A0A096MJE4_RAT Loading...

Cytotoxic T-lymphocyte protein 4

Inhibitory receptor acting as a major negative regulator of T-cell responses. The affinity of CTLA4 for its natural B7 family ligands, CD80 and CD86, is considerably stronger than the affinity of their cognate stimulatory coreceptor CD28.

AlphaFold DB , UniProt , Accession A0A096MJE4, Species RAT (Rattus norvegicus, Rat), Gene Ctla4, Length 223 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.8	Very low	44.5	Very low	251 Å²	251	174.5 Å²	174.5	100%	1.236	88%	0.877	S	S	*	*				0	111.5	0	-68.1	179.4	-169.8	0	0	108.4
2	A	48	Very low	44.2	Very low	107 Å²	107	174.3 Å²	174.3	88%	0.884	87%	0.87	S	S	*	*			trans	-164.7	120.7	155	0	0	0	0	0	107.4
3	R	46	Very low	44.1	Very low	238 Å²	238	173.5 Å²	173.5	90%	0.898	87%	0.869	S	S	*	*			trans	-80.7	158.1	178.3	-64.4	-178.4	169.2	-172.9	-2.8	110
4	L	45.1	Very low	44.2	Very low	182 Å²	182	173.4 Å²	173.4	95%	0.953	87%	0.865	S	S	*	*			trans	168	102.3	141.6	-101.5	118.5	0	0	0	104.8
5	G	42.9	Very low	44.4	Very low	72 Å²	72	172.8 Å²	172.8	74%	0.742	86%	0.864	S	S	*	*				102.8	76.7	66.8	0	0	0	0	0	108.5	Q7	G5-Q7 PolarHBondContact O-N 3.48Å
6	V	48.5	Very low	44.7	Very low	148 Å²	148	169.1 Å²	169.1	90%	0.897	86%	0.856	S	S	*	*			trans	-81.3	105.7	178.9	175.5	0	0	0	0	108.7
7	Q	51.6	Low	45.4	Very low	192 Å²	192	165.3 Å²	165.3	90%	0.897	85%	0.849	S	S	*	*			trans	-87.1	114.7	176.6	-159.2	131.6	-34.7	0	0	109.8	G5	G5-Q7 PolarHBondContact O-N 3.48Å
8	R	42.4	Very low	46	Very low	225 Å²	225	170 Å²	170	85%	0.849	85%	0.854	S	S	*	*			trans	-87.4	108	-176.6	-156.1	178.3	-162.2	174	4.6	108.7	K10	R8-K10 PolarHBondContact O-N 3.36Å
9	Y	40.3	Very low	46.4	Very low	226 Å²	226	166.9 Å²	166.9	89%	0.886	85%	0.845	S	S	*	*			trans	-82.4	108.6	172.3	-163.2	-102.5	0	0	0	109.2
10	K	40.1	Very low	47.1	Very low	172 Å²	172	169.4 Å²	169.4	75%	0.748	84%	0.844	S	S	*	*			trans	-82.4	118.7	171.4	-99.6	178.3	174.1	175.7	0	109	R8	R8-K10 PolarHBondContact O-N 3.36Å
11	T	37.3	Very low	47.5	Very low	106 Å²	106	165.5 Å²	165.5	65%	0.65	83%	0.831	S	S	*	*				34.2	114.8	129.5	-31	0	0	0	0	118
12	H	41.9	Very low	48.1	Very low	173 Å²	173	161.4 Å²	161.4	80%	0.801	81%	0.807	S	S	*	*			trans	-138	104.8	134.5	-122.2	-96.3	0	0	0	109.6
13	L	42.8	Very low	49	Very low	163 Å²	163	158.6 Å²	158.6	85%	0.853	79%	0.788	S	S	*	*			trans	-80.8	112.5	170.1	-151	84.3	0	0	0	106.3
14	Q	44.6	Very low	50	Low	173 Å²	173	150.8 Å²	150.8	81%	0.808	77%	0.766	S	S	*	*			trans	-135.4	103.7	164	-75.4	-166.8	-58.6	0	0	109.5
15	L	47.8	Very low	51	Low	164 Å²	164	147.3 Å²	147.3	86%	0.859	75%	0.748	S	S	*	*			trans	-82.8	165.3	149	-143.1	81.5	0	0	0	106.7
16	P	49.1	Very low	52.2	Low	114 Å²	114	148.7 Å²	148.7	74%	0.74	74%	0.738	S	S	*	*			cis	-133.2	161	-3.9	38.1	-20.2	0	0	0	114.6
17	S	56.3	Low	53.2	Low	104 Å²	104	144.9 Å²	144.9	73%	0.727	72%	0.718	S	S	*	*			trans	-149.8	111.4	158.8	171.6	0	0	0	0	110.5	T19	S17-T19 PolarHBondContact O-N 3.25Å; S17-T19 VanDerWaalsContact O-N 3.12Å
18	R	56.3	Low	54	Low	250 Å²	250	140.5 Å²	140.5	94%	0.943	70%	0.7	S	S	*	*			trans	-82.9	73.9	-170	-175	-179.1	175.3	-176.5	-1.5	110.6
19	T	53.7	Low	55.3	Low	112 Å²	112	136.4 Å²	136.4	69%	0.687	69%	0.694	S	S	*	*			trans	-122.5	58.6	171.6	42.5	0	0	0	0	110.5	S17	S17-T19 PolarHBondContact O-N 3.25Å; S17-T19 VanDerWaalsContact O-N 3.12Å
20	W	61.3	Low	56.7	Low	215 Å²	215	133 Å²	133	81%	0.814	68%	0.684	S	S	*	*			trans	-125.1	59.9	175.4	-162.4	-15	0	0	0	113.2
21	P	55.4	Low	58	Low	88 Å²	88	129.3 Å²	129.3	57%	0.571	67%	0.672	S	S	*	*	S	Bend	trans	-116.9	-20.9	148.3	33.9	-28.5	0	0	0	113.2	L25	P21-L25 PolarHBondContact O-N 3.17Å
22	F	59.3	Low	59.3	Low	166 Å²	166	128.9 Å²	128.9	73%	0.728	67%	0.671	S	S	*	*	H	α-helix	trans	-69.9	-35.5	-178	-83.6	-80.7	0	0	0	113.9	V24 L25 L26	F22-V24 VanDerWaalsContact C-N 3.34Å; F22-V24 PolarHBondContact O-N 3.5Å; F22-L25 PolarHBondContact O-N 2.93Å; F22-L26 WeakPolarHBondContact O-CB 3.5Å; F22-L26 PolarHBondContact O-N 3.4Å
23	G	65.7	Low	60.4	Low	47 Å²	47	128.4 Å²	128.4	49%	0.485	67%	0.673	S	S	.	*	H	α-helix	trans	-65	-35.2	179.7	0	0	0	0	0	113.7	S27	G23-S27 PolarHBondContact O-N 3.23Å
24	V	67.8	Low	61.1	Low	75 Å²	75	129.2 Å²	129.2	46%	0.455	67%	0.67	S	S	.	*	H	α-helix	trans	-75	-39.9	179.2	-176.4	0	0	0	0	110.9	F22 L26 S27 L28	F22-V24 VanDerWaalsContact C-N 3.34Å; F22-V24 PolarHBondContact O-N 3.5Å; V24-L26 VanDerWaalsContact C-N 3.31Å; V24-L26 PolarHBondContact O-N 3.42Å; V24-S27 PolarHBondContact O-N 2.93Å; V24-S27 PolarHBondContact O-OG 2.93Å; V24-L28 PolarHBondContact O-N 3.09Å
25	L	66.9	Low	62	Low	109 Å²	109	125.7 Å²	125.7	57%	0.571	66%	0.664	S	S	*	*	H	α-helix	trans	-64.7	-37.3	176	-161.1	73.5	0	0	0	111.7	P21 F22 L28	P21-L25 PolarHBondContact O-N 3.17Å; F22-L25 PolarHBondContact O-N 2.93Å; L25-L28 PolarHBondContact O-N 3.16Å
26	L	68.2	Low	63	Low	101 Å²	101	124.3 Å²	124.3	53%	0.529	65%	0.653	S	S	.	*	H	α-helix	trans	-65.8	-37.4	176.1	-167.5	69.5	0	0	0	111.9	F22 V24 L28 L29 F30	F22-L26 WeakPolarHBondContact O-CB 3.5Å; F22-L26 PolarHBondContact O-N 3.4Å; V24-L26 VanDerWaalsContact C-N 3.31Å; V24-L26 PolarHBondContact O-N 3.42Å; L26-L28 VanDerWaalsContact C-N 3.31Å; L26-L28 PolarHBondContact O-N 2.8Å; L26-L29 HydrophobicContact CD1-CD1 4.25Å; L26-L29 PolarHBondContact O-N 3.02Å; L26-F30 HydrophobicContact CD1-CE2 4.44Å; L26-F30 HydrophobicContact CG-CE2 4.05Å; L26-F30 WeakPolarHBondContact O-CD2 3.49Å
27	S	69.2	Low	64.5	Low	68 Å²	68	122.8 Å²	122.8	48%	0.476	65%	0.65	S	S	.	*	H	α-helix	trans	-65.4	-29.3	175.8	57.7	0	0	0	0	114.1	G23 V24 L29 F30	G23-S27 PolarHBondContact O-N 3.23Å; V24-S27 PolarHBondContact O-N 2.93Å; V24-S27 PolarHBondContact O-OG 2.93Å; S27-L29 VanDerWaalsContact C-N 3.35Å; S27-F30 PolarHBondContact O-N 3.28Å
28	L	68	Low	66.2	Low	99 Å²	99	118.5 Å²	118.5	52%	0.518	62%	0.619	S	S	.	*	H	α-helix	trans	-71	-28.2	176.3	-74	162.2	0	0	0	112.8	V24 L25 L26 F30 I31	V24-L28 PolarHBondContact O-N 3.09Å; L25-L28 PolarHBondContact O-N 3.16Å; L26-L28 VanDerWaalsContact C-N 3.31Å; L26-L28 PolarHBondContact O-N 2.8Å; L28-F30 PolarHBondContact O-N 3.29Å; L28-I31 HydrophobicContact CB-CD1 4.42Å; L28-I31 HydrophobicContact CD2-CD1 3.63Å; L28-I31 HydrophobicContact CD2-CG1 4.45Å; L28-I31 WeakPolarHBondContact O-CD1 3.3Å; L28-I31 VanDerWaalsContact O-CG1 3.3Å; L28-I31 WeakPolarHBondContact O-CG1 3.15Å; L28-I31 PolarHBondContact O-N 3.47Å
29	L	69.4	Low	67.9	Low	139 Å²	139	113.4 Å²	113.4	73%	0.728	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-18.5	173.6	-70.7	168.7	0	0	0	112.7	L26 S27	L26-L29 HydrophobicContact CD1-CD1 4.25Å; L26-L29 PolarHBondContact O-N 3.02Å; S27-L29 VanDerWaalsContact C-N 3.35Å
30	F	69.5	Low	69.9	Low	155 Å²	155	108.2 Å²	108.2	68%	0.68	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	13.9	176.7	-64.8	-71.7	0	0	0	113.3	L26 S27 L28 P32	L26-F30 HydrophobicContact CD1-CE2 4.44Å; L26-F30 HydrophobicContact CG-CE2 4.05Å; L26-F30 WeakPolarHBondContact O-CD2 3.49Å; S27-F30 PolarHBondContact O-N 3.28Å; L28-F30 PolarHBondContact O-N 3.29Å; F30-P32 WeakPolarHBondContact O-CD 2.83Å
31	I	67.1	Low	71.5	Confident	95 Å²	95	101 Å²	101	49%	0.487	55%	0.554	S	S	.	*			trans	-60.4	112.4	168.9	-63.8	164.9	0	0	0	106.2	L28 I33 F34	L28-I31 HydrophobicContact CB-CD1 4.42Å; L28-I31 HydrophobicContact CD2-CD1 3.63Å; L28-I31 HydrophobicContact CD2-CG1 4.45Å; L28-I31 WeakPolarHBondContact O-CD1 3.3Å; L28-I31 VanDerWaalsContact O-CG1 3.3Å; L28-I31 WeakPolarHBondContact O-CG1 3.15Å; L28-I31 PolarHBondContact O-N 3.47Å; I31-I33 PolarHBondContact O-N 3.1Å; I31-F34 HydrophobicContact CG2-CE2 4.34Å
32	P	64.2	Low	73.5	Confident	97 Å²	97	98.2 Å²	98.2	63%	0.63	53%	0.533	S	S	*	.			trans	-59	128.7	179.7	25.2	-31.7	0	0	0	106.8	F30 F34	F30-P32 WeakPolarHBondContact O-CD 2.83Å; P32-F34 PolarHBondContact O-N 3.26Å
33	I	65	Low	75.3	Confident	163 Å²	163	92.2 Å²	92.2	84%	0.836	51%	0.51	S	S	*	.			trans	-51	110	169.3	-60.8	165.7	0	0	0	104.8	I31 S35	I31-I33 PolarHBondContact O-N 3.1Å; I33-S35 VanDerWaalsContact C-N 3.25Å; I33-S35 PolarHBondContact O-N 2.94Å
34	F	59.2	Low	76.8	Confident	180 Å²	180	94.4 Å²	94.4	79%	0.789	52%	0.519	S	S	*	.			trans	-61.3	98.5	173.5	-77.1	-88.9	0	0	0	105.5	I31 P32 E36	I31-F34 HydrophobicContact CG2-CE2 4.34Å; P32-F34 PolarHBondContact O-N 3.26Å; F34-E36 PolarHBondContact O-N 3.15Å; F34-E36 VanDerWaalsContact O-N 3.11Å
35	S	63.1	Low	78.2	Confident	99 Å²	99	94.8 Å²	94.8	69%	0.692	52%	0.521	S	S	*	.			trans	-57.9	115.9	168.4	40.3	0	0	0	0	106.3	I33 A37	I33-S35 VanDerWaalsContact C-N 3.25Å; I33-S35 PolarHBondContact O-N 2.94Å; S35-A37 PolarHBondContact O-N 3.38Å
36	E	68.2	Low	79.7	Confident	135 Å²	135	90.7 Å²	90.7	63%	0.631	50%	0.5	S	S	*	.			trans	-58.4	110.3	168.9	-78.1	-144.8	153.7	0	0	107.3	F34 F140	F34-E36 PolarHBondContact O-N 3.15Å; F34-E36 VanDerWaalsContact O-N 3.11Å; E36-F140 HydrophobicContact CB-CD1 4.22Å; E36-F140 HydrophobicContact CB-CE1 3.9Å
37	A	81.6	Confident	81	Confident	81 Å²	81	91 Å²	91	67%	0.669	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-91.8	133.9	178.2	0	0	0	0	0	108	S35	S35-A37 PolarHBondContact O-N 3.38Å
38	I	90.2	Very high	82.3	Confident	14 Å²	14	88.1 Å²	88.1	7%	0.072	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-75.5	131.7	172.8	-66.2	164.3	0	0	0	108.1	V40 Y60 L133 F140 V141 G142	I38-V40 HydrophobicContact CG2-CG2 4.38Å; I38-V40 PolarHBondContact O-N 2.86Å; I38-Y60 HydrophobicContact CG2-CD2 4.17Å; I38-Y60 HydrophobicContact CG2-CG 4.4Å; I38-L133 HydrophobicContact CD1-CB 4.34Å; I38-L133 HydrophobicContact CD1-CD1 3.39Å; I38-L133 HydrophobicContact CD1-CD2 3.72Å; I38-L133 HydrophobicContact CD1-CG 3.96Å; I38-F140 HydrophobicContact CD1-CB 3.29Å; I38-F140 HydrophobicContact CD1-CG 4.22Å; I38-F140 HydrophobicContact CG1-CB 3.82Å; I38-F140 HydrophobicContact CG1-CG 4.49Å; I38-V141 PolarHBondContact N-O 3.32Å; I38-G142 WeakPolarHBondContact O-CA 3.39Å
39	Q	92.8	Very high	83.4	Confident	143 Å²	143	85.8 Å²	85.8	67%	0.668	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.8	171.5	-171.7	179.1	-7.6	0	0	109.6	Y60 A61	Q39-Y60 WeakPolarHBondContact O-CA 3.37Å; Q39-A61 PolarHBondContact O-N 2.92Å; Q39-A61 VanDerWaalsContact O-N 3.16Å
40	V	95.6	Very high	84.3	Confident	4 Å²	4	82.9 Å²	82.9	2%	0.024	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.9	176.9	178.3	0	0	0	0	109.4	I38 C58 E59 C129 V131 G144	I38-V40 HydrophobicContact CG2-CG2 4.38Å; I38-V40 PolarHBondContact O-N 2.86Å; V40-C58 WeakPolarHBondContact CG1-SG 3.48Å; V40-E59 CarbonylContact C-O 3.52Å; V40-E59 VanDerWaalsContact CA-O 3.23Å; V40-E59 WeakPolarHBondContact CA-O 3.41Å; V40-E59 WeakPolarHBondContact CG1-O 3.3Å; V40-C129 HydrophobicContact CG1-CB 4.47Å; V40-V131 HydrophobicContact CG1-CG2 4.2Å; V40-V131 HydrophobicContact CG2-CB 4.07Å; V40-V131 HydrophobicContact CG2-CG2 3.98Å; V40-G144 VanDerWaalsContact O-CA 3.25Å; V40-G144 WeakPolarHBondContact O-CA 3.39Å
41	T	96.2	Very high	85.3	Confident	63 Å²	63	83.1 Å²	83.1	39%	0.387	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.2	177.2	44.9	0	0	0	0	110.3	E59	T41-E59 PolarHBondContact N-O 2.9Å; T41-E59 PolarHBondContact O-N 2.9Å; T41-E59 WeakPolarHBondContact OG1-CB 3.38Å; T41-E59 PolarHBondContact OG1-O 2.89Å
42	Q	97	Very high	86.6	Confident	30 Å²	30	78.8 Å²	78.8	14%	0.14	45%	0.447	C	S	.	.			trans	-144.3	155.4	177.3	69.4	-172.3	-91.8	0	0	109.2	Y127 G144 G146 T147	Q42-Y127 PolarHBondContact OE1-O 3.46Å; Q42-Y127 VanDerWaalsContact OE1-O 3.04Å; Q42-G144 PolarHBondContact NE2-O 3.1Å; Q42-G146 VanDerWaalsContact CD-C 3.48Å; Q42-G146 VanDerWaalsContact CD-CA 3.46Å; Q42-G146 VanDerWaalsContact OE1-N 3.17Å; Q42-T147 PolarHBondContact OE1-OG1 2.8Å; Q42-T147 VanDerWaalsContact OE1-OG1 3.05Å
43	P	97.4	Very high	88	Confident	39 Å²	39	76.2 Å²	76.2	25%	0.253	43%	0.429	S	S	.	.			trans	-65.3	147.8	175.2	28.2	-35.1	0	0	0	110.7	V46 F56 P57 T147	P43-V46 HydrophobicContact CB-CG2 4.07Å; P43-V46 HydrophobicContact CG-CG2 3.67Å; P43-F56 HydrophobicContact CG-CB 3.8Å; P43-P57 VanDerWaalsContact CD-O 3.25Å; P43-P57 WeakPolarHBondContact CD-O 3.31Å; P43-T147 HydrophobicContact CG-CG2 4.07Å; P43-T147 VanDerWaalsContact O-CA 3.31Å; P43-T147 WeakPolarHBondContact O-CA 3.4Å; P43-T147 VanDerWaalsContact O-CB 3.26Å; P43-T147 WeakPolarHBondContact O-CB 3.3Å; P43-T147 WeakPolarHBondContact O-CG2 3.36Å; P43-T147 PolarHBondContact O-OG1 3.18Å
44	S	96.9	Very high	89.5	Confident	94 Å²	94	68.4 Å²	68.4	66%	0.657	39%	0.39	S	S	*	.	S	Bend	trans	-73.8	-34.4	178.8	52.9	0	0	0	0	112.9	Q148	S44-Q148 WeakPolarHBondContact O-CB 3.37Å; S44-Q148 PolarHBondContact O-N 3.24Å
45	V	97.4	Very high	91.3	Very high	82 Å²	82	63 Å²	63	50%	0.497	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	135.5	-175.9	-177.4	0	0	0	0	110.2	Q148 Y150	V45-Q148 CarbonylContact C-O 3.48Å; V45-Q148 WeakPolarHBondContact CA-O 3.33Å; V45-Q148 HydrophobicContact CG2-CB 4.31Å; V45-Y150 HydrophobicContact CG1-CD2 3.67Å; V45-Y150 HydrophobicContact CG1-CE2 3.62Å
46	V	97.1	Very high	92.9	Very high	23 Å²	23	58.4 Å²	58.4	14%	0.139	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	139.8	173.5	172.6	0	0	0	0	109.9	P43 F56 T147 Q148 I149 Y150	P43-V46 HydrophobicContact CB-CG2 4.07Å; P43-V46 HydrophobicContact CG-CG2 3.67Å; V46-F56 HydrophobicContact CG2-CB 3.98Å; V46-T147 HydrophobicContact CB-CG2 3.96Å; V46-T147 HydrophobicContact CG2-CG2 3.69Å; V46-Q148 PolarHBondContact N-O 2.96Å; V46-I149 WeakPolarHBondContact O-CA 3.38Å; V46-Y150 PolarHBondContact O-N 3.34Å
47	L	96.3	Very high	94.2	Very high	109 Å²	109	54 Å²	54	57%	0.571	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.8	174.1	-166.3	63.4	0	0	0	109.3	I152	L47-I152 HydrophobicContact CD1-CD1 3.59Å; L47-I152 HydrophobicContact CD1-CG1 3.8Å; L47-I152 HydrophobicContact CD2-CD1 4.19Å; L47-I152 HydrophobicContact CG-CD1 4.39Å
48	A	95.7	Very high	94.9	Very high	7 Å²	7	50.1 Å²	50.1	6%	0.058	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-71.9	146.8	168.9	0	0	0	0	0	109.7	V53 A54 L119 I149 Y150 V151	A48-V53 WeakPolarHBondContact CA-O 3.39Å; A48-A54 HydrophobicContact CB-CB 4.02Å; A48-L119 HydrophobicContact CB-CD1 4.46Å; A48-I149 HydrophobicContact CB-CG2 4.36Å; A48-Y150 WeakPolarHBondContact CB-O 3.3Å; A48-Y150 PolarHBondContact N-O 3.4Å; A48-V151 HydrophobicContact CB-CB 4.3Å; A48-V151 HydrophobicContact CB-CG1 4.29Å; A48-V151 HydrophobicContact CB-CG2 3.92Å
49	S	92.7	Very high	95.2	Very high	49 Å²	49	52.4 Å²	52.4	34%	0.343	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-65.3	165.7	171	62.7	0	0	0	0	111.6	H51 G52 V53	S49-H51 PolarHBondContact O-N 2.87Å; S49-G52 PolarHBondContact O-N 2.84Å; S49-V53 PolarHBondContact N-O 2.83Å; S49-V53 WeakPolarHBondContact OG-CB 3.27Å; S49-V53 PolarHBondContact OG-N 3.22Å; S49-V53 VanDerWaalsContact OG-N 3.12Å; S49-V53 PolarHBondContact OG-O 3.3Å; S49-V53 VanDerWaalsContact OG-O 3.07Å
50	S	88.4	Confident	95.2	Very high	79 Å²	79	46.1 Å²	46.1	55%	0.552	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-18.8	174.8	54.3	0	0	0	0	114.2	G52	S50-G52 VanDerWaalsContact C-N 3.34Å
51	H	90.2	Very high	94.9	Very high	160 Å²	160	49.4 Å²	49.4	74%	0.741	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	7.3	175	-62.8	-65.4	0	0	0	113.4	S49 V53	S49-H51 PolarHBondContact O-N 2.87Å; H51-V53 HydrophobicContact CB-CG2 4.44Å
52	G	92.8	Very high	94.3	Very high	4 Å²	4	48.4 Å²	48.4	4%	0.041	30%	0.296	C	S	.	.	S	Bend	trans	72.9	28.1	-178.1	0	0	0	0	0	113.4	S49 S50 Q117 G118 L119	S49-G52 PolarHBondContact O-N 2.84Å; S50-G52 VanDerWaalsContact C-N 3.34Å; G52-Q117 CarbonylContact O-C 3.43Å; G52-G118 PolarHBondContact O-N 3.05Å; G52-G118 VanDerWaalsContact O-N 3.09Å; G52-L119 VanDerWaalsContact CA-O 3.23Å; G52-L119 WeakPolarHBondContact CA-O 3.48Å; G52-L119 WeakPolarHBondContact O-CB 3.44Å; G52-L119 PolarHBondContact O-N 2.91Å
53	V	95.6	Very high	93.5	Very high	42 Å²	42	52 Å²	52	26%	0.255	32%	0.324	S	S	.	.			trans	-104.2	120.5	176	-177.3	0	0	0	0	109.9	A48 S49 H51 T115 I116 Q117	A48-V53 WeakPolarHBondContact CA-O 3.39Å; S49-V53 PolarHBondContact N-O 2.83Å; S49-V53 WeakPolarHBondContact OG-CB 3.27Å; S49-V53 PolarHBondContact OG-N 3.22Å; S49-V53 VanDerWaalsContact OG-N 3.12Å; S49-V53 PolarHBondContact OG-O 3.3Å; S49-V53 VanDerWaalsContact OG-O 3.07Å; H51-V53 HydrophobicContact CB-CG2 4.44Å; V53-T115 HydrophobicContact CG1-CG2 3.64Å; V53-I116 CarbonylContact C-O 3.57Å; V53-I116 WeakPolarHBondContact CA-O 3.32Å; V53-Q117 HydrophobicContact CG1-CG 4.06Å; V53-Q117 HydrophobicContact CG2-CB 4.17Å; V53-Q117 HydrophobicContact CG2-CG 4Å
54	A	96.4	Very high	92.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.2	174.3	0	0	0	0	0	109.8	A48 T115 I116 L119 I149	A48-A54 HydrophobicContact CB-CB 4.02Å; A54-T115 CarbonylContact O-C 3.43Å; A54-T115 WeakPolarHBondContact O-CA 3.41Å; A54-I116 PolarHBondContact N-O 2.78Å; A54-I116 PolarHBondContact O-N 3.1Å; A54-L119 HydrophobicContact CB-CD1 3.56Å; A54-I149 HydrophobicContact CB-CD1 4.19Å; A54-I149 HydrophobicContact CB-CG2 3.79Å
55	S	96	Very high	91.8	Very high	66 Å²	66	56.2 Å²	56.2	46%	0.462	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.9	177.1	-60	0	0	0	0	110.4	L114 T115	S55-L114 CarbonylContact C-O 3.59Å; S55-L114 VanDerWaalsContact CA-O 3.23Å; S55-L114 WeakPolarHBondContact CA-O 3.37Å; S55-T115 WeakPolarHBondContact OG-CG2 3.23Å; S55-T115 PolarHBondContact OG-OG1 3.09Å
56	F	97.1	Very high	91.2	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.009	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	140.8	179.6	61.8	-85.3	0	0	0	111.5	P43 V46 V73 L114 I116 I149	P43-F56 HydrophobicContact CG-CB 3.8Å; V46-F56 HydrophobicContact CG2-CB 3.98Å; F56-V73 HydrophobicContact CZ-CG1 4.41Å; F56-L114 HydrophobicContact CE1-CB 4.4Å; F56-L114 HydrophobicContact CE2-CB 4.33Å; F56-L114 HydrophobicContact CE2-CD1 3.81Å; F56-L114 HydrophobicContact CZ-CB 4.2Å; F56-L114 HydrophobicContact CZ-CD1 4.07Å; F56-L114 PolarHBondContact N-O 2.91Å; F56-L114 PolarHBondContact O-N 2.88Å; F56-I116 HydrophobicContact CE1-CD1 3.77Å; F56-I116 HydrophobicContact CE1-CG1 4.24Å; F56-I116 HydrophobicContact CZ-CD1 4.25Å; F56-I149 HydrophobicContact CD1-CD1 4.13Å; F56-I149 HydrophobicContact CE1-CD1 3.84Å
57	P	96.2	Very high	90.8	Very high	43 Å²	43	55.9 Å²	55.9	28%	0.279	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	143.1	174.4	32.2	-34	0	0	0	110.7	P43 V112	P43-P57 VanDerWaalsContact CD-O 3.25Å; P43-P57 WeakPolarHBondContact CD-O 3.31Å; P57-V112 CarbonylContact C-O 3.49Å
58	C	95.5	Very high	90.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	109.2	168.4	177.6	0	0	0	0	107.7	V40 V112 L114 C129	V40-C58 WeakPolarHBondContact CG1-SG 3.48Å; C58-V112 HydrophobicContact CB-CB 4.46Å; C58-V112 PolarHBondContact N-O 3.23Å; C58-V112 PolarHBondContact O-N 3.49Å; C58-L114 HydrophobicContact CB-CD1 4Å; C58-C129 HydrophobicContact CB-CB 3.71Å; C58-C129 WeakPolarHBondContact CB-SG 3.45Å; C58-C129 WeakPolarHBondContact SG-CB 3.46Å; C58-C129 CovalentContact SG-SG 2.02Å; C58-C129 PolarHBondContact SG-SG 2.9Å
59	E	95.4	Very high	90.5	Very high	62 Å²	62	54.1 Å²	54.1	29%	0.29	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	146.1	-179	-80.8	166.8	-141.2	0	0	109.7	V40 T41 S110 R111	V40-E59 CarbonylContact C-O 3.52Å; V40-E59 VanDerWaalsContact CA-O 3.23Å; V40-E59 WeakPolarHBondContact CA-O 3.41Å; V40-E59 WeakPolarHBondContact CG1-O 3.3Å; T41-E59 PolarHBondContact N-O 2.9Å; T41-E59 PolarHBondContact O-N 2.9Å; T41-E59 WeakPolarHBondContact OG1-CB 3.38Å; T41-E59 PolarHBondContact OG1-O 2.89Å; E59-S110 WeakPolarHBondContact CA-O 3.14Å; E59-R111 HydrophobicContact CG-CB 3.79Å; E59-R111 HydrophobicContact CG-CG 3.77Å; E59-R111 IonicContact OE1-CZ 3.06Å; E59-R111 IonicContact OE1-NE 2.7Å; E59-R111 PolarHBondContact OE1-NE 2.84Å; E59-R111 IonicContact OE1-NH2 2.63Å; E59-R111 PolarHBondContact OE1-NH2 3.34Å
60	Y	93.5	Very high	90.6	Very high	11 Å²	11	55.8 Å²	55.8	4%	0.043	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	140.2	175.2	68.2	-87.6	0	0	0	110.8	I38 Q39 T66 V69 F107 E109 S110 V131 L133	I38-Y60 HydrophobicContact CG2-CD2 4.17Å; I38-Y60 HydrophobicContact CG2-CG 4.4Å; Q39-Y60 WeakPolarHBondContact O-CA 3.37Å; Y60-T66 HydrophobicContact CE2-CG2 4.4Å; Y60-V69 HydrophobicContact CE1-CG1 4.29Å; Y60-V69 WeakPolarHBondContact OH-CG2 3.31Å; Y60-F107 HydrophobicContact CE1-CE2 4.07Å; Y60-F107 WeakPolarHBondContact OH-CE2 3.49Å; Y60-E109 PolarHBondContact OH-O 2.92Å; Y60-S110 VanDerWaalsContact CD1-O 3.3Å; Y60-S110 WeakPolarHBondContact CD1-O 3.35Å; Y60-S110 PolarHBondContact N-O 3.26Å; Y60-S110 WeakPolarHBondContact O-CB 3.33Å; Y60-V131 HydrophobicContact CD1-CG1 3.83Å; Y60-V131 HydrophobicContact CD1-CG2 4.44Å; Y60-V131 HydrophobicContact CE1-CG1 4.14Å; Y60-V131 HydrophobicContact CG-CG1 4.04Å; Y60-L133 HydrophobicContact CD2-CD1 4.21Å; Y60-L133 HydrophobicContact CE2-CD1 3.96Å; Y60-L133 HydrophobicContact CE2-CD2 4.4Å
61	A	88.7	Confident	90.9	Very high	73 Å²	73	52 Å²	52	60%	0.603	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	113.2	176.5	0	0	0	0	0	109.3	Q39	Q39-A61 PolarHBondContact O-N 2.92Å; Q39-A61 VanDerWaalsContact O-N 3.16Å
62	S	84.4	Confident	91.2	Very high	41 Å²	41	44.5 Å²	44.5	29%	0.287	26%	0.256	S	S	.	.			trans	-127.3	134.9	172.8	-176.9	0	0	0	0	109.9	H64	S62-H64 PolarHBondContact OG-N 3.47Å; S62-H64 VanDerWaalsContact OG-N 3.12Å; S62-H64 PolarHBondContact OG-O 2.93Å
63	S	79.9	Confident	91.4	Very high	105 Å²	105	44.3 Å²	44.3	73%	0.734	25%	0.254	S	S	*	.	S	Bend	trans	-78.4	-7.1	169.3	52	0	0	0	0	112.5
64	H	79.2	Confident	91.5	Very high	76 Å²	76	43.4 Å²	43.4	35%	0.352	25%	0.248	S	C	.	.	S	Bend	trans	-99.4	133.5	-176.8	-57.7	-76.8	0	0	0	111.1	S62 T66 F140	S62-H64 PolarHBondContact OG-N 3.47Å; S62-H64 VanDerWaalsContact OG-N 3.12Å; S62-H64 PolarHBondContact OG-O 2.93Å; H64-T66 PolarHBondContact O-N 3.36Å; H64-F140 HydrophobicContact CB-CE2 4.29Å; H64-F140 AromaticContact CD2-CE2 3.36Å; H64-F140 WeakPolarHBondContact CD2-CE2 3.45Å; H64-F140 AromaticContact CD2-CZ 3.42Å; H64-F140 VanDerWaalsContact CD2-CZ 3.42Å; H64-F140 WeakPolarHBondContact CD2-CZ 3.39Å; H64-F140 AromaticContact CE1-CZ 3.88Å; H64-F140 AromaticContact CG-CE2 3.7Å; H64-F140 AromaticContact NE2-CE2 3.75Å; H64-F140 AromaticContact NE2-CZ 3.29Å; H64-F140 VanDerWaalsContact NE2-CZ 3.29Å; H64-F140 WeakPolarHBondContact NE2-CZ 3.16Å
65	N	80.1	Confident	91.4	Very high	146 Å²	146	45.5 Å²	45.5	78%	0.781	26%	0.256	S	S	*	.			trans	-63.2	127.1	168.4	-66.9	-9.6	0	0	0	108.7	P136	N65-P136 VanDerWaalsContact O-CD 3.26Å; N65-P136 WeakPolarHBondContact O-CD 3.46Å
66	T	84	Confident	91.4	Very high	21 Å²	21	45.5 Å²	45.5	13%	0.129	25%	0.249	C	C	.	.			trans	-127.1	133.6	178.2	-173.8	0	0	0	0	110.7	Y60 H64 E68 V69 V91 L133 Y135	Y60-T66 HydrophobicContact CE2-CG2 4.4Å; H64-T66 PolarHBondContact O-N 3.36Å; T66-E68 PolarHBondContact OG1-O 3.09Å; T66-V69 HydrophobicContact CG2-CG2 3.52Å; T66-V91 WeakPolarHBondContact O-CG2 3.22Å; T66-L133 HydrophobicContact CG2-CD2 3.89Å; T66-L133 HydrophobicContact CG2-CG 3.94Å; T66-Y135 CarbonylContact C-O 3.6Å; T66-Y135 WeakPolarHBondContact CA-O 3.14Å; T66-Y135 PolarHBondContact OG1-O 2.81Å
67	D	88.3	Confident	91	Very high	77 Å²	77	48 Å²	48	41%	0.412	26%	0.264	S	S	.	.	S	Bend	trans	-102.9	-26.4	-179.4	-74.7	-17.2	0	0	0	111.9	T90 V91 Y135	D67-T90 WeakPolarHBondContact O-CA 3.38Å; D67-T90 WeakPolarHBondContact O-CB 3.49Å; D67-V91 PolarHBondContact O-N 3.37Å; D67-V91 VanDerWaalsContact O-N 3.16Å; D67-Y135 HydrophobicContact CB-CD1 3.86Å; D67-Y135 HydrophobicContact CB-CE1 4.46Å; D67-Y135 PolarHBondContact N-O 3.26Å
68	E	92.9	Very high	90.6	Very high	78 Å²	78	53.2 Å²	53.2	36%	0.364	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	120.3	179.8	-56.2	178.7	-170.6	0	0	111.4	T66 F89 T90 M134 Y135	T66-E68 PolarHBondContact OG1-O 3.09Å; E68-F89 WeakPolarHBondContact CA-O 3.09Å; E68-T90 HydrophobicContact CG-CG2 4.05Å; E68-M134 HydrophobicContact CB-CB 4.37Å; E68-M134 PolarHBondContact O-N 2.93Å; E68-Y135 HydrophobicContact CG-CD1 4.34Å; E68-Y135 HydrophobicContact CG-CG 4.4Å; E68-Y135 PolarHBondContact N-O 2.92Å; E68-Y135 VanDerWaalsContact N-O 3.11Å; E68-Y135 PolarHBondContact O-N 3.36Å
69	V	93.7	Very high	90.1	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.006	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	117.6	-175.1	-178.5	0	0	0	0	109.1	Y60 T66 V71 T88 F89 F107 V131 E132 L133	Y60-V69 HydrophobicContact CE1-CG1 4.29Å; Y60-V69 WeakPolarHBondContact OH-CG2 3.31Å; T66-V69 HydrophobicContact CG2-CG2 3.52Å; V69-V71 HydrophobicContact CG1-CG2 4.12Å; V69-T88 CarbonylContact O-C 3.59Å; V69-T88 WeakPolarHBondContact O-CA 3.41Å; V69-F89 PolarHBondContact N-O 3.44Å; V69-F89 PolarHBondContact O-N 2.91Å; V69-F107 HydrophobicContact CB-CE2 4.22Å; V69-F107 HydrophobicContact CG1-CE2 4.42Å; V69-F107 HydrophobicContact CG2-CE2 4.14Å; V69-F107 HydrophobicContact CG2-CZ 4.07Å; V69-V131 HydrophobicContact CG1-CG1 3.57Å; V69-E132 CarbonylContact C-O 3.55Å; V69-E132 WeakPolarHBondContact CA-O 3.34Å; V69-L133 HydrophobicContact CG1-CD1 4.4Å; V69-L133 HydrophobicContact CG2-CG 4.48Å
70	R	94.4	Very high	90	Very high	84 Å²	84	64.1 Å²	64.1	32%	0.317	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127.1	172.4	173	176.2	170.7	-177.3	1.3	109.9	T87 V131 E132 M134	R70-T87 CarbonylContact C-O 3.51Å; R70-T87 WeakPolarHBondContact CA-O 3.25Å; R70-V131 CarbonylContact O-C 3.22Å; R70-V131 WeakPolarHBondContact O-CA 3.09Å; R70-E132 HydrophobicContact CB-CB 4.18Å; R70-E132 VanDerWaalsContact CD-OE2 3.22Å; R70-E132 WeakPolarHBondContact CD-OE2 3.45Å; R70-E132 IonicContact CZ-OE2 3.78Å; R70-E132 PolarHBondContact N-O 2.87Å; R70-E132 IonicContact NE-OE2 2.78Å; R70-E132 PolarHBondContact NE-OE2 3.46Å; R70-E132 PolarHBondContact O-N 2.9Å; R70-M134 HydrophobicContact CB-CG 4.24Å; R70-M134 HydrophobicContact CB-SD 3.58Å; R70-M134 VanDerWaalsContact CB-SD 3.58Å
71	V	95.8	Very high	90.1	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129	176.9	-177.6	0	0	0	0	108.6	V69 A86 T87 F89 V112 L114 K130 V131	V69-V71 HydrophobicContact CG1-CG2 4.12Å; V71-A86 WeakPolarHBondContact O-CA 3.28Å; V71-T87 PolarHBondContact N-O 2.98Å; V71-T87 PolarHBondContact O-N 3.38Å; V71-F89 HydrophobicContact CB-CD2 4.32Å; V71-F89 HydrophobicContact CB-CE2 3.98Å; V71-F89 HydrophobicContact CG2-CD2 3.84Å; V71-F89 HydrophobicContact CG2-CE2 3.87Å; V71-V112 HydrophobicContact CG2-CG1 4.29Å; V71-V112 HydrophobicContact CG2-CG2 3.91Å; V71-L114 HydrophobicContact CG1-CD1 4.13Å; V71-L114 HydrophobicContact CG1-CD2 4.13Å; V71-K130 CarbonylContact C-O 3.59Å; V71-K130 WeakPolarHBondContact CA-O 3.19Å; V71-V131 HydrophobicContact CG2-CG2 4.47Å
72	T	95.9	Very high	90.4	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.018	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130	179.1	-51.9	0	0	0	0	109.3	L74 E83 C85 A86 K130	T72-L74 HydrophobicContact CG2-CD2 3.89Å; T72-L74 HydrophobicContact CG2-CG 4.19Å; T72-E83 HydrophobicContact CG2-CG 3.67Å; T72-C85 CarbonylContact C-O 3.51Å; T72-C85 WeakPolarHBondContact CA-O 3.47Å; T72-A86 HydrophobicContact CG2-CB 4.05Å; T72-K130 PolarHBondContact N-O 3.48Å; T72-K130 WeakPolarHBondContact O-CB 3.44Å; T72-K130 PolarHBondContact O-N 3.32Å
73	V	96.8	Very high	90.9	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.3	174	-178.6	0	0	0	0	108.6	F56 V84 C85 L114 I116 Y127	F56-V73 HydrophobicContact CZ-CG1 4.41Å; V73-V84 HydrophobicContact CB-CB 4.48Å; V73-V84 HydrophobicContact CG1-CB 4.32Å; V73-V84 PolarHBondContact O-N 3.41Å; V73-C85 PolarHBondContact N-O 2.94Å; V73-L114 HydrophobicContact CG2-CD1 3.81Å; V73-L114 HydrophobicContact CG2-CD2 4.32Å; V73-I116 HydrophobicContact CG1-CD1 3.89Å; V73-Y127 HydrophobicContact CG1-CD1 3.95Å
74	L	96.8	Very high	91.6	Very high	23 Å²	23	68.2 Å²	68.2	12%	0.12	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.8	-177.7	-62.1	168.9	0	0	0	109.3	T72 V81 T82 E83 Y127 F128 K130 M143	T72-L74 HydrophobicContact CG2-CD2 3.89Å; T72-L74 HydrophobicContact CG2-CG 4.19Å; L74-V81 HydrophobicContact CB-CG1 3.72Å; L74-V81 HydrophobicContact CD1-CG1 4.23Å; L74-V81 HydrophobicContact CD2-CG1 4.2Å; L74-V81 HydrophobicContact CG-CG1 4.27Å; L74-T82 CarbonylContact C-O 3.6Å; L74-T82 VanDerWaalsContact CA-O 3.29Å; L74-T82 WeakPolarHBondContact CA-O 3.37Å; L74-E83 HydrophobicContact CD2-CB 4.14Å; L74-E83 HydrophobicContact CD2-CG 4.46Å; L74-Y127 CarbonylContact O-C 3.55Å; L74-Y127 VanDerWaalsContact O-CA 3.25Å; L74-Y127 WeakPolarHBondContact O-CA 3Å; L74-F128 HydrophobicContact CB-CB 4.27Å; L74-F128 PolarHBondContact N-O 3.49Å; L74-F128 PolarHBondContact O-N 2.98Å; L74-K130 HydrophobicContact CD1-CB 4.09Å; L74-K130 HydrophobicContact CD1-CD 4.24Å; L74-M143 HydrophobicContact CD1-CE 3.68Å; L74-M143 HydrophobicContact CD1-SD 3.96Å
75	R	96.1	Very high	92.4	Very high	44 Å²	44	64.9 Å²	64.9	17%	0.166	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.1	174	173.8	-172.4	171.3	169.9	6.7	109.6	T77 V81 T82 V84 A122 D123 Y127	R75-T77 PolarHBondContact NE-OG1 3.07Å; R75-V81 CarbonylContact O-C 3.58Å; R75-V81 WeakPolarHBondContact O-CA 3.42Å; R75-T82 PolarHBondContact N-O 3.48Å; R75-T82 PolarHBondContact O-N 3.3Å; R75-T82 PolarHBondContact O-OG1 2.97Å; R75-T82 VanDerWaalsContact O-OG1 3.1Å; R75-V84 HydrophobicContact CB-CG2 3.55Å; R75-A122 PolarHBondContact NH2-O 3.43Å; R75-D123 IonicContact CZ-OD1 3.85Å; R75-D123 IonicContact NH1-OD1 3.42Å; R75-D123 PolarHBondContact NH1-OD1 3.45Å; R75-Y127 HydrophobicContact CB-CD1 4.02Å; R75-Y127 HydrophobicContact CB-CE1 3.82Å; R75-Y127 HydrophobicContact CG-CE1 4.07Å; R75-Y127 HydrophobicContact CG-CE2 4.45Å
76	Q	94.7	Very high	93	Very high	66 Å²	66	59.6 Å²	59.6	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.3	172.9	-172.1	176.6	13.1	0	0	111.2	Q80 V81 L126 F128	Q76-Q80 CarbonylContact C-O 3.59Å; Q76-Q80 WeakPolarHBondContact CA-O 3.31Å; Q76-V81 HydrophobicContact CG-CG2 4.39Å; Q76-L126 PolarHBondContact N-O 3.42Å; Q76-F128 HydrophobicContact CB-CD2 4.39Å; Q76-F128 HydrophobicContact CB-CE2 3.78Å
77	T	89.4	Confident	93.6	Very high	54 Å²	54	59.8 Å²	59.8	33%	0.331	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	122.2	176.3	-60.9	0	0	0	0	109.2	R75 D79 Q80	R75-T77 PolarHBondContact NE-OG1 3.07Å; T77-D79 VanDerWaalsContact C-N 3.32Å; T77-D79 PolarHBondContact O-N 2.93Å; T77-Q80 PolarHBondContact N-O 3.24Å; T77-Q80 WeakPolarHBondContact O-CA 3.3Å; T77-Q80 WeakPolarHBondContact O-CB 3.41Å; T77-Q80 PolarHBondContact O-N 2.76Å
78	N	87	Confident	93.8	Very high	153 Å²	153	59 Å²	59	82%	0.818	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.5	51.9	178.3	-59.3	-29.2	0	0	0	113.3	Q80	N78-Q80 PolarHBondContact O-N 2.93Å; N78-Q80 VanDerWaalsContact O-N 3.1Å
79	D	85.6	Confident	93.9	Very high	151 Å²	151	55.3 Å²	55.3	81%	0.807	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	-2.1	-176.6	-54.3	-36.9	0	0	0	116.8	T77	T77-D79 VanDerWaalsContact C-N 3.32Å; T77-D79 PolarHBondContact O-N 2.93Å
80	Q	93.1	Very high	93.7	Very high	140 Å²	140	57.4 Å²	57.4	65%	0.654	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	134.1	172.2	-62.1	-173.8	-31.3	0	0	110.4	Q76 T77 N78	Q76-Q80 CarbonylContact C-O 3.59Å; Q76-Q80 WeakPolarHBondContact CA-O 3.31Å; T77-Q80 PolarHBondContact N-O 3.24Å; T77-Q80 WeakPolarHBondContact O-CA 3.3Å; T77-Q80 WeakPolarHBondContact O-CB 3.41Å; T77-Q80 PolarHBondContact O-N 2.76Å; N78-Q80 PolarHBondContact O-N 2.93Å; N78-Q80 VanDerWaalsContact O-N 3.1Å
81	V	94.8	Very high	93.3	Very high	83 Å²	83	57.5 Å²	57.5	50%	0.503	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.8	173.2	-177	0	0	0	0	107.9	L74 R75 Q76	L74-V81 HydrophobicContact CB-CG1 3.72Å; L74-V81 HydrophobicContact CD1-CG1 4.23Å; L74-V81 HydrophobicContact CD2-CG1 4.2Å; L74-V81 HydrophobicContact CG-CG1 4.27Å; R75-V81 CarbonylContact O-C 3.58Å; R75-V81 WeakPolarHBondContact O-CA 3.42Å; Q76-V81 HydrophobicContact CG-CG2 4.39Å
82	T	95.7	Very high	92.8	Very high	64 Å²	64	67.1 Å²	67.1	39%	0.393	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.9	-177.3	53.8	0	0	0	0	110	L74 R75	L74-T82 CarbonylContact C-O 3.6Å; L74-T82 VanDerWaalsContact CA-O 3.29Å; L74-T82 WeakPolarHBondContact CA-O 3.37Å; R75-T82 PolarHBondContact N-O 3.48Å; R75-T82 PolarHBondContact O-N 3.3Å; R75-T82 PolarHBondContact O-OG1 2.97Å; R75-T82 VanDerWaalsContact O-OG1 3.1Å
83	E	95.5	Very high	92.3	Very high	115 Å²	115	70.2 Å²	70.2	54%	0.537	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	120.7	173.1	-173.8	172.1	142.5	0	0	109.4	T72 L74 A86	T72-E83 HydrophobicContact CG2-CG 3.67Å; L74-E83 HydrophobicContact CD2-CB 4.14Å; L74-E83 HydrophobicContact CD2-CG 4.46Å; E83-A86 WeakPolarHBondContact OE1-CB 3.26Å
84	V	94.2	Very high	91.9	Very high	54 Å²	54	73.6 Å²	73.6	33%	0.327	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-49.9	178.1	179.2	0	0	0	0	109.3	V73 R75 Y127	V73-V84 HydrophobicContact CB-CB 4.48Å; V73-V84 HydrophobicContact CG1-CB 4.32Å; V73-V84 PolarHBondContact O-N 3.41Å; R75-V84 HydrophobicContact CB-CG2 3.55Å; V84-Y127 HydrophobicContact CG2-CD1 4.39Å; V84-Y127 HydrophobicContact CG2-CE1 4.01Å
85	C	94.6	Very high	91.4	Very high	5 Å²	5	76.8 Å²	76.8	3%	0.034	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	151.5	177.1	55.9	0	0	0	0	111.3	T72 V73 F97 C103	T72-C85 CarbonylContact C-O 3.51Å; T72-C85 WeakPolarHBondContact CA-O 3.47Å; V73-C85 PolarHBondContact N-O 2.94Å; C85-F97 HydrophobicContact CB-CD1 4.06Å; C85-F97 HydrophobicContact CB-CE1 3.6Å; C85-C103 HydrophobicContact CB-CB 3.52Å; C85-C103 WeakPolarHBondContact CB-SG 3.33Å; C85-C103 WeakPolarHBondContact SG-CB 3.5Å; C85-C103 CovalentContact SG-SG 2.05Å; C85-C103 PolarHBondContact SG-SG 2.76Å
86	A	94.7	Very high	90.8	Very high	36 Å²	36	75 Å²	75	30%	0.298	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.9	175	0	0	0	0	0	110.9	V71 T72 E83 F97	V71-A86 WeakPolarHBondContact O-CA 3.28Å; T72-A86 HydrophobicContact CG2-CB 4.05Å; E83-A86 WeakPolarHBondContact OE1-CB 3.26Å; A86-F97 VanDerWaalsContact C-CE1 3.44Å
87	T	94.8	Very high	90.4	Very high	25 Å²	25	72.5 Å²	72.5	15%	0.153	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	161.4	172.6	-154.7	0	0	0	0	111	R70 V71 F89 F97	R70-T87 CarbonylContact C-O 3.51Å; R70-T87 WeakPolarHBondContact CA-O 3.25Å; V71-T87 PolarHBondContact N-O 2.98Å; V71-T87 PolarHBondContact O-N 3.38Å; T87-F89 HydrophobicContact CG2-CD2 3.79Å; T87-F89 HydrophobicContact CG2-CE1 4.21Å; T87-F89 HydrophobicContact CG2-CE2 3.2Å; T87-F89 HydrophobicContact CG2-CG 4.49Å; T87-F89 HydrophobicContact CG2-CZ 3.45Å; T87-F89 VanDerWaalsContact CG2-CZ 3.45Å; T87-F97 HydrophobicContact CG2-CD1 4.1Å; T87-F97 HydrophobicContact CG2-CD2 3.51Å; T87-F97 HydrophobicContact CG2-CE1 3.82Å; T87-F97 HydrophobicContact CG2-CE2 3.21Å; T87-F97 HydrophobicContact CG2-CG 3.94Å; T87-F97 HydrophobicContact CG2-CZ 3.37Å; T87-F97 PolarHBondContact OG1-N 2.98Å; T87-F97 VanDerWaalsContact OG1-N 3.08Å
88	T	94.1	Very high	90	Very high	61 Å²	61	75.9 Å²	75.9	37%	0.374	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.1	174.7	-54	0	0	0	0	109.1	V69	V69-T88 CarbonylContact O-C 3.59Å; V69-T88 WeakPolarHBondContact O-CA 3.41Å
89	F	93.1	Very high	89.8	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	149.1	173	-61.9	-85	0	0	0	109.8	E68 V69 V71 T87 F97 F107 V112	E68-F89 WeakPolarHBondContact CA-O 3.09Å; V69-F89 PolarHBondContact N-O 3.44Å; V69-F89 PolarHBondContact O-N 2.91Å; V71-F89 HydrophobicContact CB-CD2 4.32Å; V71-F89 HydrophobicContact CB-CE2 3.98Å; V71-F89 HydrophobicContact CG2-CD2 3.84Å; V71-F89 HydrophobicContact CG2-CE2 3.87Å; T87-F89 HydrophobicContact CG2-CD2 3.79Å; T87-F89 HydrophobicContact CG2-CE1 4.21Å; T87-F89 HydrophobicContact CG2-CE2 3.2Å; T87-F89 HydrophobicContact CG2-CG 4.49Å; T87-F89 HydrophobicContact CG2-CZ 3.45Å; T87-F89 VanDerWaalsContact CG2-CZ 3.45Å; F89-F97 HydrophobicContact CE2-CE2 4.34Å; F89-F97 HydrophobicContact CZ-CD2 4.34Å; F89-F97 HydrophobicContact CZ-CE2 4.05Å; F89-F107 HydrophobicContact CB-CB 3.82Å; F89-F107 HydrophobicContact CB-CD1 4.17Å; F89-F107 HydrophobicContact CB-CD2 3.99Å; F89-F107 HydrophobicContact CB-CG 3.75Å; F89-F107 HydrophobicContact CD1-CB 3.34Å; F89-F107 HydrophobicContact CD1-CG 4.23Å; F89-F107 HydrophobicContact CD2-CB 4.33Å; F89-F107 HydrophobicContact CD2-CD2 4.48Å; F89-F107 HydrophobicContact CE1-CB 3.85Å; F89-F107 HydrophobicContact CG-CB 3.59Å; F89-F107 HydrophobicContact CG-CD2 4.21Å; F89-F107 HydrophobicContact CG-CG 4.01Å; F89-V112 HydrophobicContact CD2-CG1 4.45Å; F89-V112 HydrophobicContact CE2-CG1 3.68Å; F89-V112 HydrophobicContact CZ-CG1 3.84Å
90	T	91.2	Very high	89.9	Confident	44 Å²	44	71.7 Å²	71.7	27%	0.27	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	159.3	169.9	66.5	0	0	0	0	109.2	D67 E68 K92 N93	D67-T90 WeakPolarHBondContact O-CA 3.38Å; D67-T90 WeakPolarHBondContact O-CB 3.49Å; E68-T90 HydrophobicContact CG-CG2 4.05Å; T90-K92 PolarHBondContact O-N 3.18Å; T90-N93 PolarHBondContact N-O 2.93Å; T90-N93 CarbonylContact O-C 3.55Å; T90-N93 VanDerWaalsContact O-C 3.22Å; T90-N93 PolarHBondContact O-N 3.41Å; T90-N93 WeakPolarHBondContact OG1-CB 3.34Å; T90-N93 PolarHBondContact OG1-N 2.94Å; T90-N93 VanDerWaalsContact OG1-N 3.08Å
91	V	84.7	Confident	89.7	Confident	87 Å²	87	69.8 Å²	69.8	53%	0.527	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.2	176.8	174.1	0	0	0	0	112.2	T66 D67	T66-V91 WeakPolarHBondContact O-CG2 3.22Å; D67-V91 PolarHBondContact O-N 3.37Å; D67-V91 VanDerWaalsContact O-N 3.16Å
92	K	85.3	Confident	89.6	Confident	202 Å²	202	71.7 Å²	71.7	88%	0.878	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-28.5	176.7	-64.9	178.9	-177.7	171.2	0	113.8	T90	T90-K92 PolarHBondContact O-N 3.18Å
93	N	86.7	Confident	89.5	Confident	68 Å²	68	68.9 Å²	68.9	36%	0.364	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-114.1	93.6	-179.2	-172.5	23.2	0	0	0	110.7	T90 L95	T90-N93 PolarHBondContact N-O 2.93Å; T90-N93 CarbonylContact O-C 3.55Å; T90-N93 VanDerWaalsContact O-C 3.22Å; T90-N93 PolarHBondContact O-N 3.41Å; T90-N93 WeakPolarHBondContact OG1-CB 3.34Å; T90-N93 PolarHBondContact OG1-N 2.94Å; T90-N93 VanDerWaalsContact OG1-N 3.08Å; N93-L95 VanDerWaalsContact C-N 3.3Å; N93-L95 PolarHBondContact ND2-O 2.89Å; N93-L95 VanDerWaalsContact ND2-O 3.09Å; N93-L95 PolarHBondContact OD1-N 3.5Å; N93-L95 PolarHBondContact OD1-O 3.39Å; N93-L95 VanDerWaalsContact OD1-O 3.09Å
94	T	87.3	Confident	89.5	Confident	70 Å²	70	65.4 Å²	65.4	43%	0.429	36%	0.361	S	S	.	.			trans	-80.1	-11.3	-178.9	59.1	0	0	0	0	113.2	T106 F107	T94-T106 CarbonylContact O-C 3.56Å; T94-T106 VanDerWaalsContact O-CA 3.31Å; T94-T106 WeakPolarHBondContact O-CA 3.34Å; T94-F107 WeakPolarHBondContact CB-O 3.35Å; T94-F107 WeakPolarHBondContact CG2-O 3.48Å; T94-F107 PolarHBondContact O-N 2.94Å
95	L	87.4	Confident	89.5	Confident	91 Å²	91	63 Å²	63	48%	0.476	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	123.4	178.9	-76.7	150.6	0	0	0	109.4	N93 L98 T106	N93-L95 VanDerWaalsContact C-N 3.3Å; N93-L95 PolarHBondContact ND2-O 2.89Å; N93-L95 VanDerWaalsContact ND2-O 3.09Å; N93-L95 PolarHBondContact OD1-N 3.5Å; N93-L95 PolarHBondContact OD1-O 3.39Å; N93-L95 VanDerWaalsContact OD1-O 3.09Å; L95-L98 HydrophobicContact CB-CD2 4.21Å; L95-T106 HydrophobicContact CD2-CG2 4.07Å
96	G	82.9	Confident	89.5	Confident	6 Å²	6	65.8 Å²	65.8	6%	0.062	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	167.6	177.5	0	0	0	0	0	110.5	L98 G105	G96-L98 VanDerWaalsContact C-N 3.34Å; G96-L98 PolarHBondContact O-N 3.24Å; G96-G105 PolarHBondContact N-O 2.83Å
97	F	85.2	Confident	89.5	Confident	13 Å²	13	64.7 Å²	64.7	6%	0.057	35%	0.353	C	S	.	.			trans	62.1	32.6	178.3	-50.6	-84.6	0	0	0	114.9	C85 A86 T87 F89 D99 D100 C103 L114	C85-F97 HydrophobicContact CB-CD1 4.06Å; C85-F97 HydrophobicContact CB-CE1 3.6Å; A86-F97 VanDerWaalsContact C-CE1 3.44Å; T87-F97 HydrophobicContact CG2-CD1 4.1Å; T87-F97 HydrophobicContact CG2-CD2 3.51Å; T87-F97 HydrophobicContact CG2-CE1 3.82Å; T87-F97 HydrophobicContact CG2-CE2 3.21Å; T87-F97 HydrophobicContact CG2-CG 3.94Å; T87-F97 HydrophobicContact CG2-CZ 3.37Å; T87-F97 PolarHBondContact OG1-N 2.98Å; T87-F97 VanDerWaalsContact OG1-N 3.08Å; F89-F97 HydrophobicContact CE2-CE2 4.34Å; F89-F97 HydrophobicContact CZ-CD2 4.34Å; F89-F97 HydrophobicContact CZ-CE2 4.05Å; F97-D99 PolarHBondContact O-N 3.45Å; F97-D99 VanDerWaalsContact O-N 3.17Å; F97-D100 HydrophobicContact CB-CB 3.98Å; F97-D100 HydrophobicContact CD1-CB 4.36Å; F97-D100 PolarHBondContact O-N 2.84Å; F97-D100 VanDerWaalsContact O-N 3.11Å; F97-C103 HydrophobicContact CB-CB 4.3Å; F97-C103 WeakPolarHBondContact CB-O 3.11Å; F97-C103 HydrophobicContact CD1-CB 3.63Å; F97-C103 HydrophobicContact CD2-CB 4.4Å; F97-C103 HydrophobicContact CE1-CB 3.96Å; F97-C103 HydrophobicContact CG-CB 3.88Å; F97-C103 HydrophobicContact CZ-CB 4.49Å; F97-L114 HydrophobicContact CE2-CD2 3.7Å; F97-L114 HydrophobicContact CZ-CD2 4.12Å
98	L	81	Confident	89.2	Confident	125 Å²	125	68.6 Å²	68.6	65%	0.654	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.5	-177.7	-66	173.1	0	0	0	114	L95 G96	L95-L98 HydrophobicContact CB-CD2 4.21Å; G96-L98 VanDerWaalsContact C-N 3.34Å; G96-L98 PolarHBondContact O-N 3.24Å
99	D	84	Confident	88.9	Confident	166 Å²	166	73.1 Å²	73.1	89%	0.888	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-2.4	-180	-58.8	-46.5	0	0	0	113.3	F97	F97-D99 PolarHBondContact O-N 3.45Å; F97-D99 VanDerWaalsContact O-N 3.17Å
100	D	88	Confident	88.7	Confident	50 Å²	50	76 Å²	76	27%	0.267	41%	0.409	S	S	.	.			trans	-95.8	120.8	-177.9	-165.1	-40.2	0	0	0	109.9	F97 F102 C103	F97-D100 HydrophobicContact CB-CB 3.98Å; F97-D100 HydrophobicContact CD1-CB 4.36Å; F97-D100 PolarHBondContact O-N 2.84Å; F97-D100 VanDerWaalsContact O-N 3.11Å; D100-F102 VanDerWaalsContact C-N 3.29Å; D100-F102 PolarHBondContact O-N 3.41Å; D100-F102 PolarHBondContact OD1-N 2.82Å; D100-C103 PolarHBondContact OD1-N 2.95Å; D100-C103 VanDerWaalsContact OD1-N 3.14Å
101	P	87.6	Confident	88.8	Confident	100 Å²	100	79.3 Å²	79.3	65%	0.649	42%	0.417	S	S	*	.	S	Bend	trans	-75.7	-16.2	179.7	29.7	-33.4	0	0	0	113.6
102	F	92.6	Very high	89.3	Confident	124 Å²	124	75.2 Å²	75.2	54%	0.544	39%	0.392	S	S	.	.	S	Bend	trans	-103.7	-30.8	-174.9	-61	-74.7	0	0	0	112.8	D100 I116 Q117	D100-F102 VanDerWaalsContact C-N 3.29Å; D100-F102 PolarHBondContact O-N 3.41Å; D100-F102 PolarHBondContact OD1-N 2.82Å; F102-I116 CarbonylContact O-C 3.59Å; F102-I116 WeakPolarHBondContact O-CA 3.36Å; F102-Q117 PolarHBondContact O-N 3.04Å
103	C	95.4	Very high	89.8	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.034	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	142.7	179.5	-74.9	0	0	0	0	111.9	C85 F97 D100 T115	C85-C103 HydrophobicContact CB-CB 3.52Å; C85-C103 WeakPolarHBondContact CB-SG 3.33Å; C85-C103 WeakPolarHBondContact SG-CB 3.5Å; C85-C103 CovalentContact SG-SG 2.05Å; C85-C103 PolarHBondContact SG-SG 2.76Å; F97-C103 HydrophobicContact CB-CB 4.3Å; F97-C103 WeakPolarHBondContact CB-O 3.11Å; F97-C103 HydrophobicContact CD1-CB 3.63Å; F97-C103 HydrophobicContact CD2-CB 4.4Å; F97-C103 HydrophobicContact CE1-CB 3.96Å; F97-C103 HydrophobicContact CG-CB 3.88Å; F97-C103 HydrophobicContact CZ-CB 4.49Å; D100-C103 PolarHBondContact OD1-N 2.95Å; D100-C103 VanDerWaalsContact OD1-N 3.14Å; C103-T115 CarbonylContact C-O 3.58Å; C103-T115 WeakPolarHBondContact CA-O 3.44Å
104	S	95.3	Very high	90.2	Very high	41 Å²	41	65.6 Å²	65.6	29%	0.287	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	148.2	169.9	50.3	0	0	0	0	108.2	T115	S104-T115 PolarHBondContact N-O 2.92Å; S104-T115 PolarHBondContact O-N 2.83Å; S104-T115 WeakPolarHBondContact OG-CB 3.42Å; S104-T115 PolarHBondContact OG-O 3.48Å
105	G	94.4	Very high	90.7	Very high	5 Å²	5	63.8 Å²	63.8	5%	0.052	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	145.3	-178.8	0	0	0	0	0	113.8	G96 N113	G96-G105 PolarHBondContact N-O 2.83Å; G105-N113 CarbonylContact C-O 3.5Å; G105-N113 WeakPolarHBondContact CA-O 3.5Å
106	T	94.6	Very high	91.1	Very high	63 Å²	63	59.6 Å²	59.6	39%	0.387	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.9	175.9	63.6	0	0	0	0	110.2	T94 L95 V112 N113	T94-T106 CarbonylContact O-C 3.56Å; T94-T106 VanDerWaalsContact O-CA 3.31Å; T94-T106 WeakPolarHBondContact O-CA 3.34Å; L95-T106 HydrophobicContact CD2-CG2 4.07Å; T106-V112 WeakPolarHBondContact O-CA 3.37Å; T106-N113 PolarHBondContact N-O 3.2Å; T106-N113 PolarHBondContact O-N 3.38Å
107	F	93.1	Very high	91.7	Very high	13 Å²	13	63.5 Å²	63.5	6%	0.057	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	127.7	178.6	177.5	-101	0	0	0	110.9	Y60 V69 F89 T94 E109 V112	Y60-F107 HydrophobicContact CE1-CE2 4.07Å; Y60-F107 WeakPolarHBondContact OH-CE2 3.49Å; V69-F107 HydrophobicContact CB-CE2 4.22Å; V69-F107 HydrophobicContact CG1-CE2 4.42Å; V69-F107 HydrophobicContact CG2-CE2 4.14Å; V69-F107 HydrophobicContact CG2-CZ 4.07Å; F89-F107 HydrophobicContact CB-CB 3.82Å; F89-F107 HydrophobicContact CB-CD1 4.17Å; F89-F107 HydrophobicContact CB-CD2 3.99Å; F89-F107 HydrophobicContact CB-CG 3.75Å; F89-F107 HydrophobicContact CD1-CB 3.34Å; F89-F107 HydrophobicContact CD1-CG 4.23Å; F89-F107 HydrophobicContact CD2-CB 4.33Å; F89-F107 HydrophobicContact CD2-CD2 4.48Å; F89-F107 HydrophobicContact CE1-CB 3.85Å; F89-F107 HydrophobicContact CG-CB 3.59Å; F89-F107 HydrophobicContact CG-CD2 4.21Å; F89-F107 HydrophobicContact CG-CG 4.01Å; T94-F107 WeakPolarHBondContact CB-O 3.35Å; T94-F107 WeakPolarHBondContact CG2-O 3.48Å; T94-F107 PolarHBondContact O-N 2.94Å; F107-E109 WeakPolarHBondContact CE2-O 3.23Å; F107-E109 WeakPolarHBondContact CZ-O 3.31Å; F107-V112 HydrophobicContact CD2-CG2 3.65Å; F107-V112 HydrophobicContact CE2-CG2 4.23Å
108	N	90.1	Very high	92	Very high	107 Å²	107	65 Å²	65	57%	0.572	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	88.1	174.5	-175.1	19.3	0	0	0	108.9	S110 R111	N108-S110 VanDerWaalsContact C-N 3.3Å; N108-S110 PolarHBondContact O-N 3.5Å; N108-R111 PolarHBondContact N-O 2.85Å; N108-R111 PolarHBondContact O-N 3.28Å
109	E	86.7	Confident	92.7	Very high	156 Å²	156	59.9 Å²	59.9	73%	0.729	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	-75	177.6	-59.1	179.8	169.3	0	0	115.1	Y60 F107	Y60-E109 PolarHBondContact OH-O 2.92Å; F107-E109 WeakPolarHBondContact CE2-O 3.23Å; F107-E109 WeakPolarHBondContact CZ-O 3.31Å
110	S	89.3	Confident	93.1	Very high	59 Å²	59	61 Å²	61	41%	0.413	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-3.8	-179.1	59.4	0	0	0	0	113.4	E59 Y60 N108	E59-S110 WeakPolarHBondContact CA-O 3.14Å; Y60-S110 VanDerWaalsContact CD1-O 3.3Å; Y60-S110 WeakPolarHBondContact CD1-O 3.35Å; Y60-S110 PolarHBondContact N-O 3.26Å; Y60-S110 WeakPolarHBondContact O-CB 3.33Å; N108-S110 VanDerWaalsContact C-N 3.3Å; N108-S110 PolarHBondContact O-N 3.5Å
111	R	93.3	Very high	93.3	Very high	115 Å²	115	60.3 Å²	60.3	43%	0.434	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.4	178.6	178.2	-178.5	-91.4	-177.8	-4.6	110.3	E59 N108	E59-R111 HydrophobicContact CG-CB 3.79Å; E59-R111 HydrophobicContact CG-CG 3.77Å; E59-R111 IonicContact OE1-CZ 3.06Å; E59-R111 IonicContact OE1-NE 2.7Å; E59-R111 PolarHBondContact OE1-NE 2.84Å; E59-R111 IonicContact OE1-NH2 2.63Å; E59-R111 PolarHBondContact OE1-NH2 3.34Å; N108-R111 PolarHBondContact N-O 2.85Å; N108-R111 PolarHBondContact O-N 3.28Å
112	V	94.8	Very high	93.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	113.4	173.3	-169.3	0	0	0	0	108.4	P57 C58 V71 F89 T106 F107 L114	P57-V112 CarbonylContact C-O 3.49Å; C58-V112 HydrophobicContact CB-CB 4.46Å; C58-V112 PolarHBondContact N-O 3.23Å; C58-V112 PolarHBondContact O-N 3.49Å; V71-V112 HydrophobicContact CG2-CG1 4.29Å; V71-V112 HydrophobicContact CG2-CG2 3.91Å; F89-V112 HydrophobicContact CD2-CG1 4.45Å; F89-V112 HydrophobicContact CE2-CG1 3.68Å; F89-V112 HydrophobicContact CZ-CG1 3.84Å; T106-V112 WeakPolarHBondContact O-CA 3.37Å; F107-V112 HydrophobicContact CD2-CG2 3.65Å; F107-V112 HydrophobicContact CE2-CG2 4.23Å; V112-L114 HydrophobicContact CG1-CD2 3.91Å; V112-L114 HydrophobicContact CG1-CG 4.11Å
113	N	95.9	Very high	93.5	Very high	66 Å²	66	55.5 Å²	55.5	35%	0.353	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	117.8	170.4	-62.1	-32.5	0	0	0	108.1	G105 T106	G105-N113 CarbonylContact C-O 3.5Å; G105-N113 WeakPolarHBondContact CA-O 3.5Å; T106-N113 PolarHBondContact N-O 3.2Å; T106-N113 PolarHBondContact O-N 3.38Å
114	L	96.2	Very high	93.5	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.016	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137	178.7	-65	165.7	0	0	0	109	S55 F56 C58 V71 V73 F97 V112 C129	S55-L114 CarbonylContact C-O 3.59Å; S55-L114 VanDerWaalsContact CA-O 3.23Å; S55-L114 WeakPolarHBondContact CA-O 3.37Å; F56-L114 HydrophobicContact CE1-CB 4.4Å; F56-L114 HydrophobicContact CE2-CB 4.33Å; F56-L114 HydrophobicContact CE2-CD1 3.81Å; F56-L114 HydrophobicContact CZ-CB 4.2Å; F56-L114 HydrophobicContact CZ-CD1 4.07Å; F56-L114 PolarHBondContact N-O 2.91Å; F56-L114 PolarHBondContact O-N 2.88Å; C58-L114 HydrophobicContact CB-CD1 4Å; V71-L114 HydrophobicContact CG1-CD1 4.13Å; V71-L114 HydrophobicContact CG1-CD2 4.13Å; V73-L114 HydrophobicContact CG2-CD1 3.81Å; V73-L114 HydrophobicContact CG2-CD2 4.32Å; F97-L114 HydrophobicContact CE2-CD2 3.7Å; F97-L114 HydrophobicContact CZ-CD2 4.12Å; V112-L114 HydrophobicContact CG1-CD2 3.91Å; V112-L114 HydrophobicContact CG1-CG 4.11Å; L114-C129 HydrophobicContact CD1-CB 4.46Å
115	T	96	Very high	93.5	Very high	31 Å²	31	56.1 Å²	56.1	19%	0.19	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	116.4	176.5	-64.1	0	0	0	0	108.8	V53 A54 S55 C103 S104 Q117	V53-T115 HydrophobicContact CG1-CG2 3.64Å; A54-T115 CarbonylContact O-C 3.43Å; A54-T115 WeakPolarHBondContact O-CA 3.41Å; S55-T115 WeakPolarHBondContact OG-CG2 3.23Å; S55-T115 PolarHBondContact OG-OG1 3.09Å; C103-T115 CarbonylContact C-O 3.58Å; C103-T115 WeakPolarHBondContact CA-O 3.44Å; S104-T115 PolarHBondContact N-O 2.92Å; S104-T115 PolarHBondContact O-N 2.83Å; S104-T115 WeakPolarHBondContact OG-CB 3.42Å; S104-T115 PolarHBondContact OG-O 3.48Å; T115-Q117 HydrophobicContact CG2-CG 4.15Å
116	I	96.2	Very high	93.5	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.7	176.3	-48.7	173.7	0	0	0	107.8	V53 A54 F56 V73 F102 L119 Y127 I149	V53-I116 CarbonylContact C-O 3.57Å; V53-I116 WeakPolarHBondContact CA-O 3.32Å; A54-I116 PolarHBondContact N-O 2.78Å; A54-I116 PolarHBondContact O-N 3.1Å; F56-I116 HydrophobicContact CE1-CD1 3.77Å; F56-I116 HydrophobicContact CE1-CG1 4.24Å; F56-I116 HydrophobicContact CZ-CD1 4.25Å; V73-I116 HydrophobicContact CG1-CD1 3.89Å; F102-I116 CarbonylContact O-C 3.59Å; F102-I116 WeakPolarHBondContact O-CA 3.36Å; I116-L119 HydrophobicContact CB-CD1 4.28Å; I116-L119 HydrophobicContact CG2-CD1 4.27Å; I116-L119 HydrophobicContact CG2-CD2 3.84Å; I116-L119 HydrophobicContact CG2-CG 3.98Å; I116-Y127 HydrophobicContact CD1-CD1 4.09Å; I116-Y127 HydrophobicContact CD1-CE1 4.24Å; I116-I149 HydrophobicContact CD1-CD1 4.37Å
117	Q	95	Very high	93.7	Very high	88 Å²	88	55.4 Å²	55.4	41%	0.411	30%	0.301	S	S	.	.			trans	-120.6	159	-177.1	-52.3	-170.5	16.2	0	0	110.7	G52 V53 F102 T115 L119	G52-Q117 CarbonylContact O-C 3.43Å; V53-Q117 HydrophobicContact CG1-CG 4.06Å; V53-Q117 HydrophobicContact CG2-CB 4.17Å; V53-Q117 HydrophobicContact CG2-CG 4Å; F102-Q117 PolarHBondContact O-N 3.04Å; T115-Q117 HydrophobicContact CG2-CG 4.15Å; Q117-L119 VanDerWaalsContact C-N 3.29Å; Q117-L119 PolarHBondContact O-N 2.66Å
118	G	93.4	Very high	93.9	Very high	45 Å²	45	56.3 Å²	56.3	46%	0.464	31%	0.305	S	S	.	.	S	Bend	trans	74	18.9	178.2	0	0	0	0	0	114.3	G52	G52-G118 PolarHBondContact O-N 3.05Å; G52-G118 VanDerWaalsContact O-N 3.09Å
119	L	94.5	Very high	94.2	Very high	16 Å²	16	51.2 Å²	51.2	8%	0.084	28%	0.278	C	S	.	.			trans	-67.8	138	174.6	-64.8	170.1	0	0	0	110.9	A48 G52 A54 I116 Q117 D123 I149 V151	A48-L119 HydrophobicContact CB-CD1 4.46Å; G52-L119 VanDerWaalsContact CA-O 3.23Å; G52-L119 WeakPolarHBondContact CA-O 3.48Å; G52-L119 WeakPolarHBondContact O-CB 3.44Å; G52-L119 PolarHBondContact O-N 2.91Å; A54-L119 HydrophobicContact CB-CD1 3.56Å; I116-L119 HydrophobicContact CB-CD1 4.28Å; I116-L119 HydrophobicContact CG2-CD1 4.27Å; I116-L119 HydrophobicContact CG2-CD2 3.84Å; I116-L119 HydrophobicContact CG2-CG 3.98Å; Q117-L119 VanDerWaalsContact C-N 3.29Å; Q117-L119 PolarHBondContact O-N 2.66Å; L119-D123 HydrophobicContact CB-CB 4.47Å; L119-D123 HydrophobicContact CD2-CB 3.88Å; L119-I149 HydrophobicContact CD1-CG2 4.08Å; L119-V151 HydrophobicContact CB-CG1 4.41Å; L119-V151 HydrophobicContact CB-CG2 3.75Å; L119-V151 HydrophobicContact CD1-CG2 4.31Å
120	R	93.4	Very high	94.7	Very high	189 Å²	189	46.5 Å²	46.5	71%	0.713	26%	0.255	S	S	*	.			trans	-109.4	167.6	174.7	-58.6	176.4	-179.7	176	-0.2	110.6	A122 D123 V151	R120-A122 PolarHBondContact O-N 2.88Å; R120-A122 VanDerWaalsContact O-N 3.11Å; R120-D123 WeakPolarHBondContact CB-OD2 3.43Å; R120-D123 PolarHBondContact N-OD2 2.83Å; R120-D123 WeakPolarHBondContact O-CA 3.46Å; R120-D123 WeakPolarHBondContact O-CB 3.35Å; R120-D123 PolarHBondContact O-N 3.07Å; R120-V151 VanDerWaalsContact C-CG1 3.46Å; R120-V151 WeakPolarHBondContact O-CB 3.25Å
121	A	91.3	Very high	95	Very high	36 Å²	36	43.7 Å²	43.7	30%	0.298	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-51.4	-37.1	174	0	0	0	0	0	113.4	D123 T124 D153	A121-D123 PolarHBondContact O-N 2.82Å; A121-T124 VanDerWaalsContact O-CB 3.23Å; A121-T124 WeakPolarHBondContact O-CB 3.23Å; A121-T124 PolarHBondContact O-N 3.12Å; A121-T124 PolarHBondContact O-OG1 3.44Å; A121-D153 HydrophobicContact CB-CB 4.46Å; A121-D153 VanDerWaalsContact CB-CG 3.43Å; A121-D153 WeakPolarHBondContact CB-OD1 3.49Å; A121-D153 VanDerWaalsContact CB-OD2 3.22Å; A121-D153 WeakPolarHBondContact CB-OD2 2.93Å
122	A	92	Very high	95	Very high	82 Å²	82	38.8 Å²	38.8	68%	0.678	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-66.1	-16	175.6	0	0	0	0	0	114.4	R75 R120 T124	R75-A122 PolarHBondContact NH2-O 3.43Å; R120-A122 PolarHBondContact O-N 2.88Å; R120-A122 VanDerWaalsContact O-N 3.11Å; A122-T124 VanDerWaalsContact C-N 3.35Å
123	D	93.7	Very high	94.9	Very high	41 Å²	41	39 Å²	39	22%	0.219	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-91.1	-0.1	177.5	-57.2	-46.8	0	0	0	113.2	R75 L119 R120 A121 G125 Y127	R75-D123 IonicContact CZ-OD1 3.85Å; R75-D123 IonicContact NH1-OD1 3.42Å; R75-D123 PolarHBondContact NH1-OD1 3.45Å; L119-D123 HydrophobicContact CB-CB 4.47Å; L119-D123 HydrophobicContact CD2-CB 3.88Å; R120-D123 WeakPolarHBondContact CB-OD2 3.43Å; R120-D123 PolarHBondContact N-OD2 2.83Å; R120-D123 WeakPolarHBondContact O-CA 3.46Å; R120-D123 WeakPolarHBondContact O-CB 3.35Å; R120-D123 PolarHBondContact O-N 3.07Å; A121-D123 PolarHBondContact O-N 2.82Å; D123-G125 PolarHBondContact O-N 2.85Å; D123-Y127 WeakPolarHBondContact O-CE2 3.44Å; D123-Y127 PolarHBondContact O-OH 2.94Å
124	T	94.1	Very high	94.7	Very high	50 Å²	50	39.7 Å²	39.7	31%	0.307	22%	0.221	S	C	.	.			trans	-56.3	128.2	169.5	-65.6	0	0	0	0	110.2	A121 A122 I149 Y150 V151	A121-T124 VanDerWaalsContact O-CB 3.23Å; A121-T124 WeakPolarHBondContact O-CB 3.23Å; A121-T124 PolarHBondContact O-N 3.12Å; A121-T124 PolarHBondContact O-OG1 3.44Å; A122-T124 VanDerWaalsContact C-N 3.35Å; T124-I149 WeakPolarHBondContact CA-O 3.06Å; T124-I149 WeakPolarHBondContact CG2-O 3.49Å; T124-Y150 HydrophobicContact CG2-CD1 3.86Å; T124-Y150 HydrophobicContact CG2-CE1 4.4Å; T124-V151 PolarHBondContact OG1-N 2.83Å; T124-V151 VanDerWaalsContact OG1-N 3.07Å
125	G	94.7	Very high	94.6	Very high	10 Å²	10	45 Å²	45	10%	0.103	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171	-171.6	-174.3	0	0	0	0	0	114	D123 Y127 Q148 I149	D123-G125 PolarHBondContact O-N 2.85Å; G125-Y127 WeakPolarHBondContact O-CD2 3.36Å; G125-Q148 PolarHBondContact O-NE2 2.87Å; G125-I149 PolarHBondContact N-O 3Å; G125-I149 VanDerWaalsContact N-O 3.13Å; G125-I149 PolarHBondContact O-N 2.87Å
126	L	96.1	Very high	94.4	Very high	49 Å²	49	45.9 Å²	45.9	26%	0.257	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.5	-179.3	-169.6	64.8	0	0	0	110	Q76 F128 Q148	Q76-L126 PolarHBondContact N-O 3.42Å; L126-F128 HydrophobicContact CB-CE2 4.46Å; L126-F128 HydrophobicContact CD2-CE1 4.3Å; L126-F128 HydrophobicContact CD2-CE2 3.68Å; L126-F128 HydrophobicContact CD2-CZ 3.37Å; L126-F128 HydrophobicContact CG-CE2 3.76Å; L126-F128 HydrophobicContact CG-CZ 3.82Å; L126-Q148 HydrophobicContact CD1-CB 4.43Å
127	Y	97.4	Very high	94	Very high	3 Å²	3	50.5 Å²	50.5	1%	0.012	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.8	-179.3	-69.7	-103.3	0	0	0	109.9	Q42 V73 L74 R75 V84 I116 D123 G125 G146 T147 I149	Q42-Y127 PolarHBondContact OE1-O 3.46Å; Q42-Y127 VanDerWaalsContact OE1-O 3.04Å; V73-Y127 HydrophobicContact CG1-CD1 3.95Å; L74-Y127 CarbonylContact O-C 3.55Å; L74-Y127 VanDerWaalsContact O-CA 3.25Å; L74-Y127 WeakPolarHBondContact O-CA 3Å; R75-Y127 HydrophobicContact CB-CD1 4.02Å; R75-Y127 HydrophobicContact CB-CE1 3.82Å; R75-Y127 HydrophobicContact CG-CE1 4.07Å; R75-Y127 HydrophobicContact CG-CE2 4.45Å; V84-Y127 HydrophobicContact CG2-CD1 4.39Å; V84-Y127 HydrophobicContact CG2-CE1 4.01Å; I116-Y127 HydrophobicContact CD1-CD1 4.09Å; I116-Y127 HydrophobicContact CD1-CE1 4.24Å; D123-Y127 WeakPolarHBondContact O-CE2 3.44Å; D123-Y127 PolarHBondContact O-OH 2.94Å; G125-Y127 WeakPolarHBondContact O-CD2 3.36Å; Y127-G146 CarbonylContact O-C 3.58Å; Y127-G146 VanDerWaalsContact O-CA 3.3Å; Y127-G146 WeakPolarHBondContact O-CA 2.95Å; Y127-T147 PolarHBondContact N-O 2.92Å; Y127-T147 PolarHBondContact O-N 2.76Å; Y127-I149 HydrophobicContact CD1-CD1 4.34Å; Y127-I149 HydrophobicContact CD2-CB 3.91Å; Y127-I149 HydrophobicContact CD2-CD1 3.52Å; Y127-I149 HydrophobicContact CD2-CG1 3.68Å; Y127-I149 HydrophobicContact CE2-CB 3.98Å; Y127-I149 HydrophobicContact CE2-CD1 3.97Å; Y127-I149 HydrophobicContact CE2-CG1 4.21Å; Y127-I149 HydrophobicContact CG-CD1 3.74Å; Y127-I149 HydrophobicContact CG-CG1 4.3Å
128	F	97.4	Very high	93.8	Very high	32 Å²	32	50 Å²	50	14%	0.14	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.7	178.7	-62.7	-92.3	0	0	0	109.9	L74 Q76 L126 M143 G144	L74-F128 HydrophobicContact CB-CB 4.27Å; L74-F128 PolarHBondContact N-O 3.49Å; L74-F128 PolarHBondContact O-N 2.98Å; Q76-F128 HydrophobicContact CB-CD2 4.39Å; Q76-F128 HydrophobicContact CB-CE2 3.78Å; L126-F128 HydrophobicContact CB-CE2 4.46Å; L126-F128 HydrophobicContact CD2-CE1 4.3Å; L126-F128 HydrophobicContact CD2-CE2 3.68Å; L126-F128 HydrophobicContact CD2-CZ 3.37Å; L126-F128 HydrophobicContact CG-CE2 3.76Å; L126-F128 HydrophobicContact CG-CZ 3.82Å; F128-M143 HydrophobicContact CB-CE 3.78Å; F128-M143 HydrophobicContact CD1-CE 4.49Å; F128-M143 HydrophobicContact CG-CE 4.28Å; F128-G144 WeakPolarHBondContact CD1-O 3.4Å
129	C	96.9	Very high	93.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119.4	164.4	-175.7	0	0	0	0	110.5	V40 C58 L114 G144	V40-C129 HydrophobicContact CG1-CB 4.47Å; C58-C129 HydrophobicContact CB-CB 3.71Å; C58-C129 WeakPolarHBondContact CB-SG 3.45Å; C58-C129 WeakPolarHBondContact SG-CB 3.46Å; C58-C129 CovalentContact SG-SG 2.02Å; C58-C129 PolarHBondContact SG-SG 2.9Å; L114-C129 HydrophobicContact CD1-CB 4.46Å; C129-G144 PolarHBondContact O-N 3.09Å
130	K	96.3	Very high	93.6	Very high	57 Å²	57	53.9 Å²	53.9	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.4	168.6	-173.6	178.4	-168.9	-157.4	0	109.3	V71 T72 L74 E132 V141 G142 M143	V71-K130 CarbonylContact C-O 3.59Å; V71-K130 WeakPolarHBondContact CA-O 3.19Å; T72-K130 PolarHBondContact N-O 3.48Å; T72-K130 WeakPolarHBondContact O-CB 3.44Å; T72-K130 PolarHBondContact O-N 3.32Å; L74-K130 HydrophobicContact CD1-CB 4.09Å; L74-K130 HydrophobicContact CD1-CD 4.24Å; K130-E132 HydrophobicContact CD-CG 4.46Å; K130-E132 WeakPolarHBondContact CE-OE1 3.35Å; K130-E132 HydrophobicContact CG-CG 4.29Å; K130-E132 IonicContact NZ-OE1 2.64Å; K130-E132 PolarHBondContact NZ-OE1 2.78Å; K130-V141 HydrophobicContact CG-CG2 4.34Å; K130-G142 WeakPolarHBondContact CA-O 3.46Å; K130-M143 HydrophobicContact CB-SD 3.29Å; K130-M143 WeakPolarHBondContact CB-SD 3.25Å; K130-M143 HydrophobicContact CD-SD 3.81Å; K130-M143 HydrophobicContact CG-CG 4.35Å; K130-M143 HydrophobicContact CG-SD 3.35Å; K130-M143 WeakPolarHBondContact CG-SD 3.44Å
131	V	95.5	Very high	93.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	130.7	177.3	-176.2	0	0	0	0	109	V40 Y60 V69 R70 V71 L133 V141 G142	V40-V131 HydrophobicContact CG1-CG2 4.2Å; V40-V131 HydrophobicContact CG2-CB 4.07Å; V40-V131 HydrophobicContact CG2-CG2 3.98Å; Y60-V131 HydrophobicContact CD1-CG1 3.83Å; Y60-V131 HydrophobicContact CD1-CG2 4.44Å; Y60-V131 HydrophobicContact CE1-CG1 4.14Å; Y60-V131 HydrophobicContact CG-CG1 4.04Å; V69-V131 HydrophobicContact CG1-CG1 3.57Å; R70-V131 CarbonylContact O-C 3.22Å; R70-V131 WeakPolarHBondContact O-CA 3.09Å; V71-V131 HydrophobicContact CG2-CG2 4.47Å; V131-L133 HydrophobicContact CG1-CD1 3.9Å; V131-V141 WeakPolarHBondContact O-CA 3.26Å; V131-G142 PolarHBondContact N-O 2.85Å; V131-G142 PolarHBondContact O-N 3.11Å
132	E	94	Very high	93.7	Very high	13 Å²	13	46 Å²	46	6%	0.061	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	118.2	-178.8	-63.5	176.9	142.1	0	0	108.9	V69 R70 K130 M134 Y139 F140 V141	V69-E132 CarbonylContact C-O 3.55Å; V69-E132 WeakPolarHBondContact CA-O 3.34Å; R70-E132 HydrophobicContact CB-CB 4.18Å; R70-E132 VanDerWaalsContact CD-OE2 3.22Å; R70-E132 WeakPolarHBondContact CD-OE2 3.45Å; R70-E132 IonicContact CZ-OE2 3.78Å; R70-E132 PolarHBondContact N-O 2.87Å; R70-E132 IonicContact NE-OE2 2.78Å; R70-E132 PolarHBondContact NE-OE2 3.46Å; R70-E132 PolarHBondContact O-N 2.9Å; K130-E132 HydrophobicContact CD-CG 4.46Å; K130-E132 WeakPolarHBondContact CE-OE1 3.35Å; K130-E132 HydrophobicContact CG-CG 4.29Å; K130-E132 IonicContact NZ-OE1 2.64Å; K130-E132 PolarHBondContact NZ-OE1 2.78Å; E132-M134 PolarHBondContact O-N 3.03Å; E132-Y139 HydrophobicContact CB-CE2 3.99Å; E132-Y139 HydrophobicContact CG-CE2 4.48Å; E132-Y139 VanDerWaalsContact CG-OH 3.23Å; E132-Y139 WeakPolarHBondContact CG-OH 3.44Å; E132-Y139 PolarHBondContact OE1-OH 2.81Å; E132-F140 CarbonylContact C-O 3.59Å; E132-F140 WeakPolarHBondContact CA-O 3.31Å; E132-V141 HydrophobicContact CG-CB 4.45Å; E132-V141 HydrophobicContact CG-CG2 3.99Å
133	L	92.9	Very high	93.9	Very high	3 Å²	3	46.2 Å²	46.2	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	109.4	174.6	-82.9	58	0	0	0	107.4	I38 Y60 T66 V69 V131 Y139 F140	I38-L133 HydrophobicContact CD1-CB 4.34Å; I38-L133 HydrophobicContact CD1-CD1 3.39Å; I38-L133 HydrophobicContact CD1-CD2 3.72Å; I38-L133 HydrophobicContact CD1-CG 3.96Å; Y60-L133 HydrophobicContact CD2-CD1 4.21Å; Y60-L133 HydrophobicContact CE2-CD1 3.96Å; Y60-L133 HydrophobicContact CE2-CD2 4.4Å; T66-L133 HydrophobicContact CG2-CD2 3.89Å; T66-L133 HydrophobicContact CG2-CG 3.94Å; V69-L133 HydrophobicContact CG1-CD1 4.4Å; V69-L133 HydrophobicContact CG2-CG 4.48Å; V131-L133 HydrophobicContact CG1-CD1 3.9Å; L133-Y139 WeakPolarHBondContact O-CA 3.47Å; L133-Y139 WeakPolarHBondContact O-CD2 3.43Å; L133-F140 HydrophobicContact CB-CB 4.3Å; L133-F140 PolarHBondContact N-O 2.95Å; L133-F140 PolarHBondContact O-N 2.86Å
134	M	92.5	Very high	94	Very high	81 Å²	81	44.5 Å²	44.5	40%	0.399	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-37	-171.7	-61.5	-172.1	73.2	0	0	112.1	E68 R70 E132 Y139	E68-M134 HydrophobicContact CB-CB 4.37Å; E68-M134 PolarHBondContact O-N 2.93Å; R70-M134 HydrophobicContact CB-CG 4.24Å; R70-M134 HydrophobicContact CB-SD 3.58Å; R70-M134 VanDerWaalsContact CB-SD 3.58Å; E132-M134 PolarHBondContact O-N 3.03Å; M134-Y139 HydrophobicContact CG-CE2 4.43Å
135	Y	92.6	Very high	94	Very high	116 Å²	116	49.2 Å²	49.2	46%	0.455	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	142.1	-175.9	-169.4	-102.1	0	0	0	111.6	T66 D67 E68	T66-Y135 CarbonylContact C-O 3.6Å; T66-Y135 WeakPolarHBondContact CA-O 3.14Å; T66-Y135 PolarHBondContact OG1-O 2.81Å; D67-Y135 HydrophobicContact CB-CD1 3.86Å; D67-Y135 HydrophobicContact CB-CE1 4.46Å; D67-Y135 PolarHBondContact N-O 3.26Å; E68-Y135 HydrophobicContact CG-CD1 4.34Å; E68-Y135 HydrophobicContact CG-CG 4.4Å; E68-Y135 PolarHBondContact N-O 2.92Å; E68-Y135 VanDerWaalsContact N-O 3.11Å; E68-Y135 PolarHBondContact O-N 3.36Å
136	P	91.9	Very high	94	Very high	49 Å²	49	49 Å²	49	32%	0.318	26%	0.255	S	S	.	.	S	Bend	cis	-69.4	159.2	-9.7	31.9	-33.9	0	0	0	111.9	N65	N65-P136 VanDerWaalsContact O-CD 3.26Å; N65-P136 WeakPolarHBondContact O-CD 3.46Å
137	P	89.6	Confident	94.1	Very high	101 Å²	101	46.7 Å²	46.7	66%	0.656	24%	0.242	S	C	*	.	S	Bend	trans	-56.4	149	171.7	-24	34.2	0	0	0	111.6
138	P	90	Very high	94.1	Very high	77 Å²	77	48.8 Å²	48.8	50%	0.5	25%	0.252	S	S	.	.	S	Bend	cis	-86.1	162.8	13.3	32	-32.5	0	0	0	114.7	F140	P138-F140 HydrophobicContact CB-CE2 4.46Å; P138-F140 HydrophobicContact CG-CD2 4.42Å; P138-F140 HydrophobicContact CG-CE1 4.42Å; P138-F140 HydrophobicContact CG-CE2 3.53Å; P138-F140 HydrophobicContact CG-CZ 3.53Å; P138-F140 WeakPolarHBondContact O-CD2 3.21Å
139	Y	91.2	Very high	94	Very high	120 Å²	120	47.3 Å²	47.3	47%	0.471	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-77.4	129.1	177.5	178.1	-98.4	0	0	0	111	E132 L133 M134 V141	E132-Y139 HydrophobicContact CB-CE2 3.99Å; E132-Y139 HydrophobicContact CG-CE2 4.48Å; E132-Y139 VanDerWaalsContact CG-OH 3.23Å; E132-Y139 WeakPolarHBondContact CG-OH 3.44Å; E132-Y139 PolarHBondContact OE1-OH 2.81Å; L133-Y139 WeakPolarHBondContact O-CA 3.47Å; L133-Y139 WeakPolarHBondContact O-CD2 3.43Å; M134-Y139 HydrophobicContact CG-CE2 4.43Å; Y139-V141 HydrophobicContact CE1-CB 4.17Å; Y139-V141 HydrophobicContact CE1-CG1 4.47Å
140	F	92.3	Very high	94	Very high	23 Å²	23	52.6 Å²	52.6	10%	0.101	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.9	175.1	-61.6	-79.4	0	0	0	111	E36 I38 H64 E132 L133 P138	E36-F140 HydrophobicContact CB-CD1 4.22Å; E36-F140 HydrophobicContact CB-CE1 3.9Å; I38-F140 HydrophobicContact CD1-CB 3.29Å; I38-F140 HydrophobicContact CD1-CG 4.22Å; I38-F140 HydrophobicContact CG1-CB 3.82Å; I38-F140 HydrophobicContact CG1-CG 4.49Å; H64-F140 HydrophobicContact CB-CE2 4.29Å; H64-F140 AromaticContact CD2-CE2 3.36Å; H64-F140 WeakPolarHBondContact CD2-CE2 3.45Å; H64-F140 AromaticContact CD2-CZ 3.42Å; H64-F140 VanDerWaalsContact CD2-CZ 3.42Å; H64-F140 WeakPolarHBondContact CD2-CZ 3.39Å; H64-F140 AromaticContact CE1-CZ 3.88Å; H64-F140 AromaticContact CG-CE2 3.7Å; H64-F140 AromaticContact NE2-CE2 3.75Å; H64-F140 AromaticContact NE2-CZ 3.29Å; H64-F140 VanDerWaalsContact NE2-CZ 3.29Å; H64-F140 WeakPolarHBondContact NE2-CZ 3.16Å; E132-F140 CarbonylContact C-O 3.59Å; E132-F140 WeakPolarHBondContact CA-O 3.31Å; L133-F140 HydrophobicContact CB-CB 4.3Å; L133-F140 PolarHBondContact N-O 2.95Å; L133-F140 PolarHBondContact O-N 2.86Å; P138-F140 HydrophobicContact CB-CE2 4.46Å; P138-F140 HydrophobicContact CG-CD2 4.42Å; P138-F140 HydrophobicContact CG-CE1 4.42Å; P138-F140 HydrophobicContact CG-CE2 3.53Å; P138-F140 HydrophobicContact CG-CZ 3.53Å; P138-F140 WeakPolarHBondContact O-CD2 3.21Å
141	V	93.5	Very high	93.9	Very high	56 Å²	56	50.5 Å²	50.5	34%	0.339	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.3	178.2	60.3	0	0	0	0	110.2	I38 K130 V131 E132 Y139	I38-V141 PolarHBondContact N-O 3.32Å; K130-V141 HydrophobicContact CG-CG2 4.34Å; V131-V141 WeakPolarHBondContact O-CA 3.26Å; E132-V141 HydrophobicContact CG-CB 4.45Å; E132-V141 HydrophobicContact CG-CG2 3.99Å; Y139-V141 HydrophobicContact CE1-CB 4.17Å; Y139-V141 HydrophobicContact CE1-CG1 4.47Å
142	G	94	Very high	93.5	Very high	3 Å²	3	54.9 Å²	54.9	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.5	174.5	0	0	0	0	0	110.4	I38 K130 V131	I38-G142 WeakPolarHBondContact O-CA 3.39Å; K130-G142 WeakPolarHBondContact CA-O 3.46Å; V131-G142 PolarHBondContact N-O 2.85Å; V131-G142 PolarHBondContact O-N 3.11Å
143	M	95.2	Very high	92.9	Very high	87 Å²	87	58.9 Å²	58.9	43%	0.429	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.9	173.9	-74.7	-73.1	-62.6	0	0	106.5	L74 F128 K130	L74-M143 HydrophobicContact CD1-CE 3.68Å; L74-M143 HydrophobicContact CD1-SD 3.96Å; F128-M143 HydrophobicContact CB-CE 3.78Å; F128-M143 HydrophobicContact CD1-CE 4.49Å; F128-M143 HydrophobicContact CG-CE 4.28Å; K130-M143 HydrophobicContact CB-SD 3.29Å; K130-M143 WeakPolarHBondContact CB-SD 3.25Å; K130-M143 HydrophobicContact CD-SD 3.81Å; K130-M143 HydrophobicContact CG-CG 4.35Å; K130-M143 HydrophobicContact CG-SD 3.35Å; K130-M143 WeakPolarHBondContact CG-SD 3.44Å
144	G	95.3	Very high	92	Very high	5 Å²	5	62.5 Å²	62.5	5%	0.052	33%	0.326	C	S	.	.			trans	-83.2	177	176.3	0	0	0	0	0	112.3	V40 Q42 F128 C129 G146	V40-G144 VanDerWaalsContact O-CA 3.25Å; V40-G144 WeakPolarHBondContact O-CA 3.39Å; Q42-G144 PolarHBondContact NE2-O 3.1Å; F128-G144 WeakPolarHBondContact CD1-O 3.4Å; C129-G144 PolarHBondContact O-N 3.09Å; G144-G146 VanDerWaalsContact C-N 3.28Å; G144-G146 PolarHBondContact O-N 3.07Å
145	N	94.3	Very high	91	Very high	148 Å²	148	65.7 Å²	65.7	79%	0.791	34%	0.34	S	S	*	.			trans	-74.3	-8	-169.3	-66.4	-22.9	0	0	0	116.1
146	G	95.9	Very high	90	Very high	7 Å²	7	66 Å²	66	7%	0.072	36%	0.357	C	S	.	.			trans	98.3	139.6	-174.9	0	0	0	0	0	113.7	Q42 Y127 G144	Q42-G146 VanDerWaalsContact CD-C 3.48Å; Q42-G146 VanDerWaalsContact CD-CA 3.46Å; Q42-G146 VanDerWaalsContact OE1-N 3.17Å; Y127-G146 CarbonylContact O-C 3.58Å; Y127-G146 VanDerWaalsContact O-CA 3.3Å; Y127-G146 WeakPolarHBondContact O-CA 2.95Å; G144-G146 VanDerWaalsContact C-N 3.28Å; G144-G146 PolarHBondContact O-N 3.07Å
147	T	97.2	Very high	88.9	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.1	174.1	-62.1	0	0	0	0	108.1	Q42 P43 V46 Y127 I149	Q42-T147 PolarHBondContact OE1-OG1 2.8Å; Q42-T147 VanDerWaalsContact OE1-OG1 3.05Å; P43-T147 HydrophobicContact CG-CG2 4.07Å; P43-T147 VanDerWaalsContact O-CA 3.31Å; P43-T147 WeakPolarHBondContact O-CA 3.4Å; P43-T147 VanDerWaalsContact O-CB 3.26Å; P43-T147 WeakPolarHBondContact O-CB 3.3Å; P43-T147 WeakPolarHBondContact O-CG2 3.36Å; P43-T147 PolarHBondContact O-OG1 3.18Å; V46-T147 HydrophobicContact CB-CG2 3.96Å; V46-T147 HydrophobicContact CG2-CG2 3.69Å; Y127-T147 PolarHBondContact N-O 2.92Å; Y127-T147 PolarHBondContact O-N 2.76Å; T147-I149 HydrophobicContact CG2-CG1 4.12Å; T147-I149 PolarHBondContact O-N 2.96Å
148	Q	96.8	Very high	87.9	Confident	47 Å²	47	68.4 Å²	68.4	22%	0.22	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	111	172.6	-175.6	65.7	43.5	0	0	108.9	S44 V45 V46 G125 L126 Y150	S44-Q148 WeakPolarHBondContact O-CB 3.37Å; S44-Q148 PolarHBondContact O-N 3.24Å; V45-Q148 CarbonylContact C-O 3.48Å; V45-Q148 WeakPolarHBondContact CA-O 3.33Å; V45-Q148 HydrophobicContact CG2-CB 4.31Å; V46-Q148 PolarHBondContact N-O 2.96Å; G125-Q148 PolarHBondContact O-NE2 2.87Å; L126-Q148 HydrophobicContact CD1-CB 4.43Å; Q148-Y150 HydrophobicContact CB-CE2 4.3Å; Q148-Y150 HydrophobicContact CG-CD2 4.09Å; Q148-Y150 HydrophobicContact CG-CE1 4.19Å; Q148-Y150 HydrophobicContact CG-CE2 3.41Å; Q148-Y150 VanDerWaalsContact CG-CE2 3.41Å; Q148-Y150 VanDerWaalsContact CG-CZ 3.46Å
149	I	97.1	Very high	87	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.5	176.7	-57.3	-177.9	0	0	0	108.5	V46 A48 A54 F56 I116 L119 T124 G125 Y127 T147 V151	V46-I149 WeakPolarHBondContact O-CA 3.38Å; A48-I149 HydrophobicContact CB-CG2 4.36Å; A54-I149 HydrophobicContact CB-CD1 4.19Å; A54-I149 HydrophobicContact CB-CG2 3.79Å; F56-I149 HydrophobicContact CD1-CD1 4.13Å; F56-I149 HydrophobicContact CE1-CD1 3.84Å; I116-I149 HydrophobicContact CD1-CD1 4.37Å; L119-I149 HydrophobicContact CD1-CG2 4.08Å; T124-I149 WeakPolarHBondContact CA-O 3.06Å; T124-I149 WeakPolarHBondContact CG2-O 3.49Å; G125-I149 PolarHBondContact N-O 3Å; G125-I149 VanDerWaalsContact N-O 3.13Å; G125-I149 PolarHBondContact O-N 2.87Å; Y127-I149 HydrophobicContact CD1-CD1 4.34Å; Y127-I149 HydrophobicContact CD2-CB 3.91Å; Y127-I149 HydrophobicContact CD2-CD1 3.52Å; Y127-I149 HydrophobicContact CD2-CG1 3.68Å; Y127-I149 HydrophobicContact CE2-CB 3.98Å; Y127-I149 HydrophobicContact CE2-CD1 3.97Å; Y127-I149 HydrophobicContact CE2-CG1 4.21Å; Y127-I149 HydrophobicContact CG-CD1 3.74Å; Y127-I149 HydrophobicContact CG-CG1 4.3Å; T147-I149 HydrophobicContact CG2-CG1 4.12Å; T147-I149 PolarHBondContact O-N 2.96Å; I149-V151 HydrophobicContact CG2-CG2 4.31Å
150	Y	96	Very high	86.3	Confident	112 Å²	112	68.8 Å²	68.8	44%	0.439	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.2	172	-68.1	-77.2	0	0	0	109.8	V45 V46 A48 T124 Q148	V45-Y150 HydrophobicContact CG1-CD2 3.67Å; V45-Y150 HydrophobicContact CG1-CE2 3.62Å; V46-Y150 PolarHBondContact O-N 3.34Å; A48-Y150 WeakPolarHBondContact CB-O 3.3Å; A48-Y150 PolarHBondContact N-O 3.4Å; T124-Y150 HydrophobicContact CG2-CD1 3.86Å; T124-Y150 HydrophobicContact CG2-CE1 4.4Å; Q148-Y150 HydrophobicContact CB-CE2 4.3Å; Q148-Y150 HydrophobicContact CG-CD2 4.09Å; Q148-Y150 HydrophobicContact CG-CE1 4.19Å; Q148-Y150 HydrophobicContact CG-CE2 3.41Å; Q148-Y150 VanDerWaalsContact CG-CE2 3.41Å; Q148-Y150 VanDerWaalsContact CG-CZ 3.46Å
151	V	94.2	Very high	85.8	Confident	12 Å²	12	72.8 Å²	72.8	7%	0.073	41%	0.409	C	S	.	.			trans	-105.5	102.6	173.9	-171.6	0	0	0	0	107	A48 L119 R120 T124 I149 D153	A48-V151 HydrophobicContact CB-CB 4.3Å; A48-V151 HydrophobicContact CB-CG1 4.29Å; A48-V151 HydrophobicContact CB-CG2 3.92Å; L119-V151 HydrophobicContact CB-CG1 4.41Å; L119-V151 HydrophobicContact CB-CG2 3.75Å; L119-V151 HydrophobicContact CD1-CG2 4.31Å; R120-V151 VanDerWaalsContact C-CG1 3.46Å; R120-V151 WeakPolarHBondContact O-CB 3.25Å; T124-V151 PolarHBondContact OG1-N 2.83Å; T124-V151 VanDerWaalsContact OG1-N 3.07Å; I149-V151 HydrophobicContact CG2-CG2 4.31Å; V151-D153 PolarHBondContact O-N 2.7Å
152	I	88	Confident	85.4	Confident	92 Å²	92	76.6 Å²	76.6	47%	0.472	42%	0.421	S	S	.	.			trans	-79.8	115.6	173.8	-62.9	178.4	0	0	0	106.4	L47	L47-I152 HydrophobicContact CD1-CD1 3.59Å; L47-I152 HydrophobicContact CD1-CG1 3.8Å; L47-I152 HydrophobicContact CD2-CD1 4.19Å; L47-I152 HydrophobicContact CG-CD1 4.39Å
153	D	80.8	Confident	85.1	Confident	97 Å²	97	80.2 Å²	80.2	52%	0.519	44%	0.439	S	S	.	.			trans	-61.6	125.1	163.3	-84	-16.7	0	0	0	106.6	A121 V151 E155	A121-D153 HydrophobicContact CB-CB 4.46Å; A121-D153 VanDerWaalsContact CB-CG 3.43Å; A121-D153 WeakPolarHBondContact CB-OD1 3.49Å; A121-D153 VanDerWaalsContact CB-OD2 3.22Å; A121-D153 WeakPolarHBondContact CB-OD2 2.93Å; V151-D153 PolarHBondContact O-N 2.7Å; D153-E155 PolarHBondContact O-N 2.9Å
154	P	72.9	Confident	84.8	Confident	80 Å²	80	81.1 Å²	81.1	52%	0.519	45%	0.445	S	S	.	.			trans	-57.3	114.7	172	24.1	-30.5	0	0	0	106.5
155	E	73.3	Confident	84.6	Confident	147 Å²	147	90 Å²	90	69%	0.687	48%	0.477	S	S	*	.			trans	-47.7	132.9	167.9	-93.7	74.4	-156.6	0	0	107.2	D153 C157	D153-E155 PolarHBondContact O-N 2.9Å; E155-C157 PolarHBondContact O-N 2.63Å
156	P	70	Confident	84.6	Confident	124 Å²	124	86.3 Å²	86.3	81%	0.805	46%	0.456	S	S	*	.			trans	-61.5	94.1	177.6	24.9	-32.2	0	0	0	107.1	P158	P156-P158 WeakPolarHBondContact O-CD 3.33Å; P156-P158 VanDerWaalsContact O-N 3.14Å
157	C	68.5	Low	84.4	Confident	106 Å²	106	91 Å²	91	72%	0.716	48%	0.479	S	S	*	.			trans	-58.4	121.1	165	-64.9	0	0	0	0	103.5	E155 D159	E155-C157 PolarHBondContact O-N 2.63Å; C157-D159 PolarHBondContact O-N 3.17Å
158	P	69.8	Low	84.3	Confident	93 Å²	93	93.2 Å²	93.2	60%	0.604	50%	0.498	S	S	*	.			trans	-54.1	125.5	178.4	24.4	-33.2	0	0	0	106.2	P156 S160 L163	P156-P158 WeakPolarHBondContact O-CD 3.33Å; P156-P158 VanDerWaalsContact O-N 3.14Å; P158-S160 PolarHBondContact O-N 3.14Å; P158-L163 HydrophobicContact CB-CD1 3.78Å; P158-L163 HydrophobicContact CG-CD1 3.74Å
159	D	70.6	Confident	84.3	Confident	121 Å²	121	94.1 Å²	94.1	65%	0.647	51%	0.513	S	S	*	.			trans	-45.1	109.7	-176.9	-67.9	-44.4	0	0	0	106.9	C157 D161 F162 L163	C157-D159 PolarHBondContact O-N 3.17Å; D159-D161 CarbonylContact O-C 3.59Å; D159-D161 PolarHBondContact O-N 3.11Å; D159-D161 VanDerWaalsContact O-N 3.09Å; D159-F162 HydrophobicContact CB-CB 3.91Å; D159-F162 PolarHBondContact O-N 3.09Å; D159-L163 PolarHBondContact O-N 3.09Å; D159-L163 VanDerWaalsContact O-N 3.1Å
160	S	76.2	Confident	84.2	Confident	84 Å²	84	98 Å²	98	59%	0.587	54%	0.536	S	S	*	.	H	α-helix	trans	-55.7	-33.7	-176.3	41.1	0	0	0	0	108.8	P158 L164	P158-S160 PolarHBondContact O-N 3.14Å; S160-L164 VanDerWaalsContact O-CB 3.28Å; S160-L164 WeakPolarHBondContact O-CB 3.42Å; S160-L164 WeakPolarHBondContact O-CD1 3.42Å; S160-L164 WeakPolarHBondContact O-CG 3.45Å; S160-L164 PolarHBondContact O-N 2.05Å
161	D	82	Confident	84.2	Confident	108 Å²	108	95 Å²	95	58%	0.578	53%	0.533	S	S	*	.	H	α-helix	trans	-55.6	-51.3	168.7	-73	-3.4	0	0	0	113.6	D159 L163 L164 W165	D159-D161 CarbonylContact O-C 3.59Å; D159-D161 PolarHBondContact O-N 3.11Å; D159-D161 VanDerWaalsContact O-N 3.09Å; D161-L163 PolarHBondContact O-N 3.44Å; D161-L164 WeakPolarHBondContact O-CB 3.3Å; D161-L164 PolarHBondContact O-N 2.78Å; D161-W165 PolarHBondContact O-N 3.08Å
162	F	86.1	Confident	84.3	Confident	136 Å²	136	96.9 Å²	96.9	60%	0.596	55%	0.546	S	S	*	.	H	α-helix	trans	-64	-43.4	-178.5	-176.4	-108.8	0	0	0	112	D159 L164 W165 I166	D159-F162 HydrophobicContact CB-CB 3.91Å; D159-F162 PolarHBondContact O-N 3.09Å; F162-L164 VanDerWaalsContact C-N 3.34Å; F162-L164 PolarHBondContact O-N 2.84Å; F162-W165 PolarHBondContact O-N 3.01Å; F162-I166 HydrophobicContact CD1-CD1 3.6Å; F162-I166 HydrophobicContact CD1-CG1 4.44Å; F162-I166 HydrophobicContact CE1-CD1 3.22Å; F162-I166 HydrophobicContact CE1-CG1 4.15Å; F162-I166 HydrophobicContact CE2-CD1 4.5Å; F162-I166 HydrophobicContact CG-CD1 4.4Å; F162-I166 HydrophobicContact CZ-CD1 3.73Å; F162-I166 HydrophobicContact CZ-CG1 4.24Å; F162-I166 WeakPolarHBondContact O-CG1 2.99Å; F162-I166 PolarHBondContact O-N 2.81Å
163	L	86.3	Confident	84.7	Confident	78 Å²	78	94.4 Å²	94.4	41%	0.408	54%	0.543	S	S	.	.	H	α-helix	trans	-61.6	-42.5	174	-103.9	160.4	0	0	0	111.5	P158 D159 D161 W165 I166 L167	P158-L163 HydrophobicContact CB-CD1 3.78Å; P158-L163 HydrophobicContact CG-CD1 3.74Å; D159-L163 PolarHBondContact O-N 3.09Å; D159-L163 VanDerWaalsContact O-N 3.1Å; D161-L163 PolarHBondContact O-N 3.44Å; L163-W165 VanDerWaalsContact C-N 3.35Å; L163-W165 PolarHBondContact O-N 3.32Å; L163-I166 PolarHBondContact O-N 2.76Å; L163-L167 VanDerWaalsContact O-CG 3.26Å; L163-L167 WeakPolarHBondContact O-CG 2.99Å; L163-L167 PolarHBondContact O-N 3.08Å
164	L	88.6	Confident	85.4	Confident	106 Å²	106	94.9 Å²	94.9	56%	0.555	55%	0.545	S	S	*	.	H	α-helix	trans	-61.6	-41.7	175	-75.1	168.1	0	0	0	111.7	S160 D161 F162 L167 A168	S160-L164 VanDerWaalsContact O-CB 3.28Å; S160-L164 WeakPolarHBondContact O-CB 3.42Å; S160-L164 WeakPolarHBondContact O-CD1 3.42Å; S160-L164 WeakPolarHBondContact O-CG 3.45Å; S160-L164 PolarHBondContact O-N 2.05Å; D161-L164 WeakPolarHBondContact O-CB 3.3Å; D161-L164 PolarHBondContact O-N 2.78Å; F162-L164 VanDerWaalsContact C-N 3.34Å; F162-L164 PolarHBondContact O-N 2.84Å; L164-L167 PolarHBondContact O-N 2.92Å; L164-A168 VanDerWaalsContact O-CB 3.3Å; L164-A168 WeakPolarHBondContact O-CB 3.4Å; L164-A168 PolarHBondContact O-N 3.31Å
165	W	92.7	Very high	86.6	Confident	191 Å²	191	98.4 Å²	98.4	72%	0.723	55%	0.552	S	S	*	*	H	α-helix	trans	-63.6	-41.2	174.5	-79.4	112.4	0	0	0	112.4	D161 F162 L163 A168 A169	D161-W165 PolarHBondContact O-N 3.08Å; F162-W165 PolarHBondContact O-N 3.01Å; L163-W165 VanDerWaalsContact C-N 3.35Å; L163-W165 PolarHBondContact O-N 3.32Å; W165-A168 PolarHBondContact O-N 2.72Å; W165-A169 WeakPolarHBondContact O-CB 3.42Å; W165-A169 PolarHBondContact O-N 3.36Å
166	I	92.7	Very high	87.6	Confident	71 Å²	71	97.7 Å²	97.7	36%	0.364	55%	0.547	S	S	.	.	H	α-helix	trans	-61.5	-48.4	174.2	-69.4	166.7	0	0	0	110.2	F162 L163 A168 A169 V170	F162-I166 HydrophobicContact CD1-CD1 3.6Å; F162-I166 HydrophobicContact CD1-CG1 4.44Å; F162-I166 HydrophobicContact CE1-CD1 3.22Å; F162-I166 HydrophobicContact CE1-CG1 4.15Å; F162-I166 HydrophobicContact CE2-CD1 4.5Å; F162-I166 HydrophobicContact CG-CD1 4.4Å; F162-I166 HydrophobicContact CZ-CD1 3.73Å; F162-I166 HydrophobicContact CZ-CG1 4.24Å; F162-I166 WeakPolarHBondContact O-CG1 2.99Å; F162-I166 PolarHBondContact O-N 2.81Å; L163-I166 PolarHBondContact O-N 2.76Å; I166-A168 VanDerWaalsContact C-N 3.3Å; I166-A168 PolarHBondContact O-N 2.87Å; I166-A169 PolarHBondContact O-N 2.9Å; I166-V170 HydrophobicContact CG2-CG2 4.13Å; I166-V170 WeakPolarHBondContact O-CB 3.47Å; I166-V170 VanDerWaalsContact O-CG2 3.25Å; I166-V170 WeakPolarHBondContact O-CG2 3.3Å; I166-V170 PolarHBondContact O-N 3.29Å
167	L	92.7	Very high	88.9	Confident	106 Å²	106	99.3 Å²	99.3	56%	0.555	54%	0.538	S	S	*	.	H	α-helix	trans	-62.4	-38.3	179.1	-68.4	172.2	0	0	0	111.7	L163 L164 S171	L163-L167 VanDerWaalsContact O-CG 3.26Å; L163-L167 WeakPolarHBondContact O-CG 2.99Å; L163-L167 PolarHBondContact O-N 3.08Å; L164-L167 PolarHBondContact O-N 2.92Å; L167-S171 VanDerWaalsContact O-CB 3.31Å; L167-S171 WeakPolarHBondContact O-CB 3.23Å; L167-S171 PolarHBondContact O-N 2.75Å; L167-S171 PolarHBondContact O-OG 2.63Å
168	A	95.3	Very high	90.2	Very high	47 Å²	47	97.3 Å²	97.3	39%	0.388	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-43	173.7	0	0	0	0	0	112	L164 W165 I166 S171 S172	L164-A168 VanDerWaalsContact O-CB 3.3Å; L164-A168 WeakPolarHBondContact O-CB 3.4Å; L164-A168 PolarHBondContact O-N 3.31Å; W165-A168 PolarHBondContact O-N 2.72Å; I166-A168 VanDerWaalsContact C-N 3.3Å; I166-A168 PolarHBondContact O-N 2.87Å; A168-S171 WeakPolarHBondContact CA-OG 3.36Å; A168-S171 PolarHBondContact O-OG 3.05Å; A168-S172 WeakPolarHBondContact O-CB 3.22Å; A168-S172 PolarHBondContact O-N 2.85Å
169	A	95.6	Very high	91.4	Very high	65 Å²	65	99.9 Å²	99.9	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-66.1	-44.1	176.9	0	0	0	0	0	112.1	W165 I166 S172 G173	W165-A169 WeakPolarHBondContact O-CB 3.42Å; W165-A169 PolarHBondContact O-N 3.36Å; I166-A169 PolarHBondContact O-N 2.9Å; A169-S172 PolarHBondContact O-N 3.13Å; A169-G173 PolarHBondContact O-N 3.1Å
170	V	97	Very high	92.6	Very high	81 Å²	81	99.2 Å²	99.2	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-64.3	-45.9	178	170.8	0	0	0	0	110.8	I166 G173 L174	I166-V170 HydrophobicContact CG2-CG2 4.13Å; I166-V170 WeakPolarHBondContact O-CB 3.47Å; I166-V170 VanDerWaalsContact O-CG2 3.25Å; I166-V170 WeakPolarHBondContact O-CG2 3.3Å; I166-V170 PolarHBondContact O-N 3.29Å; V170-G173 PolarHBondContact O-N 3.16Å; V170-L174 HydrophobicContact CG1-CD1 3.96Å; V170-L174 WeakPolarHBondContact O-CG 3.39Å; V170-L174 PolarHBondContact O-N 2.78Å
171	S	95.7	Very high	93.6	Very high	51 Å²	51	98.6 Å²	98.6	36%	0.357	52%	0.516	S	S	.	.	H	α-helix	trans	-62.9	-45.6	176.9	56	0	0	0	0	111.5	L167 A168 G173 L174 F175	L167-S171 VanDerWaalsContact O-CB 3.31Å; L167-S171 WeakPolarHBondContact O-CB 3.23Å; L167-S171 PolarHBondContact O-N 2.75Å; L167-S171 PolarHBondContact O-OG 2.63Å; A168-S171 WeakPolarHBondContact CA-OG 3.36Å; A168-S171 PolarHBondContact O-OG 3.05Å; S171-G173 PolarHBondContact O-N 2.89Å; S171-L174 PolarHBondContact O-N 2.94Å; S171-F175 WeakPolarHBondContact O-CD2 3.5Å; S171-F175 PolarHBondContact O-N 2.79Å
172	S	96.1	Very high	94.2	Very high	51 Å²	51	97 Å²	97	36%	0.357	51%	0.51	S	S	.	.	H	α-helix	trans	-55.3	-49.2	174	-179.4	0	0	0	0	112	A168 A169 L174 F175 F176	A168-S172 WeakPolarHBondContact O-CB 3.22Å; A168-S172 PolarHBondContact O-N 2.85Å; A169-S172 PolarHBondContact O-N 3.13Å; S172-L174 PolarHBondContact O-N 2.94Å; S172-F175 WeakPolarHBondContact O-CB 3.29Å; S172-F175 PolarHBondContact O-N 2.82Å; S172-F176 WeakPolarHBondContact O-CD2 3.43Å; S172-F176 PolarHBondContact O-N 2.9Å; S172-F176 VanDerWaalsContact OG-CE2 3.31Å; S172-F176 WeakPolarHBondContact OG-CE2 3.34Å
173	G	95.9	Very high	94.6	Very high	39 Å²	39	92.1 Å²	92.1	40%	0.402	50%	0.495	S	S	.	.	H	α-helix	trans	-59.7	-42.8	177.2	0	0	0	0	0	113.3	A169 V170 S171 F176 Y177	A169-G173 PolarHBondContact O-N 3.1Å; V170-G173 PolarHBondContact O-N 3.16Å; S171-G173 PolarHBondContact O-N 2.89Å; G173-F176 PolarHBondContact O-N 2.82Å; G173-Y177 WeakPolarHBondContact O-CB 3.43Å; G173-Y177 PolarHBondContact O-N 2.88Å
174	L	96.3	Very high	95	Very high	107 Å²	107	91.8 Å²	91.8	56%	0.56	50%	0.496	S	S	*	.	H	α-helix	trans	-64.9	-38.5	175.4	-74.4	166.4	0	0	0	112.3	V170 S171 S172 S178	V170-L174 HydrophobicContact CG1-CD1 3.96Å; V170-L174 WeakPolarHBondContact O-CG 3.39Å; V170-L174 PolarHBondContact O-N 2.78Å; S171-L174 PolarHBondContact O-N 2.94Å; S172-L174 PolarHBondContact O-N 2.94Å; L174-S178 WeakPolarHBondContact O-CB 3.26Å; L174-S178 PolarHBondContact O-N 3.19Å; L174-S178 PolarHBondContact O-OG 2.77Å
175	F	96.4	Very high	95.2	Very high	154 Å²	154	89.5 Å²	89.5	68%	0.675	49%	0.489	S	S	*	.	H	α-helix	trans	-62.6	-47.7	174	-81.4	-64.8	0	0	0	111.3	S171 S172 Y177 S178 F179	S171-F175 WeakPolarHBondContact O-CD2 3.5Å; S171-F175 PolarHBondContact O-N 2.79Å; S172-F175 WeakPolarHBondContact O-CB 3.29Å; S172-F175 PolarHBondContact O-N 2.82Å; F175-Y177 PolarHBondContact O-N 2.91Å; F175-S178 PolarHBondContact O-N 2.02Å; F175-F179 WeakPolarHBondContact O-CB 3.48Å; F175-F179 PolarHBondContact O-N 3.04Å
176	F	95.8	Very high	95.1	Very high	132 Å²	132	85 Å²	85	58%	0.579	48%	0.478	S	S	*	.	H	α-helix	trans	-62.2	-44.2	177.2	-77.6	-66.1	0	0	0	112.2	S172 G173 S178 F179 L180	S172-F176 WeakPolarHBondContact O-CD2 3.43Å; S172-F176 PolarHBondContact O-N 2.9Å; S172-F176 VanDerWaalsContact OG-CE2 3.31Å; S172-F176 WeakPolarHBondContact OG-CE2 3.34Å; G173-F176 PolarHBondContact O-N 2.82Å; F176-S178 PolarHBondContact O-N 2.84Å; F176-F179 PolarHBondContact O-N 2.86Å; F176-L180 VanDerWaalsContact O-CG 3.3Å; F176-L180 WeakPolarHBondContact O-CG 3.44Å; F176-L180 PolarHBondContact O-N 3.34Å
177	Y	96	Very high	95	Very high	158 Å²	158	86.6 Å²	86.6	62%	0.62	49%	0.488	S	S	*	.	H	α-helix	trans	-60.2	-46.9	177.1	-179.7	-101.1	0	0	0	112.1	G173 F175 F179 L180 V181	G173-Y177 WeakPolarHBondContact O-CB 3.43Å; G173-Y177 PolarHBondContact O-N 2.88Å; F175-Y177 PolarHBondContact O-N 2.91Å; Y177-F179 VanDerWaalsContact C-N 3.31Å; Y177-F179 PolarHBondContact O-N 2.72Å; Y177-L180 PolarHBondContact O-N 2.75Å; Y177-V181 HydrophobicContact CD1-CG2 4.3Å; Y177-V181 HydrophobicContact CE1-CG2 3.88Å; Y177-V181 HydrophobicContact CE2-CG2 4.14Å; Y177-V181 WeakPolarHBondContact O-CG2 3.5Å; Y177-V181 PolarHBondContact O-N 3.47Å
178	S	96.5	Very high	94.8	Very high	65 Å²	65	90.5 Å²	90.5	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-38.7	178.3	-56.9	0	0	0	0	112.1	L174 F175 F176 T182	L174-S178 WeakPolarHBondContact O-CB 3.26Å; L174-S178 PolarHBondContact O-N 3.19Å; L174-S178 PolarHBondContact O-OG 2.77Å; F175-S178 PolarHBondContact O-N 2.02Å; F176-S178 PolarHBondContact O-N 2.84Å; S178-T182 WeakPolarHBondContact O-CB 3.35Å; S178-T182 PolarHBondContact O-N 3.23Å; S178-T182 PolarHBondContact O-OG1 2.79Å
179	F	96	Very high	94.4	Very high	146 Å²	146	91.7 Å²	91.7	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-64.4	-45.9	174.7	-177.7	-99.9	0	0	0	111.8	F175 F176 Y177 T182 A183	F175-F179 WeakPolarHBondContact O-CB 3.48Å; F175-F179 PolarHBondContact O-N 3.04Å; F176-F179 PolarHBondContact O-N 2.86Å; Y177-F179 VanDerWaalsContact C-N 3.31Å; Y177-F179 PolarHBondContact O-N 2.72Å; F179-T182 PolarHBondContact O-N 2.85Å; F179-A183 WeakPolarHBondContact O-CB 3.39Å; F179-A183 PolarHBondContact O-N 2.97Å
180	L	95.5	Very high	93.8	Very high	107 Å²	107	93.6 Å²	93.6	56%	0.56	50%	0.498	S	S	*	.	H	α-helix	trans	-64	-43.3	178.7	-69.3	176	0	0	0	112.5	F176 Y177 T182 A183 V184	F176-L180 VanDerWaalsContact O-CG 3.3Å; F176-L180 WeakPolarHBondContact O-CG 3.44Å; F176-L180 PolarHBondContact O-N 3.34Å; Y177-L180 PolarHBondContact O-N 2.75Å; L180-T182 VanDerWaalsContact C-N 3.35Å; L180-T182 PolarHBondContact O-N 2.93Å; L180-A183 PolarHBondContact O-N 2.81Å; L180-V184 VanDerWaalsContact O-CG2 3.31Å; L180-V184 WeakPolarHBondContact O-CG2 3.29Å; L180-V184 PolarHBondContact O-N 3.11Å
181	V	95.5	Very high	93.1	Very high	72 Å²	72	97.8 Å²	97.8	44%	0.436	51%	0.51	S	S	.	.	H	α-helix	trans	-62.8	-42.8	176.8	172.2	0	0	0	0	111.1	Y177 V184 S185	Y177-V181 HydrophobicContact CD1-CG2 4.3Å; Y177-V181 HydrophobicContact CE1-CG2 3.88Å; Y177-V181 HydrophobicContact CE2-CG2 4.14Å; Y177-V181 WeakPolarHBondContact O-CG2 3.5Å; Y177-V181 PolarHBondContact O-N 3.47Å; V181-V184 PolarHBondContact O-N 2.92Å; V181-S185 WeakPolarHBondContact O-CB 3.45Å; V181-S185 PolarHBondContact O-N 3.42Å; V181-S185 PolarHBondContact O-OG 2.83Å
182	T	95.7	Very high	92.3	Very high	75 Å²	75	103.7 Å²	103.7	46%	0.46	53%	0.529	S	S	.	.	H	α-helix	trans	-62.8	-45.4	175.4	-55.7	0	0	0	0	111.1	S178 F179 L180 V184 S185 L186	S178-T182 WeakPolarHBondContact O-CB 3.35Å; S178-T182 PolarHBondContact O-N 3.23Å; S178-T182 PolarHBondContact O-OG1 2.79Å; F179-T182 PolarHBondContact O-N 2.85Å; L180-T182 VanDerWaalsContact C-N 3.35Å; L180-T182 PolarHBondContact O-N 2.93Å; T182-V184 PolarHBondContact O-N 3.34Å; T182-S185 WeakPolarHBondContact CA-OG 3.19Å; T182-S185 PolarHBondContact O-N 2.8Å; T182-S185 PolarHBondContact O-OG 3.42Å; T182-L186 HydrophobicContact CG2-CD1 3.93Å; T182-L186 HydrophobicContact CG2-CG 4.37Å; T182-L186 WeakPolarHBondContact O-CB 3.39Å; T182-L186 VanDerWaalsContact O-CG 3.27Å; T182-L186 WeakPolarHBondContact O-CG 3.23Å; T182-L186 PolarHBondContact O-N 2.89Å
183	A	95	Very high	91.3	Very high	32 Å²	32	110 Å²	110	26%	0.264	55%	0.545	S	S	.	.	H	α-helix	trans	-62.4	-43.7	177.3	0	0	0	0	0	112.6	F179 L180 N187	F179-A183 WeakPolarHBondContact O-CB 3.39Å; F179-A183 PolarHBondContact O-N 2.97Å; L180-A183 PolarHBondContact O-N 2.81Å; A183-N187 WeakPolarHBondContact O-CB 3.07Å; A183-N187 VanDerWaalsContact O-CG 3.32Å; A183-N187 PolarHBondContact O-N 2.84Å; A183-N187 PolarHBondContact O-ND2 3Å
184	V	94.8	Very high	89.8	Confident	72 Å²	72	111.1 Å²	111.1	44%	0.436	55%	0.547	S	S	.	.	H	α-helix	trans	-66.2	-42.2	178.8	171.5	0	0	0	0	111.3	L180 V181 T182 N187 R188	L180-V184 VanDerWaalsContact O-CG2 3.31Å; L180-V184 WeakPolarHBondContact O-CG2 3.29Å; L180-V184 PolarHBondContact O-N 3.11Å; V181-V184 PolarHBondContact O-N 2.92Å; T182-V184 PolarHBondContact O-N 3.34Å; V184-N187 PolarHBondContact O-N 2.83Å; V184-R188 WeakPolarHBondContact O-CB 3.32Å; V184-R188 VanDerWaalsContact O-CG 3.3Å; V184-R188 WeakPolarHBondContact O-CG 3.36Å; V184-R188 PolarHBondContact O-N 3.36Å
185	S	92	Very high	88.3	Confident	57 Å²	57	109.9 Å²	109.9	40%	0.399	55%	0.545	S	S	.	.	H	α-helix	trans	-67.9	-40.3	178	59.1	0	0	0	0	112.4	V181 T182 R188 T189	V181-S185 WeakPolarHBondContact O-CB 3.45Å; V181-S185 PolarHBondContact O-N 3.42Å; V181-S185 PolarHBondContact O-OG 2.83Å; T182-S185 WeakPolarHBondContact CA-OG 3.19Å; T182-S185 PolarHBondContact O-N 2.8Å; T182-S185 PolarHBondContact O-OG 3.42Å; S185-R188 PolarHBondContact O-N 3.42Å; S185-T189 WeakPolarHBondContact O-CG2 3.38Å; S185-T189 PolarHBondContact O-N 3.45Å; S185-T189 PolarHBondContact O-OG1 2.81Å; S185-T189 VanDerWaalsContact O-OG1 3.09Å
186	L	91.6	Very high	86.5	Confident	97 Å²	97	109.3 Å²	109.3	51%	0.508	55%	0.548	S	S	.	.	H	α-helix	trans	-62.1	-46.4	172.1	-72.8	174.5	0	0	0	111.7	T182 R188 T189 L190	T182-L186 HydrophobicContact CG2-CD1 3.93Å; T182-L186 HydrophobicContact CG2-CG 4.37Å; T182-L186 WeakPolarHBondContact O-CB 3.39Å; T182-L186 VanDerWaalsContact O-CG 3.27Å; T182-L186 WeakPolarHBondContact O-CG 3.23Å; T182-L186 PolarHBondContact O-N 2.89Å; L186-R188 VanDerWaalsContact C-N 3.34Å; L186-R188 PolarHBondContact O-N 3.24Å; L186-T189 WeakPolarHBondContact CA-OG1 3.25Å; L186-T189 PolarHBondContact O-N 2.77Å; L186-T189 PolarHBondContact O-OG1 3.01Å; L186-L190 WeakPolarHBondContact O-CB 3.29Å; L186-L190 VanDerWaalsContact O-CG 3.3Å; L186-L190 WeakPolarHBondContact O-CG 3.13Å; L186-L190 PolarHBondContact O-N 2.88Å
187	N	90.4	Very high	84.8	Confident	105 Å²	105	108.5 Å²	108.5	56%	0.561	55%	0.554	S	S	*	*	H	α-helix	trans	-62.1	-40	176.2	-77.5	-48.7	0	0	0	112.3	A183 V184 K191	A183-N187 WeakPolarHBondContact O-CB 3.07Å; A183-N187 VanDerWaalsContact O-CG 3.32Å; A183-N187 PolarHBondContact O-N 2.84Å; A183-N187 PolarHBondContact O-ND2 3Å; V184-N187 PolarHBondContact O-N 2.83Å; N187-K191 WeakPolarHBondContact O-CB 3.45Å; N187-K191 PolarHBondContact O-N 2.77Å
188	R	87.8	Confident	83.3	Confident	188 Å²	188	105.9 Å²	105.9	71%	0.709	56%	0.555	S	S	*	*	H	α-helix	trans	-64.2	-41.6	174.6	-76	179.1	-178.3	-168.8	1.8	112.1	V184 S185 L186 K192	V184-R188 WeakPolarHBondContact O-CB 3.32Å; V184-R188 VanDerWaalsContact O-CG 3.3Å; V184-R188 WeakPolarHBondContact O-CG 3.36Å; V184-R188 PolarHBondContact O-N 3.36Å; S185-R188 PolarHBondContact O-N 3.42Å; L186-R188 VanDerWaalsContact C-N 3.34Å; L186-R188 PolarHBondContact O-N 3.24Å; R188-K192 VanDerWaalsContact O-CB 3.3Å; R188-K192 WeakPolarHBondContact O-CB 3.49Å; R188-K192 PolarHBondContact O-N 3.12Å
189	T	86.1	Confident	81.6	Confident	71 Å²	71	105.5 Å²	105.5	44%	0.436	56%	0.561	S	S	.	*	H	α-helix	trans	-70.5	-40.7	178.6	54.1	0	0	0	0	112.2	S185 L186 K192 R193	S185-T189 WeakPolarHBondContact O-CG2 3.38Å; S185-T189 PolarHBondContact O-N 3.45Å; S185-T189 PolarHBondContact O-OG1 2.81Å; S185-T189 VanDerWaalsContact O-OG1 3.09Å; L186-T189 WeakPolarHBondContact CA-OG1 3.25Å; L186-T189 PolarHBondContact O-N 2.77Å; L186-T189 PolarHBondContact O-OG1 3.01Å; T189-K192 PolarHBondContact O-N 3.16Å; T189-R193 WeakPolarHBondContact O-CG 3.42Å; T189-R193 PolarHBondContact O-N 2.64Å
190	L	83.9	Confident	80	Confident	106 Å²	106	103.9 Å²	103.9	56%	0.555	56%	0.563	S	S	*	*	H	α-helix	trans	-63.6	-46.5	172.7	-70.1	176	0	0	0	111.5	L186 K192 R193 S194	L186-L190 WeakPolarHBondContact O-CB 3.29Å; L186-L190 VanDerWaalsContact O-CG 3.3Å; L186-L190 WeakPolarHBondContact O-CG 3.13Å; L186-L190 PolarHBondContact O-N 2.88Å; L190-K192 VanDerWaalsContact C-N 3.26Å; L190-K192 PolarHBondContact O-N 3.49Å; L190-R193 PolarHBondContact O-N 3.1Å; L190-R193 VanDerWaalsContact O-N 3.1Å; L190-S194 PolarHBondContact O-N 3.32Å
191	K	82	Confident	78.4	Confident	169 Å²	169	109 Å²	109	74%	0.735	58%	0.576	S	S	*	*	H	α-helix	trans	-62.7	-31.6	174.9	-173.8	174.7	-178.4	-179.5	0	112.3	N187 P195	N187-K191 WeakPolarHBondContact O-CB 3.45Å; N187-K191 PolarHBondContact O-N 2.77Å; K191-P195 WeakPolarHBondContact O-CD 3.3Å
192	K	79.9	Confident	77	Confident	174 Å²	174	111 Å²	111	76%	0.757	59%	0.588	S	S	*	*	H	α-helix	trans	-72.6	-34.1	173.1	-173.5	176.8	179.3	-177.9	0	112.3	R188 T189 L190 P195	R188-K192 VanDerWaalsContact O-CB 3.3Å; R188-K192 WeakPolarHBondContact O-CB 3.49Å; R188-K192 PolarHBondContact O-N 3.12Å; T189-K192 PolarHBondContact O-N 3.16Å; L190-K192 VanDerWaalsContact C-N 3.26Å; L190-K192 PolarHBondContact O-N 3.49Å; K192-P195 WeakPolarHBondContact O-CD 3.16Å
193	R	74.1	Confident	75.8	Confident	184 Å²	184	117 Å²	117	69%	0.694	61%	0.608	S	S	*	*	H	α-helix	trans	-77.7	-31.5	177.4	-73.5	-178.2	179.8	-180	1.3	113.7	T189 L190 L196 T197	T189-R193 WeakPolarHBondContact O-CG 3.42Å; T189-R193 PolarHBondContact O-N 2.64Å; L190-R193 PolarHBondContact O-N 3.1Å; L190-R193 VanDerWaalsContact O-N 3.1Å; R193-L196 PolarHBondContact O-N 2.87Å; R193-T197 PolarHBondContact O-N 3.18Å; R193-T197 PolarHBondContact O-OG1 3.31Å
194	S	65.5	Low	74.3	Confident	63 Å²	63	123.4 Å²	123.4	44%	0.441	64%	0.635	S	S	.	*	H	α-helix	trans	-56.7	-49.8	179.2	172.3	0	0	0	0	114.9	L190 L196 T197 T198	L190-S194 PolarHBondContact O-N 3.32Å; S194-L196 PolarHBondContact O-N 3.21Å; S194-T197 PolarHBondContact O-N 2.96Å; S194-T197 VanDerWaalsContact O-N 3.1Å; S194-T197 PolarHBondContact O-OG1 3.11Å; S194-T198 PolarHBondContact O-N 3.25Å; S194-T198 PolarHBondContact O-OG1 3.26Å
195	P	63.6	Low	72.7	Confident	80 Å²	80	125.3 Å²	125.3	52%	0.519	65%	0.648	S	S	.	*	H	α-helix	trans	-66	-27.6	-179.6	22.4	-31.1	0	0	0	112.6	K191 K192 T197	K191-P195 WeakPolarHBondContact O-CD 3.3Å; K192-P195 WeakPolarHBondContact O-CD 3.16Å; P195-T197 VanDerWaalsContact C-N 3.29Å; P195-T197 PolarHBondContact O-N 2.8Å
196	L	59.3	Low	71.3	Confident	142 Å²	142	128.4 Å²	128.4	74%	0.743	67%	0.667	S	S	*	*	H	α-helix	trans	-71.3	-25.8	176.9	-160.5	72.5	0	0	0	112.2	R193 S194	R193-L196 PolarHBondContact O-N 2.87Å; S194-L196 PolarHBondContact O-N 3.21Å
197	T	59.8	Low	69.9	Low	115 Å²	115	130.4 Å²	130.4	71%	0.706	68%	0.684	S	S	*	*	H	α-helix	trans	-90.8	-28.7	-177.6	35.3	0	0	0	0	113.7	R193 S194 P195	R193-T197 PolarHBondContact O-N 3.18Å; R193-T197 PolarHBondContact O-OG1 3.31Å; S194-T197 PolarHBondContact O-N 2.96Å; S194-T197 VanDerWaalsContact O-N 3.1Å; S194-T197 PolarHBondContact O-OG1 3.11Å; P195-T197 VanDerWaalsContact C-N 3.29Å; P195-T197 PolarHBondContact O-N 2.8Å
198	T	63.7	Low	68.6	Low	104 Å²	104	133.6 Å²	133.6	64%	0.638	70%	0.695	S	S	*	*	H	α-helix	trans	-97.3	-11.8	-176.4	51.3	0	0	0	0	115.4	S194	S194-T198 PolarHBondContact O-N 3.25Å; S194-T198 PolarHBondContact O-OG1 3.26Å
199	G	60.7	Low	67	Low	57 Å²	57	130 Å²	130	59%	0.588	70%	0.696	S	S	*	*	S	Bend	trans	-103.3	-15.9	-164.2	0	0	0	0	0	118.4	Y201	G199-Y201 VanDerWaalsContact C-N 3.32Å; G199-Y201 PolarHBondContact O-N 3.28Å; G199-Y201 VanDerWaalsContact O-N 3.16Å
200	V	63.8	Low	65.4	Low	112 Å²	112	135.9 Å²	135.9	68%	0.679	72%	0.718	S	S	*	*			trans	-94.1	60	-173.9	-164.9	0	0	0	0	111	V202	V200-V202 HydrophobicContact CG1-CG2 3.88Å
201	Y	60.7	Low	63.8	Low	214 Å²	214	136.7 Å²	136.7	84%	0.839	73%	0.732	S	S	*	*			trans	-96	89	156.8	-79.6	-84.1	0	0	0	107.2	G199 K203	G199-Y201 VanDerWaalsContact C-N 3.32Å; G199-Y201 PolarHBondContact O-N 3.28Å; G199-Y201 VanDerWaalsContact O-N 3.16Å; Y201-K203 PolarHBondContact O-N 3.4Å; Y201-K203 VanDerWaalsContact O-N 3.09Å
202	V	67.2	Low	62.4	Low	114 Å²	114	137.5 Å²	137.5	69%	0.691	74%	0.738	S	S	*	*			trans	-64.9	111.2	170.7	-154.2	0	0	0	0	106.1	V200 M204	V200-V202 HydrophobicContact CG1-CG2 3.88Å; V202-M204 PolarHBondContact O-N 3.32Å
203	K	68.8	Low	60.9	Low	200 Å²	200	138 Å²	138	87%	0.87	74%	0.74	S	S	*	*			trans	-60.3	103.8	165.9	-102.2	-178.3	175.6	177.8	0	106.4	Y201	Y201-K203 PolarHBondContact O-N 3.4Å; Y201-K203 VanDerWaalsContact O-N 3.09Å
204	M	65	Low	59.8	Low	168 Å²	168	137.6 Å²	137.6	83%	0.828	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-62.6	123.9	168.6	-68.7	164.5	-171.5	0	0	106.8	V202	V202-M204 PolarHBondContact O-N 3.32Å
205	P	61.6	Low	59.2	Low	111 Å²	111	143.3 Å²	143.3	72%	0.721	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-59.3	137	175.1	22.8	-29.6	0	0	0	108.3	T207	P205-T207 PolarHBondContact O-N 3.34Å
206	P	61.6	Low	58.6	Low	122 Å²	122	146.7 Å²	146.7	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-57.3	128.3	175.4	-16.9	28.9	0	0	0	108.4	E208	P206-E208 PolarHBondContact O-N 3.27Å
207	T	62.1	Low	58.5	Low	139 Å²	139	145 Å²	145	85%	0.853	77%	0.77	S	S	*	*			trans	-57	111.4	172.3	-51.9	0	0	0	0	108.1	P205	P205-T207 PolarHBondContact O-N 3.34Å
208	E	62.4	Low	58.6	Low	173 Å²	173	149.8 Å²	149.8	81%	0.808	78%	0.777	S	S	*	*			trans	-60.7	131.6	172.2	-77	-179.1	163.2	0	0	108.5	P206 E210	P206-E208 PolarHBondContact O-N 3.27Å; E208-E210 PolarHBondContact O-N 3.45Å
209	P	54.8	Low	58.5	Low	111 Å²	111	154.5 Å²	154.5	72%	0.721	79%	0.789	S	S	*	*			trans	-65.4	132.4	179.4	26.4	-31.6	0	0	0	108.9	C211	P209-C211 VanDerWaalsContact C-N 3.32Å; P209-C211 PolarHBondContact O-N 3.23Å
210	E	53.4	Low	58.8	Low	195 Å²	195	159 Å²	159	91%	0.911	80%	0.797	S	S	*	*			trans	-56.6	94.3	171	-64.4	-169.7	142.9	0	0	109.4	E208 E212	E208-E210 PolarHBondContact O-N 3.45Å; E210-E212 PolarHBondContact O-N 2.7Å; E210-E212 VanDerWaalsContact O-N 3.17Å
211	C	50.3	Low	58.7	Low	123 Å²	123	159.2 Å²	159.2	83%	0.831	80%	0.802	S	S	*	*			trans	-68.6	112	163.3	-81	0	0	0	0	107	P209 K213	P209-C211 VanDerWaalsContact C-N 3.32Å; P209-C211 PolarHBondContact O-N 3.23Å; C211-K213 PolarHBondContact O-N 3.44Å
212	E	52.2	Low	58.9	Low	186 Å²	186	157.1 Å²	157.1	87%	0.869	80%	0.803	S	S	*	*			trans	-40.5	127.4	-173.9	-64.4	-178.7	126.7	0	0	113.2	E210 Q214	E210-E212 PolarHBondContact O-N 2.7Å; E210-E212 VanDerWaalsContact O-N 3.17Å; E212-Q214 PolarHBondContact O-N 3.04Å
213	K	48	Very low	58.7	Low	184 Å²	184	162.7 Å²	162.7	80%	0.8	83%	0.829	S	S	*	*			trans	-56.7	103.9	165.7	-73.5	172.8	-179.9	166	0	108.7	C211 F215	C211-K213 PolarHBondContact O-N 3.44Å; K213-F215 VanDerWaalsContact C-N 3.33Å; K213-F215 PolarHBondContact O-N 3.4Å
214	Q	50.4	Low	58.2	Low	176 Å²	176	160.8 Å²	160.8	82%	0.822	83%	0.827	S	S	*	*			trans	-67.8	94	166.6	-171.4	175.2	-17.4	0	0	108.5	E212 Q216	E212-Q214 PolarHBondContact O-N 3.04Å; Q214-Q216 PolarHBondContact O-N 3.43Å
215	F	53.1	Low	57.8	Low	183 Å²	183	160.4 Å²	160.4	80%	0.803	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-58.2	117.3	169.7	-87.9	-98.3	0	0	0	109.4	K213	K213-F215 VanDerWaalsContact C-N 3.33Å; K213-F215 PolarHBondContact O-N 3.4Å
216	Q	51.6	Low	57.6	Low	151 Å²	151	163.2 Å²	163.2	71%	0.706	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-91.3	119.2	163.2	-71.3	-159.2	-10.3	0	0	109.1	Q214 Y218	Q214-Q216 PolarHBondContact O-N 3.43Å; Q216-Y218 PolarHBondContact O-N 3.37Å
217	P	56.6	Low	57.4	Low	107 Å²	107	165.6 Å²	165.6	70%	0.695	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-74.6	125.4	178.5	28.1	-30.6	0	0	0	110.4	F219	P217-F219 PolarHBondContact O-N 3.39Å
218	Y	62.8	Low	57.1	Low	216 Å²	216	167.3 Å²	167.3	85%	0.847	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-73.6	123.3	173.4	-49.6	-82.8	0	0	0	109.3	Q216 I220	Q216-Y218 PolarHBondContact O-N 3.37Å; Y218-I220 PolarHBondContact O-N 3.12Å
219	F	61.4	Low	56.7	Low	203 Å²	203	166.9 Å²	166.9	89%	0.89	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-71	118.4	175	-78.8	-92	0	0	0	110.1	P217 P221	P217-F219 PolarHBondContact O-N 3.39Å; F219-P221 WeakPolarHBondContact O-CD 3.45Å
220	I	67	Low	56.9	Low	150 Å²	150	170.9 Å²	170.9	77%	0.769	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-86.5	116.3	172	-58.9	165.4	0	0	0	106.9	Y218	Y218-I220 PolarHBondContact O-N 3.12Å
221	P	62.5	Low	57.1	Low	118 Å²	118	169 Å²	169	77%	0.766	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-67.9	135.3	177.2	26.8	-31.2	0	0	0	110.2	F219	F219-P221 WeakPolarHBondContact O-CD 3.45Å
222	I	64.9	Low	57.7	Low	169 Å²	169	172.8 Å²	172.8	87%	0.867	84%	0.839	S	S	*	*			trans	-95.6	107.9	174.8	-50.6	172.9	0	0	0	107.4
223	N	61.9	Low	58.2	Low	231 Å²	231	171.6 Å²	171.6	100%	1.235	84%	0.836	S	S	*	*			trans	48.4	0	161.7	-146	81.1	0	0	0	119.6

Retrieved 223 of 223 residues in 129.3 ms (Link to these results)

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