 2.86Å; L165-G168 WeakPolarHBondContact O-CA 3.46Å; L165-G168 PolarHBondContact O-N 2.78Å; L165-G168 VanDerWaalsContact O-N 3.09Å; L165-E169 WeakPolarHBondContact O-CG 3.43Å; L165-E169 PolarHBondContact O-N 3.07Å
166	H	81.2	Confident	81.2	Confident	107 Å²	107	92.6 Å²	92.6	50%	0.495	50%	0.501	S	S	.	.	H	α-helix	trans	-60.6	-42.6	178.1	-73.1	83.3	0	0	0	112	S162 V163 G168 E169 I170	S162-H166 PolarHBondContact O-N 2.91Å; S162-H166 PolarHBondContact O-ND1 3.06Å; S162-H166 PolarHBondContact OG-CE1 2.58Å; S162-H166 PolarHBondContact OG-ND1 2.87Å; V163-H166 PolarHBondContact O-N 3.12Å; H166-G168 VanDerWaalsContact C-N 3.32Å; H166-G168 PolarHBondContact O-N 2.84Å; H166-E169 PolarHBondContact O-N 2.66Å; H166-I170 VanDerWaalsContact O-CG1 3.31Å; H166-I170 WeakPolarHBondContact O-CG1 3.21Å; H166-I170 PolarHBondContact O-N 2.89Å
167	I	85.8	Confident	82.6	Confident	82 Å²	82	93.6 Å²	93.6	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-62.7	-41.2	174.9	-69.4	170	0	0	0	110.7	V163 L164 L165 I170 F171	V163-I167 HydrophobicContact CG1-CD1 3.78Å; V163-I167 HydrophobicContact CG1-CG1 4.39Å; V163-I167 VanDerWaalsContact O-CG1 3.32Å; V163-I167 WeakPolarHBondContact O-CG1 3.11Å; V163-I167 PolarHBondContact O-N 3.33Å; L164-I167 PolarHBondContact O-N 3.39Å; L165-I167 VanDerWaalsContact C-N 3.35Å; L165-I167 PolarHBondContact O-N 2.86Å; I167-I170 PolarHBondContact O-N 2.99Å; I167-F171 HydrophobicContact CG2-CD2 3.83Å; I167-F171 HydrophobicContact CG2-CE2 4.14Å; I167-F171 PolarHBondContact O-N 3.47Å
168	G	89.2	Confident	83.9	Confident	39 Å²	39	97 Å²	97	40%	0.402	51%	0.512	S	S	.	.	H	α-helix	trans	-61.1	-42.5	176	0	0	0	0	0	112.8	L164 L165 H166 F171 S172	L164-G168 PolarHBondContact O-N 2.88Å; L165-G168 WeakPolarHBondContact O-CA 3.46Å; L165-G168 PolarHBondContact O-N 2.78Å; L165-G168 VanDerWaalsContact O-N 3.09Å; H166-G168 VanDerWaalsContact C-N 3.32Å; H166-G168 PolarHBondContact O-N 2.84Å; G168-F171 PolarHBondContact O-N 3.48Å; G168-S172 WeakPolarHBondContact O-CB 3.03Å; G168-S172 PolarHBondContact O-N 3.1Å
169	E	87.3	Confident	85.2	Confident	123 Å²	123	95.4 Å²	95.4	58%	0.575	51%	0.509	S	S	*	.	H	α-helix	trans	-61.9	-43.5	174.7	-70.7	175.8	164.7	0	0	111.7	L165 H166 S172 A173	L165-E169 WeakPolarHBondContact O-CG 3.43Å; L165-E169 PolarHBondContact O-N 3.07Å; H166-E169 PolarHBondContact O-N 2.66Å; E169-S172 PolarHBondContact O-N 3.17Å; E169-A173 PolarHBondContact O-N 3.35Å
170	I	91.6	Very high	86.1	Confident	109 Å²	109	96.3 Å²	96.3	56%	0.559	51%	0.508	S	S	*	.	H	α-helix	trans	-62.8	-47	175.9	-66.9	165.7	0	0	0	110.8	H166 I167 S172 A173 V174	H166-I170 VanDerWaalsContact O-CG1 3.31Å; H166-I170 WeakPolarHBondContact O-CG1 3.21Å; H166-I170 PolarHBondContact O-N 2.89Å; I167-I170 PolarHBondContact O-N 2.99Å; I170-S172 VanDerWaalsContact C-N 3.34Å; I170-S172 PolarHBondContact O-N 3.39Å; I170-A173 PolarHBondContact O-N 2.92Å; I170-V174 HydrophobicContact CG2-CG2 4.49Å; I170-V174 WeakPolarHBondContact O-CG2 3.39Å; I170-V174 PolarHBondContact O-N 3.25Å
171	F	91.3	Very high	86.7	Confident	142 Å²	142	92.7 Å²	92.7	62%	0.623	49%	0.494	S	S	*	.	H	α-helix	trans	-61.3	-42.9	178.1	-103.2	-83.4	0	0	0	112.2	I167 G168 A173 V174 M175	I167-F171 HydrophobicContact CG2-CD2 3.83Å; I167-F171 HydrophobicContact CG2-CE2 4.14Å; I167-F171 PolarHBondContact O-N 3.47Å; G168-F171 PolarHBondContact O-N 3.48Å; F171-A173 VanDerWaalsContact C-N 3.35Å; F171-V174 PolarHBondContact O-N 3.41Å; F171-M175 WeakPolarHBondContact O-CB 3.41Å; F171-M175 PolarHBondContact O-N 2.92Å
172	S	92	Very high	87.4	Confident	69 Å²	69	93.2 Å²	93.2	48%	0.483	50%	0.497	S	S	.	.	H	α-helix	trans	-58.1	-47.2	175.6	-176.8	0	0	0	0	111.1	G168 E169 I170 V174 M175 L176	G168-S172 WeakPolarHBondContact O-CB 3.03Å; G168-S172 PolarHBondContact O-N 3.1Å; E169-S172 PolarHBondContact O-N 3.17Å; I170-S172 VanDerWaalsContact C-N 3.34Å; I170-S172 PolarHBondContact O-N 3.39Å; S172-V174 PolarHBondContact O-N 3.24Å; S172-M175 PolarHBondContact O-N 3.02Å; S172-L176 WeakPolarHBondContact O-CG 3.5Å; S172-L176 PolarHBondContact O-N 2.92Å
173	A	90.4	Very high	87.9	Confident	59 Å²	59	95.4 Å²	95.4	49%	0.488	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-42	177.9	0	0	0	0	0	112.7	E169 I170 F171 L176 F177	E169-A173 PolarHBondContact O-N 3.35Å; I170-A173 PolarHBondContact O-N 2.92Å; F171-A173 VanDerWaalsContact C-N 3.35Å; A173-L176 PolarHBondContact O-N 3.09Å; A173-F177 PolarHBondContact O-N 2.7Å
174	V	93.4	Very high	87.9	Confident	75 Å²	75	97.9 Å²	97.9	46%	0.455	51%	0.509	S	S	.	.	H	α-helix	trans	-65.5	-41.9	176.7	173	0	0	0	0	111.3	I170 F171 S172 F177 L178	I170-V174 HydrophobicContact CG2-CG2 4.49Å; I170-V174 WeakPolarHBondContact O-CG2 3.39Å; I170-V174 PolarHBondContact O-N 3.25Å; F171-V174 PolarHBondContact O-N 3.41Å; S172-V174 PolarHBondContact O-N 3.24Å; V174-F177 PolarHBondContact O-N 3.45Å; V174-L178 HydrophobicContact CG1-CD1 4.17Å; V174-L178 HydrophobicContact CG1-CG 4.41Å; V174-L178 WeakPolarHBondContact O-CG 3.38Å; V174-L178 PolarHBondContact O-N 2.84Å
175	M	92.6	Very high	87.6	Confident	105 Å²	105	99.2 Å²	99.2	52%	0.517	52%	0.517	S	S	.	.	H	α-helix	trans	-63.6	-42.4	177	-83.5	-64	-67.1	0	0	112.4	F171 S172 F177 L178 I179	F171-M175 WeakPolarHBondContact O-CB 3.41Å; F171-M175 PolarHBondContact O-N 2.92Å; S172-M175 PolarHBondContact O-N 3.02Å; M175-F177 VanDerWaalsContact C-N 3.34Å; M175-L178 PolarHBondContact O-N 3.5Å; M175-I179 HydrophobicContact CE-CD1 4.5Å; M175-I179 VanDerWaalsContact O-CG1 3.25Å; M175-I179 WeakPolarHBondContact O-CG1 3.5Å; M175-I179 PolarHBondContact O-N 3.16Å
176	L	90.8	Very high	87.3	Confident	99 Å²	99	97.6 Å²	97.6	52%	0.518	52%	0.515	S	S	.	.	H	α-helix	trans	-60	-45.8	174.2	-72.8	172.6	0	0	0	111.2	S172 A173 L178 I179 D180	S172-L176 WeakPolarHBondContact O-CG 3.5Å; S172-L176 PolarHBondContact O-N 2.92Å; A173-L176 PolarHBondContact O-N 3.09Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 3.28Å; L176-I179 PolarHBondContact O-N 2.63Å; L176-D180 PolarHBondContact O-N 2.93Å
177	F	92.7	Very high	86.9	Confident	131 Å²	131	96.4 Å²	96.4	58%	0.575	52%	0.524	S	S	*	.	H	α-helix	trans	-58.5	-44.2	175.8	179.8	-100.5	0	0	0	112.2	A173 V174 M175 D180 N181	A173-F177 PolarHBondContact O-N 2.7Å; V174-F177 PolarHBondContact O-N 3.45Å; M175-F177 VanDerWaalsContact C-N 3.34Å; F177-D180 PolarHBondContact O-N 3.36Å; F177-N181 VanDerWaalsContact CE1-ND2 3.3Å; F177-N181 WeakPolarHBondContact CE1-ND2 3.43Å; F177-N181 VanDerWaalsContact CE2-ND2 3.34Å; F177-N181 WeakPolarHBondContact CE2-ND2 3.43Å; F177-N181 WeakPolarHBondContact CZ-ND2 3.21Å; F177-N181 PolarHBondContact O-N 3.14Å; F177-N181 PolarHBondContact O-ND2 3.13Å
178	L	91	Very high	85.7	Confident	94 Å²	94	103.9 Å²	103.9	49%	0.492	55%	0.554	S	S	.	*	H	α-helix	trans	-66.3	-38.4	178.2	-68.9	176.3	0	0	0	112.6	V174 M175 L176 F182	V174-L178 HydrophobicContact CG1-CD1 4.17Å; V174-L178 HydrophobicContact CG1-CG 4.41Å; V174-L178 WeakPolarHBondContact O-CG 3.38Å; V174-L178 PolarHBondContact O-N 2.84Å; M175-L178 PolarHBondContact O-N 3.5Å; L176-L178 VanDerWaalsContact C-N 3.34Å; L176-L178 PolarHBondContact O-N 3.28Å; L178-F182 VanDerWaalsContact O-CB 3.28Å; L178-F182 WeakPolarHBondContact O-CB 3.31Å; L178-F182 PolarHBondContact O-N 2.94Å
179	I	92	Very high	85.5	Confident	80 Å²	80	107.2 Å²	107.2	41%	0.41	56%	0.561	S	S	.	*	H	α-helix	trans	-63.9	-45.9	175.9	-69.7	165.4	0	0	0	110.1	M175 L176 N181 F182 I183	M175-I179 HydrophobicContact CE-CD1 4.5Å; M175-I179 VanDerWaalsContact O-CG1 3.25Å; M175-I179 WeakPolarHBondContact O-CG1 3.5Å; M175-I179 PolarHBondContact O-N 3.16Å; L176-I179 PolarHBondContact O-N 2.63Å; I179-N181 PolarHBondContact O-N 2.87Å; I179-F182 PolarHBondContact O-N 2.77Å; I179-I183 HydrophobicContact CG2-CD1 3.71Å; I179-I183 HydrophobicContact CG2-CG1 4.36Å; I179-I183 VanDerWaalsContact O-CG1 3.29Å; I179-I183 WeakPolarHBondContact O-CG1 3.47Å; I179-I183 PolarHBondContact O-N 2.98Å
180	D	89.3	Confident	85.4	Confident	93 Å²	93	106.3 Å²	106.3	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-60.3	-46.8	178.4	-70.4	-21.2	0	0	0	111.3	L176 F177 F182 I183 E184	L176-D180 PolarHBondContact O-N 2.93Å; F177-D180 PolarHBondContact O-N 3.36Å; D180-F182 VanDerWaalsContact C-N 3.32Å; D180-F182 PolarHBondContact O-N 2.9Å; D180-I183 PolarHBondContact O-N 3.49Å; D180-E184 PolarHBondContact O-N 3.43Å
181	N	84.8	Confident	85.1	Confident	60 Å²	60	106.2 Å²	106.2	32%	0.321	56%	0.56	S	S	.	*	H	α-helix	trans	-63.3	-37	176.2	-79.3	-93.7	0	0	0	112.2	F177 I179 E184 L185	F177-N181 VanDerWaalsContact CE1-ND2 3.3Å; F177-N181 WeakPolarHBondContact CE1-ND2 3.43Å; F177-N181 VanDerWaalsContact CE2-ND2 3.34Å; F177-N181 WeakPolarHBondContact CE2-ND2 3.43Å; F177-N181 WeakPolarHBondContact CZ-ND2 3.21Å; F177-N181 PolarHBondContact O-N 3.14Å; F177-N181 PolarHBondContact O-ND2 3.13Å; I179-N181 PolarHBondContact O-N 2.87Å; N181-E184 PolarHBondContact O-N 3.13Å; N181-L185 WeakPolarHBondContact O-CB 3.48Å; N181-L185 WeakPolarHBondContact O-CD1 3.31Å; N181-L185 PolarHBondContact O-N 3.07Å
182	F	86.7	Confident	84.7	Confident	148 Å²	148	104.1 Å²	104.1	65%	0.649	56%	0.557	S	S	*	*	H	α-helix	trans	-69.9	-39.1	178.9	-170.8	-95	0	0	0	112.1	L178 I179 D180 E184 L185 S186	L178-F182 VanDerWaalsContact O-CB 3.28Å; L178-F182 WeakPolarHBondContact O-CB 3.31Å; L178-F182 PolarHBondContact O-N 2.94Å; I179-F182 PolarHBondContact O-N 2.77Å; D180-F182 VanDerWaalsContact C-N 3.32Å; D180-F182 PolarHBondContact O-N 2.9Å; F182-E184 VanDerWaalsContact C-N 3.34Å; F182-L185 PolarHBondContact O-N 3.17Å; F182-S186 WeakPolarHBondContact O-CB 3.29Å; F182-S186 PolarHBondContact O-N 2.76Å; F182-S186 PolarHBondContact O-OG 3.35Å
183	I	81.1	Confident	84.3	Confident	99 Å²	99	106.3 Å²	106.3	51%	0.508	56%	0.561	S	S	.	*	H	α-helix	trans	-62	-44.5	174.5	-69.2	167.6	0	0	0	109.8	I179 D180 L185 S186 A187	I179-I183 HydrophobicContact CG2-CD1 3.71Å; I179-I183 HydrophobicContact CG2-CG1 4.36Å; I179-I183 VanDerWaalsContact O-CG1 3.29Å; I179-I183 WeakPolarHBondContact O-CG1 3.47Å; I179-I183 PolarHBondContact O-N 2.98Å; D180-I183 PolarHBondContact O-N 3.49Å; I183-L185 PolarHBondContact O-N 3.25Å; I183-S186 PolarHBondContact O-N 3.4Å; I183-S186 PolarHBondContact O-OG 3.01Å; I183-A187 PolarHBondContact O-N 3.18Å
184	E	79.4	Confident	83.9	Confident	131 Å²	131	109.4 Å²	109.4	61%	0.612	57%	0.566	S	S	*	*	H	α-helix	trans	-60.8	-43.8	175.2	-73.8	-173.3	176	0	0	112.5	D180 N181 F182 S186 A187 F188	D180-E184 PolarHBondContact O-N 3.43Å; N181-E184 PolarHBondContact O-N 3.13Å; F182-E184 VanDerWaalsContact C-N 3.34Å; E184-S186 VanDerWaalsContact C-N 3.3Å; E184-S186 PolarHBondContact O-N 2.93Å; E184-A187 WeakPolarHBondContact O-CB 3.36Å; E184-A187 PolarHBondContact O-N 2.69Å; E184-F188 VanDerWaalsContact O-CD2 3.29Å; E184-F188 WeakPolarHBondContact O-CD2 3.45Å
185	L	75	Confident	83.2	Confident	125 Å²	125	111.9 Å²	111.9	65%	0.654	57%	0.574	S	S	*	*	H	α-helix	trans	-63.5	-33.8	176.3	-87.8	151.6	0	0	0	113.1	N181 F182 I183 A187	N181-L185 WeakPolarHBondContact O-CB 3.48Å; N181-L185 WeakPolarHBondContact O-CD1 3.31Å; N181-L185 PolarHBondContact O-N 3.07Å; F182-L185 PolarHBondContact O-N 3.17Å; I183-L185 PolarHBondContact O-N 3.25Å; L185-A187 VanDerWaalsContact C-N 3.27Å; L185-A187 PolarHBondContact O-N 3.39Å
186	S	76.4	Confident	82.5	Confident	79 Å²	79	112.4 Å²	112.4	55%	0.552	58%	0.579	S	S	*	*	H	α-helix	trans	-77	-13	178.1	73	0	0	0	0	114.1	F182 I183 E184 F188	F182-S186 WeakPolarHBondContact O-CB 3.29Å; F182-S186 PolarHBondContact O-N 2.76Å; F182-S186 PolarHBondContact O-OG 3.35Å; I183-S186 PolarHBondContact O-N 3.4Å; I183-S186 PolarHBondContact O-OG 3.01Å; E184-S186 VanDerWaalsContact C-N 3.3Å; E184-S186 PolarHBondContact O-N 2.93Å; S186-F188 VanDerWaalsContact C-N 3.31Å
187	A	71.9	Confident	81.8	Confident	83 Å²	83	113.5 Å²	113.5	69%	0.686	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-4.8	177.2	0	0	0	0	0	113.4	I183 E184 L185	I183-A187 PolarHBondContact O-N 3.18Å; E184-A187 WeakPolarHBondContact O-CB 3.36Å; E184-A187 PolarHBondContact O-N 2.69Å; L185-A187 VanDerWaalsContact C-N 3.27Å; L185-A187 PolarHBondContact O-N 3.39Å
188	F	60.9	Low	80.8	Confident	239 Å²	239	111.9 Å²	111.9	100%	1.048	59%	0.585	S	S	*	*			trans	-106.2	0	174.2	-71	-79.7	0	0	0	111.8	E184 S186	E184-F188 VanDerWaalsContact O-CD2 3.29Å; E184-F188 WeakPolarHBondContact O-CD2 3.45Å; S186-F188 VanDerWaalsContact C-N 3.31Å

Retrieved 188 of 188 residues in 178.1 ms (Link to these results)

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