A0A077Z4Z0_TRITR Loading...

GSK3-beta interaction protein

AlphaFold DB , UniProt , Accession A0A077Z4Z0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 170 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	39.7	Very low	43.7	Very low	241 Å²	241	151.7 Å²	151.7	100%	1.187	85%	0.853	S	S	*	*				0	109.8	0	-99.8	169.5	179.9	0	0	108.5
2	L	44.3	Very low	43.8	Very low	141 Å²	141	145 Å²	145	74%	0.738	84%	0.843	S	S	*	*			trans	60.1	92.6	148.1	-52.8	173.2	0	0	0	121
3	F	47.8	Very low	44.3	Very low	196 Å²	196	142.6 Å²	142.6	86%	0.86	84%	0.839	S	S	*	*			trans	80.5	112.1	132.2	-60.8	-61.2	0	0	0	122.3
4	R	37.5	Very low	44.4	Very low	238 Å²	238	141.9 Å²	141.9	90%	0.898	84%	0.84	S	S	*	*			trans	-84	149.3	162.2	-68.2	170.4	104.3	171.2	3.7	110.6
5	S	43.2	Very low	44.3	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	84%	0.835	S	S	*	*			trans	10.2	140.3	146.6	-46.4	0	0	0	0	120.8
6	T	51.2	Low	44.7	Very low	142 Å²	142	140.3 Å²	140.3	87%	0.871	84%	0.836	S	S	*	*				-169.3	145	121.1	33.4	0	0	0	0	112.4
7	D	39.6	Very low	45.5	Very low	166 Å²	166	137.6 Å²	137.6	89%	0.888	83%	0.827	S	S	*	*			trans	-51.1	163.3	174.6	-64.9	-63.2	0	0	0	116.5
8	G	41.7	Very low	46.9	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	82%	0.823	S	S	*	*			trans	-166.5	68.7	168	0	0	0	0	0	111.8	A10	G8-A10 PolarHBondContact O-N 3.33Å
9	S	41.8	Very low	48.5	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	79%	0.789	S	S	*	*			trans	-50.6	123.8	166.7	-178.9	0	0	0	0	111.3
10	A	50.3	Low	50.5	Low	98 Å²	98	126.2 Å²	126.2	81%	0.81	76%	0.761	S	S	*	*			trans	-128.4	81.6	161.2	0	0	0	0	0	108.1	G8 G12	G8-A10 PolarHBondContact O-N 3.33Å; A10-G12 VanDerWaalsContact C-N 3.32Å; A10-G12 PolarHBondContact O-N 3.1Å
11	N	44.2	Very low	52.6	Low	154 Å²	154	124 Å²	124	82%	0.824	75%	0.751	S	S	*	*			trans	-63.5	94.5	158.3	-94.7	-5.2	0	0	0	108
12	G	45	Very low	55.2	Low	71 Å²	71	112.6 Å²	112.6	73%	0.732	70%	0.695	S	S	*	*			trans	-86.2	97.7	163	0	0	0	0	0	108.8	A10	A10-G12 VanDerWaalsContact C-N 3.32Å; A10-G12 PolarHBondContact O-N 3.1Å
13	S	49.6	Very low	57.6	Low	114 Å²	114	107.5 Å²	107.5	80%	0.797	67%	0.667	S	S	*	*			trans	-59.9	127.3	169.6	-59.7	0	0	0	0	109.4
14	P	45.2	Very low	59.8	Low	132 Å²	132	102.8 Å²	102.8	86%	0.857	65%	0.651	S	S	*	*			trans	-81.3	129.3	176.9	30.9	-29.1	0	0	0	109.9
15	G	43.8	Very low	62.6	Low	73 Å²	73	94.7 Å²	94.7	75%	0.753	62%	0.623	S	S	*	*			trans	122.5	5.2	146.2	0	0	0	0	0	120.2	S17	G15-S17 PolarHBondContact O-N 3.16Å
16	E	49.8	Very low	65.2	Low	185 Å²	185	89.7 Å²	89.7	86%	0.864	59%	0.588	S	S	*	*			trans	-81.5	95.7	165.4	-71.6	-175.6	146.5	0	0	108.5	S18	E16-S18 PolarHBondContact O-N 2.68Å
17	S	58.3	Low	67.2	Low	96 Å²	96	86.6 Å²	86.6	67%	0.671	57%	0.565	S	S	*	*			trans	-67	84.7	172.3	53.3	0	0	0	0	109.1	G15 L19	G15-S17 PolarHBondContact O-N 3.16Å; S17-L19 PolarHBondContact O-N 3.12Å
18	S	71	Confident	69.9	Low	109 Å²	109	80.4 Å²	80.4	76%	0.762	54%	0.538	S	S	*	.			trans	-55.7	109.9	170.6	-57.9	0	0	0	0	108.6	E16 N20	E16-S18 PolarHBondContact O-N 2.68Å; S18-N20 PolarHBondContact O-N 3.01Å
19	L	78.3	Confident	72.5	Confident	35 Å²	35	76.9 Å²	76.9	18%	0.183	50%	0.501	C	S	.	.			trans	-55.4	132.7	174.9	-68.8	169.6	0	0	0	109	S17 E23 L24 I27 F164 I167	S17-L19 PolarHBondContact O-N 3.12Å; L19-E23 WeakPolarHBondContact CA-OE2 3.45Å; L19-E23 HydrophobicContact CB-CB 4.2Å; L19-E23 HydrophobicContact CD2-CB 4Å; L19-L24 HydrophobicContact CB-CD2 3.98Å; L19-L24 HydrophobicContact CB-CG 4.02Å; L19-L24 HydrophobicContact CD1-CD2 3.85Å; L19-I27 HydrophobicContact CD1-CD1 3.79Å; L19-F164 HydrophobicContact CD2-CZ 3.95Å; L19-I167 HydrophobicContact CD1-CD1 3.9Å
20	N	88.6	Confident	75.1	Confident	40 Å²	40	72 Å²	72	21%	0.214	47%	0.466	C	S	.	.			trans	-75.9	167.4	176	69.7	62.5	0	0	0	111	S18 L22 E23 L24 S50	S18-N20 PolarHBondContact O-N 3.01Å; N20-L22 VanDerWaalsContact C-N 3.27Å; N20-L22 PolarHBondContact O-N 2.79Å; N20-L22 PolarHBondContact OD1-N 3.49Å; N20-E23 PolarHBondContact N-OE2 3.46Å; N20-E23 WeakPolarHBondContact ND2-CG 3.28Å; N20-E23 PolarHBondContact ND2-OE2 3.33Å; N20-E23 WeakPolarHBondContact O-CB 3.42Å; N20-E23 PolarHBondContact O-N 3.32Å; N20-E23 PolarHBondContact OD1-N 3.41Å; N20-L24 PolarHBondContact O-N 3.24Å; N20-L24 VanDerWaalsContact O-N 3.11Å; N20-S50 WeakPolarHBondContact ND2-CA 3.41Å
21	S	92.8	Very high	77.2	Confident	81 Å²	81	74.5 Å²	74.5	57%	0.566	46%	0.461	S	S	*	.	H	α-helix	trans	-54.4	-41.1	-176.2	-168	0	0	0	0	113.3	L24 E25	S21-L24 PolarHBondContact O-N 3.31Å; S21-E25 WeakPolarHBondContact O-CB 3.46Å; S21-E25 PolarHBondContact O-N 3.45Å
22	L	95.8	Very high	79.5	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	44%	0.439	C	S	.	.	H	α-helix	trans	-72.4	-32.8	-179.7	-61.6	-176.7	0	0	0	111.9	N20 E25 A26 E51 I53 L69 M71	N20-L22 VanDerWaalsContact C-N 3.27Å; N20-L22 PolarHBondContact O-N 2.79Å; N20-L22 PolarHBondContact OD1-N 3.49Å; L22-E25 PolarHBondContact O-N 3.42Å; L22-A26 WeakPolarHBondContact O-CB 3.43Å; L22-A26 PolarHBondContact O-N 3.04Å; L22-E51 WeakPolarHBondContact CD1-O 3.43Å; L22-I53 VanDerWaalsContact C-CD1 3.43Å; L22-I53 HydrophobicContact CB-CD1 3.73Å; L22-I53 HydrophobicContact CB-CG1 4.21Å; L22-I53 WeakPolarHBondContact O-CD1 3.35Å; L22-L69 HydrophobicContact CB-CD2 4.26Å; L22-L69 HydrophobicContact CB-CG 4.47Å; L22-L69 HydrophobicContact CD2-CD1 4.24Å; L22-L69 HydrophobicContact CD2-CD2 4.45Å; L22-L69 HydrophobicContact CD2-CG 4.07Å; L22-L69 WeakPolarHBondContact O-CD2 3.47Å; L22-M71 HydrophobicContact CD1-CE 3.77Å; L22-M71 HydrophobicContact CD2-CE 3.79Å; L22-M71 HydrophobicContact CD2-SD 3.85Å; L22-M71 HydrophobicContact CG-CE 3.45Å; L22-M71 VanDerWaalsContact CG-CE 3.45Å; L22-M71 HydrophobicContact CG-SD 4.2Å
23	E	94.7	Very high	81.8	Confident	33 Å²	33	67.4 Å²	67.4	15%	0.154	40%	0.404	C	S	.	.	H	α-helix	trans	-65.3	-42.8	176	-69.3	178.7	127.9	0	0	111.4	L19 N20 E25 A26 I27 R48 I53	L19-E23 WeakPolarHBondContact CA-OE2 3.45Å; L19-E23 HydrophobicContact CB-CB 4.2Å; L19-E23 HydrophobicContact CD2-CB 4Å; N20-E23 PolarHBondContact N-OE2 3.46Å; N20-E23 WeakPolarHBondContact ND2-CG 3.28Å; N20-E23 PolarHBondContact ND2-OE2 3.33Å; N20-E23 WeakPolarHBondContact O-CB 3.42Å; N20-E23 PolarHBondContact O-N 3.32Å; N20-E23 PolarHBondContact OD1-N 3.41Å; E23-E25 VanDerWaalsContact C-N 3.32Å; E23-A26 PolarHBondContact O-N 3.28Å; E23-I27 WeakPolarHBondContact O-CB 3.46Å; E23-I27 WeakPolarHBondContact O-CD1 3.33Å; E23-I27 WeakPolarHBondContact O-CG1 3.39Å; E23-I27 PolarHBondContact O-N 3.33Å; E23-R48 IonicContact OE1-CZ 3.4Å; E23-R48 IonicContact OE1-NE 3.23Å; E23-R48 PolarHBondContact OE1-NE 3.21Å; E23-R48 IonicContact OE1-NH2 2.74Å; E23-R48 PolarHBondContact OE1-NH2 3.46Å; E23-I53 HydrophobicContact CB-CD1 4.24Å; E23-I53 HydrophobicContact CG-CD1 3.64Å
24	L	94.5	Very high	83.9	Confident	97 Å²	97	65 Å²	65	51%	0.508	38%	0.38	S	S	.	.	H	α-helix	trans	-62.1	-41.8	174.1	-68.4	173.1	0	0	0	111.4	L19 N20 S21 I27 A28	L19-L24 HydrophobicContact CB-CD2 3.98Å; L19-L24 HydrophobicContact CB-CG 4.02Å; L19-L24 HydrophobicContact CD1-CD2 3.85Å; N20-L24 PolarHBondContact O-N 3.24Å; N20-L24 VanDerWaalsContact O-N 3.11Å; S21-L24 PolarHBondContact O-N 3.31Å; L24-I27 PolarHBondContact O-N 3.5Å; L24-A28 WeakPolarHBondContact O-CB 3.34Å; L24-A28 PolarHBondContact O-N 3.22Å
25	E	96.1	Very high	86.1	Confident	69 Å²	69	63.2 Å²	63.2	32%	0.322	36%	0.359	S	S	.	.	H	α-helix	trans	-67.3	-40.5	177.9	179.4	171	-176.7	0	0	112.6	S21 L22 E23 I27 A28 A29 L69 W74	S21-E25 WeakPolarHBondContact O-CB 3.46Å; S21-E25 PolarHBondContact O-N 3.45Å; L22-E25 PolarHBondContact O-N 3.42Å; E23-E25 VanDerWaalsContact C-N 3.32Å; E25-I27 PolarHBondContact O-N 3.26Å; E25-A28 PolarHBondContact O-N 2.91Å; E25-A29 WeakPolarHBondContact O-CB 3.42Å; E25-A29 PolarHBondContact O-N 3.3Å; E25-L69 HydrophobicContact CB-CD2 4.11Å; E25-L69 HydrophobicContact CG-CD1 4.33Å; E25-L69 HydrophobicContact CG-CD2 3.96Å; E25-W74 HydrophobicContact CG-CH2 4.25Å; E25-W74 HydrophobicContact CG-CZ2 3.56Å; E25-W74 WeakPolarHBondContact OE1-CZ2 3.5Å; E25-W74 PolarHBondContact OE1-NE1 2.82Å
26	A	96.4	Very high	88.5	Confident	2 Å²	2	59.7 Å²	59.7	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-43	173.8	0	0	0	0	0	111.6	L22 E23 A29 V30 V42 I53 L55 L69	L22-A26 WeakPolarHBondContact O-CB 3.43Å; L22-A26 PolarHBondContact O-N 3.04Å; E23-A26 PolarHBondContact O-N 3.28Å; A26-A29 PolarHBondContact O-N 3.19Å; A26-V30 VanDerWaalsContact O-CG2 3.3Å; A26-V30 WeakPolarHBondContact O-CG2 3.17Å; A26-V30 PolarHBondContact O-N 3.5Å; A26-V42 HydrophobicContact CB-CG2 4.45Å; A26-I53 HydrophobicContact CB-CD1 4.21Å; A26-I53 HydrophobicContact CB-CG2 4.18Å; A26-L55 HydrophobicContact CB-CD1 4.44Å; A26-L55 HydrophobicContact CB-CD2 4.25Å; A26-L69 HydrophobicContact CB-CD2 4.01Å
27	I	94.8	Very high	90.8	Very high	76 Å²	76	51.4 Å²	51.4	39%	0.39	29%	0.285	S	S	.	.	H	α-helix	trans	-62.8	-46.1	176.6	-69.5	162.9	0	0	0	110.5	L19 E23 L24 E25 A29 V30 H31	L19-I27 HydrophobicContact CD1-CD1 3.79Å; E23-I27 WeakPolarHBondContact O-CB 3.46Å; E23-I27 WeakPolarHBondContact O-CD1 3.33Å; E23-I27 WeakPolarHBondContact O-CG1 3.39Å; E23-I27 PolarHBondContact O-N 3.33Å; L24-I27 PolarHBondContact O-N 3.5Å; E25-I27 PolarHBondContact O-N 3.26Å; I27-A29 VanDerWaalsContact C-N 3.34Å; I27-A29 PolarHBondContact O-N 2.97Å; I27-V30 PolarHBondContact O-N 3.44Å; I27-H31 PolarHBondContact O-N 3.35Å; I27-H31 VanDerWaalsContact O-N 3.09Å
28	A	95.9	Very high	92.6	Very high	37 Å²	37	54.2 Å²	54.2	31%	0.306	28%	0.28	S	S	.	.	H	α-helix	trans	-58.5	-46.3	176.7	0	0	0	0	0	111.1	L24 E25 V30 H31 E32	L24-A28 WeakPolarHBondContact O-CB 3.34Å; L24-A28 PolarHBondContact O-N 3.22Å; E25-A28 PolarHBondContact O-N 2.91Å; A28-V30 PolarHBondContact O-N 3.42Å; A28-H31 PolarHBondContact O-N 3.16Å; A28-E32 VanDerWaalsContact O-CB 3.3Å; A28-E32 WeakPolarHBondContact O-CB 2.97Å; A28-E32 WeakPolarHBondContact O-CG 3.28Å; A28-E32 PolarHBondContact O-N 3.41Å
29	A	96.3	Very high	93.9	Very high	2 Å²	2	52.1 Å²	52.1	2%	0.017	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-41.5	179.4	0	0	0	0	0	113.2	E25 A26 I27 H31 E32 L33 W74 V101	E25-A29 WeakPolarHBondContact O-CB 3.42Å; E25-A29 PolarHBondContact O-N 3.3Å; A26-A29 PolarHBondContact O-N 3.19Å; I27-A29 VanDerWaalsContact C-N 3.34Å; I27-A29 PolarHBondContact O-N 2.97Å; A29-H31 VanDerWaalsContact C-N 3.33Å; A29-H31 PolarHBondContact O-N 3.12Å; A29-E32 PolarHBondContact O-N 2.99Å; A29-L33 VanDerWaalsContact O-CB 3.26Å; A29-L33 WeakPolarHBondContact O-CB 3.31Å; A29-L33 WeakPolarHBondContact O-CG 3.13Å; A29-L33 PolarHBondContact O-N 3.22Å; A29-W74 HydrophobicContact CB-CH2 3.37Å; A29-W74 HydrophobicContact CB-CZ2 4.05Å; A29-W74 HydrophobicContact CB-CZ3 4.12Å; A29-V101 HydrophobicContact CB-CB 4.44Å; A29-V101 HydrophobicContact CB-CG1 4.25Å; A29-V101 HydrophobicContact CB-CG2 4.26Å
30	V	96.8	Very high	94.8	Very high	6 Å²	6	50.7 Å²	50.7	4%	0.036	25%	0.253	C	S	.	.	H	α-helix	trans	-58.1	-48.9	174.7	172.4	0	0	0	0	110.1	A26 I27 A28 H34 I40 L55 F158	A26-V30 VanDerWaalsContact O-CG2 3.3Å; A26-V30 WeakPolarHBondContact O-CG2 3.17Å; A26-V30 PolarHBondContact O-N 3.5Å; I27-V30 PolarHBondContact O-N 3.44Å; A28-V30 PolarHBondContact O-N 3.42Å; V30-H34 WeakPolarHBondContact O-CB 3.36Å; V30-H34 PolarHBondContact O-N 3.28Å; V30-I40 HydrophobicContact CG1-CG2 4.25Å; V30-I40 HydrophobicContact CG2-CG1 4.1Å; V30-L55 HydrophobicContact CG2-CD2 4.27Å; V30-F158 HydrophobicContact CG1-CE1 4.28Å; V30-F158 HydrophobicContact CG1-CE2 3.79Å; V30-F158 HydrophobicContact CG1-CZ 3.57Å
31	H	93.5	Very high	95.2	Very high	151 Å²	151	50.5 Å²	50.5	70%	0.699	26%	0.255	S	S	*	.	H	α-helix	trans	-64.9	-46.7	-178.8	177.8	-94.3	0	0	0	112.2	I27 A28 A29	I27-H31 PolarHBondContact O-N 3.35Å; I27-H31 VanDerWaalsContact O-N 3.09Å; A28-H31 PolarHBondContact O-N 3.16Å; A29-H31 VanDerWaalsContact C-N 3.33Å; A29-H31 PolarHBondContact O-N 3.12Å
32	E	92.5	Very high	95.4	Very high	77 Å²	77	48 Å²	48	36%	0.36	24%	0.236	S	C	.	.	H	α-helix	trans	-71.1	-32.4	-175.1	-71.8	174	177.7	0	0	113	A28 A29 F35 Y102	A28-E32 VanDerWaalsContact O-CB 3.3Å; A28-E32 WeakPolarHBondContact O-CB 2.97Å; A28-E32 WeakPolarHBondContact O-CG 3.28Å; A28-E32 PolarHBondContact O-N 3.41Å; A29-E32 PolarHBondContact O-N 2.99Å; E32-F35 WeakPolarHBondContact O-CD1 3.46Å; E32-F35 WeakPolarHBondContact O-CE1 3.37Å; E32-Y102 VanDerWaalsContact OE2-CZ 3.27Å; E32-Y102 PolarHBondContact OE2-OH 3.33Å
33	L	94.1	Very high	95.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-94.1	-16.1	-175.8	-64.3	-179.2	0	0	0	114.1	A29 F35 A36 V37 I40 I57 V101 Y102 M105 Y112	A29-L33 VanDerWaalsContact O-CB 3.26Å; A29-L33 WeakPolarHBondContact O-CB 3.31Å; A29-L33 WeakPolarHBondContact O-CG 3.13Å; A29-L33 PolarHBondContact O-N 3.22Å; L33-F35 PolarHBondContact O-N 3.42Å; L33-A36 PolarHBondContact O-N 3.34Å; L33-V37 WeakPolarHBondContact O-CG2 3.38Å; L33-V37 PolarHBondContact O-N 3.11Å; L33-I40 HydrophobicContact CB-CD1 4Å; L33-I40 HydrophobicContact CD1-CD1 3.91Å; L33-I57 HydrophobicContact CD1-CD1 4.38Å; L33-V101 HydrophobicContact CD1-CB 4.3Å; L33-V101 HydrophobicContact CD1-CG1 3.95Å; L33-V101 HydrophobicContact CD1-CG2 3.42Å; L33-V101 VanDerWaalsContact CD1-CG2 3.42Å; L33-V101 HydrophobicContact CD2-CG1 4.37Å; L33-V101 HydrophobicContact CG-CG1 4.26Å; L33-Y102 HydrophobicContact CD2-CD1 4.37Å; L33-Y102 HydrophobicContact CD2-CE1 4.48Å; L33-M105 HydrophobicContact CD1-CG 3.72Å; L33-M105 HydrophobicContact CD1-SD 4.26Å; L33-M105 HydrophobicContact CD2-CG 4.05Å; L33-Y112 HydrophobicContact CD2-CD2 4.36Å; L33-Y112 HydrophobicContact CD2-CE2 3.56Å
34	H	93.1	Very high	95.4	Very high	64 Å²	64	53.9 Å²	53.9	30%	0.296	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-51.9	-36.2	-173.2	-178.9	-103.3	0	0	0	113.3	V30 A36 I40 F154	V30-H34 WeakPolarHBondContact O-CB 3.36Å; V30-H34 PolarHBondContact O-N 3.28Å; H34-A36 PolarHBondContact O-N 3.03Å; H34-I40 HydrophobicContact CB-CG2 4.39Å; H34-F154 AromaticContact CD2-CE1 3.74Å; H34-F154 AromaticContact CD2-CE2 3.97Å; H34-F154 AromaticContact CD2-CZ 3.31Å; H34-F154 WeakPolarHBondContact CD2-CZ 3.4Å; H34-F154 AromaticContact CE1-CD2 3.6Å; H34-F154 AromaticContact CE1-CE1 3.78Å; H34-F154 AromaticContact CE1-CE2 3.17Å; H34-F154 WeakPolarHBondContact CE1-CE2 3.46Å; H34-F154 AromaticContact CE1-CZ 3.28Å; H34-F154 WeakPolarHBondContact CE1-CZ 3.34Å; H34-F154 AromaticContact CG-CE1 3.8Å; H34-F154 AromaticContact CG-CZ 3.81Å; H34-F154 AromaticContact ND1-CE1 3.81Å; H34-F154 AromaticContact ND1-CZ 3.78Å; H34-F154 AromaticContact NE2-CE1 3.77Å; H34-F154 AromaticContact NE2-CE2 3.13Å; H34-F154 WeakPolarHBondContact NE2-CE2 3.26Å; H34-F154 AromaticContact NE2-CZ 2.97Å; H34-F154 WeakPolarHBondContact NE2-CZ 3.37Å
35	F	91.7	Very high	95.4	Very high	93 Å²	93	55.7 Å²	55.7	41%	0.408	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-67.4	-18.7	179.9	82.2	-88.4	0	0	0	114.8	E32 L33 F116 L119	E32-F35 WeakPolarHBondContact O-CD1 3.46Å; E32-F35 WeakPolarHBondContact O-CE1 3.37Å; L33-F35 PolarHBondContact O-N 3.42Å; F35-F116 HydrophobicContact CZ-CD2 4.41Å; F35-L119 HydrophobicContact CD2-CD2 4.21Å; F35-L119 HydrophobicContact CE1-CD2 4.22Å; F35-L119 HydrophobicContact CE2-CB 4.4Å; F35-L119 HydrophobicContact CE2-CD2 3.59Å; F35-L119 HydrophobicContact CZ-CD2 3.6Å
36	A	93.9	Very high	95.4	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-120.7	12.5	-170.2	0	0	0	0	0	113.8	L33 H34 L60 Y112 R115	L33-A36 PolarHBondContact O-N 3.34Å; H34-A36 PolarHBondContact O-N 3.03Å; A36-L60 WeakPolarHBondContact O-CD1 3.31Å; A36-L60 WeakPolarHBondContact O-CG 3.4Å; A36-Y112 HydrophobicContact CB-CD2 3.56Å; A36-Y112 HydrophobicContact CB-CE2 4.07Å; A36-R115 HydrophobicContact CB-CB 4.18Å
37	V	96.7	Very high	95.1	Very high	10 Å²	10	57.3 Å²	57.3	6%	0.061	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	165.5	177.8	-59.8	0	0	0	0	109.9	L33 I40 I57 M105	L33-V37 WeakPolarHBondContact O-CG2 3.38Å; L33-V37 PolarHBondContact O-N 3.11Å; V37-I40 HydrophobicContact CG2-CB 3.92Å; V37-I40 HydrophobicContact CG2-CG2 3.66Å; V37-I57 HydrophobicContact CB-CG2 4.4Å; V37-I57 HydrophobicContact CG1-CG2 3.99Å; V37-M105 HydrophobicContact CG1-CE 3.56Å
38	R	97.3	Very high	95	Very high	155 Å²	155	59.4 Å²	59.4	59%	0.585	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	-39.7	172.1	-176.2	-178.3	-59.7	175.3	4	111.2	T58 L60	R38-T58 HydrophobicContact CB-CG2 4.02Å; R38-T58 WeakPolarHBondContact CB-O 3.38Å; R38-T58 HydrophobicContact CG-CG2 4.46Å; R38-T58 PolarHBondContact N-O 3.24Å; R38-L60 PolarHBondContact NH2-O 3.43Å
39	D	97.5	Very high	94.9	Very high	65 Å²	65	60.9 Å²	60.9	35%	0.348	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	144.4	178.3	-173.4	69.6	0	0	0	109.6	I57 T58	D39-I57 WeakPolarHBondContact O-CA 3.27Å; D39-T58 PolarHBondContact N-O 3.36Å; D39-T58 PolarHBondContact O-N 3.22Å
40	I	97.5	Very high	94.8	Very high	6 Å²	6	64 Å²	64	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	130.7	169.9	179.1	164	0	0	0	109.3	V30 L33 H34 V37 N56 I57	V30-I40 HydrophobicContact CG1-CG2 4.25Å; V30-I40 HydrophobicContact CG2-CG1 4.1Å; L33-I40 HydrophobicContact CB-CD1 4Å; L33-I40 HydrophobicContact CD1-CD1 3.91Å; H34-I40 HydrophobicContact CB-CG2 4.39Å; V37-I40 HydrophobicContact CG2-CB 3.92Å; V37-I40 HydrophobicContact CG2-CG2 3.66Å; I40-N56 WeakPolarHBondContact CA-O 3.42Å; I40-I57 HydrophobicContact CB-CG1 4.39Å; I40-I57 HydrophobicContact CD1-CD1 3.74Å; I40-I57 HydrophobicContact CD1-CG1 3.86Å; I40-I57 HydrophobicContact CG1-CD1 4.36Å; I40-I57 HydrophobicContact CG1-CG1 3.91Å
41	S	97	Very high	94.7	Very high	35 Å²	35	70.4 Å²	70.4	25%	0.245	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	156.9	-177.9	51.6	0	0	0	0	111.6	L55 N56	S41-L55 CarbonylContact O-C 3.58Å; S41-L55 VanDerWaalsContact O-CA 3.26Å; S41-L55 WeakPolarHBondContact O-CA 3.3Å; S41-N56 PolarHBondContact N-O 3.17Å; S41-N56 PolarHBondContact O-N 3.27Å
42	V	96.8	Very high	94.8	Very high	29 Å²	29	65.2 Å²	65.2	18%	0.176	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	137.8	165.9	178.1	0	0	0	0	107.9	A26 D44 I53	A26-V42 HydrophobicContact CB-CG2 4.45Å; V42-D44 PolarHBondContact O-N 3.04Å; V42-I53 HydrophobicContact CG1-CG2 3.95Å
43	S	96.7	Very high	95	Very high	7 Å²	7	61.6 Å²	61.6	5%	0.049	31%	0.313	C	S	.	.			trans	-67	128.1	177.9	175.8	0	0	0	0	110.6	L45 L46 F54 D82	S43-L45 PolarHBondContact OG-N 2.9Å; S43-L46 PolarHBondContact OG-N 2.91Å; S43-L46 VanDerWaalsContact OG-N 3.16Å; S43-F54 PolarHBondContact N-O 2.81Å; S43-D82 WeakPolarHBondContact CB-OD1 3.26Å; S43-D82 PolarHBondContact OG-OD1 3Å
44	D	94.1	Very high	95.2	Very high	151 Å²	151	61.7 Å²	61.7	81%	0.807	31%	0.314	S	S	*	.	S	Bend	trans	-84	-15.1	173.9	-67	-42.4	0	0	0	112.7	V42	V42-D44 PolarHBondContact O-N 3.04Å
45	L	95.4	Very high	95.4	Very high	135 Å²	135	58.7 Å²	58.7	71%	0.707	30%	0.3	S	S	*	.	S	Bend	trans	-101.2	-24.8	-171.9	-63.3	-175.5	0	0	0	113.5	S43 D82	S43-L45 PolarHBondContact OG-N 2.9Å; L45-D82 HydrophobicContact CB-CB 4.01Å; L45-D82 HydrophobicContact CD1-CB 3.79Å; L45-D82 HydrophobicContact CG-CB 4.36Å
46	L	95	Very high	95.7	Very high	28 Å²	28	54.6 Å²	54.6	15%	0.147	28%	0.282	C	S	.	.	S	Bend	trans	-97.5	155.7	-177	-63.5	179.9	0	0	0	112.2	S43 R48 F54 C66 M84	S43-L46 PolarHBondContact OG-N 2.91Å; S43-L46 VanDerWaalsContact OG-N 3.16Å; L46-R48 PolarHBondContact O-N 3.24Å; L46-F54 HydrophobicContact CB-CB 3.82Å; L46-F54 HydrophobicContact CB-CD2 3.53Å; L46-F54 HydrophobicContact CB-CE2 4.22Å; L46-F54 HydrophobicContact CB-CG 3.7Å; L46-F54 HydrophobicContact CD1-CB 3.78Å; L46-F54 HydrophobicContact CD1-CD1 3.59Å; L46-F54 HydrophobicContact CD1-CD2 4.12Å; L46-F54 HydrophobicContact CD1-CE1 4.18Å; L46-F54 HydrophobicContact CD1-CG 3.55Å; L46-F54 HydrophobicContact CG-CB 4.44Å; L46-F54 HydrophobicContact CG-CD2 4.47Å; L46-F54 HydrophobicContact CG-CG 4.3Å; L46-C66 WeakPolarHBondContact CD1-SG 3.42Å; L46-M84 HydrophobicContact CD1-CG 3.98Å; L46-M84 HydrophobicContact CD2-CG 3.89Å; L46-M84 HydrophobicContact CD2-SD 4.02Å
47	P	91.3	Very high	95.9	Very high	76 Å²	76	54.7 Å²	54.7	49%	0.494	28%	0.283	S	S	.	.			trans	-58.9	129	-178.2	-23.9	34.2	0	0	0	112.5	F54	P47-F54 WeakPolarHBondContact O-CD2 3.16Å
48	R	93	Very high	96	Very high	120 Å²	120	55.1 Å²	55.1	45%	0.453	29%	0.286	S	S	.	.			trans	-111.1	118	171.3	178.8	176.7	171.4	166.8	-2.2	109.1	E23 L46 I53	E23-R48 IonicContact OE1-CZ 3.4Å; E23-R48 IonicContact OE1-NE 3.23Å; E23-R48 PolarHBondContact OE1-NE 3.21Å; E23-R48 IonicContact OE1-NH2 2.74Å; E23-R48 PolarHBondContact OE1-NH2 3.46Å; L46-R48 PolarHBondContact O-N 3.24Å; R48-I53 HydrophobicContact CG-CG1 4.36Å
49	T	93.3	Very high	96	Very high	68 Å²	68	47.8 Å²	47.8	42%	0.417	26%	0.258	S	S	.	.			trans	-128.2	176.6	177	75.8	0	0	0	0	110.3	E51 L52	T49-E51 PolarHBondContact O-N 2.85Å; T49-E51 PolarHBondContact OG1-N 3.42Å; T49-L52 PolarHBondContact N-O 2.98Å; T49-L52 PolarHBondContact OG1-N 2.99Å; T49-L52 VanDerWaalsContact OG1-N 3.16Å
50	S	93.5	Very high	96	Very high	69 Å²	69	47.3 Å²	47.3	48%	0.483	26%	0.255	S	S	.	.	S	Bend	trans	-68.6	-9.6	174.7	54.7	0	0	0	0	114.9	N20	N20-S50 WeakPolarHBondContact ND2-CA 3.41Å
51	E	94.7	Very high	95.9	Very high	139 Å²	139	50.4 Å²	50.4	65%	0.65	27%	0.27	S	S	*	.	S	Bend	trans	-120.8	-10.2	-175.1	-62.1	179.8	179.1	0	0	113	L22 T49	L22-E51 WeakPolarHBondContact CD1-O 3.43Å; T49-E51 PolarHBondContact O-N 2.85Å; T49-E51 PolarHBondContact OG1-N 3.42Å
52	L	95.8	Very high	95.9	Very high	42 Å²	42	50.2 Å²	50.2	22%	0.22	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	124.2	-175.4	175.3	62.2	0	0	0	110.6	T49 F54 E68 L69 T70	T49-L52 PolarHBondContact N-O 2.98Å; T49-L52 PolarHBondContact OG1-N 2.99Å; T49-L52 VanDerWaalsContact OG1-N 3.16Å; L52-F54 HydrophobicContact CD1-CE2 3.96Å; L52-F54 HydrophobicContact CD1-CZ 3.96Å; L52-F54 HydrophobicContact CD2-CE2 3.58Å; L52-F54 HydrophobicContact CD2-CZ 3.87Å; L52-F54 HydrophobicContact CG-CD2 4.32Å; L52-F54 HydrophobicContact CG-CE2 3.7Å; L52-F54 HydrophobicContact CG-CZ 4.15Å; L52-E68 HydrophobicContact CD1-CB 3.68Å; L52-L69 WeakPolarHBondContact CA-O 3.32Å; L52-T70 HydrophobicContact CD1-CG2 3.57Å
53	I	96.9	Very high	95.9	Very high	1 Å²	1	54 Å²	54	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.1	174	-56.6	-176.3	0	0	0	108.6	L22 E23 A26 V42 R48 L55 E68 L69	L22-I53 VanDerWaalsContact C-CD1 3.43Å; L22-I53 HydrophobicContact CB-CD1 3.73Å; L22-I53 HydrophobicContact CB-CG1 4.21Å; L22-I53 WeakPolarHBondContact O-CD1 3.35Å; E23-I53 HydrophobicContact CB-CD1 4.24Å; E23-I53 HydrophobicContact CG-CD1 3.64Å; A26-I53 HydrophobicContact CB-CD1 4.21Å; A26-I53 HydrophobicContact CB-CG2 4.18Å; V42-I53 HydrophobicContact CG1-CG2 3.95Å; R48-I53 HydrophobicContact CG-CG1 4.36Å; I53-L55 HydrophobicContact CG2-CD1 4.1Å; I53-E68 CarbonylContact O-C 3.58Å; I53-E68 WeakPolarHBondContact O-CA 3.25Å; I53-L69 HydrophobicContact CB-CB 4.45Å; I53-L69 PolarHBondContact N-O 3.48Å; I53-L69 PolarHBondContact O-N 3.37Å
54	F	97.8	Very high	95.9	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.009	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.1	172.4	-70.2	-86.5	0	0	0	111.1	S43 L46 P47 L52 I67 E68 T77 M84	S43-F54 PolarHBondContact N-O 2.81Å; L46-F54 HydrophobicContact CB-CB 3.82Å; L46-F54 HydrophobicContact CB-CD2 3.53Å; L46-F54 HydrophobicContact CB-CE2 4.22Å; L46-F54 HydrophobicContact CB-CG 3.7Å; L46-F54 HydrophobicContact CD1-CB 3.78Å; L46-F54 HydrophobicContact CD1-CD1 3.59Å; L46-F54 HydrophobicContact CD1-CD2 4.12Å; L46-F54 HydrophobicContact CD1-CE1 4.18Å; L46-F54 HydrophobicContact CD1-CG 3.55Å; L46-F54 HydrophobicContact CG-CB 4.44Å; L46-F54 HydrophobicContact CG-CD2 4.47Å; L46-F54 HydrophobicContact CG-CG 4.3Å; P47-F54 WeakPolarHBondContact O-CD2 3.16Å; L52-F54 HydrophobicContact CD1-CE2 3.96Å; L52-F54 HydrophobicContact CD1-CZ 3.96Å; L52-F54 HydrophobicContact CD2-CE2 3.58Å; L52-F54 HydrophobicContact CD2-CZ 3.87Å; L52-F54 HydrophobicContact CG-CD2 4.32Å; L52-F54 HydrophobicContact CG-CE2 3.7Å; L52-F54 HydrophobicContact CG-CZ 4.15Å; F54-I67 CarbonylContact C-O 2.99Å; F54-I67 VanDerWaalsContact CA-O 3.27Å; F54-I67 WeakPolarHBondContact CA-O 3.48Å; F54-E68 HydrophobicContact CD1-CB 4.04Å; F54-E68 HydrophobicContact CE1-CB 3.79Å; F54-E68 HydrophobicContact CZ-CB 4.38Å; F54-T77 HydrophobicContact CE1-CG2 3.94Å; F54-M84 HydrophobicContact CE1-CE 4.26Å; F54-M84 HydrophobicContact CE1-CG 3.87Å; F54-M84 HydrophobicContact CE1-SD 4.34Å; F54-M84 HydrophobicContact CE2-CE 4.34Å; F54-M84 HydrophobicContact CE2-SD 4.27Å; F54-M84 HydrophobicContact CZ-CE 3.56Å; F54-M84 HydrophobicContact CZ-CG 3.96Å; F54-M84 HydrophobicContact CZ-SD 3.81Å
55	L	98	Very high	96.1	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.1	175.3	-62.5	90.9	0	0	0	110	A26 V30 S41 I53 C66 I67 L69 W74	A26-L55 HydrophobicContact CB-CD1 4.44Å; A26-L55 HydrophobicContact CB-CD2 4.25Å; V30-L55 HydrophobicContact CG2-CD2 4.27Å; S41-L55 CarbonylContact O-C 3.58Å; S41-L55 VanDerWaalsContact O-CA 3.26Å; S41-L55 WeakPolarHBondContact O-CA 3.3Å; I53-L55 HydrophobicContact CG2-CD1 4.1Å; L55-C66 CarbonylContact O-C 3.52Å; L55-C66 WeakPolarHBondContact O-CA 3.13Å; L55-I67 PolarHBondContact N-O 3.11Å; L55-I67 PolarHBondContact O-N 3.46Å; L55-L69 HydrophobicContact CD1-CB 3.94Å; L55-W74 HydrophobicContact CD1-CZ3 4.02Å; L55-W74 HydrophobicContact CD2-CZ3 4.29Å
56	N	98	Very high	96.2	Very high	7 Å²	7	42.4 Å²	42.4	4%	0.037	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	132.4	170.7	-71.7	-36.3	0	0	0	108.9	I40 S41 Y65 H81 D82	I40-N56 WeakPolarHBondContact CA-O 3.42Å; S41-N56 PolarHBondContact N-O 3.17Å; S41-N56 PolarHBondContact O-N 3.27Å; N56-Y65 WeakPolarHBondContact CA-O 3.09Å; N56-H81 HydrophobicContact CB-CB 4.33Å; N56-H81 VanDerWaalsContact OD1-CA 3.28Å; N56-H81 WeakPolarHBondContact OD1-CA 3.32Å; N56-H81 WeakPolarHBondContact OD1-CB 3.49Å; N56-D82 VanDerWaalsContact ND2-CG 3.34Å; N56-D82 PolarHBondContact ND2-OD1 3.23Å; N56-D82 PolarHBondContact ND2-OD2 2.76Å; N56-D82 PolarHBondContact OD1-N 2.88Å
57	I	98	Very high	96.3	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	135.6	172.8	-60	-171.8	0	0	0	108.5	L33 V37 D39 I40 A64 Y65 I67 H81 M105	L33-I57 HydrophobicContact CD1-CD1 4.38Å; V37-I57 HydrophobicContact CB-CG2 4.4Å; V37-I57 HydrophobicContact CG1-CG2 3.99Å; D39-I57 WeakPolarHBondContact O-CA 3.27Å; I40-I57 HydrophobicContact CB-CG1 4.39Å; I40-I57 HydrophobicContact CD1-CD1 3.74Å; I40-I57 HydrophobicContact CD1-CG1 3.86Å; I40-I57 HydrophobicContact CG1-CD1 4.36Å; I40-I57 HydrophobicContact CG1-CG1 3.91Å; I57-A64 CarbonylContact O-C 3.5Å; I57-A64 WeakPolarHBondContact O-CA 3.43Å; I57-Y65 PolarHBondContact N-O 3.31Å; I57-Y65 PolarHBondContact O-N 2.87Å; I57-I67 HydrophobicContact CB-CD1 4.33Å; I57-I67 HydrophobicContact CD1-CD1 3.39Å; I57-I67 HydrophobicContact CG1-CD1 3.82Å; I57-H81 PolarHBondContact O-NE2 3.48Å; I57-M105 HydrophobicContact CD1-SD 3.87Å; I57-M105 HydrophobicContact CG2-CE 4.5Å; I57-M105 HydrophobicContact CG2-SD 4.37Å
58	T	98.1	Very high	96.6	Very high	20 Å²	20	38 Å²	38	12%	0.123	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	116.3	161.6	-59.7	0	0	0	0	108.7	R38 D39 Q63 H81	R38-T58 HydrophobicContact CB-CG2 4.02Å; R38-T58 WeakPolarHBondContact CB-O 3.38Å; R38-T58 HydrophobicContact CG-CG2 4.46Å; R38-T58 PolarHBondContact N-O 3.24Å; D39-T58 PolarHBondContact N-O 3.36Å; D39-T58 PolarHBondContact O-N 3.22Å; T58-Q63 CarbonylContact C-O 3.41Å; T58-Q63 WeakPolarHBondContact CA-O 3.44Å; T58-H81 PolarHBondContact OG1-CE1 2.95Å; T58-H81 PolarHBondContact OG1-NE2 3.41Å
59	T	98.1	Very high	96.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	166.6	-180	76.6	0	0	0	0	111	E61 G62 Q63 Y65	T59-E61 WeakPolarHBondContact CB-OE2 3.47Å; T59-E61 PolarHBondContact O-N 3.18Å; T59-E61 PolarHBondContact OG1-N 3.4Å; T59-E61 PolarHBondContact OG1-OE2 3.5Å; T59-G62 WeakPolarHBondContact O-CA 3.48Å; T59-G62 PolarHBondContact O-N 3.41Å; T59-Q63 PolarHBondContact N-O 3.43Å; T59-Q63 PolarHBondContact OG1-N 2.92Å; T59-Y65 HydrophobicContact CG2-CD2 3.88Å; T59-Y65 HydrophobicContact CG2-CE2 3.55Å
60	L	97.1	Very high	97	Very high	55 Å²	55	30 Å²	30	29%	0.288	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.9	177.6	-69.4	173.3	0	0	0	112.1	A36 R38 G62 C111 R115	A36-L60 WeakPolarHBondContact O-CD1 3.31Å; A36-L60 WeakPolarHBondContact O-CG 3.4Å; R38-L60 PolarHBondContact NH2-O 3.43Å; L60-G62 PolarHBondContact O-N 2.86Å; L60-C111 HydrophobicContact CB-CB 3.73Å; L60-C111 HydrophobicContact CD1-CB 4.01Å; L60-C111 HydrophobicContact CG-CB 4.45Å; L60-R115 HydrophobicContact CD1-CG 3.73Å
61	E	96.3	Very high	97.1	Very high	72 Å²	72	32.8 Å²	32.8	34%	0.336	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-8.2	172.8	-52.7	91.4	151.9	0	0	113.5	T59 S109 A110 C111	T59-E61 WeakPolarHBondContact CB-OE2 3.47Å; T59-E61 PolarHBondContact O-N 3.18Å; T59-E61 PolarHBondContact OG1-N 3.4Å; T59-E61 PolarHBondContact OG1-OE2 3.5Å; E61-S109 PolarHBondContact OE1-OG 2.56Å; E61-S109 PolarHBondContact OE2-OG 2.82Å; E61-A110 PolarHBondContact OE1-N 3.49Å; E61-C111 HydrophobicContact CG-CB 4.25Å; E61-C111 WeakPolarHBondContact OE1-CB 3.3Å; E61-C111 PolarHBondContact OE1-N 3.14Å
62	G	96.7	Very high	97.1	Very high	31 Å²	31	33.7 Å²	33.7	32%	0.32	17%	0.174	S	C	.	.			trans	85	12.5	179.1	0	0	0	0	0	114.7	T59 L60	T59-G62 WeakPolarHBondContact O-CA 3.48Å; T59-G62 PolarHBondContact O-N 3.41Å; L60-G62 PolarHBondContact O-N 2.86Å
63	Q	96.6	Very high	97.2	Very high	107 Å²	107	32 Å²	32	50%	0.5	17%	0.167	S	C	.	.			trans	-80.7	134.8	174.3	-61.8	-55.7	-44.6	0	0	110.1	T58 T59 Y65	T58-Q63 CarbonylContact C-O 3.41Å; T58-Q63 WeakPolarHBondContact CA-O 3.44Å; T59-Q63 PolarHBondContact N-O 3.43Å; T59-Q63 PolarHBondContact OG1-N 2.92Å; Q63-Y65 HydrophobicContact CB-CD2 4.43Å; Q63-Y65 HydrophobicContact CB-CE2 3.52Å
64	A	96.9	Very high	97.2	Very high	26 Å²	26	32.2 Å²	32.2	22%	0.215	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.8	178.7	0	0	0	0	0	110.4	I57 L79	I57-A64 CarbonylContact O-C 3.5Å; I57-A64 WeakPolarHBondContact O-CA 3.43Å; A64-L79 CarbonylContact O-C 3.6Å; A64-L79 VanDerWaalsContact O-CA 3.32Å; A64-L79 WeakPolarHBondContact O-CA 3.04Å
65	Y	97.1	Very high	97.2	Very high	24 Å²	24	35 Å²	35	9%	0.094	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	138.2	176.7	-61	-88.2	0	0	0	109.5	N56 I57 T59 Q63 V76 S78 L79 H81 I108	N56-Y65 WeakPolarHBondContact CA-O 3.09Å; I57-Y65 PolarHBondContact N-O 3.31Å; I57-Y65 PolarHBondContact O-N 2.87Å; T59-Y65 HydrophobicContact CG2-CD2 3.88Å; T59-Y65 HydrophobicContact CG2-CE2 3.55Å; Q63-Y65 HydrophobicContact CB-CD2 4.43Å; Q63-Y65 HydrophobicContact CB-CE2 3.52Å; Y65-V76 HydrophobicContact CD1-CG1 3.82Å; Y65-V76 HydrophobicContact CD1-CG2 4.47Å; Y65-S78 WeakPolarHBondContact CA-O 3.39Å; Y65-L79 HydrophobicContact CD1-CD2 3.71Å; Y65-L79 HydrophobicContact CE1-CD2 3.43Å; Y65-L79 VanDerWaalsContact CE1-CD2 3.43Å; Y65-H81 PolarHBondContact O-CD2 2.83Å; Y65-I108 HydrophobicContact CD1-CD1 4.39Å; Y65-I108 HydrophobicContact CD2-CD1 3.79Å; Y65-I108 HydrophobicContact CE1-CB 4.35Å; Y65-I108 HydrophobicContact CE1-CG2 4.44Å; Y65-I108 HydrophobicContact CE2-CB 4.37Å; Y65-I108 HydrophobicContact CE2-CD1 3.99Å; Y65-I108 HydrophobicContact CG-CD1 4Å
66	C	97.5	Very high	97.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.2	161	177.4	0	0	0	0	107.7	L46 L55 T77 S78 R80 C83	L46-C66 WeakPolarHBondContact CD1-SG 3.42Å; L55-C66 CarbonylContact O-C 3.52Å; L55-C66 WeakPolarHBondContact O-CA 3.13Å; C66-T77 PolarHBondContact O-N 3.17Å; C66-T77 PolarHBondContact O-OG1 3.28Å; C66-T77 PolarHBondContact SG-OG1 3.39Å; C66-S78 PolarHBondContact N-O 2.91Å; C66-S78 PolarHBondContact O-N 3.34Å; C66-R80 WeakPolarHBondContact CB-O 3.33Å; C66-R80 PolarHBondContact N-O 3.3Å; C66-C83 WeakPolarHBondContact CB-O 3.29Å; C66-C83 PolarHBondContact SG-O 3.1Å; C66-C83 VanDerWaalsContact SG-O 3.41Å
67	I	97.4	Very high	97	Very high	1 Å²	1	35 Å²	35	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139.1	-173.3	-62.4	168.2	0	0	0	107.7	F54 L55 I57 W74 R75 L104	F54-I67 CarbonylContact C-O 2.99Å; F54-I67 VanDerWaalsContact CA-O 3.27Å; F54-I67 WeakPolarHBondContact CA-O 3.48Å; L55-I67 PolarHBondContact N-O 3.11Å; L55-I67 PolarHBondContact O-N 3.46Å; I57-I67 HydrophobicContact CB-CD1 4.33Å; I57-I67 HydrophobicContact CD1-CD1 3.39Å; I57-I67 HydrophobicContact CG1-CD1 3.82Å; I67-W74 HydrophobicContact CG2-CE3 4.09Å; I67-R75 CarbonylContact C-O 3.59Å; I67-R75 VanDerWaalsContact CA-O 3.26Å; I67-R75 WeakPolarHBondContact CA-O 3.4Å; I67-R75 WeakPolarHBondContact CG2-O 3.36Å; I67-L104 HydrophobicContact CD1-CD1 4.19Å; I67-L104 HydrophobicContact CD1-CD2 3.7Å; I67-L104 HydrophobicContact CG1-CD1 4.43Å; I67-L104 HydrophobicContact CG2-CD1 3.9Å
68	E	97	Very high	96.9	Very high	11 Å²	11	35 Å²	35	5%	0.051	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	140.4	165.4	66.2	179.9	-145.6	0	0	110.5	L52 I53 F54 W74 R75 T77 Y97	L52-E68 HydrophobicContact CD1-CB 3.68Å; I53-E68 CarbonylContact O-C 3.58Å; I53-E68 WeakPolarHBondContact O-CA 3.25Å; F54-E68 HydrophobicContact CD1-CB 4.04Å; F54-E68 HydrophobicContact CE1-CB 3.79Å; F54-E68 HydrophobicContact CZ-CB 4.38Å; E68-W74 WeakPolarHBondContact O-CA 3.3Å; E68-R75 VanDerWaalsContact CD-CZ 3.49Å; E68-R75 HydrophobicContact CG-CB 3.84Å; E68-R75 PolarHBondContact N-O 2.9Å; E68-R75 PolarHBondContact O-N 3.46Å; E68-R75 IonicContact OE1-CZ 2.92Å; E68-R75 IonicContact OE1-NE 3.01Å; E68-R75 PolarHBondContact OE1-NE 3.37Å; E68-R75 IonicContact OE1-NH2 3.07Å; E68-R75 PolarHBondContact OE1-NH2 2.91Å; E68-R75 IonicContact OE2-CZ 3.71Å; E68-R75 IonicContact OE2-NE 2.7Å; E68-R75 IonicContact OE2-NH2 3.49Å; E68-R75 PolarHBondContact OE2-NH2 2.7Å; E68-T77 HydrophobicContact CB-CG2 3.65Å; E68-T77 HydrophobicContact CG-CG2 3.5Å; E68-T77 VanDerWaalsContact OE2-CG2 3.26Å; E68-T77 WeakPolarHBondContact OE2-CG2 3.43Å; E68-Y97 WeakPolarHBondContact OE1-CE1 3.48Å; E68-Y97 VanDerWaalsContact OE1-CZ 3.27Å; E68-Y97 PolarHBondContact OE1-OH 3.33Å
69	L	97.9	Very high	96.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	123.4	167.6	171.5	60.1	0	0	0	108	L22 E25 A26 L52 I53 L55 W74	L22-L69 HydrophobicContact CB-CD2 4.26Å; L22-L69 HydrophobicContact CB-CG 4.47Å; L22-L69 HydrophobicContact CD2-CD1 4.24Å; L22-L69 HydrophobicContact CD2-CD2 4.45Å; L22-L69 HydrophobicContact CD2-CG 4.07Å; L22-L69 WeakPolarHBondContact O-CD2 3.47Å; E25-L69 HydrophobicContact CB-CD2 4.11Å; E25-L69 HydrophobicContact CG-CD1 4.33Å; E25-L69 HydrophobicContact CG-CD2 3.96Å; A26-L69 HydrophobicContact CB-CD2 4.01Å; L52-L69 WeakPolarHBondContact CA-O 3.32Å; I53-L69 HydrophobicContact CB-CB 4.45Å; I53-L69 PolarHBondContact N-O 3.48Å; I53-L69 PolarHBondContact O-N 3.37Å; L55-L69 HydrophobicContact CD1-CB 3.94Å; L69-W74 HydrophobicContact CB-CE3 4.19Å; L69-W74 HydrophobicContact CB-CZ3 4.12Å; L69-W74 HydrophobicContact CD1-CD2 3.84Å; L69-W74 HydrophobicContact CD1-CE3 4.18Å; L69-W74 HydrophobicContact CD1-CG 4.34Å; L69-W74 HydrophobicContact CD1-CH2 4.12Å; L69-W74 HydrophobicContact CD1-CZ2 3.79Å; L69-W74 HydrophobicContact CD1-CZ3 4.31Å; L69-W74 HydrophobicContact CD2-CH2 3.8Å; L69-W74 HydrophobicContact CD2-CZ2 4.11Å; L69-W74 HydrophobicContact CD2-CZ3 4.21Å; L69-W74 HydrophobicContact CG-CH2 4.36Å; L69-W74 HydrophobicContact CG-CZ2 4.48Å; L69-W74 HydrophobicContact CG-CZ3 4.44Å
70	T	97.1	Very high	96.6	Very high	21 Å²	21	45 Å²	45	13%	0.129	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	174.9	176.1	68.3	0	0	0	0	109.7	L52 K72 G73	L52-T70 HydrophobicContact CD1-CG2 3.57Å; T70-K72 PolarHBondContact O-N 3.19Å; T70-K72 PolarHBondContact OG1-N 2.97Å; T70-K72 VanDerWaalsContact OG1-N 3.16Å; T70-G73 PolarHBondContact N-O 3.32Å; T70-G73 PolarHBondContact O-N 3.2Å; T70-G73 PolarHBondContact OG1-O 3.49Å
71	M	95.3	Very high	96.6	Very high	127 Å²	127	45 Å²	45	63%	0.626	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-15.4	171.3	-60.7	-60.7	164.4	0	0	114.2	L22 G73	L22-M71 HydrophobicContact CD1-CE 3.77Å; L22-M71 HydrophobicContact CD2-CE 3.79Å; L22-M71 HydrophobicContact CD2-SD 3.85Å; L22-M71 HydrophobicContact CG-CE 3.45Å; L22-M71 VanDerWaalsContact CG-CE 3.45Å; L22-M71 HydrophobicContact CG-SD 4.2Å; M71-G73 VanDerWaalsContact C-N 3.32Å
72	K	96	Very high	96.6	Very high	158 Å²	158	44.2 Å²	44.2	69%	0.687	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-12.6	174	-63.2	-179.1	-179.1	175.7	0	113	T70 Y97	T70-K72 PolarHBondContact O-N 3.19Å; T70-K72 PolarHBondContact OG1-N 2.97Å; T70-K72 VanDerWaalsContact OG1-N 3.16Å; K72-Y97 HydrophobicContact CB-CD1 3.85Å; K72-Y97 HydrophobicContact CB-CE1 4.04Å; K72-Y97 HydrophobicContact CB-CG 4.2Å; K72-Y97 HydrophobicContact CD-CE2 4.33Å
73	G	97.4	Very high	96.4	Very high	7 Å²	7	43.7 Å²	43.7	7%	0.072	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	114.7	-155.1	-172.9	0	0	0	0	0	112.7	T70 M71 F98	T70-G73 PolarHBondContact N-O 3.32Å; T70-G73 PolarHBondContact O-N 3.2Å; T70-G73 PolarHBondContact OG1-O 3.49Å; M71-G73 VanDerWaalsContact C-N 3.32Å; G73-F98 WeakPolarHBondContact CA-O 3.18Å
74	W	97.9	Very high	96	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.019	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.8	-169	-57.1	78.1	0	0	0	111.1	E25 A29 L55 I67 E68 L69 Y97 F98 V101 L104	E25-W74 HydrophobicContact CG-CH2 4.25Å; E25-W74 HydrophobicContact CG-CZ2 3.56Å; E25-W74 WeakPolarHBondContact OE1-CZ2 3.5Å; E25-W74 PolarHBondContact OE1-NE1 2.82Å; A29-W74 HydrophobicContact CB-CH2 3.37Å; A29-W74 HydrophobicContact CB-CZ2 4.05Å; A29-W74 HydrophobicContact CB-CZ3 4.12Å; L55-W74 HydrophobicContact CD1-CZ3 4.02Å; L55-W74 HydrophobicContact CD2-CZ3 4.29Å; I67-W74 HydrophobicContact CG2-CE3 4.09Å; E68-W74 WeakPolarHBondContact O-CA 3.3Å; L69-W74 HydrophobicContact CB-CE3 4.19Å; L69-W74 HydrophobicContact CB-CZ3 4.12Å; L69-W74 HydrophobicContact CD1-CD2 3.84Å; L69-W74 HydrophobicContact CD1-CE3 4.18Å; L69-W74 HydrophobicContact CD1-CG 4.34Å; L69-W74 HydrophobicContact CD1-CH2 4.12Å; L69-W74 HydrophobicContact CD1-CZ2 3.79Å; L69-W74 HydrophobicContact CD1-CZ3 4.31Å; L69-W74 HydrophobicContact CD2-CH2 3.8Å; L69-W74 HydrophobicContact CD2-CZ2 4.11Å; L69-W74 HydrophobicContact CD2-CZ3 4.21Å; L69-W74 HydrophobicContact CG-CH2 4.36Å; L69-W74 HydrophobicContact CG-CZ2 4.48Å; L69-W74 HydrophobicContact CG-CZ3 4.44Å; W74-Y97 CarbonylContact O-C 3.52Å; W74-Y97 WeakPolarHBondContact O-CA 3.2Å; W74-F98 HydrophobicContact CB-CB 4.34Å; W74-F98 PolarHBondContact N-O 2.99Å; W74-F98 WeakPolarHBondContact O-CD2 3.3Å; W74-F98 PolarHBondContact O-N 3.25Å; W74-V101 HydrophobicContact CD2-CB 3.97Å; W74-V101 HydrophobicContact CD2-CG2 4.05Å; W74-V101 HydrophobicContact CE3-CB 4.26Å; W74-V101 HydrophobicContact CE3-CG2 3.85Å; W74-V101 HydrophobicContact CH2-CB 4.17Å; W74-V101 HydrophobicContact CH2-CG2 4.1Å; W74-V101 HydrophobicContact CZ2-CB 3.83Å; W74-V101 HydrophobicContact CZ2-CG2 4.26Å; W74-V101 HydrophobicContact CZ3-CB 4.36Å; W74-V101 HydrophobicContact CZ3-CG2 3.89Å; W74-L104 HydrophobicContact CB-CD1 3.69Å
75	R	96.9	Very high	95.4	Very high	61 Å²	61	48.2 Å²	48.2	23%	0.23	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	139.1	178.9	178.2	-176.2	79.9	162.4	-0.3	112.1	I67 E68 T77 H94 L96 Y97	I67-R75 CarbonylContact C-O 3.59Å; I67-R75 VanDerWaalsContact CA-O 3.26Å; I67-R75 WeakPolarHBondContact CA-O 3.4Å; I67-R75 WeakPolarHBondContact CG2-O 3.36Å; E68-R75 VanDerWaalsContact CD-CZ 3.49Å; E68-R75 HydrophobicContact CG-CB 3.84Å; E68-R75 PolarHBondContact N-O 2.9Å; E68-R75 PolarHBondContact O-N 3.46Å; E68-R75 IonicContact OE1-CZ 2.92Å; E68-R75 IonicContact OE1-NE 3.01Å; E68-R75 PolarHBondContact OE1-NE 3.37Å; E68-R75 IonicContact OE1-NH2 3.07Å; E68-R75 PolarHBondContact OE1-NH2 2.91Å; E68-R75 IonicContact OE2-CZ 3.71Å; E68-R75 IonicContact OE2-NE 2.7Å; E68-R75 IonicContact OE2-NH2 3.49Å; E68-R75 PolarHBondContact OE2-NH2 2.7Å; R75-T77 PolarHBondContact O-N 2.87Å; R75-H94 VanDerWaalsContact CD-O 3.29Å; R75-H94 WeakPolarHBondContact CD-O 3.33Å; R75-L96 WeakPolarHBondContact CG-O 3.28Å; R75-Y97 HydrophobicContact CB-CD1 3.77Å; R75-Y97 HydrophobicContact CB-CE1 3.73Å; R75-Y97 HydrophobicContact CB-CG 4.25Å
76	V	97.1	Very high	94.3	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	116.3	171.7	-179.1	0	0	0	0	109.7	Y65 L79 L93 H94 L104 I108	Y65-V76 HydrophobicContact CD1-CG1 3.82Å; Y65-V76 HydrophobicContact CD1-CG2 4.47Å; V76-L79 HydrophobicContact CG1-CD2 4.46Å; V76-L93 HydrophobicContact CB-CD1 4.49Å; V76-L93 HydrophobicContact CB-CG 4.09Å; V76-L93 HydrophobicContact CG1-CD2 4.36Å; V76-L93 HydrophobicContact CG1-CG 4.39Å; V76-L93 HydrophobicContact CG2-CD1 4.06Å; V76-L93 HydrophobicContact CG2-CG 4.14Å; V76-H94 WeakPolarHBondContact O-CA 3.31Å; V76-H94 PolarHBondContact O-ND1 3Å; V76-L104 HydrophobicContact CG2-CD1 4.32Å; V76-I108 HydrophobicContact CG2-CG2 4.18Å
77	T	95.2	Very high	93.4	Very high	6 Å²	6	52 Å²	52	4%	0.037	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-29.1	178.6	61.3	0	0	0	0	113.1	F54 C66 E68 R75 C83 N85 G86	F54-T77 HydrophobicContact CE1-CG2 3.94Å; C66-T77 PolarHBondContact O-N 3.17Å; C66-T77 PolarHBondContact O-OG1 3.28Å; C66-T77 PolarHBondContact SG-OG1 3.39Å; E68-T77 HydrophobicContact CB-CG2 3.65Å; E68-T77 HydrophobicContact CG-CG2 3.5Å; E68-T77 VanDerWaalsContact OE2-CG2 3.26Å; E68-T77 WeakPolarHBondContact OE2-CG2 3.43Å; R75-T77 PolarHBondContact O-N 2.87Å; T77-C83 PolarHBondContact OG1-O 3.07Å; T77-N85 CarbonylContact O-C 3.42Å; T77-G86 WeakPolarHBondContact O-CA 3.26Å; T77-G86 PolarHBondContact O-N 3.42Å
78	S	95.5	Very high	92.4	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.014	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	167.7	169.5	74.9	0	0	0	0	112.6	Y65 C66 R80 C83 N85	Y65-S78 WeakPolarHBondContact CA-O 3.39Å; C66-S78 PolarHBondContact N-O 2.91Å; C66-S78 PolarHBondContact O-N 3.34Å; S78-R80 PolarHBondContact O-N 3.29Å; S78-R80 PolarHBondContact OG-N 3.02Å; S78-R80 PolarHBondContact OG-O 3.31Å; S78-C83 WeakPolarHBondContact CB-O 3.43Å; S78-C83 VanDerWaalsContact OG-CB 3.3Å; S78-C83 WeakPolarHBondContact OG-CB 3.41Å; S78-C83 PolarHBondContact OG-O 3.04Å; S78-N85 VanDerWaalsContact CB-O 3.23Å; S78-N85 WeakPolarHBondContact CB-O 3.26Å
79	L	94.7	Very high	91.7	Very high	64 Å²	64	62.5 Å²	62.5	34%	0.335	33%	0.326	S	S	.	.	S	Bend	trans	-89.4	23.6	174.1	-54.1	-179.4	0	0	0	112.4	A64 Y65 V76 D87 L93	A64-L79 CarbonylContact O-C 3.6Å; A64-L79 VanDerWaalsContact O-CA 3.32Å; A64-L79 WeakPolarHBondContact O-CA 3.04Å; Y65-L79 HydrophobicContact CD1-CD2 3.71Å; Y65-L79 HydrophobicContact CE1-CD2 3.43Å; Y65-L79 VanDerWaalsContact CE1-CD2 3.43Å; V76-L79 HydrophobicContact CG1-CD2 4.46Å; L79-D87 HydrophobicContact CD1-CB 4.48Å; L79-L93 HydrophobicContact CD2-CD2 4.28Å
80	R	95.2	Very high	91	Very high	167 Å²	167	67.2 Å²	67.2	63%	0.63	35%	0.348	S	S	*	.	S	Bend	trans	-142.3	150.1	178.6	-64.9	-175.5	65.4	-106.3	-3.9	108.7	C66 S78 C83	C66-R80 WeakPolarHBondContact CB-O 3.33Å; C66-R80 PolarHBondContact N-O 3.3Å; S78-R80 PolarHBondContact O-N 3.29Å; S78-R80 PolarHBondContact OG-N 3.02Å; S78-R80 PolarHBondContact OG-O 3.31Å; R80-C83 HydrophobicContact CB-CB 4.2Å
81	H	96.9	Very high	90.5	Very high	56 Å²	56	70.7 Å²	70.7	26%	0.259	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	149.3	171.3	-67.4	170.4	0	0	0	111.6	N56 I57 T58 Y65 C83	N56-H81 HydrophobicContact CB-CB 4.33Å; N56-H81 VanDerWaalsContact OD1-CA 3.28Å; N56-H81 WeakPolarHBondContact OD1-CA 3.32Å; N56-H81 WeakPolarHBondContact OD1-CB 3.49Å; I57-H81 PolarHBondContact O-NE2 3.48Å; T58-H81 PolarHBondContact OG1-CE1 2.95Å; T58-H81 PolarHBondContact OG1-NE2 3.41Å; Y65-H81 PolarHBondContact O-CD2 2.83Å; H81-C83 PolarHBondContact O-N 2.82Å; H81-C83 VanDerWaalsContact O-N 3.14Å
82	D	96.4	Very high	90.2	Very high	54 Å²	54	71.2 Å²	71.2	29%	0.289	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	34.1	172.3	-53.7	-53.1	0	0	0	114.3	S43 L45 N56	S43-D82 WeakPolarHBondContact CB-OD1 3.26Å; S43-D82 PolarHBondContact OG-OD1 3Å; L45-D82 HydrophobicContact CB-CB 4.01Å; L45-D82 HydrophobicContact CD1-CB 3.79Å; L45-D82 HydrophobicContact CG-CB 4.36Å; N56-D82 VanDerWaalsContact ND2-CG 3.34Å; N56-D82 PolarHBondContact ND2-OD1 3.23Å; N56-D82 PolarHBondContact ND2-OD2 2.76Å; N56-D82 PolarHBondContact OD1-N 2.88Å
83	C	93.1	Very high	90	Very high	21 Å²	21	65.4 Å²	65.4	14%	0.142	35%	0.347	C	S	.	.			trans	-133.2	131.8	-176.7	179.6	0	0	0	0	110.4	C66 T77 S78 R80 H81 N85	C66-C83 WeakPolarHBondContact CB-O 3.29Å; C66-C83 PolarHBondContact SG-O 3.1Å; C66-C83 VanDerWaalsContact SG-O 3.41Å; T77-C83 PolarHBondContact OG1-O 3.07Å; S78-C83 WeakPolarHBondContact CB-O 3.43Å; S78-C83 VanDerWaalsContact OG-CB 3.3Å; S78-C83 WeakPolarHBondContact OG-CB 3.41Å; S78-C83 PolarHBondContact OG-O 3.04Å; R80-C83 HydrophobicContact CB-CB 4.2Å; H81-C83 PolarHBondContact O-N 2.82Å; H81-C83 VanDerWaalsContact O-N 3.14Å; C83-N85 PolarHBondContact SG-N 2.75Å
84	M	88.7	Confident	89.7	Confident	95 Å²	95	65.8 Å²	65.8	47%	0.468	35%	0.347	S	S	.	.			trans	-99.3	-1.7	178.1	-60.5	175.4	61.1	0	0	112.8	L46 F54 G86	L46-M84 HydrophobicContact CD1-CG 3.98Å; L46-M84 HydrophobicContact CD2-CG 3.89Å; L46-M84 HydrophobicContact CD2-SD 4.02Å; F54-M84 HydrophobicContact CE1-CE 4.26Å; F54-M84 HydrophobicContact CE1-CG 3.87Å; F54-M84 HydrophobicContact CE1-SD 4.34Å; F54-M84 HydrophobicContact CE2-CE 4.34Å; F54-M84 HydrophobicContact CE2-SD 4.27Å; F54-M84 HydrophobicContact CZ-CE 3.56Å; F54-M84 HydrophobicContact CZ-CG 3.96Å; F54-M84 HydrophobicContact CZ-SD 3.81Å; M84-G86 PolarHBondContact O-N 3.09Å
85	N	82.7	Confident	89.4	Confident	132 Å²	132	69.2 Å²	69.2	71%	0.706	37%	0.368	S	S	*	.			trans	-83.6	100.7	-177.6	-60.6	-14.2	0	0	0	108.8	T77 S78 C83	T77-N85 CarbonylContact O-C 3.42Å; S78-N85 VanDerWaalsContact CB-O 3.23Å; S78-N85 WeakPolarHBondContact CB-O 3.26Å; C83-N85 PolarHBondContact SG-N 2.75Å
86	G	74.4	Confident	89.3	Confident	40 Å²	40	70.4 Å²	70.4	41%	0.412	38%	0.379	S	S	.	.			trans	-60.1	157	171	0	0	0	0	0	111.7	T77 M84	T77-G86 WeakPolarHBondContact O-CA 3.26Å; T77-G86 PolarHBondContact O-N 3.42Å; M84-G86 PolarHBondContact O-N 3.09Å
87	D	78.2	Confident	89.3	Confident	64 Å²	64	73.7 Å²	73.7	34%	0.342	39%	0.392	S	S	.	.			trans	-89	123.2	172.9	-177.8	4.5	0	0	0	110.2	L79 A89 H90 L91 H94	L79-D87 HydrophobicContact CD1-CB 4.48Å; D87-A89 PolarHBondContact O-N 3.23Å; D87-A89 WeakPolarHBondContact OD1-CB 3.32Å; D87-A89 PolarHBondContact OD1-N 3.48Å; D87-H90 CarbonylContact O-C 3.56Å; D87-H90 PolarHBondContact O-N 3.09Å; D87-H90 IonicContact OD2-CE1 3.58Å; D87-H90 IonicContact OD2-ND1 2.89Å; D87-H90 PolarHBondContact OD2-ND1 3.44Å; D87-L91 PolarHBondContact O-N 2.91Å; D87-H94 PolarHBondContact N-CD2 2.97Å; D87-H94 PolarHBondContact N-NE2 3.47Å; D87-H94 PolarHBondContact O-CD2 2.78Å; D87-H94 VanDerWaalsContact O-CD2 3.27Å
88	L	77	Confident	89.5	Confident	155 Å²	155	74.1 Å²	74.1	81%	0.812	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-62.5	-23.5	176.4	-66.5	176.5	0	0	0	112.4	H90	L88-H90 VanDerWaalsContact C-N 3.26Å; L88-H90 PolarHBondContact O-N 2.82Å
89	A	82	Confident	89.6	Confident	78 Å²	78	82.2 Å²	82.2	65%	0.645	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-71.8	-22	175.4	0	0	0	0	0	113	D87	D87-A89 PolarHBondContact O-N 3.23Å; D87-A89 WeakPolarHBondContact OD1-CB 3.32Å; D87-A89 PolarHBondContact OD1-N 3.48Å
90	H	83.6	Confident	89.6	Confident	98 Å²	98	81.8 Å²	81.8	45%	0.454	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-123	40.6	-177.6	-62	94.8	0	0	0	111.1	D87 L88 D92 L93 H94	D87-H90 CarbonylContact O-C 3.56Å; D87-H90 PolarHBondContact O-N 3.09Å; D87-H90 IonicContact OD2-CE1 3.58Å; D87-H90 IonicContact OD2-ND1 2.89Å; D87-H90 PolarHBondContact OD2-ND1 3.44Å; L88-H90 VanDerWaalsContact C-N 3.26Å; L88-H90 PolarHBondContact O-N 2.82Å; H90-D92 PolarHBondContact O-N 3.35Å; H90-D92 VanDerWaalsContact O-N 3.16Å; H90-L93 HydrophobicContact CB-CB 4.42Å; H90-L93 WeakPolarHBondContact O-CB 3.32Å; H90-L93 PolarHBondContact O-N 3.45Å; H90-H94 PolarHBondContact O-CD2 2.54Å; H90-H94 PolarHBondContact O-N 2.96Å
91	L	86.8	Confident	89.7	Confident	94 Å²	94	74.2 Å²	74.2	49%	0.492	40%	0.403	S	S	.	.	H	α-helix	trans	-54.4	-38.5	-174.4	-174.6	65	0	0	0	112.8	D87 L93 H94 T95	D87-L91 PolarHBondContact O-N 2.91Å; L91-L93 VanDerWaalsContact C-N 3.3Å; L91-L93 PolarHBondContact O-N 3.48Å; L91-H94 CarbonylContact O-C 3.59Å; L91-H94 PolarHBondContact O-N 2.76Å; L91-H94 VanDerWaalsContact O-N 3.15Å; L91-T95 HydrophobicContact CD1-CG2 3.8Å; L91-T95 HydrophobicContact CG-CG2 4.07Å; L91-T95 WeakPolarHBondContact O-CB 2.95Å; L91-T95 WeakPolarHBondContact O-CG2 3.14Å; L91-T95 PolarHBondContact O-N 2.93Å; L91-T95 PolarHBondContact O-OG1 2.84Å
92	D	88.7	Confident	89.6	Confident	138 Å²	138	76.1 Å²	76.1	74%	0.738	41%	0.409	S	S	*	.	H	α-helix	trans	-60.5	-41	179.4	-63	-26.1	0	0	0	111.4	H90 T95 L96	H90-D92 PolarHBondContact O-N 3.35Å; H90-D92 VanDerWaalsContact O-N 3.16Å; D92-T95 PolarHBondContact O-N 2.86Å; D92-T95 PolarHBondContact O-OG1 3.35Å; D92-L96 VanDerWaalsContact O-CB 3.26Å; D92-L96 WeakPolarHBondContact O-CB 3.35Å; D92-L96 PolarHBondContact O-N 3.43Å
93	L	91.4	Very high	89.7	Confident	37 Å²	37	75.5 Å²	75.5	19%	0.194	41%	0.409	C	S	.	.	H	α-helix	trans	-68.4	-36	177.2	-176.1	63.8	0	0	0	111.9	V76 L79 H90 L91 T95 F98 I108	V76-L93 HydrophobicContact CB-CD1 4.49Å; V76-L93 HydrophobicContact CB-CG 4.09Å; V76-L93 HydrophobicContact CG1-CD2 4.36Å; V76-L93 HydrophobicContact CG1-CG 4.39Å; V76-L93 HydrophobicContact CG2-CD1 4.06Å; V76-L93 HydrophobicContact CG2-CG 4.14Å; L79-L93 HydrophobicContact CD2-CD2 4.28Å; H90-L93 HydrophobicContact CB-CB 4.42Å; H90-L93 WeakPolarHBondContact O-CB 3.32Å; H90-L93 PolarHBondContact O-N 3.45Å; L91-L93 VanDerWaalsContact C-N 3.3Å; L91-L93 PolarHBondContact O-N 3.48Å; L93-T95 VanDerWaalsContact C-N 3.35Å; L93-F98 HydrophobicContact CD1-CE2 4.49Å; L93-F98 HydrophobicContact CD1-CZ 4.45Å; L93-I108 HydrophobicContact CD1-CG2 4.07Å
94	H	91.9	Very high	89.9	Confident	14 Å²	14	74.5 Å²	74.5	7%	0.065	40%	0.402	C	S	.	.	H	α-helix	trans	-83.9	-6.4	-177.9	-65.1	-59.2	0	0	0	114.8	R75 V76 D87 H90 L91	R75-H94 VanDerWaalsContact CD-O 3.29Å; R75-H94 WeakPolarHBondContact CD-O 3.33Å; V76-H94 WeakPolarHBondContact O-CA 3.31Å; V76-H94 PolarHBondContact O-ND1 3Å; D87-H94 PolarHBondContact N-CD2 2.97Å; D87-H94 PolarHBondContact N-NE2 3.47Å; D87-H94 PolarHBondContact O-CD2 2.78Å; D87-H94 VanDerWaalsContact O-CD2 3.27Å; H90-H94 PolarHBondContact O-CD2 2.54Å; H90-H94 PolarHBondContact O-N 2.96Å; L91-H94 CarbonylContact O-C 3.59Å; L91-H94 PolarHBondContact O-N 2.76Å; L91-H94 VanDerWaalsContact O-N 3.15Å
95	T	91.7	Very high	90.3	Very high	77 Å²	77	70 Å²	70	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-112.2	-17	178.5	53.8	0	0	0	0	113.1	L91 D92 L93	L91-T95 HydrophobicContact CD1-CG2 3.8Å; L91-T95 HydrophobicContact CG-CG2 4.07Å; L91-T95 WeakPolarHBondContact O-CB 2.95Å; L91-T95 WeakPolarHBondContact O-CG2 3.14Å; L91-T95 PolarHBondContact O-N 2.93Å; L91-T95 PolarHBondContact O-OG1 2.84Å; D92-T95 PolarHBondContact O-N 2.86Å; D92-T95 PolarHBondContact O-OG1 3.35Å; L93-T95 VanDerWaalsContact C-N 3.35Å
96	L	94.8	Very high	90.9	Very high	87 Å²	87	67.8 Å²	67.8	46%	0.455	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-79.9	125.5	179.9	-176.6	60.4	0	0	0	112.1	R75 D92 F98	R75-L96 WeakPolarHBondContact CG-O 3.28Å; D92-L96 VanDerWaalsContact O-CB 3.26Å; D92-L96 WeakPolarHBondContact O-CB 3.35Å; D92-L96 PolarHBondContact O-N 3.43Å; L96-F98 HydrophobicContact CB-CE2 4.47Å; L96-F98 HydrophobicContact CD2-CD1 4.49Å; L96-F98 HydrophobicContact CD2-CE1 3.75Å; L96-F98 HydrophobicContact CD2-CE2 4.1Å; L96-F98 HydrophobicContact CD2-CZ 3.53Å; L96-F98 HydrophobicContact CG-CE1 4.37Å; L96-F98 HydrophobicContact CG-CE2 4.16Å; L96-F98 HydrophobicContact CG-CZ 4.07Å
97	Y	97.4	Very high	92	Very high	68 Å²	68	69.6 Å²	69.6	27%	0.267	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-93.3	130	165.2	-74.3	-91.8	0	0	0	109.8	E68 K72 W74 R75	E68-Y97 WeakPolarHBondContact OE1-CE1 3.48Å; E68-Y97 VanDerWaalsContact OE1-CZ 3.27Å; E68-Y97 PolarHBondContact OE1-OH 3.33Å; K72-Y97 HydrophobicContact CB-CD1 3.85Å; K72-Y97 HydrophobicContact CB-CE1 4.04Å; K72-Y97 HydrophobicContact CB-CG 4.2Å; K72-Y97 HydrophobicContact CD-CE2 4.33Å; W74-Y97 CarbonylContact O-C 3.52Å; W74-Y97 WeakPolarHBondContact O-CA 3.2Å; R75-Y97 HydrophobicContact CB-CD1 3.77Å; R75-Y97 HydrophobicContact CB-CE1 3.73Å; R75-Y97 HydrophobicContact CB-CG 4.25Å
98	F	98.1	Very high	92.8	Very high	16 Å²	16	67.4 Å²	67.4	7%	0.07	36%	0.359	C	S	.	.	B	Isolated β-bridge	trans	-95.4	138.7	171.9	-61.4	-89.6	0	0	0	109.2	G73 W74 L93 L96 T100 L104 T107	G73-F98 WeakPolarHBondContact CA-O 3.18Å; W74-F98 HydrophobicContact CB-CB 4.34Å; W74-F98 PolarHBondContact N-O 2.99Å; W74-F98 WeakPolarHBondContact O-CD2 3.3Å; W74-F98 PolarHBondContact O-N 3.25Å; L93-F98 HydrophobicContact CD1-CE2 4.49Å; L93-F98 HydrophobicContact CD1-CZ 4.45Å; L96-F98 HydrophobicContact CB-CE2 4.47Å; L96-F98 HydrophobicContact CD2-CD1 4.49Å; L96-F98 HydrophobicContact CD2-CE1 3.75Å; L96-F98 HydrophobicContact CD2-CE2 4.1Å; L96-F98 HydrophobicContact CD2-CZ 3.53Å; L96-F98 HydrophobicContact CG-CE1 4.37Å; L96-F98 HydrophobicContact CG-CE2 4.16Å; L96-F98 HydrophobicContact CG-CZ 4.07Å; F98-T100 VanDerWaalsContact C-N 3.32Å; F98-T100 PolarHBondContact O-N 3.04Å; F98-L104 HydrophobicContact CB-CB 3.88Å; F98-L104 HydrophobicContact CD1-CB 4.3Å; F98-L104 HydrophobicContact CD2-CB 3.79Å; F98-L104 HydrophobicContact CD2-CD1 3.87Å; F98-L104 HydrophobicContact CD2-CG 3.87Å; F98-L104 HydrophobicContact CE2-CB 4.4Å; F98-L104 HydrophobicContact CE2-CD1 4.41Å; F98-L104 HydrophobicContact CE2-CG 4.18Å; F98-L104 HydrophobicContact CG-CB 3.73Å; F98-L104 HydrophobicContact CG-CG 4.33Å; F98-T107 HydrophobicContact CE1-CG2 4.29Å; F98-T107 VanDerWaalsContact CE1-OG1 3.3Å; F98-T107 WeakPolarHBondContact CE1-OG1 3.34Å; F98-T107 HydrophobicContact CZ-CG2 4.04Å
99	E	97	Very high	93.7	Very high	171 Å²	171	60 Å²	60	80%	0.799	32%	0.321	S	S	*	.	S	Bend	trans	-68	-35	-179.8	-175.4	177.8	-178.9	0	0	111.9
100	T	96.4	Very high	94.4	Very high	56 Å²	56	58.9 Å²	58.9	34%	0.344	31%	0.311	S	S	.	.	S	Bend	trans	-132	151.7	-176.8	65.8	0	0	0	0	111	F98 Y102 S103 L104	F98-T100 VanDerWaalsContact C-N 3.32Å; F98-T100 PolarHBondContact O-N 3.04Å; T100-Y102 PolarHBondContact O-N 3.42Å; T100-S103 PolarHBondContact N-OG 3.39Å; T100-S103 PolarHBondContact O-N 3.37Å; T100-S103 PolarHBondContact O-OG 2.68Å; T100-S103 PolarHBondContact OG1-N 2.74Å; T100-S103 PolarHBondContact OG1-OG 3.11Å; T100-S103 VanDerWaalsContact OG1-OG 3.1Å; T100-L104 PolarHBondContact O-N 3.23Å
101	V	96.4	Very high	95.1	Very high	8 Å²	8	56 Å²	56	5%	0.048	30%	0.302	C	S	.	.	H	α-helix	trans	-59.8	-30.7	174.5	80.6	0	0	0	0	111.9	A29 L33 W74 L104 M105	A29-V101 HydrophobicContact CB-CB 4.44Å; A29-V101 HydrophobicContact CB-CG1 4.25Å; A29-V101 HydrophobicContact CB-CG2 4.26Å; L33-V101 HydrophobicContact CD1-CB 4.3Å; L33-V101 HydrophobicContact CD1-CG1 3.95Å; L33-V101 HydrophobicContact CD1-CG2 3.42Å; L33-V101 VanDerWaalsContact CD1-CG2 3.42Å; L33-V101 HydrophobicContact CD2-CG1 4.37Å; L33-V101 HydrophobicContact CG-CG1 4.26Å; W74-V101 HydrophobicContact CD2-CB 3.97Å; W74-V101 HydrophobicContact CD2-CG2 4.05Å; W74-V101 HydrophobicContact CE3-CB 4.26Å; W74-V101 HydrophobicContact CE3-CG2 3.85Å; W74-V101 HydrophobicContact CH2-CB 4.17Å; W74-V101 HydrophobicContact CH2-CG2 4.1Å; W74-V101 HydrophobicContact CZ2-CB 3.83Å; W74-V101 HydrophobicContact CZ2-CG2 4.26Å; W74-V101 HydrophobicContact CZ3-CB 4.36Å; W74-V101 HydrophobicContact CZ3-CG2 3.89Å; V101-L104 PolarHBondContact O-N 3.49Å; V101-M105 HydrophobicContact CG2-CG 4.48Å; V101-M105 WeakPolarHBondContact O-CB 3.42Å; V101-M105 VanDerWaalsContact O-CG 3.26Å; V101-M105 WeakPolarHBondContact O-CG 3.45Å; V101-M105 PolarHBondContact O-N 2.99Å
102	Y	96	Very high	95.6	Very high	96 Å²	96	51.8 Å²	51.8	38%	0.376	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-42	177.6	-52.9	-57.5	0	0	0	113	E32 L33 T100 M105 D106 Y112	E32-Y102 VanDerWaalsContact OE2-CZ 3.27Å; E32-Y102 PolarHBondContact OE2-OH 3.33Å; L33-Y102 HydrophobicContact CD2-CD1 4.37Å; L33-Y102 HydrophobicContact CD2-CE1 4.48Å; T100-Y102 PolarHBondContact O-N 3.42Å; Y102-M105 PolarHBondContact O-N 3.16Å; Y102-D106 VanDerWaalsContact O-CB 3.31Å; Y102-D106 WeakPolarHBondContact O-CB 3.45Å; Y102-D106 PolarHBondContact O-N 3.07Å; Y102-Y112 WeakPolarHBondContact CD1-OH 3.35Å
103	S	96.8	Very high	95.9	Very high	41 Å²	41	50 Å²	50	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-71.2	-33.6	178.2	55	0	0	0	0	112.3	T100 T107	T100-S103 PolarHBondContact N-OG 3.39Å; T100-S103 PolarHBondContact O-N 3.37Å; T100-S103 PolarHBondContact O-OG 2.68Å; T100-S103 PolarHBondContact OG1-N 2.74Å; T100-S103 PolarHBondContact OG1-OG 3.11Å; T100-S103 VanDerWaalsContact OG1-OG 3.1Å; S103-T107 PolarHBondContact O-N 2.85Å; S103-T107 PolarHBondContact O-OG1 3.03Å
104	L	97.7	Very high	96.1	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-52.5	168.7	-177	153.1	0	0	0	110.5	I67 W74 V76 F98 T100 V101 D106 T107 I108	I67-L104 HydrophobicContact CD1-CD1 4.19Å; I67-L104 HydrophobicContact CD1-CD2 3.7Å; I67-L104 HydrophobicContact CG1-CD1 4.43Å; I67-L104 HydrophobicContact CG2-CD1 3.9Å; W74-L104 HydrophobicContact CB-CD1 3.69Å; V76-L104 HydrophobicContact CG2-CD1 4.32Å; F98-L104 HydrophobicContact CB-CB 3.88Å; F98-L104 HydrophobicContact CD1-CB 4.3Å; F98-L104 HydrophobicContact CD2-CB 3.79Å; F98-L104 HydrophobicContact CD2-CD1 3.87Å; F98-L104 HydrophobicContact CD2-CG 3.87Å; F98-L104 HydrophobicContact CE2-CB 4.4Å; F98-L104 HydrophobicContact CE2-CD1 4.41Å; F98-L104 HydrophobicContact CE2-CG 4.18Å; F98-L104 HydrophobicContact CG-CB 3.73Å; F98-L104 HydrophobicContact CG-CG 4.33Å; T100-L104 PolarHBondContact O-N 3.23Å; V101-L104 PolarHBondContact O-N 3.49Å; L104-D106 VanDerWaalsContact C-N 3.34Å; L104-D106 PolarHBondContact O-N 3.34Å; L104-T107 WeakPolarHBondContact O-CA 3.37Å; L104-T107 WeakPolarHBondContact O-CB 3.27Å; L104-T107 PolarHBondContact O-N 3.37Å; L104-I108 HydrophobicContact CD2-CD1 3.49Å; L104-I108 VanDerWaalsContact CD2-CD1 3.49Å; L104-I108 HydrophobicContact CD2-CG1 3.95Å; L104-I108 PolarHBondContact O-N 3.49Å
105	M	97.6	Very high	96.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-64.6	-36.5	-177.7	-72.8	-59.3	-61.1	0	0	112.8	L33 V37 I57 V101 Y102 T107 I108 S109 Y112	L33-M105 HydrophobicContact CD1-CG 3.72Å; L33-M105 HydrophobicContact CD1-SD 4.26Å; L33-M105 HydrophobicContact CD2-CG 4.05Å; V37-M105 HydrophobicContact CG1-CE 3.56Å; I57-M105 HydrophobicContact CD1-SD 3.87Å; I57-M105 HydrophobicContact CG2-CE 4.5Å; I57-M105 HydrophobicContact CG2-SD 4.37Å; V101-M105 HydrophobicContact CG2-CG 4.48Å; V101-M105 WeakPolarHBondContact O-CB 3.42Å; V101-M105 VanDerWaalsContact O-CG 3.26Å; V101-M105 WeakPolarHBondContact O-CG 3.45Å; V101-M105 PolarHBondContact O-N 2.99Å; Y102-M105 PolarHBondContact O-N 3.16Å; M105-T107 PolarHBondContact O-N 3.39Å; M105-I108 PolarHBondContact O-N 2.81Å; M105-I108 HydrophobicContact SD-CD1 3.89Å; M105-I108 HydrophobicContact SD-CG1 4.13Å; M105-S109 PolarHBondContact O-N 2.92Å; M105-Y112 HydrophobicContact CB-CD1 3.51Å; M105-Y112 HydrophobicContact CB-CD2 4.02Å; M105-Y112 HydrophobicContact CB-CE1 3.52Å; M105-Y112 HydrophobicContact CB-CE2 4.04Å; M105-Y112 HydrophobicContact CB-CG 3.79Å; M105-Y112 HydrophobicContact CE-CD2 3.88Å; M105-Y112 HydrophobicContact CE-CG 3.93Å; M105-Y112 HydrophobicContact CG-CD2 4.49Å; M105-Y112 HydrophobicContact CG-CE2 4.5Å
106	D	96.1	Very high	96.3	Very high	86 Å²	86	60.5 Å²	60.5	46%	0.46	30%	0.298	S	S	.	.	H	α-helix	trans	-59.1	-33.8	171.9	-171.4	71.1	0	0	0	111.5	Y102 L104 R113	Y102-D106 VanDerWaalsContact O-CB 3.31Å; Y102-D106 WeakPolarHBondContact O-CB 3.45Å; Y102-D106 PolarHBondContact O-N 3.07Å; L104-D106 VanDerWaalsContact C-N 3.34Å; L104-D106 PolarHBondContact O-N 3.34Å; D106-R113 HydrophobicContact CB-CG 4.46Å; D106-R113 WeakPolarHBondContact O-CD 3.39Å; D106-R113 PolarHBondContact O-NH1 2.97Å; D106-R113 WeakPolarHBondContact OD1-CD 3.23Å; D106-R113 WeakPolarHBondContact OD1-CG 3.42Å
107	T	95.6	Very high	96.2	Very high	77 Å²	77	60.4 Å²	60.4	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-78.1	-44.8	177.9	-57.4	0	0	0	0	112.3	F98 S103 L104 M105	F98-T107 HydrophobicContact CE1-CG2 4.29Å; F98-T107 VanDerWaalsContact CE1-OG1 3.3Å; F98-T107 WeakPolarHBondContact CE1-OG1 3.34Å; F98-T107 HydrophobicContact CZ-CG2 4.04Å; S103-T107 PolarHBondContact O-N 2.85Å; S103-T107 PolarHBondContact O-OG1 3.03Å; L104-T107 WeakPolarHBondContact O-CA 3.37Å; L104-T107 WeakPolarHBondContact O-CB 3.27Å; L104-T107 PolarHBondContact O-N 3.37Å; M105-T107 PolarHBondContact O-N 3.39Å
108	I	95.7	Very high	96.1	Very high	19 Å²	19	61.1 Å²	61.1	10%	0.097	31%	0.309	C	S	.	.	H	α-helix	trans	-91.4	-19	-167.9	68.6	165.7	0	0	0	115.3	Y65 V76 L93 L104 M105	Y65-I108 HydrophobicContact CD1-CD1 4.39Å; Y65-I108 HydrophobicContact CD2-CD1 3.79Å; Y65-I108 HydrophobicContact CE1-CB 4.35Å; Y65-I108 HydrophobicContact CE1-CG2 4.44Å; Y65-I108 HydrophobicContact CE2-CB 4.37Å; Y65-I108 HydrophobicContact CE2-CD1 3.99Å; Y65-I108 HydrophobicContact CG-CD1 4Å; V76-I108 HydrophobicContact CG2-CG2 4.18Å; L93-I108 HydrophobicContact CD1-CG2 4.07Å; L104-I108 HydrophobicContact CD2-CD1 3.49Å; L104-I108 VanDerWaalsContact CD2-CD1 3.49Å; L104-I108 HydrophobicContact CD2-CG1 3.95Å; L104-I108 PolarHBondContact O-N 3.49Å; M105-I108 PolarHBondContact O-N 2.81Å; M105-I108 HydrophobicContact SD-CD1 3.89Å; M105-I108 HydrophobicContact SD-CG1 4.13Å
109	S	97	Very high	95.8	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.32	C	S	.	.			trans	-134.5	115.1	-176.1	177.6	0	0	0	0	112.5	E61 M105 Y112 R113	E61-S109 PolarHBondContact OE1-OG 2.56Å; E61-S109 PolarHBondContact OE2-OG 2.82Å; M105-S109 PolarHBondContact O-N 2.92Å; S109-Y112 PolarHBondContact O-N 3.33Å; S109-Y112 WeakPolarHBondContact OG-CB 3.37Å; S109-Y112 PolarHBondContact OG-N 2.79Å; S109-R113 PolarHBondContact O-N 3.41Å
110	A	96.7	Very high	95.6	Very high	53 Å²	53	59.3 Å²	59.3	44%	0.438	31%	0.305	S	S	.	.	H	α-helix	trans	-69.7	-37.1	175.2	0	0	0	0	0	111.8	E61 R113 Q114	E61-A110 PolarHBondContact OE1-N 3.49Å; A110-R113 WeakPolarHBondContact O-CB 3.26Å; A110-R113 PolarHBondContact O-N 3.23Å; A110-Q114 PolarHBondContact O-N 2.75Å; A110-Q114 VanDerWaalsContact O-N 3.07Å
111	C	97.1	Very high	95.5	Very high	39 Å²	39	58.7 Å²	58.7	26%	0.264	31%	0.305	S	S	.	.	H	α-helix	trans	-67.2	-36.1	175.7	-73.2	0	0	0	0	111.9	L60 E61 Q114 R115	L60-C111 HydrophobicContact CB-CB 3.73Å; L60-C111 HydrophobicContact CD1-CB 4.01Å; L60-C111 HydrophobicContact CG-CB 4.45Å; E61-C111 HydrophobicContact CG-CB 4.25Å; E61-C111 WeakPolarHBondContact OE1-CB 3.3Å; E61-C111 PolarHBondContact OE1-N 3.14Å; C111-Q114 PolarHBondContact O-N 2.77Å; C111-R115 WeakPolarHBondContact O-CB 3.38Å; C111-R115 VanDerWaalsContact O-CG 3.31Å; C111-R115 WeakPolarHBondContact O-CG 3.49Å; C111-R115 PolarHBondContact O-N 3.2Å
112	Y	97.1	Very high	95.4	Very high	5 Å²	5	61.8 Å²	61.8	2%	0.02	32%	0.321	C	S	.	.	H	α-helix	trans	-56.9	-50.7	170.3	169.2	-94.8	0	0	0	110.6	L33 A36 Y102 M105 S109 Q114 R115 F116	L33-Y112 HydrophobicContact CD2-CD2 4.36Å; L33-Y112 HydrophobicContact CD2-CE2 3.56Å; A36-Y112 HydrophobicContact CB-CD2 3.56Å; A36-Y112 HydrophobicContact CB-CE2 4.07Å; Y102-Y112 WeakPolarHBondContact CD1-OH 3.35Å; M105-Y112 HydrophobicContact CB-CD1 3.51Å; M105-Y112 HydrophobicContact CB-CD2 4.02Å; M105-Y112 HydrophobicContact CB-CE1 3.52Å; M105-Y112 HydrophobicContact CB-CE2 4.04Å; M105-Y112 HydrophobicContact CB-CG 3.79Å; M105-Y112 HydrophobicContact CE-CD2 3.88Å; M105-Y112 HydrophobicContact CE-CG 3.93Å; M105-Y112 HydrophobicContact CG-CD2 4.49Å; M105-Y112 HydrophobicContact CG-CE2 4.5Å; S109-Y112 PolarHBondContact O-N 3.33Å; S109-Y112 WeakPolarHBondContact OG-CB 3.37Å; S109-Y112 PolarHBondContact OG-N 2.79Å; Y112-Q114 VanDerWaalsContact C-N 3.3Å; Y112-Q114 PolarHBondContact O-N 2.63Å; Y112-R115 PolarHBondContact O-N 2.88Å; Y112-F116 HydrophobicContact CE1-CB 4.48Å; Y112-F116 VanDerWaalsContact O-CB 3.29Å; Y112-F116 WeakPolarHBondContact O-CB 3.07Å; Y112-F116 PolarHBondContact O-N 3.34Å
113	R	96.2	Very high	95.3	Very high	101 Å²	101	63.8 Å²	63.8	38%	0.381	33%	0.328	S	S	.	.	H	α-helix	trans	-55.9	-44.5	178	-64.8	-165.5	-62.6	-100.1	-0.4	112.4	D106 S109 A110 T117	D106-R113 HydrophobicContact CB-CG 4.46Å; D106-R113 WeakPolarHBondContact O-CD 3.39Å; D106-R113 PolarHBondContact O-NH1 2.97Å; D106-R113 WeakPolarHBondContact OD1-CD 3.23Å; D106-R113 WeakPolarHBondContact OD1-CG 3.42Å; S109-R113 PolarHBondContact O-N 3.41Å; A110-R113 WeakPolarHBondContact O-CB 3.26Å; A110-R113 PolarHBondContact O-N 3.23Å; R113-T117 WeakPolarHBondContact O-CB 3.39Å; R113-T117 PolarHBondContact O-N 3.4Å; R113-T117 PolarHBondContact O-OG1 3.24Å
114	Q	95.8	Very high	95.2	Very high	120 Å²	120	66.3 Å²	66.3	56%	0.561	34%	0.338	S	S	*	.	H	α-helix	trans	-63.6	-50.8	177.9	-174.5	177.2	3.1	0	0	111.4	A110 C111 Y112 F116 T117 D118	A110-Q114 PolarHBondContact O-N 2.75Å; A110-Q114 VanDerWaalsContact O-N 3.07Å; C111-Q114 PolarHBondContact O-N 2.77Å; Y112-Q114 VanDerWaalsContact C-N 3.3Å; Y112-Q114 PolarHBondContact O-N 2.63Å; Q114-F116 VanDerWaalsContact C-N 3.33Å; Q114-F116 PolarHBondContact O-N 2.87Å; Q114-T117 PolarHBondContact O-N 3.2Å; Q114-D118 VanDerWaalsContact O-CG 3.26Å; Q114-D118 PolarHBondContact O-N 2.85Å
115	R	93.8	Very high	95	Very high	142 Å²	142	73.7 Å²	73.7	54%	0.536	37%	0.366	S	S	.	.	H	α-helix	trans	-60.3	-42.3	179.5	-75.9	-67.2	-169.8	163.1	2.7	112.6	A36 L60 C111 Y112 D118 L119	A36-R115 HydrophobicContact CB-CB 4.18Å; L60-R115 HydrophobicContact CD1-CG 3.73Å; C111-R115 WeakPolarHBondContact O-CB 3.38Å; C111-R115 VanDerWaalsContact O-CG 3.31Å; C111-R115 WeakPolarHBondContact O-CG 3.49Å; C111-R115 PolarHBondContact O-N 3.2Å; Y112-R115 PolarHBondContact O-N 2.88Å; R115-D118 PolarHBondContact O-N 3.18Å; R115-L119 WeakPolarHBondContact O-CB 3.48Å; R115-L119 PolarHBondContact O-N 3.1Å
116	F	92.3	Very high	94.8	Very high	86 Å²	86	77.5 Å²	77.5	38%	0.377	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-44.2	176.7	-174.4	-96.4	0	0	0	111.1	F35 Y112 Q114 L119 L120	F35-F116 HydrophobicContact CZ-CD2 4.41Å; Y112-F116 HydrophobicContact CE1-CB 4.48Å; Y112-F116 VanDerWaalsContact O-CB 3.29Å; Y112-F116 WeakPolarHBondContact O-CB 3.07Å; Y112-F116 PolarHBondContact O-N 3.34Å; Q114-F116 VanDerWaalsContact C-N 3.33Å; Q114-F116 PolarHBondContact O-N 2.87Å; F116-L119 PolarHBondContact O-N 3.22Å; F116-L120 WeakPolarHBondContact O-CB 3.39Å; F116-L120 PolarHBondContact O-N 3.01Å
117	T	94.4	Very high	94.7	Very high	84 Å²	84	77.9 Å²	77.9	52%	0.515	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-44.1	176.7	-57.3	0	0	0	0	111.9	R113 Q114 L119 L120 A121	R113-T117 WeakPolarHBondContact O-CB 3.39Å; R113-T117 PolarHBondContact O-N 3.4Å; R113-T117 PolarHBondContact O-OG1 3.24Å; Q114-T117 PolarHBondContact O-N 3.2Å; T117-L119 PolarHBondContact O-N 3.43Å; T117-L120 PolarHBondContact O-N 3.27Å; T117-A121 WeakPolarHBondContact O-CB 3.44Å; T117-A121 PolarHBondContact O-N 2.92Å
118	D	94.3	Very high	94.5	Very high	83 Å²	83	80.1 Å²	80.1	44%	0.444	39%	0.394	S	S	.	.	H	α-helix	trans	-62.6	-42.9	178.1	-70.3	-21.8	0	0	0	111.5	Q114 R115 A121 L122	Q114-D118 VanDerWaalsContact O-CG 3.26Å; Q114-D118 PolarHBondContact O-N 2.85Å; R115-D118 PolarHBondContact O-N 3.18Å; D118-A121 PolarHBondContact O-N 3.19Å; D118-L122 WeakPolarHBondContact O-CB 3.41Å; D118-L122 PolarHBondContact O-N 2.83Å
119	L	91.3	Very high	94.3	Very high	58 Å²	58	81.8 Å²	81.8	30%	0.304	41%	0.41	S	S	.	.	H	α-helix	trans	-62.8	-46.7	175.4	-179.6	62.1	0	0	0	110.9	F35 R115 F116 T117 A121 L122 R123	F35-L119 HydrophobicContact CD2-CD2 4.21Å; F35-L119 HydrophobicContact CE1-CD2 4.22Å; F35-L119 HydrophobicContact CE2-CB 4.4Å; F35-L119 HydrophobicContact CE2-CD2 3.59Å; F35-L119 HydrophobicContact CZ-CD2 3.6Å; R115-L119 WeakPolarHBondContact O-CB 3.48Å; R115-L119 PolarHBondContact O-N 3.1Å; F116-L119 PolarHBondContact O-N 3.22Å; T117-L119 PolarHBondContact O-N 3.43Å; L119-A121 PolarHBondContact O-N 3.02Å; L119-L122 WeakPolarHBondContact O-CB 3.46Å; L119-L122 PolarHBondContact O-N 3.01Å; L119-R123 HydrophobicContact CD1-CG 4.35Å; L119-R123 WeakPolarHBondContact O-CG 3.46Å; L119-R123 PolarHBondContact O-N 2.92Å
120	L	92.5	Very high	93.8	Very high	91 Å²	91	88 Å²	88	48%	0.476	44%	0.441	S	S	.	.	H	α-helix	trans	-60.1	-45.7	177.4	-177.5	61.7	0	0	0	111.3	F116 T117 L122 R123 L124	F116-L120 WeakPolarHBondContact O-CB 3.39Å; F116-L120 PolarHBondContact O-N 3.01Å; T117-L120 PolarHBondContact O-N 3.27Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L120-L122 PolarHBondContact O-N 3.04Å; L120-R123 PolarHBondContact O-N 3.04Å; L120-L124 HydrophobicContact CD1-CD1 4.39Å; L120-L124 HydrophobicContact CD1-CG 4.32Å; L120-L124 HydrophobicContact CG-CD1 4.05Å; L120-L124 HydrophobicContact CG-CG 4.42Å; L120-L124 WeakPolarHBondContact O-CB 3.39Å; L120-L124 VanDerWaalsContact O-CG 3.27Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 3.06Å
121	A	95.6	Very high	93.1	Very high	43 Å²	43	89.4 Å²	89.4	36%	0.355	45%	0.448	S	S	.	.	H	α-helix	trans	-63.3	-35.9	177.1	0	0	0	0	0	112.6	T117 D118 L119 R125	T117-A121 WeakPolarHBondContact O-CB 3.44Å; T117-A121 PolarHBondContact O-N 2.92Å; D118-A121 PolarHBondContact O-N 3.19Å; L119-A121 PolarHBondContact O-N 3.02Å; A121-R125 WeakPolarHBondContact O-CG 3.17Å; A121-R125 PolarHBondContact O-N 3.31Å; A121-R125 PolarHBondContact O-NE 2.87Å
122	L	94.5	Very high	92.2	Very high	73 Å²	73	90.4 Å²	90.4	38%	0.382	46%	0.459	S	S	.	.	H	α-helix	trans	-64.7	-49	172.6	-179.9	64.7	0	0	0	111.2	D118 L119 L120 L124 R125 Q126	D118-L122 WeakPolarHBondContact O-CB 3.41Å; D118-L122 PolarHBondContact O-N 2.83Å; L119-L122 WeakPolarHBondContact O-CB 3.46Å; L119-L122 PolarHBondContact O-N 3.01Å; L120-L122 VanDerWaalsContact C-N 3.32Å; L120-L122 PolarHBondContact O-N 3.04Å; L122-L124 PolarHBondContact O-N 3.37Å; L122-R125 PolarHBondContact O-N 2.99Å; L122-Q126 WeakPolarHBondContact O-CG 3.39Å; L122-Q126 PolarHBondContact O-N 2.78Å
123	R	92.8	Very high	90.4	Very high	139 Å²	139	93.9 Å²	93.9	53%	0.525	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-41.5	179.7	-66	-52.6	-173.7	175.8	2.8	112.2	L119 L120 R125 Q126 V127	L119-R123 HydrophobicContact CD1-CG 4.35Å; L119-R123 WeakPolarHBondContact O-CG 3.46Å; L119-R123 PolarHBondContact O-N 2.92Å; L120-R123 PolarHBondContact O-N 3.04Å; R123-R125 VanDerWaalsContact C-N 3.33Å; R123-R125 PolarHBondContact O-N 3.05Å; R123-Q126 WeakPolarHBondContact O-CB 3.26Å; R123-Q126 PolarHBondContact O-N 2.98Å; R123-V127 WeakPolarHBondContact O-CG2 3.4Å; R123-V127 PolarHBondContact O-N 3.23Å
124	L	94.3	Very high	88.6	Confident	94 Å²	94	96.5 Å²	96.5	49%	0.492	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-42.6	175.1	-72.9	172.5	0	0	0	111.9	L120 L122 Q126 V127 Q128	L120-L124 HydrophobicContact CD1-CD1 4.39Å; L120-L124 HydrophobicContact CD1-CG 4.32Å; L120-L124 HydrophobicContact CG-CD1 4.05Å; L120-L124 HydrophobicContact CG-CG 4.42Å; L120-L124 WeakPolarHBondContact O-CB 3.39Å; L120-L124 VanDerWaalsContact O-CG 3.27Å; L120-L124 WeakPolarHBondContact O-CG 3.32Å; L120-L124 PolarHBondContact O-N 3.06Å; L122-L124 PolarHBondContact O-N 3.37Å; L124-Q126 PolarHBondContact O-N 3.22Å; L124-V127 PolarHBondContact O-N 3.32Å; L124-Q128 VanDerWaalsContact O-CG 3.3Å; L124-Q128 WeakPolarHBondContact O-CG 3.49Å; L124-Q128 PolarHBondContact O-N 2.93Å
125	R	95.2	Very high	86.7	Confident	154 Å²	154	95.6 Å²	95.6	58%	0.581	51%	0.512	S	S	*	.	H	α-helix	trans	-63.9	-38.4	175.3	-76.2	-177.9	-69.4	173	-1.4	112.6	A121 L122 R123 Q128 A129	A121-R125 WeakPolarHBondContact O-CG 3.17Å; A121-R125 PolarHBondContact O-N 3.31Å; A121-R125 PolarHBondContact O-NE 2.87Å; L122-R125 PolarHBondContact O-N 2.99Å; R123-R125 VanDerWaalsContact C-N 3.33Å; R123-R125 PolarHBondContact O-N 3.05Å; R125-Q128 PolarHBondContact O-N 2.96Å; R125-A129 WeakPolarHBondContact O-CB 3.43Å; R125-A129 PolarHBondContact O-N 2.84Å
126	Q	93.4	Very high	84.5	Confident	80 Å²	80	96.3 Å²	96.3	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-62.8	-46.6	175.5	-71.6	173.7	-16.9	0	0	111.3	L122 R123 L124 Q128 A129 M130	L122-Q126 WeakPolarHBondContact O-CG 3.39Å; L122-Q126 PolarHBondContact O-N 2.78Å; R123-Q126 WeakPolarHBondContact O-CB 3.26Å; R123-Q126 PolarHBondContact O-N 2.98Å; L124-Q126 PolarHBondContact O-N 3.22Å; Q126-Q128 VanDerWaalsContact C-N 3.33Å; Q126-Q128 PolarHBondContact O-N 3.33Å; Q126-A129 PolarHBondContact O-N 3.49Å; Q126-M130 VanDerWaalsContact O-CG 3.28Å; Q126-M130 WeakPolarHBondContact O-CG 3.39Å; Q126-M130 PolarHBondContact O-N 3.42Å
127	V	92.3	Very high	82.3	Confident	94 Å²	94	98.5 Å²	98.5	57%	0.57	54%	0.536	S	S	*	.	H	α-helix	trans	-62.1	-40.4	177.4	174.7	0	0	0	0	111.5	R123 L124 M130 S131	R123-V127 WeakPolarHBondContact O-CG2 3.4Å; R123-V127 PolarHBondContact O-N 3.23Å; L124-V127 PolarHBondContact O-N 3.32Å; V127-M130 PolarHBondContact O-N 2.93Å; V127-S131 PolarHBondContact O-N 3.08Å; V127-S131 VanDerWaalsContact O-N 3.12Å; V127-S131 PolarHBondContact O-OG 2.84Å
128	Q	92.7	Very high	80.1	Confident	125 Å²	125	102.8 Å²	102.8	58%	0.584	55%	0.552	S	S	*	*	H	α-helix	trans	-66.8	-37.4	175.4	-72.6	173.8	-4.4	0	0	113.1	L124 R125 Q126 S131 A132	L124-Q128 VanDerWaalsContact O-CG 3.3Å; L124-Q128 WeakPolarHBondContact O-CG 3.49Å; L124-Q128 PolarHBondContact O-N 2.93Å; R125-Q128 PolarHBondContact O-N 2.96Å; Q126-Q128 VanDerWaalsContact C-N 3.33Å; Q126-Q128 PolarHBondContact O-N 3.33Å; Q128-S131 PolarHBondContact O-OG 2.78Å; Q128-A132 PolarHBondContact O-N 3.27Å; Q128-A132 VanDerWaalsContact O-N 3.16Å
129	A	91.1	Very high	77.5	Confident	53 Å²	53	103.5 Å²	103.5	44%	0.438	56%	0.564	S	S	.	*	H	α-helix	trans	-68.2	-38.1	176.4	0	0	0	0	0	111.6	R125 Q126 A132 S133	R125-A129 WeakPolarHBondContact O-CB 3.43Å; R125-A129 PolarHBondContact O-N 2.84Å; Q126-A129 PolarHBondContact O-N 3.49Å; A129-A132 PolarHBondContact O-N 3.14Å; A129-S133 WeakPolarHBondContact O-CB 3.16Å; A129-S133 PolarHBondContact O-N 3.14Å; A129-S133 PolarHBondContact O-OG 3.04Å
130	M	85.9	Confident	75.5	Confident	130 Å²	130	109.4 Å²	109.4	64%	0.64	59%	0.592	S	S	*	*	H	α-helix	trans	-64	-43	175.9	-69.2	166.1	72.9	0	0	111.5	Q126 V127 A132 S133 D134	Q126-M130 VanDerWaalsContact O-CG 3.28Å; Q126-M130 WeakPolarHBondContact O-CG 3.39Å; Q126-M130 PolarHBondContact O-N 3.42Å; V127-M130 PolarHBondContact O-N 2.93Å; M130-A132 VanDerWaalsContact C-N 3.32Å; M130-A132 PolarHBondContact O-N 3.04Å; M130-S133 PolarHBondContact O-N 2.92Å; M130-D134 PolarHBondContact O-N 3.21Å
131	S	82.8	Confident	73.4	Confident	84 Å²	84	110.7 Å²	110.7	59%	0.587	61%	0.606	S	S	*	*	H	α-helix	trans	-69	-27.9	177.7	65	0	0	0	0	113.7	V127 Q128	V127-S131 PolarHBondContact O-N 3.08Å; V127-S131 VanDerWaalsContact O-N 3.12Å; V127-S131 PolarHBondContact O-OG 2.84Å; Q128-S131 PolarHBondContact O-OG 2.78Å
132	A	77.7	Confident	71.1	Confident	59 Å²	59	116.8 Å²	116.8	49%	0.488	63%	0.627	S	S	.	*	H	α-helix	trans	-74.9	-36.7	173.2	0	0	0	0	0	112.5	Q128 A129 M130 D134 S135	Q128-A132 PolarHBondContact O-N 3.27Å; Q128-A132 VanDerWaalsContact O-N 3.16Å; A129-A132 PolarHBondContact O-N 3.14Å; M130-A132 VanDerWaalsContact C-N 3.32Å; M130-A132 PolarHBondContact O-N 3.04Å; A132-D134 VanDerWaalsContact C-N 3.33Å; A132-D134 PolarHBondContact O-N 3.21Å; A132-S135 PolarHBondContact O-N 3.15Å; A132-S135 PolarHBondContact O-OG 3.01Å
133	S	60	Low	68.1	Low	78 Å²	78	120.6 Å²	120.6	55%	0.545	65%	0.648	S	S	.	*	H	α-helix	trans	-71.5	-25.3	-176.6	-52.3	0	0	0	0	113.2	A129 M130 S135	A129-S133 WeakPolarHBondContact O-CB 3.16Å; A129-S133 PolarHBondContact O-N 3.14Å; A129-S133 PolarHBondContact O-OG 3.04Å; M130-S133 PolarHBondContact O-N 2.92Å; S133-S135 PolarHBondContact O-N 3.42Å; S133-S135 VanDerWaalsContact O-N 3.12Å
134	D	58.3	Low	65.7	Low	157 Å²	157	122.4 Å²	122.4	84%	0.84	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-5.1	175.3	-97.6	-14.1	0	0	0	113.9	M130 A132	M130-D134 PolarHBondContact O-N 3.21Å; A132-D134 VanDerWaalsContact C-N 3.33Å; A132-D134 PolarHBondContact O-N 3.21Å
135	S	54.6	Low	63	Low	100 Å²	100	123.7 Å²	123.7	70%	0.699	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-6.6	-176.9	66.9	0	0	0	0	115.8	A132 S133	A132-S135 PolarHBondContact O-N 3.15Å; A132-S135 PolarHBondContact O-OG 3.01Å; S133-S135 PolarHBondContact O-N 3.42Å; S133-S135 VanDerWaalsContact O-N 3.12Å
136	H	49.2	Very low	60.3	Low	158 Å²	158	122 Å²	122	73%	0.731	69%	0.694	S	S	*	*	S	Bend	trans	-162.1	126.3	-178	-145.4	-34.9	0	0	0	111.5
137	L	45.9	Very low	58	Low	132 Å²	132	123 Å²	123	69%	0.691	71%	0.71	S	S	*	*			trans	85.3	108.1	-179.4	-105	77	0	0	0	115.1
138	M	48	Very low	55.7	Low	173 Å²	173	123.2 Å²	123.2	85%	0.852	71%	0.708	S	S	*	*			cis	52.2	120.6	46.4	-144	91.4	107.4	0	0	110.3
139	S	38.7	Very low	53.7	Low	99 Å²	99	120.9 Å²	120.9	69%	0.692	71%	0.706	S	S	*	*			trans	60	96.6	176.3	60	0	0	0	0	118.1
140	M	50	Low	51.8	Low	182 Å²	182	122.7 Å²	122.7	90%	0.897	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-67.4	131.7	155.6	-73.5	-92.6	124.7	0	0	110
141	P	47.5	Very low	50.1	Low	117 Å²	117	121.8 Å²	121.8	76%	0.76	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-81.7	129.4	146.6	5.9	12.8	0	0	0	108.5
142	E	47.9	Very low	48.1	Very low	172 Å²	172	124.9 Å²	124.9	80%	0.804	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-56.4	155.8	158.3	-66	170.5	124.8	0	0	108.5
143	D	32.4	Very low	46.6	Very low	153 Å²	153	126.3 Å²	126.3	82%	0.818	72%	0.719	S	S	*	*			trans	103.9	59.7	173.2	-40.6	-22.4	0	0	0	116.6
144	L	42.7	Very low	45.8	Very low	176 Å²	176	126.2 Å²	126.2	92%	0.921	71%	0.709	S	S	*	*			trans	-139.3	83.3	146.8	-95.4	112.1	0	0	0	110.9	C146	L144-C146 PolarHBondContact O-N 3.38Å
145	S	36.1	Very low	45	Very low	122 Å²	122	122.6 Å²	122.6	85%	0.853	70%	0.695	S	S	*	*			trans	-71.6	105.1	155.2	59	0	0	0	0	108.3
146	C	39.5	Very low	44.6	Very low	118 Å²	118	123.6 Å²	123.6	80%	0.797	69%	0.692	S	S	*	*			trans	-104	99.6	161.4	-155.4	0	0	0	0	107.4	L144 D148	L144-C146 PolarHBondContact O-N 3.38Å; C146-D148 PolarHBondContact O-N 3.16Å; C146-D148 VanDerWaalsContact O-N 3.16Å
147	S	43.8	Very low	44.1	Very low	101 Å²	101	122.3 Å²	122.3	71%	0.706	69%	0.686	S	S	*	*			trans	-69	98.5	168.1	50.4	0	0	0	0	108.5	S149	S147-S149 PolarHBondContact O-N 3.37Å; S147-S149 VanDerWaalsContact O-N 3.1Å
148	D	46	Very low	44.1	Very low	98 Å²	98	119.8 Å²	119.8	52%	0.524	67%	0.669	S	S	.	*			trans	-82.3	76.2	165.8	-164.5	0.4	0	0	0	109.3	C146 S150 I151	C146-D148 PolarHBondContact O-N 3.16Å; C146-D148 VanDerWaalsContact O-N 3.16Å; D148-S150 PolarHBondContact O-N 3.48Å; D148-S150 WeakPolarHBondContact OD1-CB 3.35Å; D148-S150 PolarHBondContact OD1-N 3.03Å; D148-I151 WeakPolarHBondContact OD2-CD1 3.4Å
149	S	48.7	Very low	44	Very low	76 Å²	76	114.5 Å²	114.5	53%	0.531	65%	0.649	S	S	.	*	H	α-helix	trans	-74.4	5.2	175.7	50.9	0	0	0	0	113.2	S147 V153	S147-S149 PolarHBondContact O-N 3.37Å; S147-S149 VanDerWaalsContact O-N 3.1Å; S149-V153 WeakPolarHBondContact O-CG2 3.3Å
150	S	51.4	Low	43.9	Very low	91 Å²	91	118.7 Å²	118.7	64%	0.636	66%	0.655	S	S	*	*	H	α-helix	trans	-88.7	-16	-177.2	-49.7	0	0	0	0	113	D148	D148-S150 PolarHBondContact O-N 3.48Å; D148-S150 WeakPolarHBondContact OD1-CB 3.35Å; D148-S150 PolarHBondContact OD1-N 3.03Å
151	I	50.2	Low	43.8	Very low	111 Å²	111	120.3 Å²	120.3	57%	0.569	65%	0.651	S	S	*	*	H	α-helix	trans	-91.1	-37.6	-179.8	-61.7	177.7	0	0	0	111.3	D148 F154	D148-I151 WeakPolarHBondContact OD2-CD1 3.4Å; I151-F154 PolarHBondContact O-N 3.39Å
152	E	41.3	Very low	43.8	Very low	150 Å²	150	116.7 Å²	116.7	70%	0.701	63%	0.631	S	S	*	*	H	α-helix	trans	-71.2	-32	-178.6	-74.6	-165.6	149.7	0	0	114	F154 C155	E152-F154 VanDerWaalsContact C-N 3.28Å; E152-F154 PolarHBondContact O-N 3.16Å; E152-C155 PolarHBondContact O-N 3.16Å
153	V	46.1	Very low	43.5	Very low	89 Å²	89	116.1 Å²	116.1	54%	0.539	63%	0.634	S	S	.	*	H	α-helix	trans	-68.8	-30.9	-179.3	179.7	0	0	0	0	111.3	S149 I156 E157	S149-V153 WeakPolarHBondContact O-CG2 3.3Å; V153-I156 PolarHBondContact O-N 3.24Å; V153-E157 PolarHBondContact O-N 3.23Å
154	F	42.6	Very low	44	Very low	76 Å²	76	112.7 Å²	112.7	33%	0.333	61%	0.611	S	S	.	*	H	α-helix	trans	-74.4	-33.7	-178.9	-151.7	-100.6	0	0	0	112.6	H34 I151 E152 I156 E157 F158	H34-F154 AromaticContact CD2-CE1 3.74Å; H34-F154 AromaticContact CD2-CE2 3.97Å; H34-F154 AromaticContact CD2-CZ 3.31Å; H34-F154 WeakPolarHBondContact CD2-CZ 3.4Å; H34-F154 AromaticContact CE1-CD2 3.6Å; H34-F154 AromaticContact CE1-CE1 3.78Å; H34-F154 AromaticContact CE1-CE2 3.17Å; H34-F154 WeakPolarHBondContact CE1-CE2 3.46Å; H34-F154 AromaticContact CE1-CZ 3.28Å; H34-F154 WeakPolarHBondContact CE1-CZ 3.34Å; H34-F154 AromaticContact CG-CE1 3.8Å; H34-F154 AromaticContact CG-CZ 3.81Å; H34-F154 AromaticContact ND1-CE1 3.81Å; H34-F154 AromaticContact ND1-CZ 3.78Å; H34-F154 AromaticContact NE2-CE1 3.77Å; H34-F154 AromaticContact NE2-CE2 3.13Å; H34-F154 WeakPolarHBondContact NE2-CE2 3.26Å; H34-F154 AromaticContact NE2-CZ 2.97Å; H34-F154 WeakPolarHBondContact NE2-CZ 3.37Å; I151-F154 PolarHBondContact O-N 3.39Å; E152-F154 VanDerWaalsContact C-N 3.28Å; E152-F154 PolarHBondContact O-N 3.16Å; F154-I156 PolarHBondContact O-N 3.05Å; F154-E157 PolarHBondContact O-N 2.56Å; F154-F158 HydrophobicContact CE1-CB 4.43Å; F154-F158 HydrophobicContact CE1-CD2 4.18Å; F154-F158 WeakPolarHBondContact O-CB 3.38Å; F154-F158 PolarHBondContact O-N 2.7Å
155	C	43.5	Very low	43.8	Very low	81 Å²	81	108.7 Å²	108.7	55%	0.547	60%	0.604	S	S	.	*	H	α-helix	trans	-59.6	-35.6	171.9	-79	0	0	0	0	112.2	E152 C159	E152-C155 PolarHBondContact O-N 3.16Å; C155-C159 WeakPolarHBondContact O-CB 3.33Å; C155-C159 PolarHBondContact O-N 3.05Å; C155-C159 VanDerWaalsContact O-N 3.11Å; C155-C159 PolarHBondContact O-SG 2.89Å
156	I	44.7	Very low	44.3	Very low	121 Å²	121	110.6 Å²	110.6	62%	0.621	60%	0.604	S	S	*	*	H	α-helix	trans	-73.9	-44.5	-179.2	-63.3	173.8	0	0	0	111.1	V153 F154 F160	V153-I156 PolarHBondContact O-N 3.24Å; F154-I156 PolarHBondContact O-N 3.05Å; I156-F160 PolarHBondContact O-N 2.92Å
157	E	40.3	Very low	44.7	Very low	130 Å²	130	109.6 Å²	109.6	61%	0.607	59%	0.59	S	S	*	*	H	α-helix	trans	-73.9	-33.8	-175.9	-154.5	165.8	-169.5	0	0	112.1	V153 F154	V153-E157 PolarHBondContact O-N 3.23Å; F154-E157 PolarHBondContact O-N 2.56Å
158	F	44	Very low	44.3	Very low	79 Å²	79	115 Å²	115	35%	0.346	60%	0.595	S	S	.	*	H	α-helix	trans	-77.9	-36.6	176.7	-153.9	-95.9	0	0	0	112.9	V30 F154 F160 R161 A162	V30-F158 HydrophobicContact CG1-CE1 4.28Å; V30-F158 HydrophobicContact CG1-CE2 3.79Å; V30-F158 HydrophobicContact CG1-CZ 3.57Å; F154-F158 HydrophobicContact CE1-CB 4.43Å; F154-F158 HydrophobicContact CE1-CD2 4.18Å; F154-F158 WeakPolarHBondContact O-CB 3.38Å; F154-F158 PolarHBondContact O-N 2.7Å; F158-F160 PolarHBondContact O-N 2.99Å; F158-R161 PolarHBondContact O-N 3.49Å; F158-A162 HydrophobicContact CE1-CB 4.48Å; F158-A162 WeakPolarHBondContact O-CB 3.29Å; F158-A162 PolarHBondContact O-N 3.18Å; F158-A162 VanDerWaalsContact O-N 3.11Å
159	C	46	Very low	43.9	Very low	63 Å²	63	115.2 Å²	115.2	43%	0.426	60%	0.601	S	S	.	*	H	α-helix	trans	-59.1	-33.1	170.8	-79.9	0	0	0	0	112.2	C155 N163 F164	C155-C159 WeakPolarHBondContact O-CB 3.33Å; C155-C159 PolarHBondContact O-N 3.05Å; C155-C159 VanDerWaalsContact O-N 3.11Å; C155-C159 PolarHBondContact O-SG 2.89Å; C159-N163 PolarHBondContact O-N 3.01Å; C159-F164 PolarHBondContact SG-O 3.4Å; C159-F164 VanDerWaalsContact SG-O 3.39Å
160	F	37.3	Very low	43.4	Very low	186 Å²	186	124.2 Å²	124.2	82%	0.816	63%	0.631	S	S	*	*	H	α-helix	trans	-74.1	-29.9	-178.2	-131.3	-88.4	0	0	0	113.7	I156 F158	I156-F160 PolarHBondContact O-N 2.92Å; F158-F160 PolarHBondContact O-N 2.99Å
161	R	47.6	Very low	43	Very low	216 Å²	216	125.9 Å²	125.9	82%	0.815	63%	0.631	S	S	*	*	H	α-helix	trans	-86.9	-26.1	175.7	-72.8	179.8	103.3	178.1	1.1	113.2	F158	F158-R161 PolarHBondContact O-N 3.49Å
162	A	48.5	Very low	42.6	Very low	41 Å²	41	126.7 Å²	126.7	34%	0.339	63%	0.634	S	S	.	*	H	α-helix	trans	-94.4	-5.2	-175.6	0	0	0	0	0	115.5	F158 F164	F158-A162 HydrophobicContact CE1-CB 4.48Å; F158-A162 WeakPolarHBondContact O-CB 3.29Å; F158-A162 PolarHBondContact O-N 3.18Å; F158-A162 VanDerWaalsContact O-N 3.11Å; A162-F164 VanDerWaalsContact O-CD2 3.25Å; A162-F164 WeakPolarHBondContact O-CD2 3.44Å; A162-F164 PolarHBondContact O-N 2.8Å; A162-F164 VanDerWaalsContact O-N 3.09Å
163	N	40.6	Very low	42.7	Very low	160 Å²	160	125.4 Å²	125.4	86%	0.856	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.8	25	-176.5	-156.1	28	0	0	0	114	C159	C159-N163 PolarHBondContact O-N 3.01Å
164	F	43.9	Very low	42.5	Very low	81 Å²	81	127.5 Å²	127.5	36%	0.355	64%	0.636	S	S	.	*			trans	-115.5	96.6	-179.2	-93.8	-84.3	0	0	0	109.6	L19 C159 A162 I167	L19-F164 HydrophobicContact CD2-CZ 3.95Å; C159-F164 PolarHBondContact SG-O 3.4Å; C159-F164 VanDerWaalsContact SG-O 3.39Å; A162-F164 VanDerWaalsContact O-CD2 3.25Å; A162-F164 WeakPolarHBondContact O-CD2 3.44Å; A162-F164 PolarHBondContact O-N 2.8Å; A162-F164 VanDerWaalsContact O-N 3.09Å; F164-I167 HydrophobicContact CD1-CD1 3.66Å; F164-I167 HydrophobicContact CD1-CG1 4.33Å; F164-I167 HydrophobicContact CE1-CD1 3.93Å
165	A	38.1	Very low	42.5	Very low	93 Å²	93	130.8 Å²	130.8	77%	0.769	66%	0.655	S	S	*	*			trans	-96.4	15.7	179.4	0	0	0	0	0	114
166	L	45.9	Very low	42.4	Very low	161 Å²	161	134.1 Å²	134.1	84%	0.843	66%	0.662	S	S	*	*			trans	-134.9	11.6	-163.1	-68.9	176	0	0	0	116.7
167	I	47.8	Very low	42.3	Very low	98 Å²	98	135 Å²	135	50%	0.503	67%	0.665	S	S	.	*	S	Bend	trans	-125.1	66.8	-176.4	-51.2	172.6	0	0	0	110.1	L19 F164	L19-I167 HydrophobicContact CD1-CD1 3.9Å; F164-I167 HydrophobicContact CD1-CD1 3.66Å; F164-I167 HydrophobicContact CD1-CG1 4.33Å; F164-I167 HydrophobicContact CE1-CD1 3.93Å
168	W	35.7	Very low	42.4	Very low	214 Å²	214	135.4 Å²	135.4	81%	0.811	67%	0.67	S	S	*	*				170	126.6	129.3	-138.5	-104.4	0	0	0	111.2
169	P	38.6	Very low	42.3	Very low	102 Å²	102	140.1 Å²	140.1	66%	0.662	70%	0.697	S	S	*	*			trans	-97.4	135.5	157.9	34.4	-23.9	0	0	0	110.2
170	F	37.4	Very low	41.9	Very low	266 Å²	266	147.1 Å²	147.1	100%	1.167	72%	0.721	S	S	*	*			trans	80.1	0	172.6	-55.8	-78.4	0	0	0	118.2

Retrieved 170 of 170 residues in 72.6 ms (Link to these results)

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