G4VFY7_SCHMA Loading...

Pepsin A

AlphaFold DB , UniProt , Accession G4VFY7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 401 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.2	Very low	47.3	Very low	221 Å²	221	161.5 Å²	161.5	100%	1.089	80%	0.802	S	S	*	*				0	101.5	0	-93.1	165	63.7	0	0	108.5	L3	M1-L3 PolarHBondContact O-N 3.02Å
2	I	46.7	Very low	47.4	Very low	160 Å²	160	155.8 Å²	155.8	82%	0.821	79%	0.786	S	S	*	*			trans	-87.6	103.4	176.3	-62.5	171.2	0	0	0	106.4	F4	I2-F4 PolarHBondContact O-N 2.92Å
3	L	46	Very low	47.2	Very low	142 Å²	142	158.8 Å²	158.8	74%	0.743	79%	0.791	S	S	*	*			trans	-76.4	106.9	175.8	-89.1	95.3	0	0	0	109.6	M1 K5	M1-L3 PolarHBondContact O-N 3.02Å; L3-K5 PolarHBondContact O-N 3.45Å
4	F	49.3	Very low	47	Very low	185 Å²	185	159.3 Å²	159.3	81%	0.811	79%	0.787	S	S	*	*			trans	-68.4	107	163	-92.9	-95	0	0	0	109	I2 V6	I2-F4 PolarHBondContact O-N 2.92Å; F4-V6 PolarHBondContact O-N 2.86Å
5	K	51.3	Low	46.8	Very low	178 Å²	178	156.5 Å²	156.5	77%	0.774	78%	0.782	S	S	*	*			trans	-75.7	98.3	166.3	-76.2	-176.5	176.3	-178.4	0	108.3	L3 F7	L3-K5 PolarHBondContact O-N 3.45Å; K5-F7 PolarHBondContact O-N 3.06Å
6	V	52.4	Low	46.7	Very low	120 Å²	120	156.8 Å²	156.8	73%	0.727	78%	0.78	S	S	*	*			trans	-73.3	106.1	168.9	179.4	0	0	0	0	107.7	F4 I8	F4-V6 PolarHBondContact O-N 2.86Å; V6-I8 HydrophobicContact CG1-CG1 4.08Å; V6-I8 PolarHBondContact O-N 3.25Å
7	F	46	Very low	47.1	Very low	182 Å²	182	153.2 Å²	153.2	80%	0.798	77%	0.774	S	S	*	*			trans	-77.3	101.8	167	-88.9	-91.6	0	0	0	108.3	K5 L9	K5-F7 PolarHBondContact O-N 3.06Å; F7-L9 PolarHBondContact O-N 2.89Å
8	I	46.3	Very low	47.8	Very low	137 Å²	137	152.8 Å²	152.8	70%	0.703	77%	0.769	S	S	*	*			trans	-76.4	101	166.4	-60.9	177.2	0	0	0	106.6	V6 L10	V6-I8 HydrophobicContact CG1-CG1 4.08Å; V6-I8 PolarHBondContact O-N 3.25Å; I8-L10 HydrophobicContact CG2-CG 4.42Å; I8-L10 PolarHBondContact O-N 3.15Å
9	L	44.3	Very low	49.5	Very low	154 Å²	154	146.5 Å²	146.5	81%	0.806	74%	0.74	S	S	*	*			trans	-66.7	95.3	166.2	-89.1	149.5	0	0	0	108.2	F7 L11	F7-L9 PolarHBondContact O-N 2.89Å; L9-L11 VanDerWaalsContact C-N 3.28Å; L9-L11 PolarHBondContact O-N 2.79Å
10	L	44.7	Very low	51.3	Low	157 Å²	157	141.5 Å²	141.5	82%	0.822	72%	0.715	S	S	*	*			trans	-70.9	89.6	162.1	-75.6	164.3	0	0	0	107.4	I8 P12	I8-L10 HydrophobicContact CG2-CG 4.42Å; I8-L10 PolarHBondContact O-N 3.15Å; L10-P12 WeakPolarHBondContact O-CD 3.26Å
11	L	44.9	Very low	53.2	Low	140 Å²	140	135 Å²	135	73%	0.733	68%	0.682	S	S	*	*			trans	-63.9	119.3	162	-84.7	158.2	0	0	0	107	L9 F13	L9-L11 VanDerWaalsContact C-N 3.28Å; L9-L11 PolarHBondContact O-N 2.79Å; L11-F13 PolarHBondContact O-N 2.87Å
12	P	48.4	Very low	55.3	Low	94 Å²	94	129.6 Å²	129.6	61%	0.61	65%	0.65	S	S	*	*			trans	-65.7	110.2	173.5	26.9	-29.6	0	0	0	106.6	L10 F14	L10-P12 WeakPolarHBondContact O-CD 3.26Å; P12-F14 HydrophobicContact CB-CD2 4.02Å; P12-F14 HydrophobicContact CB-CE2 4Å; P12-F14 HydrophobicContact CG-CD2 4.08Å; P12-F14 HydrophobicContact CG-CE2 3.94Å; P12-F14 PolarHBondContact O-N 3.17Å
13	F	45.5	Very low	57.5	Low	194 Å²	194	122.7 Å²	122.7	85%	0.851	61%	0.614	S	S	*	*			trans	-62.3	86.6	159.8	-87.2	-93.3	0	0	0	106.6	L11 V15	L11-F13 PolarHBondContact O-N 2.87Å; F13-V15 PolarHBondContact O-N 2.67Å
14	F	44.4	Very low	59.6	Low	166 Å²	166	121.4 Å²	121.4	73%	0.728	60%	0.599	S	S	*	*			trans	-67.5	84.6	155.4	-80.8	-84.7	0	0	0	105.8	P12 H16	P12-F14 HydrophobicContact CB-CD2 4.02Å; P12-F14 HydrophobicContact CB-CE2 4Å; P12-F14 HydrophobicContact CG-CD2 4.08Å; P12-F14 HydrophobicContact CG-CE2 3.94Å; P12-F14 PolarHBondContact O-N 3.17Å; F14-H16 PolarHBondContact O-N 3.29Å
15	V	43.6	Very low	61.5	Low	118 Å²	118	112.9 Å²	112.9	72%	0.715	56%	0.563	S	S	*	*			trans	-60.6	95.8	155.5	-178.2	0	0	0	0	103.9	F13 S17	F13-V15 PolarHBondContact O-N 2.67Å; V15-S17 PolarHBondContact O-N 2.03Å
16	H	45	Very low	63.1	Low	160 Å²	160	108.7 Å²	108.7	74%	0.741	54%	0.543	S	S	*	.			trans	-62.1	97.9	160.4	-80	65	0	0	0	103.8	F14 E18	F14-H16 PolarHBondContact O-N 3.29Å; H16-E18 PolarHBondContact O-N 2.7Å; H16-E18 VanDerWaalsContact O-N 3.09Å
17	S	53	Low	64.3	Low	97 Å²	97	104 Å²	104	68%	0.678	52%	0.515	S	S	*	.			trans	-63.9	111.3	160.1	64.4	0	0	0	0	104.3	V15 S19	V15-S17 PolarHBondContact O-N 2.03Å; S17-S19 PolarHBondContact O-N 3.33Å
18	E	61	Low	65.3	Low	146 Å²	146	96.3 Å²	96.3	68%	0.682	48%	0.484	S	S	*	.			trans	-48.8	119.2	169.5	-67.4	-178.9	159.7	0	0	107.1	H16 I20 D213	H16-E18 PolarHBondContact O-N 2.7Å; H16-E18 VanDerWaalsContact O-N 3.09Å; E18-I20 HydrophobicContact CB-CB 4.48Å; E18-I20 HydrophobicContact CB-CD1 3.99Å; E18-I20 HydrophobicContact CB-CG1 4.11Å; E18-I20 PolarHBondContact O-N 2.97Å; E18-D213 VanDerWaalsContact CA-OD2 3.23Å; E18-D213 WeakPolarHBondContact CA-OD2 2.99Å
19	S	80.3	Confident	66.2	Low	32 Å²	32	94.4 Å²	94.4	22%	0.224	47%	0.471	C	S	.	.			trans	-79.9	54.1	177.5	66.8	0	0	0	0	109.7	S17 V212 D213	S17-S19 PolarHBondContact O-N 3.33Å; S19-V212 VanDerWaalsContact OG-C 3.26Å; S19-V212 WeakPolarHBondContact OG-CA 3.19Å; S19-D213 WeakPolarHBondContact CB-OD1 3.37Å; S19-D213 PolarHBondContact N-OD1 2.87Å; S19-D213 PolarHBondContact N-OD2 3.22Å; S19-D213 PolarHBondContact OG-N 3.41Å; S19-D213 PolarHBondContact OG-OD1 2.89Å
20	I	85.6	Confident	66.6	Low	46 Å²	46	88.2 Å²	88.2	24%	0.236	44%	0.438	C	S	.	.			trans	-97.5	121.9	175.7	-70.4	174.6	0	0	0	107.2	E18 R22 M234	E18-I20 HydrophobicContact CB-CB 4.48Å; E18-I20 HydrophobicContact CB-CD1 3.99Å; E18-I20 HydrophobicContact CB-CG1 4.11Å; E18-I20 PolarHBondContact O-N 2.97Å; I20-R22 HydrophobicContact CG2-CG 4.37Å; I20-M234 HydrophobicContact CB-CE 4.33Å; I20-M234 HydrophobicContact CD1-CE 3.9Å; I20-M234 HydrophobicContact CG1-CE 4.21Å; I20-M234 HydrophobicContact CG2-CE 3.23Å; I20-M234 HydrophobicContact CG2-CG 4.17Å; I20-M234 HydrophobicContact CG2-SD 4.49Å
21	T	91.3	Very high	66.5	Low	5 Å²	5	86.6 Å²	86.6	3%	0.031	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.5	173.4	-62.3	0	0	0	0	109.9	I23 I156 S158 L159 M234 F235	T21-I23 HydrophobicContact CG2-CD1 3.95Å; T21-I23 HydrophobicContact CG2-CG1 4.4Å; T21-I156 WeakPolarHBondContact CG2-O 3.22Å; T21-S158 PolarHBondContact OG1-OG 2.81Å; T21-L159 HydrophobicContact CG2-CD1 4.42Å; T21-L159 HydrophobicContact CG2-CG 4.02Å; T21-L159 WeakPolarHBondContact OG1-CD2 3.45Å; T21-L159 VanDerWaalsContact OG1-CG 3.29Å; T21-L159 WeakPolarHBondContact OG1-CG 3.44Å; T21-M234 WeakPolarHBondContact O-CA 3.28Å; T21-F235 PolarHBondContact N-O 3.01Å; T21-F235 PolarHBondContact O-N 2.74Å
22	R	92.1	Very high	66.1	Low	109 Å²	109	87.4 Å²	87.4	41%	0.411	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127	177.6	-61.7	177.5	179.9	140.9	-0.2	109.3	I20 E232 M234 D239	I20-R22 HydrophobicContact CG2-CG 4.37Å; R22-E232 HydrophobicContact CB-CG 4.39Å; R22-E232 IonicContact NE-OE1 3.54Å; R22-M234 HydrophobicContact CG-CG 4.18Å; R22-D239 IonicContact CZ-OD2 3.33Å; R22-D239 IonicContact NE-OD2 3.65Å; R22-D239 IonicContact NH2-OD2 2.87Å
23	I	91.8	Very high	65.5	Low	15 Å²	15	89.3 Å²	89.3	8%	0.077	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.3	174.5	-53.9	-61.3	0	0	0	108.2	T21 L25 F94 I156 E232 I233 F235	T21-I23 HydrophobicContact CG2-CD1 3.95Å; T21-I23 HydrophobicContact CG2-CG1 4.4Å; I23-L25 PolarHBondContact O-N 3.36Å; I23-F94 HydrophobicContact CG2-CE2 4.21Å; I23-F94 HydrophobicContact CG2-CZ 4.13Å; I23-I156 HydrophobicContact CD1-CG2 3.64Å; I23-I156 HydrophobicContact CG1-CG2 3.53Å; I23-E232 WeakPolarHBondContact O-CA 3.37Å; I23-I233 HydrophobicContact CB-CG2 3.75Å; I23-I233 HydrophobicContact CG1-CG2 4.43Å; I23-I233 HydrophobicContact CG2-CG2 4.4Å; I23-I233 PolarHBondContact N-O 2.81Å; I23-I233 PolarHBondContact O-N 2.93Å; I23-F235 HydrophobicContact CG1-CD2 4.45Å; I23-F235 HydrophobicContact CG1-CE2 3.97Å
24	R	90.1	Very high	64.5	Low	114 Å²	114	84.3 Å²	84.3	43%	0.43	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	132.6	171.4	178.4	177.4	178.3	166.6	1.1	109	Y26 T228 T229	R24-Y26 HydrophobicContact CG-CE1 4.5Å; R24-T228 PolarHBondContact NH1-O 3.41Å; R24-T228 VanDerWaalsContact NH1-O 3.08Å; R24-T228 PolarHBondContact NH2-O 2.79Å; R24-T229 HydrophobicContact CG-CG2 3.84Å
25	L	90.2	Very high	63.9	Low	7 Å²	7	83.2 Å²	83.2	4%	0.037	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.2	169.6	-55.7	176.7	0	0	0	109.5	I23 Y77 Y78 F94 L221 G231 I233	I23-L25 PolarHBondContact O-N 3.36Å; L25-Y77 HydrophobicContact CB-CD1 4.49Å; L25-Y78 CarbonylContact C-O 3.55Å; L25-Y78 WeakPolarHBondContact CA-O 3.11Å; L25-F94 HydrophobicContact CD2-CD2 3.57Å; L25-F94 HydrophobicContact CD2-CE2 3.72Å; L25-L221 HydrophobicContact CD1-CD2 3.76Å; L25-G231 PolarHBondContact N-O 2.97Å; L25-G231 PolarHBondContact O-N 2.82Å; L25-I233 HydrophobicContact CD2-CG2 4.01Å; L25-I233 HydrophobicContact CG-CG2 4.48Å
26	Y	84.1	Confident	63	Low	90 Å²	90	86 Å²	86	35%	0.353	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	138.2	171.7	-56.6	-81	0	0	0	108.5	R24 Y77 Y78	R24-Y26 HydrophobicContact CG-CE1 4.5Å; Y26-Y77 WeakPolarHBondContact O-CA 2.95Å; Y26-Y78 HydrophobicContact CD2-CD2 4.35Å; Y26-Y78 HydrophobicContact CD2-CE2 4.07Å; Y26-Y78 HydrophobicContact CG-CE2 4.29Å; Y26-Y78 PolarHBondContact N-O 2.79Å; Y26-Y78 PolarHBondContact O-N 2.81Å
27	S	77.6	Confident	62	Low	21 Å²	21	82.5 Å²	82.5	15%	0.147	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	130.2	167.2	55.6	0	0	0	0	109.1	E76 S230	S27-E76 VanDerWaalsContact CA-O 3.25Å; S27-E76 WeakPolarHBondContact CA-O 3.37Å; S27-S230 PolarHBondContact N-OG 2.84Å; S27-S230 WeakPolarHBondContact OG-CB 3.03Å; S27-S230 PolarHBondContact OG-OG 3.34Å
28	S	68	Low	60.8	Low	20 Å²	20	85.7 Å²	85.7	14%	0.14	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	152.1	167.6	-171.4	0	0	0	0	112.1	I75 E76 H181	S28-I75 VanDerWaalsContact O-CA 3.26Å; S28-I75 WeakPolarHBondContact O-CA 3.48Å; S28-E76 PolarHBondContact N-O 3.02Å; S28-E76 VanDerWaalsContact N-O 3.16Å; S28-E76 PolarHBondContact O-N 3.22Å; S28-E76 VanDerWaalsContact O-N 3.09Å; S28-H181 PolarHBondContact OG-CD2 3.17Å; S28-H181 PolarHBondContact OG-NE2 2.81Å
29	H	64.6	Low	59.1	Low	97 Å²	97	86 Å²	86	45%	0.449	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	127.2	168.1	-70.8	-69.6	0	0	0	111.7	N74 I75	H29-N74 CarbonylContact C-O 3.53Å; H29-N74 WeakPolarHBondContact CA-O 3.45Å; H29-N74 HydrophobicContact CB-CB 4.33Å; H29-I75 WeakPolarHBondContact CE1-CG1 3.46Å
30	H	52.2	Low	56.6	Low	24 Å²	24	94 Å²	94	11%	0.111	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-55.1	146	165.9	-82.6	-70.8	0	0	0	115.1	N71 N74 N179 F180	H30-N71 PolarHBondContact CD2-ND2 3.11Å; H30-N71 VanDerWaalsContact CD2-ND2 3.3Å; H30-N71 PolarHBondContact NE2-ND2 2.94Å; H30-N74 HydrophobicContact CB-CB 3.88Å; H30-N74 PolarHBondContact N-O 2.95Å; H30-N74 PolarHBondContact O-ND2 3.27Å; H30-N179 PolarHBondContact ND1-O 2.76Å; H30-F180 AromaticContact CE1-CD1 2.85Å; H30-F180 WeakPolarHBondContact CE1-CD1 3.44Å; H30-F180 AromaticContact CE1-CE1 3.19Å; H30-F180 WeakPolarHBondContact CE1-CE1 2.92Å; H30-F180 AromaticContact CE1-CG 3.58Å; H30-F180 AromaticContact NE2-CD1 3.09Å; H30-F180 WeakPolarHBondContact NE2-CD1 3.43Å; H30-F180 AromaticContact NE2-CE1 3.01Å; H30-F180 WeakPolarHBondContact NE2-CE1 3.33Å
31	L	43.5	Very low	53.9	Low	124 Å²	124	100.1 Å²	100.1	65%	0.649	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-68.4	136.1	164.5	-64.7	168.7	0	0	0	110.9
32	N	34.9	Very low	51	Low	156 Å²	156	108.6 Å²	108.6	83%	0.834	51%	0.512	S	S	*	.			trans	-38	129.5	-173.3	-89.4	-34.2	0	0	0	116.2
33	L	36.5	Very low	48.3	Very low	134 Å²	134	108.1 Å²	108.1	70%	0.702	52%	0.517	S	S	*	.			trans	-93.4	126.4	166.9	-80.2	168	0	0	0	111.7
34	S	25.8	Very low	45.6	Very low	89 Å²	89	114 Å²	114	62%	0.622	55%	0.549	S	S	*	.			trans	-94.6	115.7	140.8	53.3	0	0	0	0	107.5	Y36	S34-Y36 PolarHBondContact O-N 3.19Å
35	Y	30.5	Very low	43.5	Very low	144 Å²	144	111.3 Å²	111.3	57%	0.565	55%	0.547	S	S	*	.			trans	-54.7	130.7	178.6	-170.5	-93.2	0	0	0	111.4	N309	Y35-N309 WeakPolarHBondContact CE1-ND2 3.08Å
36	Y	24.4	Very low	41.3	Very low	175 Å²	175	111.7 Å²	111.7	69%	0.686	55%	0.549	S	S	*	.			trans	-117.4	127.8	164.7	-82.5	-89	0	0	0	108.5	S34	S34-Y36 PolarHBondContact O-N 3.19Å
37	P	25.4	Very low	39.4	Very low	88 Å²	88	113 Å²	113	57%	0.571	56%	0.557	S	S	*	*			trans	-61.6	141.7	176.4	24.1	-31.4	0	0	0	110.6	N39	P37-N39 PolarHBondContact O-N 3.39Å
38	L	27.7	Very low	38	Very low	163 Å²	163	118.9 Å²	118.9	85%	0.853	58%	0.582	S	S	*	*	S	Bend	trans	-59.1	79.4	175.5	-73.5	161.5	0	0	0	111.1
39	N	25.1	Very low	36.9	Very low	153 Å²	153	121.2 Å²	121.2	82%	0.818	59%	0.59	S	S	*	*			trans	-134.4	62.4	165	-87.3	-22.4	0	0	0	107.7	P37	P37-N39 PolarHBondContact O-N 3.39Å
40	Y	27.1	Very low	36.2	Very low	199 Å²	199	118.7 Å²	118.7	78%	0.78	58%	0.579	S	S	*	*			trans	-102.8	124.3	167.3	-135.3	-94.3	0	0	0	109.6	W42	Y40-W42 PolarHBondContact O-N 2.96Å
41	Q	28.3	Very low	36.1	Very low	176 Å²	176	121.7 Å²	121.7	82%	0.822	60%	0.596	S	S	*	*			trans	-53.4	125.6	179.9	-70.8	175.7	-9.6	0	0	110.2	N43	Q41-N43 PolarHBondContact O-N 3.09Å; Q41-N43 VanDerWaalsContact O-N 3.09Å
42	W	31.4	Very low	36.2	Very low	182 Å²	182	122.7 Å²	122.7	69%	0.689	60%	0.595	S	S	*	*			trans	-53.2	110.4	175.1	-70.2	87.9	0	0	0	111.1	Y40 V46 I50	Y40-W42 PolarHBondContact O-N 2.96Å; W42-V46 HydrophobicContact CE3-CB 4.38Å; W42-V46 HydrophobicContact CE3-CG1 3.71Å; W42-V46 HydrophobicContact CZ3-CG1 3.68Å; W42-I50 HydrophobicContact CE3-CD1 4.3Å; W42-I50 HydrophobicContact CH2-CD1 4.31Å; W42-I50 HydrophobicContact CZ3-CD1 3.61Å
43	N	34.5	Very low	36.5	Very low	99 Å²	99	117.6 Å²	117.6	53%	0.529	56%	0.564	S	S	.	*			trans	-62.3	141.2	172.8	-83	-24.4	0	0	0	110.7	Q41 S45 V46 K47	Q41-N43 PolarHBondContact O-N 3.09Å; Q41-N43 VanDerWaalsContact O-N 3.09Å; N43-S45 PolarHBondContact O-N 2.95Å; N43-S45 VanDerWaalsContact O-N 3.14Å; N43-V46 WeakPolarHBondContact O-CB 3.12Å; N43-V46 PolarHBondContact O-N 2.91Å; N43-K47 PolarHBondContact O-N 2.84Å
44	L	36.8	Very low	36.9	Very low	140 Å²	140	115.5 Å²	115.5	73%	0.733	55%	0.553	S	S	*	*	H	α-helix	trans	-55.4	-30.9	-176.7	-74.7	163.6	0	0	0	113.8	V46 K47 Q48	L44-V46 VanDerWaalsContact C-N 3.34Å; L44-K47 PolarHBondContact O-N 3.07Å; L44-Q48 PolarHBondContact O-N 3.17Å
45	S	44.4	Very low	37.8	Very low	57 Å²	57	118.4 Å²	118.4	40%	0.399	56%	0.557	S	S	.	*	H	α-helix	trans	-62.6	-40.1	175.7	55	0	0	0	0	112	N43 Q48 F49	N43-S45 PolarHBondContact O-N 2.95Å; N43-S45 VanDerWaalsContact O-N 3.14Å; S45-Q48 PolarHBondContact O-N 3.22Å; S45-F49 WeakPolarHBondContact O-CB 3.48Å; S45-F49 WeakPolarHBondContact O-CD2 3.27Å; S45-F49 PolarHBondContact O-N 2.95Å
46	V	43.6	Very low	38.4	Very low	14 Å²	14	119.4 Å²	119.4	9%	0.085	56%	0.56	C	S	.	*	H	α-helix	trans	-68.6	-40.8	177.2	-176.6	0	0	0	0	110.7	W42 N43 L44 Q48 F49 I50 N171	W42-V46 HydrophobicContact CE3-CB 4.38Å; W42-V46 HydrophobicContact CE3-CG1 3.71Å; W42-V46 HydrophobicContact CZ3-CG1 3.68Å; N43-V46 WeakPolarHBondContact O-CB 3.12Å; N43-V46 PolarHBondContact O-N 2.91Å; L44-V46 VanDerWaalsContact C-N 3.34Å; V46-Q48 PolarHBondContact O-N 2.59Å; V46-F49 PolarHBondContact O-N 3.27Å; V46-I50 HydrophobicContact CG1-CD1 3.67Å; V46-I50 HydrophobicContact CG1-CG1 4.17Å; V46-I50 VanDerWaalsContact O-CB 3.3Å; V46-I50 WeakPolarHBondContact O-CB 3.15Å; V46-I50 VanDerWaalsContact O-CG1 3.27Å; V46-I50 WeakPolarHBondContact O-CG1 3.45Å; V46-I50 PolarHBondContact O-N 2.86Å; V46-N171 WeakPolarHBondContact CG2-ND2 3.48Å
47	K	44.5	Very low	39	Very low	119 Å²	119	113 Å²	113	52%	0.517	54%	0.538	S	S	.	.	H	α-helix	trans	-61.1	-41.3	173.2	-96.5	-173	177	-180	0	112.5	N43 L44 N51	N43-K47 PolarHBondContact O-N 2.84Å; L44-K47 PolarHBondContact O-N 3.07Å; K47-N51 VanDerWaalsContact O-CB 3.22Å; K47-N51 WeakPolarHBondContact O-CB 3.35Å; K47-N51 PolarHBondContact O-N 3.5Å; K47-N51 PolarHBondContact O-ND2 3.46Å
48	Q	48.5	Very low	39.5	Very low	144 Å²	144	115.3 Å²	115.3	67%	0.673	55%	0.55	S	S	*	.	H	α-helix	trans	-68.5	-39.7	176.9	-77.5	-177.8	-3.1	0	0	112.3	L44 S45 V46 K52	L44-Q48 PolarHBondContact O-N 3.17Å; S45-Q48 PolarHBondContact O-N 3.22Å; V46-Q48 PolarHBondContact O-N 2.59Å; Q48-K52 PolarHBondContact O-N 3.13Å
49	F	45.4	Very low	40	Very low	69 Å²	69	112.9 Å²	112.9	30%	0.303	55%	0.547	S	S	.	.	H	α-helix	trans	-61.9	-50.4	173.1	-100.9	-94.6	0	0	0	111.4	S45 V46 N51 K52 W53 L135 I170	S45-F49 WeakPolarHBondContact O-CB 3.48Å; S45-F49 WeakPolarHBondContact O-CD2 3.27Å; S45-F49 PolarHBondContact O-N 2.95Å; V46-F49 PolarHBondContact O-N 3.27Å; F49-N51 PolarHBondContact O-N 3.01Å; F49-K52 PolarHBondContact O-N 2.91Å; F49-W53 VanDerWaalsContact O-CB 3.28Å; F49-W53 WeakPolarHBondContact O-CB 3.25Å; F49-W53 PolarHBondContact O-N 3.45Å; F49-L135 HydrophobicContact CD1-CD2 4.15Å; F49-L135 HydrophobicContact CE1-CD2 3.62Å; F49-L135 HydrophobicContact CZ-CD2 4.45Å; F49-I170 HydrophobicContact CE2-CD1 4.22Å; F49-I170 HydrophobicContact CZ-CD1 3.89Å
50	I	48.8	Very low	40.4	Very low	44 Å²	44	108.6 Å²	108.6	23%	0.226	53%	0.529	C	S	.	.	H	α-helix	trans	-62.6	-41.5	177.2	-70.7	176.1	0	0	0	110.8	W42 V46 K52 W53 L54	W42-I50 HydrophobicContact CE3-CD1 4.3Å; W42-I50 HydrophobicContact CH2-CD1 4.31Å; W42-I50 HydrophobicContact CZ3-CD1 3.61Å; V46-I50 HydrophobicContact CG1-CD1 3.67Å; V46-I50 HydrophobicContact CG1-CG1 4.17Å; V46-I50 VanDerWaalsContact O-CB 3.3Å; V46-I50 WeakPolarHBondContact O-CB 3.15Å; V46-I50 VanDerWaalsContact O-CG1 3.27Å; V46-I50 WeakPolarHBondContact O-CG1 3.45Å; V46-I50 PolarHBondContact O-N 2.86Å; I50-K52 PolarHBondContact O-N 2.91Å; I50-W53 CarbonylContact O-C 3.54Å; I50-W53 PolarHBondContact O-N 3.14Å; I50-W53 VanDerWaalsContact O-N 3.12Å; I50-L54 HydrophobicContact CG2-CD1 3.41Å; I50-L54 VanDerWaalsContact CG2-CD1 3.41Å; I50-L54 HydrophobicContact CG2-CG 3.71Å; I50-L54 VanDerWaalsContact O-CB 3.24Å; I50-L54 WeakPolarHBondContact O-CB 3.3Å; I50-L54 VanDerWaalsContact O-CG 3.27Å; I50-L54 WeakPolarHBondContact O-CG 3.17Å; I50-L54 PolarHBondContact O-N 3.44Å
51	N	50.6	Low	40.7	Very low	87 Å²	87	109.2 Å²	109.2	47%	0.465	54%	0.535	S	S	.	.	H	α-helix	trans	-64.7	-40.4	177.6	-75.2	-17.9	0	0	0	111.9	K47 F49 W53 Q55	K47-N51 VanDerWaalsContact O-CB 3.22Å; K47-N51 WeakPolarHBondContact O-CB 3.35Å; K47-N51 PolarHBondContact O-N 3.5Å; K47-N51 PolarHBondContact O-ND2 3.46Å; F49-N51 PolarHBondContact O-N 3.01Å; N51-W53 VanDerWaalsContact C-N 3.28Å; N51-W53 PolarHBondContact O-N 2.76Å; N51-Q55 WeakPolarHBondContact O-CB 3.45Å; N51-Q55 WeakPolarHBondContact O-CG 3.28Å; N51-Q55 PolarHBondContact O-N 2.86Å; N51-Q55 VanDerWaalsContact O-N 3.08Å
52	K	46.7	Very low	40.9	Very low	144 Å²	144	107.8 Å²	107.8	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-64.1	-34.1	171.8	-92.2	-174.3	172.8	179.9	0	112.4	Q48 F49 I50	Q48-K52 PolarHBondContact O-N 3.13Å; F49-K52 PolarHBondContact O-N 2.91Å; I50-K52 PolarHBondContact O-N 2.91Å
53	W	40.7	Very low	41	Very low	49 Å²	49	102.4 Å²	102.4	19%	0.186	53%	0.534	C	S	.	.	H	α-helix	trans	-80.8	-42.2	-178	-156.6	75.7	0	0	0	112.4	F49 I50 N51 Q55 R56 L57 I64 Y137	F49-W53 VanDerWaalsContact O-CB 3.28Å; F49-W53 WeakPolarHBondContact O-CB 3.25Å; F49-W53 PolarHBondContact O-N 3.45Å; I50-W53 CarbonylContact O-C 3.54Å; I50-W53 PolarHBondContact O-N 3.14Å; I50-W53 VanDerWaalsContact O-N 3.12Å; N51-W53 VanDerWaalsContact C-N 3.28Å; N51-W53 PolarHBondContact O-N 2.76Å; W53-Q55 VanDerWaalsContact C-N 3.33Å; W53-Q55 PolarHBondContact O-N 2.92Å; W53-R56 CarbonylContact O-C 3.6Å; W53-R56 WeakPolarHBondContact O-CA 3.3Å; W53-R56 WeakPolarHBondContact O-CB 3.29Å; W53-R56 PolarHBondContact O-N 3.49Å; W53-L57 HydrophobicContact CD2-CD1 4.09Å; W53-L57 HydrophobicContact CD2-CG 4.36Å; W53-L57 HydrophobicContact CE3-CD1 3.3Å; W53-L57 HydrophobicContact CE3-CG 4.04Å; W53-L57 HydrophobicContact CH2-CD1 3.91Å; W53-L57 HydrophobicContact CH2-CD2 4.24Å; W53-L57 HydrophobicContact CH2-CG 4.44Å; W53-L57 HydrophobicContact CZ2-CD2 4.5Å; W53-L57 HydrophobicContact CZ3-CD1 3.22Å; W53-L57 HydrophobicContact CZ3-CD2 4.38Å; W53-L57 HydrophobicContact CZ3-CG 4.11Å; W53-L57 PolarHBondContact O-N 3.44Å; W53-I64 HydrophobicContact CZ3-CD1 4.13Å; W53-Y137 HydrophobicContact CH2-CD1 4.36Å; W53-Y137 HydrophobicContact CZ2-CD1 4.44Å
54	L	44.2	Very low	40.9	Very low	90 Å²	90	102.3 Å²	102.3	47%	0.471	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-37.4	172.1	-74.4	174.8	0	0	0	112.1	I50 R56 L57 T58	I50-L54 HydrophobicContact CG2-CD1 3.41Å; I50-L54 VanDerWaalsContact CG2-CD1 3.41Å; I50-L54 HydrophobicContact CG2-CG 3.71Å; I50-L54 VanDerWaalsContact O-CB 3.24Å; I50-L54 WeakPolarHBondContact O-CB 3.3Å; I50-L54 VanDerWaalsContact O-CG 3.27Å; I50-L54 WeakPolarHBondContact O-CG 3.17Å; I50-L54 PolarHBondContact O-N 3.44Å; L54-R56 PolarHBondContact O-N 2.98Å; L54-L57 HydrophobicContact CD2-CD1 4.14Å; L54-L57 PolarHBondContact O-N 3.01Å; L54-L57 VanDerWaalsContact O-N 3.15Å; L54-T58 PolarHBondContact O-N 3.21Å
55	Q	45.8	Very low	41.3	Very low	151 Å²	151	99.9 Å²	99.9	71%	0.706	52%	0.521	S	S	*	.	H	α-helix	trans	-62.5	-23.8	171.8	-78.2	174.5	9.8	0	0	112.9	N51 W53	N51-Q55 WeakPolarHBondContact O-CB 3.45Å; N51-Q55 WeakPolarHBondContact O-CG 3.28Å; N51-Q55 PolarHBondContact O-N 2.86Å; N51-Q55 VanDerWaalsContact O-N 3.08Å; W53-Q55 VanDerWaalsContact C-N 3.33Å; W53-Q55 PolarHBondContact O-N 2.92Å
56	R	42.3	Very low	41.3	Very low	165 Å²	165	100.8 Å²	100.8	62%	0.623	52%	0.52	S	S	*	.	H	α-helix	trans	-88	-26.4	172.9	-72.2	-179.2	162.4	-173.7	-5.3	112.9	W53 L54 S59	W53-R56 CarbonylContact O-C 3.6Å; W53-R56 WeakPolarHBondContact O-CA 3.3Å; W53-R56 WeakPolarHBondContact O-CB 3.29Å; W53-R56 PolarHBondContact O-N 3.49Å; L54-R56 PolarHBondContact O-N 2.98Å; R56-S59 PolarHBondContact O-OG 3.34Å
57	L	38	Very low	41.7	Very low	41 Å²	41	100.7 Å²	100.7	22%	0.215	52%	0.519	C	S	.	.	H	α-helix	trans	-81.1	-10.1	-176.6	-78.5	176.9	0	0	0	115.7	W53 L54 S59 S60	W53-L57 HydrophobicContact CD2-CD1 4.09Å; W53-L57 HydrophobicContact CD2-CG 4.36Å; W53-L57 HydrophobicContact CE3-CD1 3.3Å; W53-L57 HydrophobicContact CE3-CG 4.04Å; W53-L57 HydrophobicContact CH2-CD1 3.91Å; W53-L57 HydrophobicContact CH2-CD2 4.24Å; W53-L57 HydrophobicContact CH2-CG 4.44Å; W53-L57 HydrophobicContact CZ2-CD2 4.5Å; W53-L57 HydrophobicContact CZ3-CD1 3.22Å; W53-L57 HydrophobicContact CZ3-CD2 4.38Å; W53-L57 HydrophobicContact CZ3-CG 4.11Å; W53-L57 PolarHBondContact O-N 3.44Å; L54-L57 HydrophobicContact CD2-CD1 4.14Å; L54-L57 PolarHBondContact O-N 3.01Å; L54-L57 VanDerWaalsContact O-N 3.15Å; L57-S59 PolarHBondContact O-N 2.84Å; L57-S60 PolarHBondContact O-N 2.81Å
58	T	36.3	Very low	41.7	Very low	135 Å²	135	96.4 Å²	96.4	83%	0.828	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	1	177.1	50	0	0	0	0	113.9	L54	L54-T58 PolarHBondContact O-N 3.21Å
59	S	37.5	Very low	41.5	Very low	113 Å²	113	89.9 Å²	89.9	79%	0.79	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-1	172.3	58.5	0	0	0	0	116.6	R56 L57	R56-S59 PolarHBondContact O-OG 3.34Å; L57-S59 PolarHBondContact O-N 2.84Å
60	S	32.3	Very low	41.5	Very low	62 Å²	62	88.2 Å²	88.2	43%	0.434	46%	0.462	S	S	.	.			trans	-122.6	120.8	175.5	-176.6	0	0	0	0	111.6	L57	L57-S60 PolarHBondContact O-N 2.81Å
61	K	33.6	Very low	41.2	Very low	212 Å²	212	88 Å²	88	92%	0.922	46%	0.462	S	S	*	.			trans	-99.4	13	-170.4	-133.7	-174.3	-172.7	-174.6	0	114.3
62	N	32.7	Very low	40.6	Very low	147 Å²	147	87.3 Å²	87.3	79%	0.786	45%	0.453	S	S	*	.	S	Bend	trans	-112.8	135.7	177.5	-70.4	-4.9	0	0	0	110.1
63	G	33.9	Very low	40.6	Very low	68 Å²	68	81.3 Å²	81.3	70%	0.701	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-57.9	161.4	-169.4	0	0	0	0	0	114.3	D65	G63-D65 PolarHBondContact O-N 3.31Å
64	I	32.2	Very low	41.2	Very low	97 Å²	97	80.2 Å²	80.2	50%	0.497	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-68.7	116.1	170.9	-58.6	172.9	0	0	0	106.8	W53 I66 Q139	W53-I64 HydrophobicContact CZ3-CD1 4.13Å; I64-I66 PolarHBondContact O-N 3.02Å; I64-Q139 HydrophobicContact CG2-CB 4.16Å; I64-Q139 HydrophobicContact CG2-CG 4.42Å
65	D	46	Very low	42.1	Very low	90 Å²	90	76.6 Å²	76.6	48%	0.481	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-66.2	123.2	167.7	-74.1	-21	0	0	0	108.3	G63 Y257	G63-D65 PolarHBondContact O-N 3.31Å; D65-Y257 WeakPolarHBondContact CB-OH 3.39Å; D65-Y257 PolarHBondContact OD2-OH 3.28Å
66	I	43.8	Very low	43.5	Very low	76 Å²	76	69.6 Å²	69.6	39%	0.39	37%	0.373	S	S	.	.			trans	-86.9	115.9	175.1	-60.6	173	0	0	0	106.2	I64 Y68	I64-I66 PolarHBondContact O-N 3.02Å; I66-Y68 HydrophobicContact CB-CE2 3.92Å; I66-Y68 HydrophobicContact CG2-CD2 4.2Å; I66-Y68 HydrophobicContact CG2-CE1 4.41Å; I66-Y68 HydrophobicContact CG2-CE2 3.65Å; I66-Y68 WeakPolarHBondContact O-CD2 3.49Å; I66-Y68 WeakPolarHBondContact O-CE2 3.02Å
67	E	51.3	Low	45.6	Very low	11 Å²	11	62.2 Å²	62.2	5%	0.051	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-90.9	121.3	179.3	-65.2	177.2	173	0	0	109.3	S98 P99 V138 Q139 Y140 G141 Q192	E67-S98 WeakPolarHBondContact OE2-CB 3.26Å; E67-P99 WeakPolarHBondContact OE1-CD 3.41Å; E67-V138 WeakPolarHBondContact OE2-CG2 3.19Å; E67-Q139 PolarHBondContact N-O 3.3Å; E67-Q139 VanDerWaalsContact N-O 3.11Å; E67-Y140 HydrophobicContact CB-CD1 3.89Å; E67-Y140 HydrophobicContact CB-CE1 4.31Å; E67-Y140 CarbonylContact O-C 3.35Å; E67-Y140 WeakPolarHBondContact O-CA 3.09Å; E67-Y140 WeakPolarHBondContact O-CB 2.85Å; E67-G141 PolarHBondContact O-N 2.89Å; E67-Q192 PolarHBondContact OE1-NE2 2.85Å
68	Y	45.1	Very low	48.2	Very low	30 Å²	30	61.7 Å²	61.7	12%	0.118	34%	0.341	C	S	.	.			trans	-87.3	129.8	-167.9	-72.4	-106.4	0	0	0	111.6	I66 T285 T360 F362 I369	I66-Y68 HydrophobicContact CB-CE2 3.92Å; I66-Y68 HydrophobicContact CG2-CD2 4.2Å; I66-Y68 HydrophobicContact CG2-CE1 4.41Å; I66-Y68 HydrophobicContact CG2-CE2 3.65Å; I66-Y68 WeakPolarHBondContact O-CD2 3.49Å; I66-Y68 WeakPolarHBondContact O-CE2 3.02Å; Y68-T285 PolarHBondContact O-OG1 3.48Å; Y68-T360 HydrophobicContact CD1-CG2 4.04Å; Y68-T360 HydrophobicContact CE1-CG2 3.34Å; Y68-F362 HydrophobicContact CD2-CD1 4.41Å; Y68-F362 AromaticContact CD2-CE1 3.38Å; Y68-F362 HydrophobicContact CD2-CE1 3.38Å; Y68-F362 AromaticContact CD2-CZ 3.82Å; Y68-F362 HydrophobicContact CD2-CZ 3.82Å; Y68-F362 HydrophobicContact CE1-CE1 4.42Å; Y68-F362 HydrophobicContact CE1-CZ 4.37Å; Y68-F362 AromaticContact CE2-CD1 3.58Å; Y68-F362 HydrophobicContact CE2-CD1 3.58Å; Y68-F362 AromaticContact CE2-CE1 2.9Å; Y68-F362 HydrophobicContact CE2-CE1 2.9Å; Y68-F362 AromaticContact CE2-CZ 3.57Å; Y68-F362 HydrophobicContact CE2-CZ 3.57Å; Y68-F362 HydrophobicContact CG-CE1 4.32Å; Y68-F362 HydrophobicContact CG-CZ 4.34Å; Y68-F362 AromaticContact CZ-CD1 3.98Å; Y68-F362 AromaticContact CZ-CE1 3.47Å; Y68-F362 VanDerWaalsContact CZ-CE1 3.47Å; Y68-F362 AromaticContact CZ-CZ 3.8Å; Y68-I369 HydrophobicContact CD2-CD1 4.25Å; Y68-I369 HydrophobicContact CG-CD1 4.05Å
69	L	45.1	Very low	50.8	Low	6 Å²	6	55.3 Å²	55.3	3%	0.031	30%	0.302	C	S	.	.			trans	-121.3	103.5	163.2	-67.3	172.4	0	0	0	106.2	Y140 T142 F177 I185 G284	L69-Y140 HydrophobicContact CD1-CD1 3.41Å; L69-Y140 VanDerWaalsContact CD1-CD1 3.41Å; L69-Y140 HydrophobicContact CD1-CD2 3.75Å; L69-Y140 HydrophobicContact CD1-CE1 3.84Å; L69-Y140 HydrophobicContact CD1-CE2 4.15Å; L69-Y140 HydrophobicContact CD1-CG 3.34Å; L69-Y140 HydrophobicContact CD2-CD1 4.39Å; L69-Y140 HydrophobicContact CG-CD1 3.54Å; L69-Y140 HydrophobicContact CG-CE1 4.15Å; L69-Y140 HydrophobicContact CG-CG 3.84Å; L69-T142 WeakPolarHBondContact O-CB 3.17Å; L69-T142 WeakPolarHBondContact O-CG2 3.41Å; L69-T142 PolarHBondContact O-OG1 3.05Å; L69-F177 HydrophobicContact CD1-CE1 4.28Å; L69-I185 HydrophobicContact CD1-CD1 3.29Å; L69-I185 HydrophobicContact CD2-CD1 4.28Å; L69-I185 HydrophobicContact CG-CD1 4.4Å; L69-G284 VanDerWaalsContact CD2-O 3.25Å; L69-G284 WeakPolarHBondContact CD2-O 3.27Å
70	E	45.2	Very low	53.6	Low	35 Å²	35	54.3 Å²	54.3	16%	0.164	28%	0.284	C	S	.	.			trans	-120.3	111.4	174.2	-72.8	-173.1	175.3	0	0	109.8	T142 A286 I358	E70-T142 HydrophobicContact CG-CG2 4.12Å; E70-A286 WeakPolarHBondContact O-CB 3.48Å; E70-A286 PolarHBondContact O-N 3.41Å; E70-I358 VanDerWaalsContact OE2-CG2 3.26Å; E70-I358 WeakPolarHBondContact OE2-CG2 3.44Å
71	N	41.9	Very low	56.7	Low	40 Å²	40	51.5 Å²	51.5	21%	0.214	26%	0.264	C	S	.	.			trans	-103.3	107.7	172.3	-167.6	-16.6	0	0	0	110.5	H30 I75 F180 A286	H30-N71 PolarHBondContact CD2-ND2 3.11Å; H30-N71 VanDerWaalsContact CD2-ND2 3.3Å; H30-N71 PolarHBondContact NE2-ND2 2.94Å; N71-I75 PolarHBondContact ND2-O 2.96Å; N71-I75 PolarHBondContact OD1-O 2.93Å; N71-F180 HydrophobicContact CB-CE1 4.23Å; N71-A286 HydrophobicContact CB-CB 4.5Å
72	Y	38.7	Very low	59.8	Low	72 Å²	72	42.1 Å²	42.1	28%	0.282	23%	0.226	S	C	.	.			trans	-132.2	136.4	169.2	-132.8	-80.9	0	0	0	106.7	A286 L287 E311	Y72-A286 WeakPolarHBondContact O-CB 3.42Å; Y72-L287 VanDerWaalsContact CB-CD1 3.46Å; Y72-L287 HydrophobicContact CG-CD1 4.21Å; Y72-L287 WeakPolarHBondContact O-CD2 3.42Å; Y72-E311 HydrophobicContact CE2-CG 4.4Å; Y72-E311 VanDerWaalsContact CZ-OE1 3.27Å; Y72-E311 PolarHBondContact OH-OE1 3.21Å; Y72-E311 PolarHBondContact OH-OE2 2.58Å
73	Q	46.2	Very low	63	Low	17 Å²	17	35.1 Å²	35.1	8%	0.079	19%	0.188	C	C	.	.	S	Bend	trans	105.8	-13.7	-158.9	-56	-137	-37.1	0	0	112.8	I75 V343 C356	Q73-I75 PolarHBondContact O-N 3.1Å; Q73-V343 HydrophobicContact CB-CG2 4.04Å; Q73-V343 HydrophobicContact CG-CG2 3.27Å; Q73-C356 PolarHBondContact NE2-SG 3.04Å
74	N	53.4	Low	66.1	Low	27 Å²	27	31.9 Å²	31.9	14%	0.144	16%	0.155	C	C	.	.	S	Bend	trans	67.5	-2.1	-173.4	-71	16.7	0	0	0	114.4	H29 H30 K345	H29-N74 CarbonylContact C-O 3.53Å; H29-N74 WeakPolarHBondContact CA-O 3.45Å; H29-N74 HydrophobicContact CB-CB 4.33Å; H30-N74 HydrophobicContact CB-CB 3.88Å; H30-N74 PolarHBondContact N-O 2.95Å; H30-N74 PolarHBondContact O-ND2 3.27Å; N74-K345 PolarHBondContact ND2-NZ 2.87Å; N74-K345 PolarHBondContact OD1-NZ 2.87Å
75	I	62.5	Low	69.2	Low	14 Å²	14	29.6 Å²	29.6	7%	0.072	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	122.6	-175.7	-61.9	172.7	0	0	0	109.4	S28 H29 N71 Q73 Y77 L223	S28-I75 VanDerWaalsContact O-CA 3.26Å; S28-I75 WeakPolarHBondContact O-CA 3.48Å; H29-I75 WeakPolarHBondContact CE1-CG1 3.46Å; N71-I75 PolarHBondContact ND2-O 2.96Å; N71-I75 PolarHBondContact OD1-O 2.93Å; Q73-I75 PolarHBondContact O-N 3.1Å; I75-Y77 HydrophobicContact CG2-CE2 4.02Å; I75-L223 HydrophobicContact CD1-CD2 3.26Å
76	E	75	Confident	71.7	Confident	3 Å²	3	29.1 Å²	29.1	1%	0.014	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.5	173.1	54.4	-172	172.2	0	0	109.8	S27 S28 Y78 F180 H181 F182	S27-E76 VanDerWaalsContact CA-O 3.25Å; S27-E76 WeakPolarHBondContact CA-O 3.37Å; S28-E76 PolarHBondContact N-O 3.02Å; S28-E76 VanDerWaalsContact N-O 3.16Å; S28-E76 PolarHBondContact O-N 3.22Å; S28-E76 VanDerWaalsContact O-N 3.09Å; E76-Y78 HydrophobicContact CG-CD1 4.09Å; E76-Y78 HydrophobicContact CG-CE1 4.36Å; E76-F180 WeakPolarHBondContact OE2-CD1 3.38Å; E76-H181 WeakPolarHBondContact OE1-CB 3.22Å; E76-H181 IonicContact OE1-CG 2.7Å; E76-H181 PolarHBondContact OE1-N 2.64Å; E76-H181 IonicContact OE1-ND1 3.29Å; E76-F182 WeakPolarHBondContact OE2-CD1 3.22Å; E76-F182 WeakPolarHBondContact OE2-CE1 3.35Å
77	Y	87.3	Confident	74.3	Confident	10 Å²	10	29.2 Å²	29.2	4%	0.039	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.4	173.2	-64.8	-82.9	0	0	0	110.5	L25 Y26 I75 L221 N222 S230 D372 R376	L25-Y77 HydrophobicContact CB-CD1 4.49Å; Y26-Y77 WeakPolarHBondContact O-CA 2.95Å; I75-Y77 HydrophobicContact CG2-CE2 4.02Å; Y77-L221 HydrophobicContact CD1-CD2 3.8Å; Y77-L221 HydrophobicContact CD2-CD1 3.87Å; Y77-L221 HydrophobicContact CD2-CD2 3.94Å; Y77-L221 HydrophobicContact CD2-CG 4.37Å; Y77-L221 HydrophobicContact CE1-CB 4.27Å; Y77-L221 HydrophobicContact CE1-CD2 4.18Å; Y77-L221 HydrophobicContact CE2-CB 4.18Å; Y77-L221 HydrophobicContact CE2-CD1 3.94Å; Y77-L221 HydrophobicContact CE2-CD2 4.32Å; Y77-L221 HydrophobicContact CE2-CG 4.38Å; Y77-L221 HydrophobicContact CG-CD1 4.44Å; Y77-L221 HydrophobicContact CG-CD2 3.66Å; Y77-N222 WeakPolarHBondContact CE1-O 3.45Å; Y77-N222 VanDerWaalsContact OH-C 3.27Å; Y77-N222 PolarHBondContact OH-O 2.88Å; Y77-S230 WeakPolarHBondContact CE1-O 3.32Å; Y77-D372 WeakPolarHBondContact CD2-OD2 3.19Å; Y77-D372 HydrophobicContact CE2-CB 4.07Å; Y77-R376 WeakPolarHBondContact OH-CD 3.21Å
78	Y	91.3	Very high	76.5	Confident	31 Å²	31	29.9 Å²	29.9	12%	0.122	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	156	178.4	63.4	-89.3	0	0	0	111.2	L25 Y26 E76 H91 V92 H181 F182	L25-Y78 CarbonylContact C-O 3.55Å; L25-Y78 WeakPolarHBondContact CA-O 3.11Å; Y26-Y78 HydrophobicContact CD2-CD2 4.35Å; Y26-Y78 HydrophobicContact CD2-CE2 4.07Å; Y26-Y78 HydrophobicContact CG-CE2 4.29Å; Y26-Y78 PolarHBondContact N-O 2.79Å; Y26-Y78 PolarHBondContact O-N 2.81Å; E76-Y78 HydrophobicContact CG-CD1 4.09Å; E76-Y78 HydrophobicContact CG-CE1 4.36Å; Y78-H91 HydrophobicContact CD2-CB 3.66Å; Y78-H91 AromaticContact CD2-CD2 3.96Å; Y78-H91 AromaticContact CD2-CG 3.91Å; Y78-H91 HydrophobicContact CE2-CB 4.11Å; Y78-H91 AromaticContact CE2-CD2 3.88Å; Y78-H91 AromaticContact CE2-CG 3.91Å; Y78-H91 HydrophobicContact CG-CB 4.47Å; Y78-V92 CarbonylContact C-O 3.38Å; Y78-V92 WeakPolarHBondContact CA-O 3.36Å; Y78-V92 VanDerWaalsContact CB-O 3.29Å; Y78-V92 WeakPolarHBondContact CB-O 3.47Å; Y78-H181 HydrophobicContact CE1-CB 4.24Å; Y78-F182 HydrophobicContact CG-CB 4.45Å
79	G	92.4	Very high	79.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	177.8	171.7	0	0	0	0	0	111.8	H91 V92	G79-H91 CarbonylContact O-C 3.45Å; G79-H91 WeakPolarHBondContact O-CA 3.36Å; G79-V92 PolarHBondContact N-O 3.46Å; G79-V92 PolarHBondContact O-N 3.25Å
80	E	95.6	Very high	81.6	Confident	92 Å²	92	32.4 Å²	32.4	43%	0.43	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.7	-174.5	-168.1	-179	93.8	0	0	111.2	I89 F90	E80-I89 HydrophobicContact CG-CG2 3.53Å; E80-F90 WeakPolarHBondContact CA-O 3.14Å
81	I	98.1	Very high	84	Confident	3 Å²	3	33 Å²	33	2%	0.015	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	167.1	163.4	67.4	168.2	0	0	0	108.8	I83 F90 V92 F94 L101 H155 I156 M186	I81-I83 HydrophobicContact CD1-CD1 4.38Å; I81-I83 HydrophobicContact CD1-CG1 4.43Å; I81-F90 HydrophobicContact CG1-CB 4.14Å; I81-F90 PolarHBondContact N-O 3.45Å; I81-F90 PolarHBondContact O-N 2.89Å; I81-F90 VanDerWaalsContact O-O 3.14Å; I81-V92 HydrophobicContact CD1-CG1 3.67Å; I81-V92 HydrophobicContact CD1-CG2 4.05Å; I81-V92 HydrophobicContact CG1-CG1 3.92Å; I81-V92 HydrophobicContact CG1-CG2 4.04Å; I81-V92 HydrophobicContact CG2-CG2 3.77Å; I81-F94 HydrophobicContact CG2-CE1 4.39Å; I81-F94 HydrophobicContact CG2-CZ 4.11Å; I81-L101 HydrophobicContact CD1-CD1 3.82Å; I81-H155 WeakPolarHBondContact CA-O 3.37Å; I81-I156 HydrophobicContact CB-CG1 4.32Å; I81-I156 HydrophobicContact CG2-CD1 3.97Å; I81-I156 HydrophobicContact CG2-CG1 3.8Å; I81-I156 HydrophobicContact CG2-CG2 4.46Å; I81-M186 HydrophobicContact CG2-SD 4.11Å
82	S	98.6	Very high	86.5	Confident	15 Å²	15	31.1 Å²	31.1	11%	0.105	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.5	164.9	60.1	0	0	0	0	112.7	Q88 V154 H155	S82-Q88 CarbonylContact C-O 3.57Å; S82-Q88 WeakPolarHBondContact CA-O 3.21Å; S82-Q88 WeakPolarHBondContact CB-O 3.07Å; S82-V154 CarbonylContact O-C 3.58Å; S82-V154 WeakPolarHBondContact O-CA 3.45Å; S82-H155 PolarHBondContact N-O 2.86Å; S82-H155 PolarHBondContact O-N 2.61Å; S82-H155 WeakPolarHBondContact OG-CB 3.45Å
83	I	98.8	Very high	89.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.3	-176.8	-48.5	-170.8	0	0	0	110.1	I81 Q88 F90 L101 I103 Y121 D152 C153 V154 F166	I81-I83 HydrophobicContact CD1-CD1 4.38Å; I81-I83 HydrophobicContact CD1-CG1 4.43Å; I83-Q88 PolarHBondContact N-O 3.29Å; I83-Q88 WeakPolarHBondContact O-CB 3.34Å; I83-Q88 PolarHBondContact O-N 3.14Å; I83-F90 HydrophobicContact CB-CD2 4.47Å; I83-F90 HydrophobicContact CB-CE2 4.03Å; I83-F90 HydrophobicContact CD1-CD2 4.36Å; I83-F90 HydrophobicContact CD1-CE2 4.39Å; I83-F90 HydrophobicContact CG1-CD2 4Å; I83-F90 HydrophobicContact CG1-CE2 4.02Å; I83-L101 HydrophobicContact CD1-CD2 4.3Å; I83-I103 HydrophobicContact CD1-CG1 3.77Å; I83-I103 HydrophobicContact CD1-CG2 4.43Å; I83-Y121 HydrophobicContact CB-CD2 4.14Å; I83-Y121 HydrophobicContact CB-CE2 4.16Å; I83-Y121 HydrophobicContact CG2-CD2 4.06Å; I83-Y121 HydrophobicContact CG2-CE2 3.68Å; I83-D152 HydrophobicContact CG2-CB 3.79Å; I83-C153 CarbonylContact C-O 3.48Å; I83-C153 WeakPolarHBondContact CA-O 3.33Å; I83-V154 HydrophobicContact CD1-CG2 4.26Å; I83-V154 HydrophobicContact CG1-CG2 4.08Å; I83-V154 HydrophobicContact CG2-CG2 4.26Å; I83-F166 HydrophobicContact CD1-CD2 4.37Å; I83-F166 HydrophobicContact CD1-CE2 4.39Å; I83-F166 HydrophobicContact CD1-CG 4.49Å; I83-F166 HydrophobicContact CG2-CE1 3.82Å; I83-F166 HydrophobicContact CG2-CZ 3.93Å
84	G	98.6	Very high	91.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.6	174.8	173.7	0	0	0	0	0	115.9	P86 P87 S126 D152 C153	G84-P86 CarbonylContact C-O 3.52Å; G84-P86 CarbonylContact O-C 3.57Å; G84-P87 WeakPolarHBondContact O-CA 3.48Å; G84-S126 WeakPolarHBondContact CA-OG 3.49Å; G84-D152 VanDerWaalsContact CA-CG 3.45Å; G84-D152 WeakPolarHBondContact CA-OD1 3.37Å; G84-D152 WeakPolarHBondContact CA-OD2 3.39Å; G84-C153 PolarHBondContact N-O 2.91Å
85	T	98.4	Very high	93.4	Very high	50 Å²	50	26.7 Å²	26.7	31%	0.307	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.2	109.4	-180	-56.1	0	0	0	0	110.6	S126 L127 T128	T85-S126 PolarHBondContact N-OG 2.69Å; T85-S126 CarbonylContact O-C 3.54Å; T85-S126 WeakPolarHBondContact O-CA 3.23Å; T85-L127 WeakPolarHBondContact O-CB 3.2Å; T85-L127 WeakPolarHBondContact O-CG 3.5Å; T85-L127 PolarHBondContact O-N 3.39Å; T85-T128 WeakPolarHBondContact CB-OG1 3.26Å; T85-T128 PolarHBondContact N-OG1 3.27Å; T85-T128 VanDerWaalsContact OG1-CG2 3.29Å; T85-T128 WeakPolarHBondContact OG1-CG2 3.42Å; T85-T128 PolarHBondContact OG1-OG1 2.63Å
86	P	98.1	Very high	94.9	Very high	80 Å²	80	26.1 Å²	26.1	52%	0.519	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	cis	-68.3	156.6	2.6	30.1	-36.5	0	0	0	112.8	G84 Q88 K125	G84-P86 CarbonylContact C-O 3.52Å; G84-P86 CarbonylContact O-C 3.57Å; P86-Q88 PolarHBondContact O-N 3.28Å; P86-K125 WeakPolarHBondContact CD-O 3.45Å
87	P	98.3	Very high	95.6	Very high	77 Å²	77	26.1 Å²	26.1	50%	0.5	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	132.7	-179.4	-27.4	36	0	0	0	113.7	G84	G84-P87 WeakPolarHBondContact O-CA 3.48Å
88	Q	98.7	Very high	95.7	Very high	26 Å²	26	25.7 Å²	25.7	12%	0.121	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.7	169.1	-59.1	175.2	73.4	0	0	108.6	S82 I83 P86 F90 D122	S82-Q88 CarbonylContact C-O 3.57Å; S82-Q88 WeakPolarHBondContact CA-O 3.21Å; S82-Q88 WeakPolarHBondContact CB-O 3.07Å; I83-Q88 PolarHBondContact N-O 3.29Å; I83-Q88 WeakPolarHBondContact O-CB 3.34Å; I83-Q88 PolarHBondContact O-N 3.14Å; P86-Q88 PolarHBondContact O-N 3.28Å; Q88-F90 HydrophobicContact CB-CE2 3.85Å; Q88-F90 HydrophobicContact CB-CZ 4.02Å; Q88-F90 VanDerWaalsContact O-CD2 3.22Å; Q88-F90 WeakPolarHBondContact O-CD2 3.48Å; Q88-F90 WeakPolarHBondContact O-CE2 3.37Å; Q88-D122 PolarHBondContact NE2-O 3.1Å; Q88-D122 VanDerWaalsContact NE2-O 3.1Å
89	I	98.4	Very high	95.7	Very high	88 Å²	88	24.3 Å²	24.3	45%	0.451	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.9	-169.5	-61.3	171.7	0	0	0	111.2	E80	E80-I89 HydrophobicContact CG-CG2 3.53Å
90	F	98.3	Very high	95.7	Very high	1 Å²	1	24.9 Å²	24.9	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.2	175.1	-55.7	-82.5	0	0	0	110.8	E80 I81 I83 Q88 V92 I103 H119 Y121 D183	E80-F90 WeakPolarHBondContact CA-O 3.14Å; I81-F90 HydrophobicContact CG1-CB 4.14Å; I81-F90 PolarHBondContact N-O 3.45Å; I81-F90 PolarHBondContact O-N 2.89Å; I81-F90 VanDerWaalsContact O-O 3.14Å; I83-F90 HydrophobicContact CB-CD2 4.47Å; I83-F90 HydrophobicContact CB-CE2 4.03Å; I83-F90 HydrophobicContact CD1-CD2 4.36Å; I83-F90 HydrophobicContact CD1-CE2 4.39Å; I83-F90 HydrophobicContact CG1-CD2 4Å; I83-F90 HydrophobicContact CG1-CE2 4.02Å; Q88-F90 HydrophobicContact CB-CE2 3.85Å; Q88-F90 HydrophobicContact CB-CZ 4.02Å; Q88-F90 VanDerWaalsContact O-CD2 3.22Å; Q88-F90 WeakPolarHBondContact O-CD2 3.48Å; Q88-F90 WeakPolarHBondContact O-CE2 3.37Å; F90-V92 HydrophobicContact CB-CG1 4.46Å; F90-I103 HydrophobicContact CB-CG2 4.2Å; F90-I103 HydrophobicContact CD1-CB 4.2Å; F90-I103 HydrophobicContact CD1-CG2 4.14Å; F90-I103 HydrophobicContact CD2-CG2 4.41Å; F90-I103 HydrophobicContact CE1-CB 4.39Å; F90-I103 HydrophobicContact CG-CB 4.46Å; F90-I103 HydrophobicContact CG-CG2 3.98Å; F90-I103 HydrophobicContact CZ-CG1 4.47Å; F90-H119 HydrophobicContact CD1-CB 3.86Å; F90-H119 HydrophobicContact CE1-CB 3.99Å; F90-Y121 HydrophobicContact CE2-CD2 4.39Å; F90-Y121 HydrophobicContact CZ-CD2 4.27Å; F90-Y121 HydrophobicContact CZ-CG 4.46Å; F90-D183 WeakPolarHBondContact CA-OD2 3.29Å; F90-D183 HydrophobicContact CB-CB 4.29Å; F90-D183 HydrophobicContact CD1-CB 4.14Å
91	H	95.2	Very high	95.8	Very high	47 Å²	47	20.7 Å²	20.7	22%	0.218	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.6	165.3	-61.4	119.5	0	0	0	109.6	Y78 G79 F182 D183 G184	Y78-H91 HydrophobicContact CD2-CB 3.66Å; Y78-H91 AromaticContact CD2-CD2 3.96Å; Y78-H91 AromaticContact CD2-CG 3.91Å; Y78-H91 HydrophobicContact CE2-CB 4.11Å; Y78-H91 AromaticContact CE2-CD2 3.88Å; Y78-H91 AromaticContact CE2-CG 3.91Å; Y78-H91 HydrophobicContact CG-CB 4.47Å; G79-H91 CarbonylContact O-C 3.45Å; G79-H91 WeakPolarHBondContact O-CA 3.36Å; H91-F182 HydrophobicContact CB-CB 4.48Å; H91-F182 CarbonylContact O-C 3.55Å; H91-D183 PolarHBondContact N-OD2 3.18Å; H91-D183 IonicContact ND1-OD2 2.69Å; H91-D183 PolarHBondContact O-N 2.79Å; H91-G184 PolarHBondContact O-N 3Å
92	V	95.6	Very high	95.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.3	-179.1	-62.2	0	0	0	0	112.3	Y78 G79 I81 F90 F94 I103 G184 M186	Y78-V92 CarbonylContact C-O 3.38Å; Y78-V92 WeakPolarHBondContact CA-O 3.36Å; Y78-V92 VanDerWaalsContact CB-O 3.29Å; Y78-V92 WeakPolarHBondContact CB-O 3.47Å; G79-V92 PolarHBondContact N-O 3.46Å; G79-V92 PolarHBondContact O-N 3.25Å; I81-V92 HydrophobicContact CD1-CG1 3.67Å; I81-V92 HydrophobicContact CD1-CG2 4.05Å; I81-V92 HydrophobicContact CG1-CG1 3.92Å; I81-V92 HydrophobicContact CG1-CG2 4.04Å; I81-V92 HydrophobicContact CG2-CG2 3.77Å; F90-V92 HydrophobicContact CB-CG1 4.46Å; V92-F94 HydrophobicContact CG2-CE2 4.3Å; V92-F94 HydrophobicContact CG2-CZ 4.23Å; V92-I103 HydrophobicContact CG1-CG2 4.29Å; V92-G184 VanDerWaalsContact CA-O 3.25Å; V92-G184 WeakPolarHBondContact CA-O 3.47Å; V92-M186 HydrophobicContact CB-CB 4.17Å; V92-M186 HydrophobicContact CG2-CB 3.79Å
93	I	92.9	Very high	95.7	Very high	14 Å²	14	19.8 Å²	19.8	7%	0.072	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	130.4	159.1	-64.7	-176	0	0	0	107.8	D95 F182 G184 M186	I93-D95 HydrophobicContact CG2-CB 3.95Å; I93-D95 PolarHBondContact O-N 3.34Å; I93-F182 HydrophobicContact CD1-CD1 3.52Å; I93-F182 HydrophobicContact CD1-CE1 3.15Å; I93-F182 HydrophobicContact CD1-CE2 4.4Å; I93-F182 HydrophobicContact CD1-CG 4.29Å; I93-F182 HydrophobicContact CD1-CZ 3.66Å; I93-F182 HydrophobicContact CG1-CB 4.46Å; I93-F182 HydrophobicContact CG1-CD1 3.51Å; I93-F182 HydrophobicContact CG1-CD2 4.41Å; I93-F182 HydrophobicContact CG1-CE1 3.71Å; I93-F182 HydrophobicContact CG1-CG 3.9Å; I93-F182 HydrophobicContact CG1-CZ 4.24Å; I93-G184 PolarHBondContact N-O 3.4Å; I93-M186 PolarHBondContact O-N 3.11Å
94	F	95.5	Very high	95.6	Very high	9 Å²	9	19.8 Å²	19.8	4%	0.039	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	98	164.6	-64.6	-89.6	0	0	0	107.1	I23 L25 I81 V92 M186 M188 I233 F235 T283	I23-F94 HydrophobicContact CG2-CE2 4.21Å; I23-F94 HydrophobicContact CG2-CZ 4.13Å; L25-F94 HydrophobicContact CD2-CD2 3.57Å; L25-F94 HydrophobicContact CD2-CE2 3.72Å; I81-F94 HydrophobicContact CG2-CE1 4.39Å; I81-F94 HydrophobicContact CG2-CZ 4.11Å; V92-F94 HydrophobicContact CG2-CE2 4.3Å; V92-F94 HydrophobicContact CG2-CZ 4.23Å; F94-M186 WeakPolarHBondContact CA-O 3.31Å; F94-M186 HydrophobicContact CD1-CB 4.48Å; F94-M186 HydrophobicContact CD1-CE 4.07Å; F94-M186 HydrophobicContact CD1-CG 4.39Å; F94-M186 HydrophobicContact CD1-SD 3.86Å; F94-M186 HydrophobicContact CE1-CE 3.91Å; F94-M186 HydrophobicContact CE1-SD 3.55Å; F94-M186 VanDerWaalsContact CE1-SD 3.55Å; F94-M188 HydrophobicContact CB-CG 4.05Å; F94-M188 HydrophobicContact CD1-CG 4.48Å; F94-M188 HydrophobicContact CD1-SD 4.21Å; F94-I233 HydrophobicContact CB-CD1 3.99Å; F94-I233 HydrophobicContact CD1-CD1 4Å; F94-I233 HydrophobicContact CD1-CG2 4.4Å; F94-I233 HydrophobicContact CD2-CG2 4.09Å; F94-I233 HydrophobicContact CE1-CG2 4.39Å; F94-I233 HydrophobicContact CE2-CG2 4.08Å; F94-I233 HydrophobicContact CG-CD1 4.03Å; F94-I233 HydrophobicContact CG-CG2 4.25Å; F94-I233 HydrophobicContact CZ-CG2 4.24Å; F94-F235 HydrophobicContact CD1-CZ 4.08Å; F94-F235 HydrophobicContact CE1-CE2 4.37Å; F94-F235 AromaticContact CE1-CZ 3.87Å; F94-F235 HydrophobicContact CE1-CZ 3.87Å; F94-T283 WeakPolarHBondContact O-CB 3.11Å; F94-T283 PolarHBondContact O-OG1 3.06Å
95	D	94	Very high	95.6	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	108.2	-165.6	174.4	10.7	0	0	0	110.8	I93 G97 S98 I185 M186 G187 M188 G284	I93-D95 HydrophobicContact CG2-CB 3.95Å; I93-D95 PolarHBondContact O-N 3.34Å; D95-G97 VanDerWaalsContact C-N 3.26Å; D95-G97 PolarHBondContact O-N 3.39Å; D95-G97 VanDerWaalsContact OD1-CA 3.31Å; D95-G97 WeakPolarHBondContact OD1-CA 3.07Å; D95-G97 PolarHBondContact OD1-N 3.5Å; D95-S98 VanDerWaalsContact CG-OG 3.31Å; D95-S98 PolarHBondContact OD1-N 2.54Å; D95-S98 VanDerWaalsContact OD2-CB 3.3Å; D95-S98 WeakPolarHBondContact OD2-CB 3.22Å; D95-S98 PolarHBondContact OD2-OG 3.06Å; D95-I185 HydrophobicContact CB-CG2 3.5Å; D95-M186 PolarHBondContact N-O 2.95Å; D95-G187 CarbonylContact O-C 3.43Å; D95-G187 WeakPolarHBondContact O-CA 3.27Å; D95-M188 PolarHBondContact O-N 3.47Å; D95-G284 WeakPolarHBondContact OD1-CA 3.21Å
96	T	94.3	Very high	95.6	Very high	1 Å²	1	23 Å²	23	1%	0.006	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.1	176.4	57	0	0	0	0	113.6	M188 F217 I281 D282 T283 F382	T96-M188 HydrophobicContact CG2-CB 3.78Å; T96-F217 HydrophobicContact CG2-CE2 3.8Å; T96-F217 HydrophobicContact CG2-CZ 3.9Å; T96-I281 PolarHBondContact OG1-O 3.36Å; T96-D282 VanDerWaalsContact OG1-CA 3.28Å; T96-D282 WeakPolarHBondContact OG1-CA 3.41Å; T96-T283 HydrophobicContact CG2-CG2 4.16Å; T96-T283 WeakPolarHBondContact CG2-OG1 3.33Å; T96-T283 PolarHBondContact N-OG1 2.81Å; T96-T283 PolarHBondContact OG1-N 3.04Å; T96-T283 PolarHBondContact OG1-OG1 2.77Å; T96-F382 HydrophobicContact CG2-CD1 4.27Å; T96-F382 HydrophobicContact CG2-CD2 4.45Å; T96-F382 HydrophobicContact CG2-CE1 3.83Å; T96-F382 HydrophobicContact CG2-CE2 4.04Å; T96-F382 HydrophobicContact CG2-CZ 3.71Å
97	G	90.1	Very high	95.5	Very high	3 Å²	3	24.1 Å²	24.1	3%	0.031	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-16.1	173.2	0	0	0	0	0	114.1	D95 D282	D95-G97 VanDerWaalsContact C-N 3.26Å; D95-G97 PolarHBondContact O-N 3.39Å; D95-G97 VanDerWaalsContact OD1-CA 3.31Å; D95-G97 WeakPolarHBondContact OD1-CA 3.07Å; D95-G97 PolarHBondContact OD1-N 3.5Å; G97-D282 WeakPolarHBondContact CA-OD1 3.34Å; G97-D282 PolarHBondContact N-OD1 3.18Å; G97-D282 VanDerWaalsContact N-OD1 3.11Å
98	S	89.3	Confident	95.4	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.007	10%	0.098	C	C	.	.			trans	-134.3	160.4	178.8	73.2	0	0	0	0	113.8	E67 D95 G187 M188 G189	E67-S98 WeakPolarHBondContact OE2-CB 3.26Å; D95-S98 VanDerWaalsContact CG-OG 3.31Å; D95-S98 PolarHBondContact OD1-N 2.54Å; D95-S98 VanDerWaalsContact OD2-CB 3.3Å; D95-S98 WeakPolarHBondContact OD2-CB 3.22Å; D95-S98 PolarHBondContact OD2-OG 3.06Å; S98-G187 CarbonylContact O-C 3.57Å; S98-G187 VanDerWaalsContact O-C 3.28Å; S98-G187 WeakPolarHBondContact O-CA 3.24Å; S98-M188 PolarHBondContact O-N 3.12Å; S98-G189 PolarHBondContact O-N 2.62Å
99	P	90.5	Very high	95	Very high	2 Å²	2	24 Å²	24	1%	0.013	12%	0.115	C	C	.	.			trans	-100	-14.5	-176.3	37.2	-37.1	0	0	0	114.8	E67 F190 Q192 P201	E67-P99 WeakPolarHBondContact OE1-CD 3.41Å; P99-F190 WeakPolarHBondContact CB-O 3.34Å; P99-Q192 HydrophobicContact CG-CG 4.04Å; P99-P201 HydrophobicContact CB-CG 4.14Å
100	Y	92.1	Very high	94.6	Very high	13 Å²	13	25 Å²	25	5%	0.051	13%	0.127	C	C	.	.			trans	-101.3	134.9	-164.3	-55.7	-46.6	0	0	0	113.5	F136 V138 G187 Q192 N198 P199	Y100-F136 HydrophobicContact CD2-CE2 4.15Å; Y100-F136 HydrophobicContact CG-CE2 4.04Å; Y100-V138 HydrophobicContact CD2-CG2 4.48Å; Y100-G187 PolarHBondContact O-N 3.44Å; Y100-Q192 PolarHBondContact OH-OE1 2.85Å; Y100-N198 HydrophobicContact CE1-CB 4.12Å; Y100-N198 PolarHBondContact OH-ND2 2.89Å; Y100-P199 HydrophobicContact CD1-CG 3.55Å; Y100-P199 HydrophobicContact CE1-CG 3.94Å; Y100-P199 HydrophobicContact CG-CG 4.36Å
101	L	97.1	Very high	94.2	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	129.4	163.4	174	61	0	0	0	109.6	I81 I83 V154 Q164 F166 G167 I185 M186 I202	I81-L101 HydrophobicContact CD1-CD1 3.82Å; I83-L101 HydrophobicContact CD1-CD2 4.3Å; L101-V154 HydrophobicContact CD2-CG1 4.43Å; L101-V154 HydrophobicContact CD2-CG2 3.95Å; L101-Q164 HydrophobicContact CD2-CG 4.19Å; L101-F166 HydrophobicContact CB-CB 4.02Å; L101-F166 HydrophobicContact CD2-CB 3.87Å; L101-F166 HydrophobicContact CG-CB 3.7Å; L101-F166 CarbonylContact O-C 3.58Å; L101-F166 VanDerWaalsContact O-CA 3.29Å; L101-F166 WeakPolarHBondContact O-CA 3.36Å; L101-F166 WeakPolarHBondContact O-CB 3.42Å; L101-G167 PolarHBondContact O-N 2.67Å; L101-I185 CarbonylContact C-O 3.55Å; L101-I185 VanDerWaalsContact CA-O 3.31Å; L101-I185 WeakPolarHBondContact CA-O 3.4Å; L101-I185 WeakPolarHBondContact CD1-O 3.28Å; L101-M186 HydrophobicContact CD1-CB 3.85Å; L101-M186 HydrophobicContact CD1-CG 4.16Å; L101-I202 HydrophobicContact CD2-CD1 4.07Å
102	W	96.9	Very high	93.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	147.2	167.3	64.6	-94.8	0	0	0	112	F136 Y140 A145 G167 V169 F177 G184 I185	W102-F136 HydrophobicContact CB-CD1 4.49Å; W102-F136 HydrophobicContact CB-CE1 3.57Å; W102-F136 HydrophobicContact CB-CZ 3.8Å; W102-F136 AromaticContact CD1-CZ 3.89Å; W102-F136 AromaticContact CG-CE1 3.91Å; W102-F136 HydrophobicContact CG-CE1 3.91Å; W102-F136 HydrophobicContact CG-CZ 4.1Å; W102-Y140 HydrophobicContact CZ2-CE2 4.08Å; W102-Y140 AromaticContact NE1-CE2 3.5Å; W102-Y140 AromaticContact NE1-CZ 3.56Å; W102-Y140 PolarHBondContact NE1-OH 2.97Å; W102-A145 HydrophobicContact CD2-CB 4.24Å; W102-A145 HydrophobicContact CE3-CB 4.49Å; W102-A145 HydrophobicContact CH2-CB 4.44Å; W102-A145 HydrophobicContact CZ2-CB 4.15Å; W102-G167 VanDerWaalsContact CA-O 3.27Å; W102-G167 WeakPolarHBondContact CA-O 3.44Å; W102-G167 WeakPolarHBondContact CB-O 3.37Å; W102-V169 HydrophobicContact CB-CG2 3.79Å; W102-V169 HydrophobicContact CD2-CG2 3.87Å; W102-V169 HydrophobicContact CE3-CB 4.08Å; W102-V169 HydrophobicContact CE3-CG1 4.49Å; W102-V169 HydrophobicContact CE3-CG2 3.61Å; W102-V169 HydrophobicContact CG-CG2 3.99Å; W102-V169 HydrophobicContact CZ3-CG2 4.49Å; W102-F177 HydrophobicContact CH2-CD1 4.02Å; W102-F177 HydrophobicContact CH2-CE1 4.04Å; W102-F177 HydrophobicContact CH2-CG 4.47Å; W102-F177 HydrophobicContact CH2-CZ 4.49Å; W102-F177 HydrophobicContact CZ2-CD1 4.41Å; W102-F177 AromaticContact CZ2-CE1 3.97Å; W102-F177 HydrophobicContact CZ2-CE1 3.97Å; W102-F177 HydrophobicContact CZ2-CZ 4.24Å; W102-G184 WeakPolarHBondContact O-CA 3.38Å; W102-I185 HydrophobicContact CH2-CG1 4.36Å; W102-I185 HydrophobicContact CZ2-CB 4.07Å; W102-I185 HydrophobicContact CZ2-CD1 3.55Å; W102-I185 HydrophobicContact CZ2-CG1 3.59Å; W102-I185 PolarHBondContact N-O 3.42Å; W102-I185 PolarHBondContact O-N 2.81Å; W102-I185 VanDerWaalsContact O-N 3.09Å
103	I	98.2	Very high	93.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	159	173.8	50.3	58.9	0	0	0	110.6	I83 F90 V92 Y121 F166 G167 V169	I83-I103 HydrophobicContact CD1-CG1 3.77Å; I83-I103 HydrophobicContact CD1-CG2 4.43Å; F90-I103 HydrophobicContact CB-CG2 4.2Å; F90-I103 HydrophobicContact CD1-CB 4.2Å; F90-I103 HydrophobicContact CD1-CG2 4.14Å; F90-I103 HydrophobicContact CD2-CG2 4.41Å; F90-I103 HydrophobicContact CE1-CB 4.39Å; F90-I103 HydrophobicContact CG-CB 4.46Å; F90-I103 HydrophobicContact CG-CG2 3.98Å; F90-I103 HydrophobicContact CZ-CG1 4.47Å; V92-I103 HydrophobicContact CG1-CG2 4.29Å; I103-Y121 HydrophobicContact CD1-CD1 4.29Å; I103-Y121 HydrophobicContact CD1-CG 3.86Å; I103-F166 HydrophobicContact CD1-CD2 3.98Å; I103-F166 HydrophobicContact CD1-CE2 3.54Å; I103-F166 HydrophobicContact CG1-CD2 4.04Å; I103-F166 HydrophobicContact CG1-CE2 3.98Å; I103-G167 PolarHBondContact N-O 3.07Å; I103-V169 PolarHBondContact O-N 3.22Å
104	P	97.7	Very high	93.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	136.4	176.7	-21.2	34	0	0	0	111.1	C115 H118 K120 Y121 D183	P104-C115 HydrophobicContact CB-CB 4.47Å; P104-H118 HydrophobicContact CG-CB 4.16Å; P104-K120 HydrophobicContact CB-CG 4.1Å; P104-K120 CarbonylContact O-C 3.22Å; P104-K120 VanDerWaalsContact O-CA 3.29Å; P104-K120 WeakPolarHBondContact O-CA 3.32Å; P104-Y121 PolarHBondContact O-N 2.79Å; P104-D183 WeakPolarHBondContact CD-O 3.48Å; P104-D183 WeakPolarHBondContact CG-O 3.41Å
105	S	98.4	Very high	93.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-92.4	143.2	178.1	179.1	0	0	0	0	111.2	K107 C108 C115 E168 V169	S105-K107 PolarHBondContact O-N 3.46Å; S105-K107 WeakPolarHBondContact OG-CB 3.26Å; S105-K107 PolarHBondContact OG-N 3.43Å; S105-K107 VanDerWaalsContact OG-N 3.1Å; S105-C108 WeakPolarHBondContact O-CB 3.18Å; S105-C108 PolarHBondContact O-N 3.27Å; S105-C108 PolarHBondContact O-SG 3.04Å; S105-C115 PolarHBondContact O-SG 3.16Å; S105-C115 VanDerWaalsContact O-SG 3.36Å; S105-E168 WeakPolarHBondContact CB-OE2 3.38Å; S105-E168 PolarHBondContact OG-OE2 3.38Å; S105-V169 WeakPolarHBondContact CB-O 3.38Å; S105-V169 PolarHBondContact N-O 3.09Å
106	K	97.5	Very high	93.1	Very high	116 Å²	116	35.1 Å²	35.1	50%	0.504	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.8	168	-175.7	179.2	175.5	-167.6	0	112.7	C108 K120 Y121 D122	K106-C108 VanDerWaalsContact C-N 3.26Å; K106-C108 PolarHBondContact O-N 2.88Å; K106-K120 HydrophobicContact CB-CB 4.34Å; K106-Y121 VanDerWaalsContact CB-O 3.27Å; K106-Y121 WeakPolarHBondContact CB-O 3.35Å; K106-Y121 PolarHBondContact N-O 3.38Å; K106-D122 HydrophobicContact CB-CB 4.38Å; K106-D122 HydrophobicContact CD-CB 3.73Å; K106-D122 WeakPolarHBondContact CD-OD2 3.44Å; K106-D122 WeakPolarHBondContact CE-OD2 3.12Å; K106-D122 IonicContact NZ-OD1 3.36Å; K106-D122 IonicContact NZ-OD2 2.64Å; K106-D122 PolarHBondContact NZ-OD2 3.09Å
107	K	96.9	Very high	92.9	Very high	105 Å²	105	40.3 Å²	40.3	46%	0.457	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.4	178.9	-56.2	175.9	-164.2	131.2	0	113.3	S105 S123 F148 E168 I170	S105-K107 PolarHBondContact O-N 3.46Å; S105-K107 WeakPolarHBondContact OG-CB 3.26Å; S105-K107 PolarHBondContact OG-N 3.43Å; S105-K107 VanDerWaalsContact OG-N 3.1Å; K107-S123 PolarHBondContact NZ-OG 3.44Å; K107-F148 HydrophobicContact CD-CE1 4.24Å; K107-F148 HydrophobicContact CD-CZ 3.77Å; K107-E168 IonicContact NZ-OE1 3.02Å; K107-E168 PolarHBondContact NZ-OE1 3.23Å; K107-E168 IonicContact NZ-OE2 2.74Å; K107-E168 PolarHBondContact NZ-OE2 3.02Å; K107-I170 HydrophobicContact CB-CG2 4.32Å
108	C	95.5	Very high	93.1	Very high	8 Å²	8	40.9 Å²	40.9	5%	0.054	22%	0.218	C	C	.	.	S	Bend	trans	-63.8	151.8	174.7	71.7	0	0	0	0	111.8	S105 K106 C115 Q116 I170	S105-C108 WeakPolarHBondContact O-CB 3.18Å; S105-C108 PolarHBondContact O-N 3.27Å; S105-C108 PolarHBondContact O-SG 3.04Å; K106-C108 VanDerWaalsContact C-N 3.26Å; K106-C108 PolarHBondContact O-N 2.88Å; C108-C115 HydrophobicContact CB-CB 3.69Å; C108-C115 WeakPolarHBondContact CB-SG 3.32Å; C108-C115 WeakPolarHBondContact SG-CB 3.44Å; C108-C115 CovalentContact SG-SG 2.01Å; C108-C115 PolarHBondContact SG-SG 2.75Å; C108-Q116 PolarHBondContact SG-NE2 2.72Å; C108-Q116 VanDerWaalsContact SG-NE2 3.42Å; C108-I170 HydrophobicContact CB-CB 4.27Å; C108-I170 WeakPolarHBondContact CB-O 3.43Å
109	D	91.6	Very high	93.4	Very high	92 Å²	92	45.6 Å²	45.6	49%	0.492	24%	0.239	S	C	.	.			trans	-65.9	141.9	-179.5	-169.2	-84.5	0	0	0	110.9	S111 N112 Q116	D109-S111 PolarHBondContact O-N 2.84Å; D109-S111 VanDerWaalsContact O-N 3.1Å; D109-S111 WeakPolarHBondContact OD1-CA 3.33Å; D109-S111 WeakPolarHBondContact OD1-CB 3.18Å; D109-S111 PolarHBondContact OD1-N 3.05Å; D109-S111 PolarHBondContact OD1-OG 3.22Å; D109-N112 WeakPolarHBondContact O-CB 3.25Å; D109-N112 PolarHBondContact O-N 2.84Å; D109-Q116 PolarHBondContact O-NE2 3.34Å
110	P	90	Very high	93.8	Very high	108 Å²	108	48.4 Å²	48.4	70%	0.701	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.1	174.4	-27.7	36.2	0	0	0	114.7	N112 Q116	P110-N112 VanDerWaalsContact C-N 3.33Å; P110-Q116 WeakPolarHBondContact O-CG 3.49Å
111	S	89	Confident	94.1	Very high	96 Å²	96	47.8 Å²	47.8	67%	0.671	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-10.9	174.8	69	0	0	0	0	114.2	D109 L113	D109-S111 PolarHBondContact O-N 2.84Å; D109-S111 VanDerWaalsContact O-N 3.1Å; D109-S111 WeakPolarHBondContact OD1-CA 3.33Å; D109-S111 WeakPolarHBondContact OD1-CB 3.18Å; D109-S111 PolarHBondContact OD1-N 3.05Å; D109-S111 PolarHBondContact OD1-OG 3.22Å; S111-L113 PolarHBondContact O-N 3.02Å
112	N	88.9	Confident	94.1	Very high	15 Å²	15	48 Å²	48	8%	0.08	25%	0.25	C	S	.	.			trans	-77.5	92.7	175	-169.2	-68.5	0	0	0	110.5	D109 P110 A114 C115 Q116 Q172	D109-N112 WeakPolarHBondContact O-CB 3.25Å; D109-N112 PolarHBondContact O-N 2.84Å; P110-N112 VanDerWaalsContact C-N 3.33Å; N112-A114 VanDerWaalsContact C-N 3.34Å; N112-A114 PolarHBondContact O-N 2.86Å; N112-A114 PolarHBondContact OD1-N 2.9Å; N112-C115 HydrophobicContact CB-CB 4.06Å; N112-C115 PolarHBondContact O-N 2.91Å; N112-C115 VanDerWaalsContact OD1-CB 3.28Å; N112-C115 WeakPolarHBondContact OD1-CB 3.32Å; N112-C115 PolarHBondContact OD1-N 3.49Å; N112-Q116 WeakPolarHBondContact O-CG 3.42Å; N112-Q116 PolarHBondContact O-N 3.09Å; N112-Q172 PolarHBondContact ND2-N 3.29Å; N112-Q172 PolarHBondContact ND2-O 2.67Å
113	L	89.3	Confident	94.2	Very high	95 Å²	95	48.8 Å²	48.8	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-57.5	-41.5	-175.2	-177.7	60.7	0	0	0	113.6	S111 Q116 L117 V178	S111-L113 PolarHBondContact O-N 3.02Å; L113-Q116 PolarHBondContact O-N 3.09Å; L113-L117 HydrophobicContact CD1-CD1 3.75Å; L113-L117 HydrophobicContact CD1-CG 4.05Å; L113-L117 HydrophobicContact CG-CD1 3.89Å; L113-L117 WeakPolarHBondContact O-CG 3.38Å; L113-L117 PolarHBondContact O-N 3.1Å; L113-L117 VanDerWaalsContact O-N 3.09Å; L113-V178 HydrophobicContact CB-CG2 4.33Å; L113-V178 HydrophobicContact CD2-CG1 3.8Å; L113-V178 HydrophobicContact CD2-CG2 4.31Å; L113-V178 HydrophobicContact CG-CG1 3.96Å; L113-V178 HydrophobicContact CG-CG2 4.24Å
114	A	87.9	Confident	94.2	Very high	2 Å²	2	53.3 Å²	53.3	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-51.1	178.7	0	0	0	0	0	110.4	N112 Q116 L117 H118 Q172 F177 V178	N112-A114 VanDerWaalsContact C-N 3.34Å; N112-A114 PolarHBondContact O-N 2.86Å; N112-A114 PolarHBondContact OD1-N 2.9Å; A114-Q116 VanDerWaalsContact C-N 3.29Å; A114-Q116 PolarHBondContact O-N 3.49Å; A114-L117 PolarHBondContact O-N 3.16Å; A114-H118 PolarHBondContact O-N 2.82Å; A114-H118 PolarHBondContact O-ND1 2.89Å; A114-Q172 HydrophobicContact CB-CB 4.01Å; A114-F177 HydrophobicContact CB-CB 4.02Å; A114-V178 HydrophobicContact CB-CG2 3.79Å
115	C	91.2	Very high	94.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.9	-35.5	177.8	-173.6	0	0	0	0	112.9	P104 S105 C108 N112 K120	P104-C115 HydrophobicContact CB-CB 4.47Å; S105-C115 PolarHBondContact O-SG 3.16Å; S105-C115 VanDerWaalsContact O-SG 3.36Å; C108-C115 HydrophobicContact CB-CB 3.69Å; C108-C115 WeakPolarHBondContact CB-SG 3.32Å; C108-C115 WeakPolarHBondContact SG-CB 3.44Å; C108-C115 CovalentContact SG-SG 2.01Å; C108-C115 PolarHBondContact SG-SG 2.75Å; N112-C115 HydrophobicContact CB-CB 4.06Å; N112-C115 PolarHBondContact O-N 2.91Å; N112-C115 VanDerWaalsContact OD1-CB 3.28Å; N112-C115 WeakPolarHBondContact OD1-CB 3.32Å; N112-C115 PolarHBondContact OD1-N 3.49Å; C115-K120 WeakPolarHBondContact O-CD 3.35Å; C115-K120 WeakPolarHBondContact O-CG 3.18Å; C115-K120 PolarHBondContact O-NZ 3.21Å; C115-K120 VanDerWaalsContact SG-CD 3.58Å
116	Q	91.9	Very high	94.2	Very high	78 Å²	78	59.9 Å²	59.9	36%	0.364	32%	0.317	S	S	.	.	H	α-helix	trans	-70.4	-32	179.4	-65.2	-44	-44.9	0	0	113.3	C108 D109 P110 N112 L113 A114 K120	C108-Q116 PolarHBondContact SG-NE2 2.72Å; C108-Q116 VanDerWaalsContact SG-NE2 3.42Å; D109-Q116 PolarHBondContact O-NE2 3.34Å; P110-Q116 WeakPolarHBondContact O-CG 3.49Å; N112-Q116 WeakPolarHBondContact O-CG 3.42Å; N112-Q116 PolarHBondContact O-N 3.09Å; L113-Q116 PolarHBondContact O-N 3.09Å; A114-Q116 VanDerWaalsContact C-N 3.29Å; A114-Q116 PolarHBondContact O-N 3.49Å; Q116-K120 PolarHBondContact O-NZ 2.9Å
117	L	90.6	Very high	94.3	Very high	109 Å²	109	61.6 Å²	61.6	57%	0.571	33%	0.331	S	S	*	.	H	α-helix	trans	-82.5	-10.5	-179.1	-70.8	171.9	0	0	0	114.6	L113 A114 V178	L113-L117 HydrophobicContact CD1-CD1 3.75Å; L113-L117 HydrophobicContact CD1-CG 4.05Å; L113-L117 HydrophobicContact CG-CD1 3.89Å; L113-L117 WeakPolarHBondContact O-CG 3.38Å; L113-L117 PolarHBondContact O-N 3.1Å; L113-L117 VanDerWaalsContact O-N 3.09Å; A114-L117 PolarHBondContact O-N 3.16Å; L117-V178 HydrophobicContact CD1-CG1 3.76Å
118	H	93.7	Very high	94.4	Very high	16 Å²	16	59 Å²	59	7%	0.074	32%	0.324	C	S	.	.	S	Bend	trans	-112.8	164.4	-178.3	-66.3	89.5	0	0	0	112.4	P104 A114 K120 F177 F180 F182 D183	P104-H118 HydrophobicContact CG-CB 4.16Å; A114-H118 PolarHBondContact O-N 2.82Å; A114-H118 PolarHBondContact O-ND1 2.89Å; H118-K120 PolarHBondContact O-NZ 2.8Å; H118-F177 PolarHBondContact CE1-O 3.4Å; H118-F180 PolarHBondContact NE2-O 3.29Å; H118-F182 PolarHBondContact CD2-O 3.02Å; H118-F182 PolarHBondContact NE2-O 2.76Å; H118-D183 HydrophobicContact CB-CB 4.34Å; H118-D183 WeakPolarHBondContact CB-OD1 3.1Å; H118-D183 IonicContact CD2-OD1 3.7Å; H118-D183 IonicContact CG-OD1 3.64Å
119	H	96.7	Very high	94.5	Very high	99 Å²	99	61.5 Å²	61.5	46%	0.458	33%	0.333	S	S	.	.			trans	-60.9	142	169.7	-59.7	119.4	0	0	0	110.3	F90 D183	F90-H119 HydrophobicContact CD1-CB 3.86Å; F90-H119 HydrophobicContact CE1-CB 3.99Å; H119-D183 HydrophobicContact CB-CB 4.48Å; H119-D183 WeakPolarHBondContact CB-OD1 3.25Å; H119-D183 IonicContact CE1-OD2 2.79Å; H119-D183 IonicContact CG-OD1 2.65Å; H119-D183 IonicContact CG-OD2 3.56Å; H119-D183 PolarHBondContact N-OD1 3.22Å; H119-D183 IonicContact ND1-OD1 3.42Å; H119-D183 PolarHBondContact ND1-OD1 2.74Å; H119-D183 IonicContact ND1-OD2 3.69Å; H119-D183 PolarHBondContact ND1-OD2 3.24Å
120	K	97.9	Very high	94.9	Very high	61 Å²	61	61.8 Å²	61.8	27%	0.265	33%	0.329	S	S	.	.			trans	-124.3	129.5	-174.5	-77.7	168.8	-72.4	-63.2	0	109.9	P104 K106 C115 Q116 H118 D122	P104-K120 HydrophobicContact CB-CG 4.1Å; P104-K120 CarbonylContact O-C 3.22Å; P104-K120 VanDerWaalsContact O-CA 3.29Å; P104-K120 WeakPolarHBondContact O-CA 3.32Å; K106-K120 HydrophobicContact CB-CB 4.34Å; C115-K120 WeakPolarHBondContact O-CD 3.35Å; C115-K120 WeakPolarHBondContact O-CG 3.18Å; C115-K120 PolarHBondContact O-NZ 3.21Å; C115-K120 VanDerWaalsContact SG-CD 3.58Å; Q116-K120 PolarHBondContact O-NZ 2.9Å; H118-K120 PolarHBondContact O-NZ 2.8Å; K120-D122 PolarHBondContact O-N 2.9Å
121	Y	98.7	Very high	95.2	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-70.4	128.6	172.7	175.9	-103	0	0	0	111.4	I83 F90 I103 P104 K106 Y129 D152 F166 E168	I83-Y121 HydrophobicContact CB-CD2 4.14Å; I83-Y121 HydrophobicContact CB-CE2 4.16Å; I83-Y121 HydrophobicContact CG2-CD2 4.06Å; I83-Y121 HydrophobicContact CG2-CE2 3.68Å; F90-Y121 HydrophobicContact CE2-CD2 4.39Å; F90-Y121 HydrophobicContact CZ-CD2 4.27Å; F90-Y121 HydrophobicContact CZ-CG 4.46Å; I103-Y121 HydrophobicContact CD1-CD1 4.29Å; I103-Y121 HydrophobicContact CD1-CG 3.86Å; P104-Y121 PolarHBondContact O-N 2.79Å; K106-Y121 VanDerWaalsContact CB-O 3.27Å; K106-Y121 WeakPolarHBondContact CB-O 3.35Å; K106-Y121 PolarHBondContact N-O 3.38Å; Y121-Y129 HydrophobicContact CE1-CD2 4.45Å; Y121-Y129 WeakPolarHBondContact OH-CD2 3.45Å; Y121-D152 PolarHBondContact OH-OD2 3.47Å; Y121-F166 HydrophobicContact CD1-CE2 4.13Å; Y121-F166 AromaticContact CD1-CZ 3.97Å; Y121-F166 HydrophobicContact CD1-CZ 3.97Å; Y121-F166 HydrophobicContact CD2-CZ 4.49Å; Y121-F166 HydrophobicContact CE1-CE2 4.29Å; Y121-F166 AromaticContact CE1-CZ 3.7Å; Y121-F166 HydrophobicContact CE1-CZ 3.7Å; Y121-F166 HydrophobicContact CE2-CZ 4.25Å; Y121-F166 HydrophobicContact CG-CE2 4.43Å; Y121-F166 HydrophobicContact CG-CZ 4.36Å; Y121-F166 AromaticContact CZ-CZ 3.86Å; Y121-E168 HydrophobicContact CD1-CG 3.84Å; Y121-E168 HydrophobicContact CE1-CG 4.25Å
122	D	98.6	Very high	95.5	Very high	9 Å²	9	60.6 Å²	60.6	5%	0.048	32%	0.316	C	S	.	.			trans	-110.8	94.1	177.8	-171.6	-8.4	0	0	0	109.3	Q88 K106 K120 S124 K125	Q88-D122 PolarHBondContact NE2-O 3.1Å; Q88-D122 VanDerWaalsContact NE2-O 3.1Å; K106-D122 HydrophobicContact CB-CB 4.38Å; K106-D122 HydrophobicContact CD-CB 3.73Å; K106-D122 WeakPolarHBondContact CD-OD2 3.44Å; K106-D122 WeakPolarHBondContact CE-OD2 3.12Å; K106-D122 IonicContact NZ-OD1 3.36Å; K106-D122 IonicContact NZ-OD2 2.64Å; K106-D122 PolarHBondContact NZ-OD2 3.09Å; K120-D122 PolarHBondContact O-N 2.9Å; D122-S124 PolarHBondContact O-N 2.88Å; D122-S124 VanDerWaalsContact O-N 3.09Å; D122-S124 WeakPolarHBondContact OD1-CB 3.43Å; D122-S124 PolarHBondContact OD1-N 3.08Å; D122-S124 PolarHBondContact OD1-OG 2.86Å; D122-K125 HydrophobicContact CB-CB 4.39Å; D122-K125 HydrophobicContact CB-CD 3.92Å; D122-K125 HydrophobicContact CB-CG 4.09Å; D122-K125 PolarHBondContact O-N 2.91Å; D122-K125 WeakPolarHBondContact OD2-CD 3.38Å; D122-K125 WeakPolarHBondContact OD2-CE 3.41Å; D122-K125 WeakPolarHBondContact OD2-CG 3.12Å; D122-K125 IonicContact OD2-NZ 3.39Å
123	S	98.3	Very high	95.7	Very high	15 Å²	15	62.3 Å²	62.3	11%	0.105	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-58.4	-24.9	-179.4	72.9	0	0	0	0	112.9	K107 K125 S126	K107-S123 PolarHBondContact NZ-OG 3.44Å; S123-K125 VanDerWaalsContact C-N 3.25Å; S123-K125 PolarHBondContact O-N 2.8Å; S123-S126 PolarHBondContact O-N 3.39Å
124	S	98.3	Very high	95.8	Very high	96 Å²	96	59.2 Å²	59.2	67%	0.671	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-73.5	-15.9	179	72	0	0	0	0	114	D122	D122-S124 PolarHBondContact O-N 2.88Å; D122-S124 VanDerWaalsContact O-N 3.09Å; D122-S124 WeakPolarHBondContact OD1-CB 3.43Å; D122-S124 PolarHBondContact OD1-N 3.08Å; D122-S124 PolarHBondContact OD1-OG 2.86Å
125	K	98.3	Very high	96	Very high	126 Å²	126	61.5 Å²	61.5	55%	0.548	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-89.4	-18.4	176.3	-69.8	-179.6	-178.5	166.5	0	113	P86 D122 S123	P86-K125 WeakPolarHBondContact CD-O 3.45Å; D122-K125 HydrophobicContact CB-CB 4.39Å; D122-K125 HydrophobicContact CB-CD 3.92Å; D122-K125 HydrophobicContact CB-CG 4.09Å; D122-K125 PolarHBondContact O-N 2.91Å; D122-K125 WeakPolarHBondContact OD2-CD 3.38Å; D122-K125 WeakPolarHBondContact OD2-CE 3.41Å; D122-K125 WeakPolarHBondContact OD2-CG 3.12Å; D122-K125 IonicContact OD2-NZ 3.39Å; S123-K125 VanDerWaalsContact C-N 3.25Å; S123-K125 PolarHBondContact O-N 2.8Å
126	S	98.6	Very high	96	Very high	12 Å²	12	61.9 Å²	61.9	8%	0.084	34%	0.338	C	S	.	.			trans	-92.3	126.4	-175.6	-178.5	0	0	0	0	112	G84 T85 S123 T128 Y129 D152	G84-S126 WeakPolarHBondContact CA-OG 3.49Å; T85-S126 PolarHBondContact N-OG 2.69Å; T85-S126 CarbonylContact O-C 3.54Å; T85-S126 WeakPolarHBondContact O-CA 3.23Å; S123-S126 PolarHBondContact O-N 3.39Å; S126-T128 VanDerWaalsContact C-N 3.33Å; S126-T128 PolarHBondContact OG-N 3.43Å; S126-T128 PolarHBondContact OG-OG1 3.49Å; S126-Y129 PolarHBondContact OG-N 2.74Å; S126-D152 WeakPolarHBondContact CB-OD2 3.01Å; S126-D152 VanDerWaalsContact OG-CG 3.29Å; S126-D152 PolarHBondContact OG-OD1 3.39Å; S126-D152 PolarHBondContact OG-OD2 2.92Å
127	L	98.4	Very high	95.9	Very high	151 Å²	151	61 Å²	61	79%	0.791	33%	0.332	S	S	*	.	S	Bend	trans	-76.8	-20	174.3	-62.1	174.2	0	0	0	112.8	T85	T85-L127 WeakPolarHBondContact O-CB 3.2Å; T85-L127 WeakPolarHBondContact O-CG 3.5Å; T85-L127 PolarHBondContact O-N 3.39Å
128	T	98.6	Very high	95.6	Very high	50 Å²	50	56 Å²	56	31%	0.307	31%	0.306	S	S	.	.	S	Bend	trans	-99.8	-2	-179.3	45.2	0	0	0	0	113.2	T85 S126 K130 D152	T85-T128 WeakPolarHBondContact CB-OG1 3.26Å; T85-T128 PolarHBondContact N-OG1 3.27Å; T85-T128 VanDerWaalsContact OG1-CG2 3.29Å; T85-T128 WeakPolarHBondContact OG1-CG2 3.42Å; T85-T128 PolarHBondContact OG1-OG1 2.63Å; S126-T128 VanDerWaalsContact C-N 3.33Å; S126-T128 PolarHBondContact OG-N 3.43Å; S126-T128 PolarHBondContact OG-OG1 3.49Å; T128-K130 PolarHBondContact O-N 3.31Å; T128-D152 WeakPolarHBondContact CB-OD1 3.16Å; T128-D152 PolarHBondContact OG1-OD1 3.47Å
129	Y	98.7	Very high	95	Very high	62 Å²	62	58 Å²	58	24%	0.243	32%	0.315	C	S	.	.			trans	-60.5	132.8	177.6	166.6	-111.6	0	0	0	112.2	Y121 S126 P131 D152	Y121-Y129 HydrophobicContact CE1-CD2 4.45Å; Y121-Y129 WeakPolarHBondContact OH-CD2 3.45Å; S126-Y129 PolarHBondContact OG-N 2.74Å; Y129-P131 HydrophobicContact CE1-CB 4.23Å; Y129-P131 WeakPolarHBondContact OH-CA 3.27Å; Y129-D152 PolarHBondContact N-OD1 2.93Å
130	K	98.4	Very high	94.2	Very high	97 Å²	97	53.3 Å²	53.3	42%	0.422	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.5	172.7	-65.2	176.7	-178.9	177.9	0	109.2	T128 S151 D163	T128-K130 PolarHBondContact O-N 3.31Å; K130-S151 PolarHBondContact N-O 3.2Å; K130-S151 PolarHBondContact O-N 3.37Å; K130-S151 VanDerWaalsContact O-N 3.08Å; K130-D163 WeakPolarHBondContact CE-OD1 3.49Å; K130-D163 IonicContact NZ-OD1 3.81Å; K130-D163 PolarHBondContact NZ-OD1 3.12Å; K130-D163 IonicContact NZ-OD2 3.68Å; K130-D163 PolarHBondContact NZ-OD2 2.9Å
131	P	97.2	Very high	92.8	Very high	103 Å²	103	52 Å²	52	67%	0.669	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	136.1	177.5	28	-33.9	0	0	0	111.1	Y129	Y129-P131 HydrophobicContact CE1-CB 4.23Å; Y129-P131 WeakPolarHBondContact OH-CA 3.27Å
132	N	94.5	Very high	91.4	Very high	77 Å²	77	54.3 Å²	54.3	41%	0.412	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	-60	171.4	175.8	-39.3	0	0	0	110.2	A134 L149	N132-A134 VanDerWaalsContact C-N 3.27Å; N132-A134 PolarHBondContact O-N 3.22Å; N132-A134 WeakPolarHBondContact OD1-CB 3.33Å; N132-A134 PolarHBondContact OD1-N 2.87Å; N132-A134 VanDerWaalsContact OD1-N 3.07Å; N132-L149 HydrophobicContact CB-CB 4.25Å; N132-L149 WeakPolarHBondContact CB-O 3.39Å
133	G	93.1	Very high	90.5	Very high	50 Å²	50	54.3 Å²	54.3	52%	0.515	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	77.8	-0.8	171.6	0	0	0	0	0	115.7	L149	G133-L149 PolarHBondContact N-O 3.41Å
134	A	92.7	Very high	89.9	Confident	31 Å²	31	54.5 Å²	54.5	26%	0.256	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	152.2	169.3	0	0	0	0	0	110.8	N132 F136 F148 L149	N132-A134 VanDerWaalsContact C-N 3.27Å; N132-A134 PolarHBondContact O-N 3.22Å; N132-A134 WeakPolarHBondContact OD1-CB 3.33Å; N132-A134 PolarHBondContact OD1-N 2.87Å; N132-A134 VanDerWaalsContact OD1-N 3.07Å; A134-F136 PolarHBondContact O-N 3.27Å; A134-F148 CarbonylContact O-C 3.41Å; A134-F148 WeakPolarHBondContact O-CA 3.24Å; A134-F148 WeakPolarHBondContact O-CB 2.97Å; A134-L149 HydrophobicContact CB-CB 4.45Å; A134-L149 HydrophobicContact CB-CD1 4.12Å; A134-L149 HydrophobicContact CB-CG 4.47Å; A134-L149 PolarHBondContact O-N 2.85Å
135	L	91.7	Very high	89.5	Confident	49 Å²	49	50 Å²	50	26%	0.257	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	133.8	-178.8	-66.5	175.6	0	0	0	110.6	F49	F49-L135 HydrophobicContact CD1-CD2 4.15Å; F49-L135 HydrophobicContact CE1-CD2 3.62Å; F49-L135 HydrophobicContact CZ-CD2 4.45Å
136	F	90.8	Very high	89.3	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.2	171.1	178.5	-106	0	0	0	109.7	Y100 W102 A134 V138 S146 G147 L149 V169	Y100-F136 HydrophobicContact CD2-CE2 4.15Å; Y100-F136 HydrophobicContact CG-CE2 4.04Å; W102-F136 HydrophobicContact CB-CD1 4.49Å; W102-F136 HydrophobicContact CB-CE1 3.57Å; W102-F136 HydrophobicContact CB-CZ 3.8Å; W102-F136 AromaticContact CD1-CZ 3.89Å; W102-F136 AromaticContact CG-CE1 3.91Å; W102-F136 HydrophobicContact CG-CE1 3.91Å; W102-F136 HydrophobicContact CG-CZ 4.1Å; A134-F136 PolarHBondContact O-N 3.27Å; F136-V138 HydrophobicContact CE1-CG1 3.96Å; F136-V138 HydrophobicContact CZ-CB 4.14Å; F136-V138 HydrophobicContact CZ-CG1 3.87Å; F136-S146 WeakPolarHBondContact O-CA 3.28Å; F136-G147 PolarHBondContact N-O 2.83Å; F136-G147 PolarHBondContact O-N 3.12Å; F136-L149 HydrophobicContact CB-CD2 3.85Å; F136-L149 HydrophobicContact CB-CG 4.2Å; F136-L149 HydrophobicContact CD2-CD2 3.61Å; F136-L149 HydrophobicContact CG-CD2 4.03Å; F136-V169 HydrophobicContact CD1-CG2 4.07Å; F136-V169 HydrophobicContact CE1-CG2 3.93Å
137	Y	89.2	Confident	89.1	Confident	60 Å²	60	43.7 Å²	43.7	24%	0.235	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	133.4	176.5	-179.5	-91.8	0	0	0	109	W53 Q139 T144	W53-Y137 HydrophobicContact CH2-CD1 4.36Å; W53-Y137 HydrophobicContact CZ2-CD1 4.44Å; Y137-Q139 HydrophobicContact CE1-CB 3.91Å; Y137-Q139 PolarHBondContact OH-OE1 2.83Å; Y137-T144 WeakPolarHBondContact OH-CG2 3.01Å
138	V	85	Confident	89	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.03	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.6	171.5	62.1	0	0	0	0	109.6	E67 Y100 F136 Y140 T144 A145	E67-V138 WeakPolarHBondContact OE2-CG2 3.19Å; Y100-V138 HydrophobicContact CD2-CG2 4.48Å; F136-V138 HydrophobicContact CE1-CG1 3.96Å; F136-V138 HydrophobicContact CZ-CB 4.14Å; F136-V138 HydrophobicContact CZ-CG1 3.87Å; V138-Y140 HydrophobicContact CB-CE2 4.24Å; V138-Y140 HydrophobicContact CG1-CD2 4.19Å; V138-Y140 HydrophobicContact CG1-CE2 3.42Å; V138-Y140 VanDerWaalsContact CG1-CE2 3.42Å; V138-Y140 HydrophobicContact CG2-CD1 4.46Å; V138-Y140 HydrophobicContact CG2-CD2 4.31Å; V138-Y140 HydrophobicContact CG2-CE1 3.95Å; V138-Y140 HydrophobicContact CG2-CE2 3.79Å; V138-T144 WeakPolarHBondContact O-CA 3.36Å; V138-A145 HydrophobicContact CG1-CB 3.82Å; V138-A145 PolarHBondContact N-O 2.81Å; V138-A145 PolarHBondContact O-N 3Å
139	Q	82.3	Confident	88.9	Confident	58 Å²	58	36 Å²	36	27%	0.271	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	107.5	179.1	174.9	80.2	57.5	0	0	108.5	I64 E67 Y137 T144	I64-Q139 HydrophobicContact CG2-CB 4.16Å; I64-Q139 HydrophobicContact CG2-CG 4.42Å; E67-Q139 PolarHBondContact N-O 3.3Å; E67-Q139 VanDerWaalsContact N-O 3.11Å; Y137-Q139 HydrophobicContact CE1-CB 3.91Å; Y137-Q139 PolarHBondContact OH-OE1 2.83Å; Q139-T144 HydrophobicContact CB-CG2 4.44Å; Q139-T144 HydrophobicContact CG-CG2 4.39Å
140	Y	78.4	Confident	88.9	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-89.5	165.2	169	-56.6	-77.2	0	0	0	111.9	E67 L69 W102 V138 T142 G143 F177 I185	E67-Y140 HydrophobicContact CB-CD1 3.89Å; E67-Y140 HydrophobicContact CB-CE1 4.31Å; E67-Y140 CarbonylContact O-C 3.35Å; E67-Y140 WeakPolarHBondContact O-CA 3.09Å; E67-Y140 WeakPolarHBondContact O-CB 2.85Å; L69-Y140 HydrophobicContact CD1-CD1 3.41Å; L69-Y140 VanDerWaalsContact CD1-CD1 3.41Å; L69-Y140 HydrophobicContact CD1-CD2 3.75Å; L69-Y140 HydrophobicContact CD1-CE1 3.84Å; L69-Y140 HydrophobicContact CD1-CE2 4.15Å; L69-Y140 HydrophobicContact CD1-CG 3.34Å; L69-Y140 HydrophobicContact CD2-CD1 4.39Å; L69-Y140 HydrophobicContact CG-CD1 3.54Å; L69-Y140 HydrophobicContact CG-CE1 4.15Å; L69-Y140 HydrophobicContact CG-CG 3.84Å; W102-Y140 HydrophobicContact CZ2-CE2 4.08Å; W102-Y140 AromaticContact NE1-CE2 3.5Å; W102-Y140 AromaticContact NE1-CZ 3.56Å; W102-Y140 PolarHBondContact NE1-OH 2.97Å; V138-Y140 HydrophobicContact CB-CE2 4.24Å; V138-Y140 HydrophobicContact CG1-CD2 4.19Å; V138-Y140 HydrophobicContact CG1-CE2 3.42Å; V138-Y140 VanDerWaalsContact CG1-CE2 3.42Å; V138-Y140 HydrophobicContact CG2-CD1 4.46Å; V138-Y140 HydrophobicContact CG2-CD2 4.31Å; V138-Y140 HydrophobicContact CG2-CE1 3.95Å; V138-Y140 HydrophobicContact CG2-CE2 3.79Å; Y140-T142 VanDerWaalsContact C-N 3.25Å; Y140-T142 PolarHBondContact O-N 3.28Å; Y140-G143 CarbonylContact C-O 3.38Å; Y140-G143 VanDerWaalsContact CA-O 3.23Å; Y140-G143 WeakPolarHBondContact CA-O 3.39Å; Y140-G143 VanDerWaalsContact CB-O 3.28Å; Y140-G143 WeakPolarHBondContact CB-O 3.26Å; Y140-G143 PolarHBondContact N-O 2.82Å; Y140-G143 PolarHBondContact O-N 2.99Å; Y140-G143 VanDerWaalsContact O-O 3.07Å; Y140-F177 AromaticContact CD2-CZ 3.87Å; Y140-F177 HydrophobicContact CD2-CZ 3.87Å; Y140-F177 HydrophobicContact CE2-CZ 4.4Å; Y140-I185 HydrophobicContact CE1-CD1 4.23Å; Y140-I185 HydrophobicContact CE2-CD1 3.94Å
141	G	69.3	Low	88.9	Confident	32 Å²	32	29.1 Å²	29.1	33%	0.33	18%	0.184	S	C	.	.	S	Bend	trans	-61.3	-35.1	179	0	0	0	0	0	112	E67	E67-G141 PolarHBondContact O-N 2.89Å
142	T	69.5	Low	88.9	Confident	50 Å²	50	24.2 Å²	24.2	31%	0.307	15%	0.152	S	C	.	.	S	Bend	trans	-103.1	-16.3	-179.9	51.3	0	0	0	0	114.4	L69 E70 Y140 V176	L69-T142 WeakPolarHBondContact O-CB 3.17Å; L69-T142 WeakPolarHBondContact O-CG2 3.41Å; L69-T142 PolarHBondContact O-OG1 3.05Å; E70-T142 HydrophobicContact CG-CG2 4.12Å; Y140-T142 VanDerWaalsContact C-N 3.25Å; Y140-T142 PolarHBondContact O-N 3.28Å; T142-V176 WeakPolarHBondContact O-CG2 3.48Å
143	G	79.7	Confident	89.1	Confident	9 Å²	9	21 Å²	21	9%	0.093	14%	0.135	C	C	.	.			trans	-164.9	172.2	-173.5	0	0	0	0	0	113.9	Y140	Y140-G143 CarbonylContact C-O 3.38Å; Y140-G143 VanDerWaalsContact CA-O 3.23Å; Y140-G143 WeakPolarHBondContact CA-O 3.39Å; Y140-G143 VanDerWaalsContact CB-O 3.28Å; Y140-G143 WeakPolarHBondContact CB-O 3.26Å; Y140-G143 PolarHBondContact N-O 2.82Å; Y140-G143 PolarHBondContact O-N 2.99Å; Y140-G143 VanDerWaalsContact O-O 3.07Å
144	T	86	Confident	89.4	Confident	19 Å²	19	18.7 Å²	18.7	12%	0.117	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	152	175.6	59.4	0	0	0	0	110.6	Y137 V138 Q139 P173 F177	Y137-T144 WeakPolarHBondContact OH-CG2 3.01Å; V138-T144 WeakPolarHBondContact O-CA 3.36Å; Q139-T144 HydrophobicContact CB-CG2 4.44Å; Q139-T144 HydrophobicContact CG-CG2 4.39Å; T144-P173 WeakPolarHBondContact O-CD 3.35Å; T144-P173 WeakPolarHBondContact OG1-CD 3.48Å; T144-P173 WeakPolarHBondContact OG1-CG 3.48Å; T144-F177 WeakPolarHBondContact O-CE2 3.12Å
145	A	90	Very high	89.7	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.1	171.2	0	0	0	0	0	108.8	W102 V138 V169 Q172	W102-A145 HydrophobicContact CD2-CB 4.24Å; W102-A145 HydrophobicContact CE3-CB 4.49Å; W102-A145 HydrophobicContact CH2-CB 4.44Å; W102-A145 HydrophobicContact CZ2-CB 4.15Å; V138-A145 HydrophobicContact CG1-CB 3.82Å; V138-A145 PolarHBondContact N-O 2.81Å; V138-A145 PolarHBondContact O-N 3Å; A145-V169 HydrophobicContact CB-CG1 4.02Å; A145-V169 HydrophobicContact CB-CG2 3.94Å; A145-Q172 HydrophobicContact CB-CG 4.39Å
146	S	93.1	Very high	89.9	Confident	6 Å²	6	16.9 Å²	16.9	4%	0.042	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	150.6	-179.9	71.8	0	0	0	0	113.4	F136 I170 N171	F136-S146 WeakPolarHBondContact O-CA 3.28Å; S146-I170 PolarHBondContact O-N 2.97Å; S146-N171 PolarHBondContact N-O 3.13Å; S146-N171 PolarHBondContact O-N 3.24Å; S146-N171 PolarHBondContact OG-ND2 3.49Å
147	G	95.1	Very high	90	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.8	-127.7	177.4	0	0	0	0	0	111.7	F136 E168	F136-G147 PolarHBondContact N-O 2.83Å; F136-G147 PolarHBondContact O-N 3.12Å; G147-E168 WeakPolarHBondContact CA-O 3.48Å
148	F	95.5	Very high	90.1	Very high	36 Å²	36	21.1 Å²	21.1	16%	0.158	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	158	-176.7	60.3	-84.8	0	0	0	111.1	K107 A134 S150 E168 I170	K107-F148 HydrophobicContact CD-CE1 4.24Å; K107-F148 HydrophobicContact CD-CZ 3.77Å; A134-F148 CarbonylContact O-C 3.41Å; A134-F148 WeakPolarHBondContact O-CA 3.24Å; A134-F148 WeakPolarHBondContact O-CB 2.97Å; F148-S150 WeakPolarHBondContact CE2-OG 3.12Å; F148-E168 HydrophobicContact CD1-CB 4.44Å; F148-E168 HydrophobicContact CD2-CB 4.15Å; F148-E168 HydrophobicContact CE1-CB 3.96Å; F148-E168 HydrophobicContact CE2-CB 3.65Å; F148-E168 VanDerWaalsContact CE2-CD 3.5Å; F148-E168 HydrophobicContact CE2-CG 4.06Å; F148-E168 WeakPolarHBondContact CE2-OE1 3.35Å; F148-E168 HydrophobicContact CG-CB 4.5Å; F148-E168 HydrophobicContact CZ-CB 3.5Å; F148-E168 VanDerWaalsContact CZ-CB 3.5Å; F148-E168 VanDerWaalsContact CZ-CD 3.42Å; F148-E168 HydrophobicContact CZ-CG 4.07Å; F148-E168 WeakPolarHBondContact CZ-OE2 3.17Å; F148-E168 PolarHBondContact N-O 3.02Å; F148-E168 VanDerWaalsContact N-O 3.15Å; F148-E168 PolarHBondContact O-N 2.64Å; F148-I170 HydrophobicContact CD1-CG2 4.31Å; F148-I170 HydrophobicContact CE1-CG2 3.79Å
149	L	96.8	Very high	90.6	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.016	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	143.9	177.5	-65.4	-178.5	0	0	0	110.8	N132 G133 A134 F136 T165 F166 S197 P199	N132-L149 HydrophobicContact CB-CB 4.25Å; N132-L149 WeakPolarHBondContact CB-O 3.39Å; G133-L149 PolarHBondContact N-O 3.41Å; A134-L149 HydrophobicContact CB-CB 4.45Å; A134-L149 HydrophobicContact CB-CD1 4.12Å; A134-L149 HydrophobicContact CB-CG 4.47Å; A134-L149 PolarHBondContact O-N 2.85Å; F136-L149 HydrophobicContact CB-CD2 3.85Å; F136-L149 HydrophobicContact CB-CG 4.2Å; F136-L149 HydrophobicContact CD2-CD2 3.61Å; F136-L149 HydrophobicContact CG-CD2 4.03Å; L149-T165 HydrophobicContact CB-CG2 4.01Å; L149-T165 HydrophobicContact CD1-CG2 4.15Å; L149-T165 HydrophobicContact CD2-CG2 4.2Å; L149-T165 HydrophobicContact CG-CG2 4.36Å; L149-F166 WeakPolarHBondContact CA-O 3.31Å; L149-S197 WeakPolarHBondContact CD1-O 3.35Å; L149-P199 HydrophobicContact CD2-CB 4.29Å; L149-P199 HydrophobicContact CD2-CG 3.96Å
150	S	98.1	Very high	91.3	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.8	170.7	-75.6	0	0	0	0	108.8	F148 T165 F166 E168	F148-S150 WeakPolarHBondContact CE2-OG 3.12Å; S150-T165 CarbonylContact O-C 3.59Å; S150-T165 VanDerWaalsContact O-CA 3.31Å; S150-T165 WeakPolarHBondContact O-CA 3.48Å; S150-F166 PolarHBondContact N-O 3.47Å; S150-F166 WeakPolarHBondContact O-CD1 3.38Å; S150-F166 PolarHBondContact O-N 2.86Å; S150-E168 WeakPolarHBondContact CB-OE1 2.96Å; S150-E168 PolarHBondContact OG-OE1 2.81Å
151	S	98.5	Very high	92.2	Very high	15 Å²	15	21.6 Å²	21.6	11%	0.105	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.3	174.2	-49.4	0	0	0	0	110	K130 Q164 T165	K130-S151 PolarHBondContact N-O 3.2Å; K130-S151 PolarHBondContact O-N 3.37Å; K130-S151 VanDerWaalsContact O-N 3.08Å; S151-Q164 VanDerWaalsContact CA-O 3.25Å; S151-Q164 WeakPolarHBondContact CA-O 3.44Å; S151-T165 PolarHBondContact OG-OG1 3.09Å
152	D	98.7	Very high	93.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	179.7	177.5	-152.3	-18.8	0	0	0	110.2	I83 G84 Y121 S126 T128 Y129 Q164 F166	I83-D152 HydrophobicContact CG2-CB 3.79Å; G84-D152 VanDerWaalsContact CA-CG 3.45Å; G84-D152 WeakPolarHBondContact CA-OD1 3.37Å; G84-D152 WeakPolarHBondContact CA-OD2 3.39Å; Y121-D152 PolarHBondContact OH-OD2 3.47Å; S126-D152 WeakPolarHBondContact CB-OD2 3.01Å; S126-D152 VanDerWaalsContact OG-CG 3.29Å; S126-D152 PolarHBondContact OG-OD1 3.39Å; S126-D152 PolarHBondContact OG-OD2 2.92Å; T128-D152 WeakPolarHBondContact CB-OD1 3.16Å; T128-D152 PolarHBondContact OG1-OD1 3.47Å; Y129-D152 PolarHBondContact N-OD1 2.93Å; D152-Q164 PolarHBondContact N-O 2.94Å; D152-Q164 PolarHBondContact O-N 3.03Å; D152-F166 HydrophobicContact CB-CE1 3.86Å
153	C	98.6	Very high	94.9	Very high	10 Å²	10	24.7 Å²	24.7	7%	0.068	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	126.7	172	-146	0	0	0	0	110	I83 G84 N160 I161	I83-C153 CarbonylContact C-O 3.48Å; I83-C153 WeakPolarHBondContact CA-O 3.33Å; G84-C153 PolarHBondContact N-O 2.91Å; C153-N160 PolarHBondContact SG-OD1 3.5Å; C153-I161 WeakPolarHBondContact CA-O 3.27Å
154	V	98.7	Very high	95.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127	175	178.9	0	0	0	0	109.3	S82 I83 L101 I156 I161 Q164 I202	S82-V154 CarbonylContact O-C 3.58Å; S82-V154 WeakPolarHBondContact O-CA 3.45Å; I83-V154 HydrophobicContact CD1-CG2 4.26Å; I83-V154 HydrophobicContact CG1-CG2 4.08Å; I83-V154 HydrophobicContact CG2-CG2 4.26Å; L101-V154 HydrophobicContact CD2-CG1 4.43Å; L101-V154 HydrophobicContact CD2-CG2 3.95Å; V154-I156 HydrophobicContact CG1-CD1 4.34Å; V154-I156 HydrophobicContact CG1-CG1 4.07Å; V154-I161 HydrophobicContact CB-CB 4.47Å; V154-I161 PolarHBondContact N-O 2.8Å; V154-I161 VanDerWaalsContact O-CD1 3.27Å; V154-I161 WeakPolarHBondContact O-CD1 3.37Å; V154-I161 PolarHBondContact O-N 2.84Å; V154-Q164 HydrophobicContact CB-CB 4.3Å; V154-Q164 HydrophobicContact CB-CG 4.48Å; V154-Q164 HydrophobicContact CG2-CB 3.71Å; V154-Q164 HydrophobicContact CG2-CG 3.77Å; V154-I202 HydrophobicContact CB-CD1 4.09Å; V154-I202 HydrophobicContact CG1-CD1 3.68Å; V154-I202 HydrophobicContact CG2-CD1 4.48Å
155	H	98	Very high	96.4	Very high	42 Å²	42	24.6 Å²	24.6	19%	0.194	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	133.7	175.5	-54.9	-80.6	0	0	0	110.9	I81 S82 L159 N160	I81-H155 WeakPolarHBondContact CA-O 3.37Å; S82-H155 PolarHBondContact N-O 2.86Å; S82-H155 PolarHBondContact O-N 2.61Å; S82-H155 WeakPolarHBondContact OG-CB 3.45Å; H155-L159 VanDerWaalsContact CA-O 3.29Å; H155-L159 WeakPolarHBondContact CA-O 3.31Å; H155-N160 PolarHBondContact CE1-OD1 2.87Å; H155-N160 PolarHBondContact ND1-OD1 2.76Å
156	I	96.5	Very high	96.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	100.9	177.9	-52.8	-170.8	0	0	0	107	T21 I23 I81 V154 S158 L159 I161 M186 I202 M206 F235	T21-I156 WeakPolarHBondContact CG2-O 3.22Å; I23-I156 HydrophobicContact CD1-CG2 3.64Å; I23-I156 HydrophobicContact CG1-CG2 3.53Å; I81-I156 HydrophobicContact CB-CG1 4.32Å; I81-I156 HydrophobicContact CG2-CD1 3.97Å; I81-I156 HydrophobicContact CG2-CG1 3.8Å; I81-I156 HydrophobicContact CG2-CG2 4.46Å; V154-I156 HydrophobicContact CG1-CD1 4.34Å; V154-I156 HydrophobicContact CG1-CG1 4.07Å; I156-S158 PolarHBondContact O-N 3.35Å; I156-S158 VanDerWaalsContact O-N 3.13Å; I156-L159 HydrophobicContact CB-CB 4.41Å; I156-L159 PolarHBondContact N-O 3.26Å; I156-L159 VanDerWaalsContact N-O 3.07Å; I156-L159 WeakPolarHBondContact O-CB 3.04Å; I156-L159 PolarHBondContact O-N 3.34Å; I156-I161 HydrophobicContact CD1-CD1 4.3Å; I156-I161 HydrophobicContact CG1-CD1 4.13Å; I156-M186 HydrophobicContact CD1-CE 3.17Å; I156-M186 HydrophobicContact CD1-SD 3.4Å; I156-M186 WeakPolarHBondContact CD1-SD 3.35Å; I156-I202 HydrophobicContact CD1-CD1 3.99Å; I156-M206 HydrophobicContact CD1-CE 3.56Å; I156-F235 HydrophobicContact CG2-CE2 3.9Å; I156-F235 HydrophobicContact CG2-CZ 4.49Å
157	G	92.4	Very high	96.9	Very high	58 Å²	58	24.3 Å²	24.3	60%	0.598	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	-119.3	-169.2	0	0	0	0	0	110.8
158	S	91.3	Very high	97.1	Very high	99 Å²	99	24.2 Å²	24.2	69%	0.692	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-11	175.5	39.8	0	0	0	0	114.9	T21 I156	T21-S158 PolarHBondContact OG1-OG 2.81Å; I156-S158 PolarHBondContact O-N 3.35Å; I156-S158 VanDerWaalsContact O-N 3.13Å
159	L	95.7	Very high	97.1	Very high	8 Å²	8	22.5 Å²	22.5	4%	0.042	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	138.1	-179.8	-55.9	-179.4	0	0	0	110.5	T21 H155 I156 I161 M206 L211 F235	T21-L159 HydrophobicContact CG2-CD1 4.42Å; T21-L159 HydrophobicContact CG2-CG 4.02Å; T21-L159 WeakPolarHBondContact OG1-CD2 3.45Å; T21-L159 VanDerWaalsContact OG1-CG 3.29Å; T21-L159 WeakPolarHBondContact OG1-CG 3.44Å; H155-L159 VanDerWaalsContact CA-O 3.29Å; H155-L159 WeakPolarHBondContact CA-O 3.31Å; I156-L159 HydrophobicContact CB-CB 4.41Å; I156-L159 PolarHBondContact N-O 3.26Å; I156-L159 VanDerWaalsContact N-O 3.07Å; I156-L159 WeakPolarHBondContact O-CB 3.04Å; I156-L159 PolarHBondContact O-N 3.34Å; L159-I161 HydrophobicContact CB-CD1 3.84Å; L159-M206 HydrophobicContact CD1-CE 3.89Å; L159-M206 HydrophobicContact CD1-CG 4.48Å; L159-M206 HydrophobicContact CD1-SD 3.88Å; L159-L211 HydrophobicContact CD2-CB 4.21Å; L159-L211 WeakPolarHBondContact CD2-O 3.45Å; L159-F235 HydrophobicContact CD1-CB 4.05Å; L159-F235 HydrophobicContact CD1-CD2 4.25Å; L159-F235 HydrophobicContact CD1-CG 4.14Å
160	N	96.9	Very high	97	Very high	66 Å²	66	24.2 Å²	24.2	35%	0.353	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	97.4	174.3	-173.4	30.2	0	0	0	110.3	C153 H155 L211	C153-N160 PolarHBondContact SG-OD1 3.5Å; H155-N160 PolarHBondContact CE1-OD1 2.87Å; H155-N160 PolarHBondContact ND1-OD1 2.76Å; N160-L211 VanDerWaalsContact O-CD1 3.27Å; N160-L211 WeakPolarHBondContact O-CD1 3.23Å
161	I	98.4	Very high	96.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	105.9	-178.5	-53.2	82.9	0	0	0	107.8	C153 V154 I156 L159 Q164 I202 N205 M206 L211	C153-I161 WeakPolarHBondContact CA-O 3.27Å; V154-I161 HydrophobicContact CB-CB 4.47Å; V154-I161 PolarHBondContact N-O 2.8Å; V154-I161 VanDerWaalsContact O-CD1 3.27Å; V154-I161 WeakPolarHBondContact O-CD1 3.37Å; V154-I161 PolarHBondContact O-N 2.84Å; I156-I161 HydrophobicContact CD1-CD1 4.3Å; I156-I161 HydrophobicContact CG1-CD1 4.13Å; L159-I161 HydrophobicContact CB-CD1 3.84Å; I161-Q164 HydrophobicContact CG2-CB 4.11Å; I161-I202 HydrophobicContact CG1-CG1 4.35Å; I161-I202 HydrophobicContact CG2-CG1 4.43Å; I161-N205 HydrophobicContact CG2-CB 3.74Å; I161-M206 HydrophobicContact CD1-CE 3.96Å; I161-M206 HydrophobicContact CD1-CG 4.3Å; I161-M206 HydrophobicContact CG1-CE 4.31Å; I161-M206 HydrophobicContact CG1-CG 3.77Å; I161-L211 HydrophobicContact CB-CD1 4.37Å; I161-L211 HydrophobicContact CG1-CD1 3.86Å
162	V	98.2	Very high	96.4	Very high	66 Å²	66	24.9 Å²	24.9	40%	0.4	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	151.9	178.5	-62.2	0	0	0	0	110.7	Q164 Q209	V162-Q164 PolarHBondContact O-N 3.22Å; V162-Q164 VanDerWaalsContact O-N 3.1Å; V162-Q209 PolarHBondContact O-NE2 3.09Å
163	D	97.5	Very high	95.6	Very high	80 Å²	80	27.2 Å²	27.2	43%	0.428	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55.6	28.5	174.2	-64.5	-19.8	0	0	0	115	K130 T165	K130-D163 WeakPolarHBondContact CE-OD1 3.49Å; K130-D163 IonicContact NZ-OD1 3.81Å; K130-D163 PolarHBondContact NZ-OD1 3.12Å; K130-D163 IonicContact NZ-OD2 3.68Å; K130-D163 PolarHBondContact NZ-OD2 2.9Å; D163-T165 PolarHBondContact O-N 2.89Å
164	Q	98.4	Very high	94.7	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	124.5	175.1	179	60	48.5	0	0	109.8	L101 S151 D152 V154 I161 V162 T200 I202 N205	L101-Q164 HydrophobicContact CD2-CG 4.19Å; S151-Q164 VanDerWaalsContact CA-O 3.25Å; S151-Q164 WeakPolarHBondContact CA-O 3.44Å; D152-Q164 PolarHBondContact N-O 2.94Å; D152-Q164 PolarHBondContact O-N 3.03Å; V154-Q164 HydrophobicContact CB-CB 4.3Å; V154-Q164 HydrophobicContact CB-CG 4.48Å; V154-Q164 HydrophobicContact CG2-CB 3.71Å; V154-Q164 HydrophobicContact CG2-CG 3.77Å; I161-Q164 HydrophobicContact CG2-CB 4.11Å; V162-Q164 PolarHBondContact O-N 3.22Å; V162-Q164 VanDerWaalsContact O-N 3.1Å; Q164-T200 PolarHBondContact NE2-O 2.79Å; Q164-I202 HydrophobicContact CG-CB 4.49Å; Q164-I202 HydrophobicContact CG-CD1 4.04Å; Q164-I202 HydrophobicContact CG-CG1 4.21Å; Q164-I202 VanDerWaalsContact OE1-CA 3.28Å; Q164-N205 PolarHBondContact OE1-ND2 3.22Å
165	T	97.5	Very high	93.7	Very high	25 Å²	25	35.5 Å²	35.5	15%	0.153	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	135.2	172.5	-55.5	0	0	0	0	110.2	L149 S150 S151 D163 P199	L149-T165 HydrophobicContact CB-CG2 4.01Å; L149-T165 HydrophobicContact CD1-CG2 4.15Å; L149-T165 HydrophobicContact CD2-CG2 4.2Å; L149-T165 HydrophobicContact CG-CG2 4.36Å; S150-T165 CarbonylContact O-C 3.59Å; S150-T165 VanDerWaalsContact O-CA 3.31Å; S150-T165 WeakPolarHBondContact O-CA 3.48Å; S151-T165 PolarHBondContact OG-OG1 3.09Å; D163-T165 PolarHBondContact O-N 2.89Å; T165-P199 HydrophobicContact CG2-CB 3.71Å
166	F	97.9	Very high	92.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	163.7	-178.9	66.1	-83.3	0	0	0	111.4	I83 L101 I103 Y121 L149 S150 D152 E168	I83-F166 HydrophobicContact CD1-CD2 4.37Å; I83-F166 HydrophobicContact CD1-CE2 4.39Å; I83-F166 HydrophobicContact CD1-CG 4.49Å; I83-F166 HydrophobicContact CG2-CE1 3.82Å; I83-F166 HydrophobicContact CG2-CZ 3.93Å; L101-F166 HydrophobicContact CB-CB 4.02Å; L101-F166 HydrophobicContact CD2-CB 3.87Å; L101-F166 HydrophobicContact CG-CB 3.7Å; L101-F166 CarbonylContact O-C 3.58Å; L101-F166 VanDerWaalsContact O-CA 3.29Å; L101-F166 WeakPolarHBondContact O-CA 3.36Å; L101-F166 WeakPolarHBondContact O-CB 3.42Å; I103-F166 HydrophobicContact CD1-CD2 3.98Å; I103-F166 HydrophobicContact CD1-CE2 3.54Å; I103-F166 HydrophobicContact CG1-CD2 4.04Å; I103-F166 HydrophobicContact CG1-CE2 3.98Å; Y121-F166 HydrophobicContact CD1-CE2 4.13Å; Y121-F166 AromaticContact CD1-CZ 3.97Å; Y121-F166 HydrophobicContact CD1-CZ 3.97Å; Y121-F166 HydrophobicContact CD2-CZ 4.49Å; Y121-F166 HydrophobicContact CE1-CE2 4.29Å; Y121-F166 AromaticContact CE1-CZ 3.7Å; Y121-F166 HydrophobicContact CE1-CZ 3.7Å; Y121-F166 HydrophobicContact CE2-CZ 4.25Å; Y121-F166 HydrophobicContact CG-CE2 4.43Å; Y121-F166 HydrophobicContact CG-CZ 4.36Å; Y121-F166 AromaticContact CZ-CZ 3.86Å; L149-F166 WeakPolarHBondContact CA-O 3.31Å; S150-F166 PolarHBondContact N-O 3.47Å; S150-F166 WeakPolarHBondContact O-CD1 3.38Å; S150-F166 PolarHBondContact O-N 2.86Å; D152-F166 HydrophobicContact CB-CE1 3.86Å; F166-E168 HydrophobicContact CE2-CG 3.81Å; F166-E168 HydrophobicContact CZ-CG 4.39Å
167	G	97.1	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	117.7	173.8	0	0	0	0	0	112.5	L101 W102 I103 V169	L101-G167 PolarHBondContact O-N 2.67Å; W102-G167 VanDerWaalsContact CA-O 3.27Å; W102-G167 WeakPolarHBondContact CA-O 3.44Å; W102-G167 WeakPolarHBondContact CB-O 3.37Å; I103-G167 PolarHBondContact N-O 3.07Å; G167-V169 PolarHBondContact O-N 3.27Å
168	E	97.7	Very high	91.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	99	159.4	-87.2	-162.6	-104.7	0	0	108.7	S105 K107 Y121 G147 F148 S150 F166	S105-E168 WeakPolarHBondContact CB-OE2 3.38Å; S105-E168 PolarHBondContact OG-OE2 3.38Å; K107-E168 IonicContact NZ-OE1 3.02Å; K107-E168 PolarHBondContact NZ-OE1 3.23Å; K107-E168 IonicContact NZ-OE2 2.74Å; K107-E168 PolarHBondContact NZ-OE2 3.02Å; Y121-E168 HydrophobicContact CD1-CG 3.84Å; Y121-E168 HydrophobicContact CE1-CG 4.25Å; G147-E168 WeakPolarHBondContact CA-O 3.48Å; F148-E168 HydrophobicContact CD1-CB 4.44Å; F148-E168 HydrophobicContact CD2-CB 4.15Å; F148-E168 HydrophobicContact CE1-CB 3.96Å; F148-E168 HydrophobicContact CE2-CB 3.65Å; F148-E168 VanDerWaalsContact CE2-CD 3.5Å; F148-E168 HydrophobicContact CE2-CG 4.06Å; F148-E168 WeakPolarHBondContact CE2-OE1 3.35Å; F148-E168 HydrophobicContact CG-CB 4.5Å; F148-E168 HydrophobicContact CZ-CB 3.5Å; F148-E168 VanDerWaalsContact CZ-CB 3.5Å; F148-E168 VanDerWaalsContact CZ-CD 3.42Å; F148-E168 HydrophobicContact CZ-CG 4.07Å; F148-E168 WeakPolarHBondContact CZ-OE2 3.17Å; F148-E168 PolarHBondContact N-O 3.02Å; F148-E168 VanDerWaalsContact N-O 3.15Å; F148-E168 PolarHBondContact O-N 2.64Å; S150-E168 WeakPolarHBondContact CB-OE1 2.96Å; S150-E168 PolarHBondContact OG-OE1 2.81Å; F166-E168 HydrophobicContact CE2-CG 3.81Å; F166-E168 HydrophobicContact CZ-CG 4.39Å
169	V	96.1	Very high	90.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.6	-175.4	170.4	0	0	0	0	110.5	W102 I103 S105 F136 A145 G167 Q172	W102-V169 HydrophobicContact CB-CG2 3.79Å; W102-V169 HydrophobicContact CD2-CG2 3.87Å; W102-V169 HydrophobicContact CE3-CB 4.08Å; W102-V169 HydrophobicContact CE3-CG1 4.49Å; W102-V169 HydrophobicContact CE3-CG2 3.61Å; W102-V169 HydrophobicContact CG-CG2 3.99Å; W102-V169 HydrophobicContact CZ3-CG2 4.49Å; I103-V169 PolarHBondContact O-N 3.22Å; S105-V169 WeakPolarHBondContact CB-O 3.38Å; S105-V169 PolarHBondContact N-O 3.09Å; F136-V169 HydrophobicContact CD1-CG2 4.07Å; F136-V169 HydrophobicContact CE1-CG2 3.93Å; A145-V169 HydrophobicContact CB-CG1 4.02Å; A145-V169 HydrophobicContact CB-CG2 3.94Å; G167-V169 PolarHBondContact O-N 3.27Å; V169-Q172 HydrophobicContact CG1-CG 3.55Å
170	I	95.8	Very high	89.6	Confident	38 Å²	38	32.2 Å²	32.2	20%	0.195	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-13.8	177.7	62.6	178.1	0	0	0	112.5	F49 K107 C108 S146 F148	F49-I170 HydrophobicContact CE2-CD1 4.22Å; F49-I170 HydrophobicContact CZ-CD1 3.89Å; K107-I170 HydrophobicContact CB-CG2 4.32Å; C108-I170 HydrophobicContact CB-CB 4.27Å; C108-I170 WeakPolarHBondContact CB-O 3.43Å; S146-I170 PolarHBondContact O-N 2.97Å; F148-I170 HydrophobicContact CD1-CG2 4.31Å; F148-I170 HydrophobicContact CE1-CG2 3.79Å
171	N	92.4	Very high	89	Confident	24 Å²	24	32.5 Å²	32.5	13%	0.128	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	121	-176.6	-179.5	64.8	0	0	0	112	V46 S146	V46-N171 WeakPolarHBondContact CG2-ND2 3.48Å; S146-N171 PolarHBondContact N-O 3.13Å; S146-N171 PolarHBondContact O-N 3.24Å; S146-N171 PolarHBondContact OG-ND2 3.49Å
172	Q	89.7	Confident	88.5	Confident	6 Å²	6	32.7 Å²	32.7	3%	0.028	18%	0.184	C	C	.	.			trans	-126.4	91.6	172.7	-71	153.3	-71.6	0	0	107.3	N112 A114 A145 V169 F177	N112-Q172 PolarHBondContact ND2-N 3.29Å; N112-Q172 PolarHBondContact ND2-O 2.67Å; A114-Q172 HydrophobicContact CB-CB 4.01Å; A145-Q172 HydrophobicContact CB-CG 4.39Å; V169-Q172 HydrophobicContact CG1-CG 3.55Å; Q172-F177 HydrophobicContact CB-CB 4.32Å; Q172-F177 HydrophobicContact CB-CD2 3.92Å; Q172-F177 HydrophobicContact CG-CB 4.42Å; Q172-F177 HydrophobicContact CG-CD2 3.98Å; Q172-F177 HydrophobicContact CG-CG 4.42Å
173	P	82.8	Confident	88.3	Confident	48 Å²	48	29.9 Å²	29.9	31%	0.312	17%	0.166	S	C	.	.			trans	-70.5	152.6	-177.4	29.2	-33.1	0	0	0	111.6	T144	T144-P173 WeakPolarHBondContact O-CD 3.35Å; T144-P173 WeakPolarHBondContact OG1-CD 3.48Å; T144-P173 WeakPolarHBondContact OG1-CG 3.48Å
174	G	78.8	Confident	88.2	Confident	50 Å²	50	26.1 Å²	26.1	52%	0.515	15%	0.146	S	C	.	.	S	Bend	trans	83.7	-157.4	179.8	0	0	0	0	0	113.3
175	K	77.8	Confident	88	Confident	135 Å²	135	26 Å²	26	59%	0.587	15%	0.146	S	C	*	.	S	Bend	trans	-118	-0.3	-176.7	-66.9	-174.4	178.2	-178.8	0	113.9	F177 V178	K175-F177 PolarHBondContact O-N 3.34Å; K175-V178 HydrophobicContact CB-CG2 4.5Å; K175-V178 WeakPolarHBondContact O-CB 3.12Å; K175-V178 PolarHBondContact O-N 3.25Å; K175-V178 VanDerWaalsContact O-N 3.13Å
176	V	73.3	Confident	88	Confident	44 Å²	44	24.9 Å²	24.9	27%	0.267	14%	0.138	S	C	.	.	G	3₁₀ helix	trans	-58.6	-53.6	-174.8	171.3	0	0	0	0	109.7	T142 V178 F180	T142-V176 WeakPolarHBondContact O-CG2 3.48Å; V176-V178 VanDerWaalsContact C-N 3.25Å; V176-V178 PolarHBondContact O-N 3.06Å; V176-F180 HydrophobicContact CG1-CE2 3.77Å; V176-F180 HydrophobicContact CG1-CZ 4.12Å; V176-F180 VanDerWaalsContact O-CD2 3.22Å; V176-F180 WeakPolarHBondContact O-CD2 2.99Å; V176-F180 WeakPolarHBondContact O-CE2 3.04Å
177	F	80.1	Confident	87.8	Confident	5 Å²	5	24.9 Å²	24.9	2%	0.022	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-79.1	3.1	178.5	-56	-67.5	0	0	0	115.9	L69 W102 A114 H118 Y140 T144 Q172 K175 F180 F182 I185	L69-F177 HydrophobicContact CD1-CE1 4.28Å; W102-F177 HydrophobicContact CH2-CD1 4.02Å; W102-F177 HydrophobicContact CH2-CE1 4.04Å; W102-F177 HydrophobicContact CH2-CG 4.47Å; W102-F177 HydrophobicContact CH2-CZ 4.49Å; W102-F177 HydrophobicContact CZ2-CD1 4.41Å; W102-F177 AromaticContact CZ2-CE1 3.97Å; W102-F177 HydrophobicContact CZ2-CE1 3.97Å; W102-F177 HydrophobicContact CZ2-CZ 4.24Å; A114-F177 HydrophobicContact CB-CB 4.02Å; H118-F177 PolarHBondContact CE1-O 3.4Å; Y140-F177 AromaticContact CD2-CZ 3.87Å; Y140-F177 HydrophobicContact CD2-CZ 3.87Å; Y140-F177 HydrophobicContact CE2-CZ 4.4Å; T144-F177 WeakPolarHBondContact O-CE2 3.12Å; Q172-F177 HydrophobicContact CB-CB 4.32Å; Q172-F177 HydrophobicContact CB-CD2 3.92Å; Q172-F177 HydrophobicContact CG-CB 4.42Å; Q172-F177 HydrophobicContact CG-CD2 3.98Å; Q172-F177 HydrophobicContact CG-CG 4.42Å; K175-F177 PolarHBondContact O-N 3.34Å; F177-F180 AromaticContact CD1-CD2 3.86Å; F177-F180 HydrophobicContact CD1-CD2 3.86Å; F177-F180 AromaticContact CD1-CE2 3.75Å; F177-F180 HydrophobicContact CD1-CE2 3.75Å; F177-F180 HydrophobicContact CE1-CE2 4.19Å; F177-F182 HydrophobicContact CD1-CE2 4.39Å; F177-F182 HydrophobicContact CD1-CZ 4.47Å; F177-I185 HydrophobicContact CE1-CD1 4.48Å
178	V	80.2	Confident	87.7	Confident	15 Å²	15	24.9 Å²	24.9	9%	0.091	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-81.5	-33.4	-177.3	172.3	0	0	0	0	111.7	L113 A114 L117 K175 V176	L113-V178 HydrophobicContact CB-CG2 4.33Å; L113-V178 HydrophobicContact CD2-CG1 3.8Å; L113-V178 HydrophobicContact CD2-CG2 4.31Å; L113-V178 HydrophobicContact CG-CG1 3.96Å; L113-V178 HydrophobicContact CG-CG2 4.24Å; A114-V178 HydrophobicContact CB-CG2 3.79Å; L117-V178 HydrophobicContact CD1-CG1 3.76Å; K175-V178 HydrophobicContact CB-CG2 4.5Å; K175-V178 WeakPolarHBondContact O-CB 3.12Å; K175-V178 PolarHBondContact O-N 3.25Å; K175-V178 VanDerWaalsContact O-N 3.13Å; V176-V178 VanDerWaalsContact C-N 3.25Å; V176-V178 PolarHBondContact O-N 3.06Å
179	N	74.1	Confident	87.5	Confident	52 Å²	52	25 Å²	25	28%	0.278	14%	0.14	S	C	.	.	S	Bend	trans	-108	0.8	-167.8	-66.3	-24.3	0	0	0	114.1	H30	H30-N179 PolarHBondContact ND1-O 2.76Å
180	F	81.4	Confident	87.2	Confident	21 Å²	21	25.1 Å²	25.1	9%	0.092	14%	0.141	C	C	.	.			trans	-72.4	159.1	170.5	-65.4	-66.5	0	0	0	110	H30 N71 E76 H118 V176 F177 F182	H30-F180 AromaticContact CE1-CD1 2.85Å; H30-F180 WeakPolarHBondContact CE1-CD1 3.44Å; H30-F180 AromaticContact CE1-CE1 3.19Å; H30-F180 WeakPolarHBondContact CE1-CE1 2.92Å; H30-F180 AromaticContact CE1-CG 3.58Å; H30-F180 AromaticContact NE2-CD1 3.09Å; H30-F180 WeakPolarHBondContact NE2-CD1 3.43Å; H30-F180 AromaticContact NE2-CE1 3.01Å; H30-F180 WeakPolarHBondContact NE2-CE1 3.33Å; N71-F180 HydrophobicContact CB-CE1 4.23Å; E76-F180 WeakPolarHBondContact OE2-CD1 3.38Å; H118-F180 PolarHBondContact NE2-O 3.29Å; V176-F180 HydrophobicContact CG1-CE2 3.77Å; V176-F180 HydrophobicContact CG1-CZ 4.12Å; V176-F180 VanDerWaalsContact O-CD2 3.22Å; V176-F180 WeakPolarHBondContact O-CD2 2.99Å; V176-F180 WeakPolarHBondContact O-CE2 3.04Å; F177-F180 AromaticContact CD1-CD2 3.86Å; F177-F180 HydrophobicContact CD1-CD2 3.86Å; F177-F180 AromaticContact CD1-CE2 3.75Å; F177-F180 HydrophobicContact CD1-CE2 3.75Å; F177-F180 HydrophobicContact CE1-CE2 4.19Å; F180-F182 HydrophobicContact CB-CD1 3.58Å; F180-F182 HydrophobicContact CB-CD2 4.41Å; F180-F182 HydrophobicContact CB-CE1 3.35Å; F180-F182 HydrophobicContact CB-CE2 4.24Å; F180-F182 HydrophobicContact CB-CG 4.12Å; F180-F182 HydrophobicContact CB-CZ 3.73Å; F180-F182 HydrophobicContact CD1-CD1 4.03Å; F180-F182 AromaticContact CD1-CE1 3.16Å; F180-F182 HydrophobicContact CD1-CE1 3.16Å; F180-F182 AromaticContact CD1-CZ 3.72Å; F180-F182 HydrophobicContact CD1-CZ 3.72Å; F180-F182 AromaticContact CD2-CE1 3.59Å; F180-F182 HydrophobicContact CD2-CE1 3.59Å; F180-F182 HydrophobicContact CD2-CE2 4.03Å; F180-F182 AromaticContact CD2-CZ 3.24Å; F180-F182 HydrophobicContact CD2-CZ 3.24Å; F180-F182 AromaticContact CE1-CE1 3.85Å; F180-F182 HydrophobicContact CE1-CE1 3.85Å; F180-F182 HydrophobicContact CE1-CZ 4.19Å; F180-F182 HydrophobicContact CE2-CE1 4.21Å; F180-F182 AromaticContact CE2-CZ 3.75Å; F180-F182 HydrophobicContact CE2-CZ 3.75Å; F180-F182 AromaticContact CG-CD1 3.88Å; F180-F182 HydrophobicContact CG-CD1 3.88Å; F180-F182 AromaticContact CG-CE1 3.09Å; F180-F182 HydrophobicContact CG-CE1 3.09Å; F180-F182 HydrophobicContact CG-CE2 4.22Å; F180-F182 AromaticContact CG-CZ 3.31Å; F180-F182 HydrophobicContact CG-CZ 3.31Å; F180-F182 HydrophobicContact CZ-CE1 4.36Å; F180-F182 HydrophobicContact CZ-CZ 4.23Å
181	H	83.1	Confident	86.9	Confident	73 Å²	73	25.8 Å²	25.8	34%	0.338	14%	0.143	S	C	.	.	S	Bend	trans	-95.7	-15.7	172.5	-63.9	21.4	0	0	0	112.3	S28 E76 Y78	S28-H181 PolarHBondContact OG-CD2 3.17Å; S28-H181 PolarHBondContact OG-NE2 2.81Å; E76-H181 WeakPolarHBondContact OE1-CB 3.22Å; E76-H181 IonicContact OE1-CG 2.7Å; E76-H181 PolarHBondContact OE1-N 2.64Å; E76-H181 IonicContact OE1-ND1 3.29Å; Y78-H181 HydrophobicContact CE1-CB 4.24Å
182	F	89	Confident	86.3	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.018	14%	0.141	C	C	.	.			trans	-77.6	148.1	171.6	67	-100.8	0	0	0	111.3	E76 Y78 H91 I93 H118 F177 F180 G184 I185	E76-F182 WeakPolarHBondContact OE2-CD1 3.22Å; E76-F182 WeakPolarHBondContact OE2-CE1 3.35Å; Y78-F182 HydrophobicContact CG-CB 4.45Å; H91-F182 HydrophobicContact CB-CB 4.48Å; H91-F182 CarbonylContact O-C 3.55Å; I93-F182 HydrophobicContact CD1-CD1 3.52Å; I93-F182 HydrophobicContact CD1-CE1 3.15Å; I93-F182 HydrophobicContact CD1-CE2 4.4Å; I93-F182 HydrophobicContact CD1-CG 4.29Å; I93-F182 HydrophobicContact CD1-CZ 3.66Å; I93-F182 HydrophobicContact CG1-CB 4.46Å; I93-F182 HydrophobicContact CG1-CD1 3.51Å; I93-F182 HydrophobicContact CG1-CD2 4.41Å; I93-F182 HydrophobicContact CG1-CE1 3.71Å; I93-F182 HydrophobicContact CG1-CG 3.9Å; I93-F182 HydrophobicContact CG1-CZ 4.24Å; H118-F182 PolarHBondContact CD2-O 3.02Å; H118-F182 PolarHBondContact NE2-O 2.76Å; F177-F182 HydrophobicContact CD1-CE2 4.39Å; F177-F182 HydrophobicContact CD1-CZ 4.47Å; F180-F182 HydrophobicContact CB-CD1 3.58Å; F180-F182 HydrophobicContact CB-CD2 4.41Å; F180-F182 HydrophobicContact CB-CE1 3.35Å; F180-F182 HydrophobicContact CB-CE2 4.24Å; F180-F182 HydrophobicContact CB-CG 4.12Å; F180-F182 HydrophobicContact CB-CZ 3.73Å; F180-F182 HydrophobicContact CD1-CD1 4.03Å; F180-F182 AromaticContact CD1-CE1 3.16Å; F180-F182 HydrophobicContact CD1-CE1 3.16Å; F180-F182 AromaticContact CD1-CZ 3.72Å; F180-F182 HydrophobicContact CD1-CZ 3.72Å; F180-F182 AromaticContact CD2-CE1 3.59Å; F180-F182 HydrophobicContact CD2-CE1 3.59Å; F180-F182 HydrophobicContact CD2-CE2 4.03Å; F180-F182 AromaticContact CD2-CZ 3.24Å; F180-F182 HydrophobicContact CD2-CZ 3.24Å; F180-F182 AromaticContact CE1-CE1 3.85Å; F180-F182 HydrophobicContact CE1-CE1 3.85Å; F180-F182 HydrophobicContact CE1-CZ 4.19Å; F180-F182 HydrophobicContact CE2-CE1 4.21Å; F180-F182 AromaticContact CE2-CZ 3.75Å; F180-F182 HydrophobicContact CE2-CZ 3.75Å; F180-F182 AromaticContact CG-CD1 3.88Å; F180-F182 HydrophobicContact CG-CD1 3.88Å; F180-F182 AromaticContact CG-CE1 3.09Å; F180-F182 HydrophobicContact CG-CE1 3.09Å; F180-F182 HydrophobicContact CG-CE2 4.22Å; F180-F182 AromaticContact CG-CZ 3.31Å; F180-F182 HydrophobicContact CG-CZ 3.31Å; F180-F182 HydrophobicContact CZ-CE1 4.36Å; F180-F182 HydrophobicContact CZ-CZ 4.23Å; F182-G184 WeakPolarHBondContact CD2-O 3.25Å; F182-I185 HydrophobicContact CE2-CG1 4.04Å
183	D	93.7	Very high	85.2	Confident	7 Å²	7	30.7 Å²	30.7	4%	0.037	17%	0.173	C	C	.	.	S	Bend	trans	-81.8	-38.8	178.1	-58.6	-60.5	0	0	0	112	F90 H91 P104 H118 H119	F90-D183 WeakPolarHBondContact CA-OD2 3.29Å; F90-D183 HydrophobicContact CB-CB 4.29Å; F90-D183 HydrophobicContact CD1-CB 4.14Å; H91-D183 PolarHBondContact N-OD2 3.18Å; H91-D183 IonicContact ND1-OD2 2.69Å; H91-D183 PolarHBondContact O-N 2.79Å; P104-D183 WeakPolarHBondContact CD-O 3.48Å; P104-D183 WeakPolarHBondContact CG-O 3.41Å; H118-D183 HydrophobicContact CB-CB 4.34Å; H118-D183 WeakPolarHBondContact CB-OD1 3.1Å; H118-D183 IonicContact CD2-OD1 3.7Å; H118-D183 IonicContact CG-OD1 3.64Å; H119-D183 HydrophobicContact CB-CB 4.48Å; H119-D183 WeakPolarHBondContact CB-OD1 3.25Å; H119-D183 IonicContact CE1-OD2 2.79Å; H119-D183 IonicContact CG-OD1 2.65Å; H119-D183 IonicContact CG-OD2 3.56Å; H119-D183 PolarHBondContact N-OD1 3.22Å; H119-D183 IonicContact ND1-OD1 3.42Å; H119-D183 PolarHBondContact ND1-OD1 2.74Å; H119-D183 IonicContact ND1-OD2 3.69Å; H119-D183 PolarHBondContact ND1-OD2 3.24Å
184	G	95.4	Very high	84.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	-165.3	-177.8	0	0	0	0	0	114.1	H91 V92 I93 W102 F182	H91-G184 PolarHBondContact O-N 3Å; V92-G184 VanDerWaalsContact CA-O 3.25Å; V92-G184 WeakPolarHBondContact CA-O 3.47Å; I93-G184 PolarHBondContact N-O 3.4Å; W102-G184 WeakPolarHBondContact O-CA 3.38Å; F182-G184 WeakPolarHBondContact CD2-O 3.25Å
185	I	94.4	Very high	83	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.2	-178.1	-62.2	179.3	0	0	0	108.8	L69 D95 L101 W102 Y140 F177 F182	L69-I185 HydrophobicContact CD1-CD1 3.29Å; L69-I185 HydrophobicContact CD2-CD1 4.28Å; L69-I185 HydrophobicContact CG-CD1 4.4Å; D95-I185 HydrophobicContact CB-CG2 3.5Å; L101-I185 CarbonylContact C-O 3.55Å; L101-I185 VanDerWaalsContact CA-O 3.31Å; L101-I185 WeakPolarHBondContact CA-O 3.4Å; L101-I185 WeakPolarHBondContact CD1-O 3.28Å; W102-I185 HydrophobicContact CH2-CG1 4.36Å; W102-I185 HydrophobicContact CZ2-CB 4.07Å; W102-I185 HydrophobicContact CZ2-CD1 3.55Å; W102-I185 HydrophobicContact CZ2-CG1 3.59Å; W102-I185 PolarHBondContact N-O 3.42Å; W102-I185 PolarHBondContact O-N 2.81Å; W102-I185 VanDerWaalsContact O-N 3.09Å; Y140-I185 HydrophobicContact CE1-CD1 4.23Å; Y140-I185 HydrophobicContact CE2-CD1 3.94Å; F177-I185 HydrophobicContact CE1-CD1 4.48Å; F182-I185 HydrophobicContact CE2-CG1 4.04Å
186	M	96.5	Very high	81.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	98	169.9	-179	173.3	152.8	0	0	108.6	I81 V92 I93 F94 D95 L101 I156 M188 I202 M206 F235	I81-M186 HydrophobicContact CG2-SD 4.11Å; V92-M186 HydrophobicContact CB-CB 4.17Å; V92-M186 HydrophobicContact CG2-CB 3.79Å; I93-M186 PolarHBondContact O-N 3.11Å; F94-M186 WeakPolarHBondContact CA-O 3.31Å; F94-M186 HydrophobicContact CD1-CB 4.48Å; F94-M186 HydrophobicContact CD1-CE 4.07Å; F94-M186 HydrophobicContact CD1-CG 4.39Å; F94-M186 HydrophobicContact CD1-SD 3.86Å; F94-M186 HydrophobicContact CE1-CE 3.91Å; F94-M186 HydrophobicContact CE1-SD 3.55Å; F94-M186 VanDerWaalsContact CE1-SD 3.55Å; D95-M186 PolarHBondContact N-O 2.95Å; L101-M186 HydrophobicContact CD1-CB 3.85Å; L101-M186 HydrophobicContact CD1-CG 4.16Å; I156-M186 HydrophobicContact CD1-CE 3.17Å; I156-M186 HydrophobicContact CD1-SD 3.4Å; I156-M186 WeakPolarHBondContact CD1-SD 3.35Å; M186-M188 HydrophobicContact CE-SD 3.63Å; M186-M188 HydrophobicContact CG-SD 4.39Å; M186-I202 HydrophobicContact CE-CB 4.26Å; M186-I202 HydrophobicContact CE-CD1 3.83Å; M186-I202 HydrophobicContact CE-CG1 4.1Å; M186-I202 HydrophobicContact CE-CG2 3.22Å; M186-I202 HydrophobicContact CG-CG2 3.77Å; M186-I202 HydrophobicContact SD-CD1 4.13Å; M186-I202 HydrophobicContact SD-CG2 4.12Å; M186-M206 HydrophobicContact CE-CE 3.86Å; M186-F235 HydrophobicContact CE-CZ 4.36Å
187	G	95	Very high	81.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	135.1	175	0	0	0	0	0	112.7	D95 S98 Y100	D95-G187 CarbonylContact O-C 3.43Å; D95-G187 WeakPolarHBondContact O-CA 3.27Å; S98-G187 CarbonylContact O-C 3.57Å; S98-G187 VanDerWaalsContact O-C 3.28Å; S98-G187 WeakPolarHBondContact O-CA 3.24Å; Y100-G187 PolarHBondContact O-N 3.44Å
188	M	95.5	Very high	81.6	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	21%	0.207	C	C	.	.			trans	-117.1	7.9	-177.5	-66.4	-55.5	-54.2	0	0	112	F94 D95 T96 S98 M186 I202 F203 F217 I233 F235 W258	F94-M188 HydrophobicContact CB-CG 4.05Å; F94-M188 HydrophobicContact CD1-CG 4.48Å; F94-M188 HydrophobicContact CD1-SD 4.21Å; D95-M188 PolarHBondContact O-N 3.47Å; T96-M188 HydrophobicContact CG2-CB 3.78Å; S98-M188 PolarHBondContact O-N 3.12Å; M186-M188 HydrophobicContact CE-SD 3.63Å; M186-M188 HydrophobicContact CG-SD 4.39Å; M188-I202 HydrophobicContact SD-CG2 4.46Å; M188-F203 HydrophobicContact CE-CB 3.84Å; M188-F203 HydrophobicContact CE-CD2 4.06Å; M188-F203 HydrophobicContact CE-CG 4.03Å; M188-F217 HydrophobicContact CB-CE2 4.29Å; M188-F217 HydrophobicContact CB-CZ 3.86Å; M188-F217 HydrophobicContact CE-CD1 3.66Å; M188-F217 HydrophobicContact CE-CD2 4.12Å; M188-F217 HydrophobicContact CE-CE1 3.56Å; M188-F217 HydrophobicContact CE-CE2 4.02Å; M188-F217 HydrophobicContact CE-CG 3.95Å; M188-F217 HydrophobicContact CE-CZ 3.76Å; M188-I233 HydrophobicContact CE-CD1 4.49Å; M188-F235 HydrophobicContact CE-CD1 4.49Å; M188-F235 HydrophobicContact CE-CE1 3.62Å; M188-F235 HydrophobicContact CE-CZ 4.45Å; M188-F235 HydrophobicContact SD-CE1 4.26Å; M188-W258 PolarHBondContact O-NE1 3Å
189	G	92.2	Very high	81.9	Confident	3 Å²	3	37 Å²	37	3%	0.031	21%	0.206	C	C	.	.	S	Bend	trans	-77.6	-172.2	175.4	0	0	0	0	0	114.8	S98	S98-G189 PolarHBondContact O-N 2.62Å
190	F	90.1	Very high	82.8	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.009	21%	0.207	C	C	.	.			trans	-87.1	167.8	-178.9	-63.7	-93.1	0	0	0	112.7	P99 Q192 V252 E255 W258 F384	P99-F190 WeakPolarHBondContact CB-O 3.34Å; F190-Q192 PolarHBondContact O-N 2.85Å; F190-Q192 VanDerWaalsContact O-N 3.15Å; F190-V252 HydrophobicContact CZ-CG1 4.49Å; F190-V252 HydrophobicContact CZ-CG2 4.24Å; F190-E255 WeakPolarHBondContact CB-O 3.35Å; F190-E255 HydrophobicContact CD1-CB 4.29Å; F190-E255 WeakPolarHBondContact CG-O 3.47Å; F190-W258 HydrophobicContact CD2-CD2 4.47Å; F190-W258 HydrophobicContact CE1-CH2 4.32Å; F190-W258 AromaticContact CE2-CD2 3.53Å; F190-W258 HydrophobicContact CE2-CD2 3.53Å; F190-W258 AromaticContact CE2-CE2 3.71Å; F190-W258 AromaticContact CE2-CE3 3.7Å; F190-W258 HydrophobicContact CE2-CE3 3.7Å; F190-W258 HydrophobicContact CE2-CG 4.05Å; F190-W258 HydrophobicContact CE2-CH2 4.22Å; F190-W258 HydrophobicContact CE2-CZ2 4.07Å; F190-W258 HydrophobicContact CE2-CZ3 4.04Å; F190-W258 AromaticContact CZ-CD2 3.95Å; F190-W258 HydrophobicContact CZ-CD2 3.95Å; F190-W258 AromaticContact CZ-CE2 4Å; F190-W258 AromaticContact CZ-CE3 3.71Å; F190-W258 HydrophobicContact CZ-CE3 3.71Å; F190-W258 AromaticContact CZ-CH2 3.65Å; F190-W258 HydrophobicContact CZ-CH2 3.65Å; F190-W258 AromaticContact CZ-CZ2 3.88Å; F190-W258 HydrophobicContact CZ-CZ2 3.88Å; F190-W258 AromaticContact CZ-CZ3 3.56Å; F190-W258 HydrophobicContact CZ-CZ3 3.56Å; F190-F384 AromaticContact CD1-CD2 3.97Å; F190-F384 HydrophobicContact CD1-CD2 3.97Å; F190-F384 HydrophobicContact CD1-CE1 4.5Å; F190-F384 AromaticContact CD1-CE2 3.22Å; F190-F384 HydrophobicContact CD1-CE2 3.22Å; F190-F384 AromaticContact CD1-CZ 3.54Å; F190-F384 HydrophobicContact CD1-CZ 3.54Å; F190-F384 AromaticContact CE1-CD2 3.64Å; F190-F384 HydrophobicContact CE1-CD2 3.64Å; F190-F384 AromaticContact CE1-CE2 3.42Å; F190-F384 HydrophobicContact CE1-CE2 3.42Å; F190-F384 VanDerWaalsContact CE1-CE2 3.42Å; F190-F384 HydrophobicContact CE1-CG 4.34Å; F190-F384 AromaticContact CE1-CZ 3.94Å; F190-F384 HydrophobicContact CE1-CZ 3.94Å; F190-F384 AromaticContact CG-CE2 3.99Å; F190-F384 HydrophobicContact CG-CE2 3.99Å; F190-F384 HydrophobicContact CG-CZ 4.48Å; F190-F384 HydrophobicContact CZ-CD2 4.29Å; F190-F384 HydrophobicContact CZ-CE2 4.31Å
191	Q	89.1	Confident	83.5	Confident	52 Å²	52	36 Å²	36	24%	0.243	20%	0.203	C	C	.	.			trans	-65.6	115	173.9	178.2	70.7	58.1	0	0	110.5	T193 P201 M204	Q191-T193 PolarHBondContact O-N 2.87Å; Q191-P201 HydrophobicContact CB-CG 4.24Å; Q191-M204 HydrophobicContact CB-CE 4.33Å; Q191-M204 HydrophobicContact CB-SD 3.79Å
192	Q	80.2	Confident	84.1	Confident	19 Å²	19	32.5 Å²	32.5	9%	0.089	19%	0.187	C	C	.	.			trans	-77	124	169.1	-69.6	177	5.4	0	0	110.4	E67 P99 Y100 F190 S194 N198 Y257	E67-Q192 PolarHBondContact OE1-NE2 2.85Å; P99-Q192 HydrophobicContact CG-CG 4.04Å; Y100-Q192 PolarHBondContact OH-OE1 2.85Å; F190-Q192 PolarHBondContact O-N 2.85Å; F190-Q192 VanDerWaalsContact O-N 3.15Å; Q192-S194 VanDerWaalsContact C-N 3.31Å; Q192-N198 PolarHBondContact O-ND2 2.56Å; Q192-Y257 PolarHBondContact NE2-OH 3.33Å
193	T	67	Low	84.6	Confident	114 Å²	114	32.3 Å²	32.3	70%	0.699	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-0.8	-176.4	58.4	0	0	0	0	113.8	Q191 Q195	Q191-T193 PolarHBondContact O-N 2.87Å; T193-Q195 PolarHBondContact O-N 3.16Å; T193-Q195 VanDerWaalsContact O-N 3.09Å
194	S	59.9	Low	84.7	Confident	79 Å²	79	33.8 Å²	33.8	55%	0.552	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.5	-174.1	61.8	0	0	0	0	113.5	Q192 N198	Q192-S194 VanDerWaalsContact C-N 3.31Å; S194-N198 PolarHBondContact OG-ND2 2.92Å
195	Q	55.1	Low	84.8	Confident	68 Å²	68	34.6 Å²	34.6	32%	0.318	20%	0.198	S	C	.	.			trans	-145.8	138.3	173.9	-58.8	-156.4	37.8	0	0	114.3	T193 S197 N198	T193-Q195 PolarHBondContact O-N 3.16Å; T193-Q195 VanDerWaalsContact O-N 3.09Å; Q195-S197 PolarHBondContact O-N 2.87Å; Q195-S197 VanDerWaalsContact O-N 3.08Å; Q195-N198 PolarHBondContact N-ND2 3.22Å; Q195-N198 WeakPolarHBondContact O-CB 3.29Å; Q195-N198 PolarHBondContact O-N 2.98Å; Q195-N198 VanDerWaalsContact O-N 3.11Å; Q195-N198 PolarHBondContact O-ND2 2.91Å
196	N	55.2	Low	84.9	Confident	180 Å²	180	34.6 Å²	34.6	96%	0.963	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.1	178	-70.3	-13.7	0	0	0	114.7
197	S	67.4	Low	85	Confident	59 Å²	59	36.9 Å²	36.9	41%	0.413	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	3.8	179.2	56.9	0	0	0	0	113.6	L149 Q195	L149-S197 WeakPolarHBondContact CD1-O 3.35Å; Q195-S197 PolarHBondContact O-N 2.87Å; Q195-S197 VanDerWaalsContact O-N 3.08Å
198	N	78.2	Confident	85	Confident	32 Å²	32	42.8 Å²	42.8	17%	0.171	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-67	131.7	-179.1	-71.5	-12.5	0	0	0	109.8	Y100 Q192 S194 Q195	Y100-N198 HydrophobicContact CE1-CB 4.12Å; Y100-N198 PolarHBondContact OH-ND2 2.89Å; Q192-N198 PolarHBondContact O-ND2 2.56Å; S194-N198 PolarHBondContact OG-ND2 2.92Å; Q195-N198 PolarHBondContact N-ND2 3.22Å; Q195-N198 WeakPolarHBondContact O-CB 3.29Å; Q195-N198 PolarHBondContact O-N 2.98Å; Q195-N198 VanDerWaalsContact O-N 3.11Å; Q195-N198 PolarHBondContact O-ND2 2.91Å
199	P	87.9	Confident	85.2	Confident	10 Å²	10	45.4 Å²	45.4	7%	0.065	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-65.1	145.2	177.2	28.3	-33.7	0	0	0	110.4	Y100 L149 T165 P201	Y100-P199 HydrophobicContact CD1-CG 3.55Å; Y100-P199 HydrophobicContact CE1-CG 3.94Å; Y100-P199 HydrophobicContact CG-CG 4.36Å; L149-P199 HydrophobicContact CD2-CB 4.29Å; L149-P199 HydrophobicContact CD2-CG 3.96Å; T165-P199 HydrophobicContact CG2-CB 3.71Å; P199-P201 WeakPolarHBondContact O-CD 3.18Å
200	T	92.7	Very high	85.4	Confident	50 Å²	50	52 Å²	52	31%	0.307	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-62.9	126.7	174.2	-51.8	0	0	0	0	110.3	Q164 I202 M204	Q164-T200 PolarHBondContact NE2-O 2.79Å; T200-I202 PolarHBondContact O-N 2.8Å; T200-M204 HydrophobicContact CG2-CB 4.03Å
201	P	95	Very high	85.7	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.013	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-53.6	138.3	173.1	-26.1	32	0	0	0	111.7	P99 Q191 P199 F203 M204 N205	P99-P201 HydrophobicContact CB-CG 4.14Å; Q191-P201 HydrophobicContact CB-CG 4.24Å; P199-P201 WeakPolarHBondContact O-CD 3.18Å; P201-F203 VanDerWaalsContact C-N 3.3Å; P201-F203 PolarHBondContact O-N 2.85Å; P201-M204 HydrophobicContact CB-CG 4.31Å; P201-M204 HydrophobicContact CB-SD 4.31Å; P201-M204 HydrophobicContact CG-SD 3.95Å; P201-M204 WeakPolarHBondContact O-CB 3.33Å; P201-M204 PolarHBondContact O-N 2.95Å; P201-N205 PolarHBondContact O-N 2.81Å
202	I	97.6	Very high	86.1	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-33.9	-171.3	-173.4	163.9	0	0	0	113.3	L101 V154 I156 I161 Q164 M186 M188 T200 M204 N205 M206	L101-I202 HydrophobicContact CD2-CD1 4.07Å; V154-I202 HydrophobicContact CB-CD1 4.09Å; V154-I202 HydrophobicContact CG1-CD1 3.68Å; V154-I202 HydrophobicContact CG2-CD1 4.48Å; I156-I202 HydrophobicContact CD1-CD1 3.99Å; I161-I202 HydrophobicContact CG1-CG1 4.35Å; I161-I202 HydrophobicContact CG2-CG1 4.43Å; Q164-I202 HydrophobicContact CG-CB 4.49Å; Q164-I202 HydrophobicContact CG-CD1 4.04Å; Q164-I202 HydrophobicContact CG-CG1 4.21Å; Q164-I202 VanDerWaalsContact OE1-CA 3.28Å; M186-I202 HydrophobicContact CE-CB 4.26Å; M186-I202 HydrophobicContact CE-CD1 3.83Å; M186-I202 HydrophobicContact CE-CG1 4.1Å; M186-I202 HydrophobicContact CE-CG2 3.22Å; M186-I202 HydrophobicContact CG-CG2 3.77Å; M186-I202 HydrophobicContact SD-CD1 4.13Å; M186-I202 HydrophobicContact SD-CG2 4.12Å; M188-I202 HydrophobicContact SD-CG2 4.46Å; T200-I202 PolarHBondContact O-N 2.8Å; I202-M204 VanDerWaalsContact C-N 3.28Å; I202-M204 PolarHBondContact O-N 2.81Å; I202-N205 PolarHBondContact O-N 2.86Å; I202-M206 HydrophobicContact CG1-CE 4.23Å; I202-M206 WeakPolarHBondContact O-CG 3.47Å; I202-M206 PolarHBondContact O-N 2.75Å
203	F	97.5	Very high	86.7	Confident	1 Å²	1	54.9 Å²	54.9	0%	0.004	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-31.7	176.6	-167.7	-115.3	0	0	0	112.4	M188 P201 M206 I207 V212 L216 F217 F235 F384	M188-F203 HydrophobicContact CE-CB 3.84Å; M188-F203 HydrophobicContact CE-CD2 4.06Å; M188-F203 HydrophobicContact CE-CG 4.03Å; P201-F203 VanDerWaalsContact C-N 3.3Å; P201-F203 PolarHBondContact O-N 2.85Å; F203-M206 HydrophobicContact CD2-CB 4.44Å; F203-M206 HydrophobicContact CD2-SD 3.62Å; F203-M206 HydrophobicContact CE2-SD 4.17Å; F203-M206 WeakPolarHBondContact O-CB 3.32Å; F203-M206 PolarHBondContact O-N 3.09Å; F203-I207 HydrophobicContact CD1-CD1 3.93Å; F203-I207 HydrophobicContact CE1-CD1 3.63Å; F203-I207 HydrophobicContact CE1-CG1 4.23Å; F203-I207 HydrophobicContact CZ-CD1 4.2Å; F203-I207 HydrophobicContact CZ-CG1 4.33Å; F203-I207 WeakPolarHBondContact O-CG1 3.34Å; F203-I207 PolarHBondContact O-N 3.17Å; F203-I207 VanDerWaalsContact O-N 3.14Å; F203-V212 HydrophobicContact CE2-CG1 4.46Å; F203-L216 WeakPolarHBondContact CZ-O 3.4Å; F203-F217 AromaticContact CD1-CD1 3.8Å; F203-F217 HydrophobicContact CD1-CD1 3.8Å; F203-F217 AromaticContact CD1-CE1 3.97Å; F203-F217 HydrophobicContact CD1-CE1 3.97Å; F203-F217 AromaticContact CD2-CD1 3.96Å; F203-F217 HydrophobicContact CD2-CD1 3.96Å; F203-F217 AromaticContact CE1-CD1 3.7Å; F203-F217 HydrophobicContact CE1-CD1 3.7Å; F203-F217 HydrophobicContact CE1-CE1 4.21Å; F203-F217 HydrophobicContact CE2-CB 4.2Å; F203-F217 AromaticContact CE2-CD1 3.9Å; F203-F217 HydrophobicContact CE2-CD1 3.9Å; F203-F217 AromaticContact CG-CD1 3.95Å; F203-F217 HydrophobicContact CG-CD1 3.95Å; F203-F217 HydrophobicContact CG-CE1 4.22Å; F203-F217 HydrophobicContact CZ-CB 4.39Å; F203-F217 AromaticContact CZ-CD1 3.79Å; F203-F217 HydrophobicContact CZ-CD1 3.79Å; F203-F235 AromaticContact CD2-CD1 3.93Å; F203-F235 HydrophobicContact CD2-CD1 3.93Å; F203-F235 HydrophobicContact CD2-CE1 4.31Å; F203-F235 AromaticContact CE2-CD1 3.92Å; F203-F235 HydrophobicContact CE2-CD1 3.92Å; F203-F384 HydrophobicContact CD1-CB 4.22Å; F203-F384 HydrophobicContact CD1-CD2 4.13Å; F203-F384 HydrophobicContact CD1-CG 4.27Å; F203-F384 HydrophobicContact CE1-CB 3.77Å; F203-F384 HydrophobicContact CE1-CG 4.29Å
204	M	95.9	Very high	88.2	Confident	38 Å²	38	54.9 Å²	54.9	19%	0.187	29%	0.293	C	S	.	.	H	α-helix	trans	-66.2	-43.2	172.8	-67.3	179	63.7	0	0	110.9	Q191 T200 P201 I202 M206 I207 E208 F384	Q191-M204 HydrophobicContact CB-CE 4.33Å; Q191-M204 HydrophobicContact CB-SD 3.79Å; T200-M204 HydrophobicContact CG2-CB 4.03Å; P201-M204 HydrophobicContact CB-CG 4.31Å; P201-M204 HydrophobicContact CB-SD 4.31Å; P201-M204 HydrophobicContact CG-SD 3.95Å; P201-M204 WeakPolarHBondContact O-CB 3.33Å; P201-M204 PolarHBondContact O-N 2.95Å; I202-M204 VanDerWaalsContact C-N 3.28Å; I202-M204 PolarHBondContact O-N 2.81Å; M204-M206 VanDerWaalsContact C-N 3.29Å; M204-M206 PolarHBondContact O-N 3.3Å; M204-I207 PolarHBondContact O-N 3.1Å; M204-I207 VanDerWaalsContact O-N 3.12Å; M204-E208 WeakPolarHBondContact O-CB 3.48Å; M204-E208 WeakPolarHBondContact O-CG 3.42Å; M204-E208 PolarHBondContact O-N 2.84Å; M204-F384 HydrophobicContact CG-CE1 3.9Å; M204-F384 HydrophobicContact CG-CE2 4.28Å; M204-F384 HydrophobicContact CG-CZ 3.52Å; M204-F384 HydrophobicContact SD-CE1 4.48Å; M204-F384 HydrophobicContact SD-CZ 3.87Å
205	N	97.5	Very high	89.9	Confident	16 Å²	16	53.6 Å²	53.6	9%	0.086	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-36.6	173.6	-82.1	-27.3	0	0	0	112.3	I161 Q164 P201 I202 I207 E208 Q209	I161-N205 HydrophobicContact CG2-CB 3.74Å; Q164-N205 PolarHBondContact OE1-ND2 3.22Å; P201-N205 PolarHBondContact O-N 2.81Å; I202-N205 PolarHBondContact O-N 2.86Å; N205-I207 VanDerWaalsContact C-N 3.33Å; N205-I207 PolarHBondContact O-N 2.86Å; N205-E208 PolarHBondContact O-N 2.9Å; N205-Q209 WeakPolarHBondContact O-CB 3.39Å; N205-Q209 WeakPolarHBondContact O-CG 3.3Å; N205-Q209 PolarHBondContact O-N 2.94Å
206	M	97.9	Very high	92	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-43	173.3	-66.9	173.7	-177.2	0	0	112.2	I156 L159 I161 M186 I202 F203 M204 N210 L211 V212 F235	I156-M206 HydrophobicContact CD1-CE 3.56Å; L159-M206 HydrophobicContact CD1-CE 3.89Å; L159-M206 HydrophobicContact CD1-CG 4.48Å; L159-M206 HydrophobicContact CD1-SD 3.88Å; I161-M206 HydrophobicContact CD1-CE 3.96Å; I161-M206 HydrophobicContact CD1-CG 4.3Å; I161-M206 HydrophobicContact CG1-CE 4.31Å; I161-M206 HydrophobicContact CG1-CG 3.77Å; M186-M206 HydrophobicContact CE-CE 3.86Å; I202-M206 HydrophobicContact CG1-CE 4.23Å; I202-M206 WeakPolarHBondContact O-CG 3.47Å; I202-M206 PolarHBondContact O-N 2.75Å; F203-M206 HydrophobicContact CD2-CB 4.44Å; F203-M206 HydrophobicContact CD2-SD 3.62Å; F203-M206 HydrophobicContact CE2-SD 4.17Å; F203-M206 WeakPolarHBondContact O-CB 3.32Å; F203-M206 PolarHBondContact O-N 3.09Å; M204-M206 VanDerWaalsContact C-N 3.29Å; M204-M206 PolarHBondContact O-N 3.3Å; M206-N210 PolarHBondContact O-N 3.05Å; M206-L211 HydrophobicContact CB-CB 4.47Å; M206-L211 WeakPolarHBondContact O-CB 3.46Å; M206-L211 PolarHBondContact O-N 3.19Å; M206-V212 HydrophobicContact CB-CG1 4.2Å; M206-V212 HydrophobicContact CB-CG2 4.45Å; M206-V212 HydrophobicContact SD-CG1 4.48Å; M206-F235 HydrophobicContact CE-CD1 4.13Å; M206-F235 HydrophobicContact CE-CE1 3.95Å; M206-F235 HydrophobicContact CE-CZ 4.32Å; M206-F235 HydrophobicContact SD-CD1 3.72Å; M206-F235 HydrophobicContact SD-CE1 4.05Å; M206-F235 HydrophobicContact SD-CG 4.32Å
207	I	97.3	Very high	94.1	Very high	49 Å²	49	42.3 Å²	42.3	25%	0.251	22%	0.224	S	C	.	.	H	α-helix	trans	-67	-50.4	177.6	-64.9	165.8	0	0	0	110.4	F203 M204 N205 Q209 N210 V212 P215 F384	F203-I207 HydrophobicContact CD1-CD1 3.93Å; F203-I207 HydrophobicContact CE1-CD1 3.63Å; F203-I207 HydrophobicContact CE1-CG1 4.23Å; F203-I207 HydrophobicContact CZ-CD1 4.2Å; F203-I207 HydrophobicContact CZ-CG1 4.33Å; F203-I207 WeakPolarHBondContact O-CG1 3.34Å; F203-I207 PolarHBondContact O-N 3.17Å; F203-I207 VanDerWaalsContact O-N 3.14Å; M204-I207 PolarHBondContact O-N 3.1Å; M204-I207 VanDerWaalsContact O-N 3.12Å; N205-I207 VanDerWaalsContact C-N 3.33Å; N205-I207 PolarHBondContact O-N 2.86Å; I207-Q209 VanDerWaalsContact C-N 3.27Å; I207-Q209 PolarHBondContact O-N 3.32Å; I207-N210 PolarHBondContact O-N 3.4Å; I207-V212 HydrophobicContact CG1-CG2 3.98Å; I207-P215 HydrophobicContact CD1-CB 3.71Å; I207-P215 HydrophobicContact CG1-CB 4Å; I207-P215 HydrophobicContact CG2-CB 4.37Å; I207-F384 HydrophobicContact CD1-CB 4.14Å; I207-F384 HydrophobicContact CD1-CD1 3.8Å; I207-F384 HydrophobicContact CD1-CG 4.12Å
208	E	96.8	Very high	95.5	Very high	124 Å²	124	39.5 Å²	39.5	58%	0.579	21%	0.205	S	C	*	.	H	α-helix	trans	-62.6	-33.5	-177.5	-71.9	177.4	-173.2	0	0	112.6	M204 N205 N210	M204-E208 WeakPolarHBondContact O-CB 3.48Å; M204-E208 WeakPolarHBondContact O-CG 3.42Å; M204-E208 PolarHBondContact O-N 2.84Å; N205-E208 PolarHBondContact O-N 2.9Å; E208-N210 VanDerWaalsContact C-N 3.27Å; E208-N210 PolarHBondContact O-N 3Å
209	Q	97.8	Very high	96.5	Very high	56 Å²	56	38.2 Å²	38.2	26%	0.262	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	4.5	176.9	-62.9	176.2	31.5	0	0	113	V162 N205 I207 L211	V162-Q209 PolarHBondContact O-NE2 3.09Å; N205-Q209 WeakPolarHBondContact O-CB 3.39Å; N205-Q209 WeakPolarHBondContact O-CG 3.3Å; N205-Q209 PolarHBondContact O-N 2.94Å; I207-Q209 VanDerWaalsContact C-N 3.27Å; I207-Q209 PolarHBondContact O-N 3.32Å; Q209-L211 VanDerWaalsContact C-N 3.28Å; Q209-L211 HydrophobicContact CB-CD1 3.88Å; Q209-L211 HydrophobicContact CB-CD2 4.47Å; Q209-L211 HydrophobicContact CB-CG 3.74Å; Q209-L211 PolarHBondContact O-N 3.25Å
210	N	96.9	Very high	96.8	Very high	141 Å²	141	37.9 Å²	37.9	75%	0.754	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	41.1	-177.8	-56.5	-80.2	0	0	0	113.1	M206 I207 E208	M206-N210 PolarHBondContact O-N 3.05Å; I207-N210 PolarHBondContact O-N 3.4Å; E208-N210 VanDerWaalsContact C-N 3.27Å; E208-N210 PolarHBondContact O-N 3Å
211	L	97	Very high	96.7	Very high	38 Å²	38	35.7 Å²	35.7	20%	0.199	18%	0.181	C	C	.	.			trans	-91.3	-7.8	-178.3	-60.5	177.2	0	0	0	113.3	L159 N160 I161 M206 Q209	L159-L211 HydrophobicContact CD2-CB 4.21Å; L159-L211 WeakPolarHBondContact CD2-O 3.45Å; N160-L211 VanDerWaalsContact O-CD1 3.27Å; N160-L211 WeakPolarHBondContact O-CD1 3.23Å; I161-L211 HydrophobicContact CB-CD1 4.37Å; I161-L211 HydrophobicContact CG1-CD1 3.86Å; M206-L211 HydrophobicContact CB-CB 4.47Å; M206-L211 WeakPolarHBondContact O-CB 3.46Å; M206-L211 PolarHBondContact O-N 3.19Å; Q209-L211 VanDerWaalsContact C-N 3.28Å; Q209-L211 HydrophobicContact CB-CD1 3.88Å; Q209-L211 HydrophobicContact CB-CD2 4.47Å; Q209-L211 HydrophobicContact CB-CG 3.74Å; Q209-L211 PolarHBondContact O-N 3.25Å
212	V	96.6	Very high	96.2	Very high	15 Å²	15	36.6 Å²	36.6	9%	0.091	19%	0.186	C	C	.	.	S	Bend	trans	-129.8	135.9	-178.9	-69	0	0	0	0	110.7	S19 F203 M206 I207 K214 F235	S19-V212 VanDerWaalsContact OG-C 3.26Å; S19-V212 WeakPolarHBondContact OG-CA 3.19Å; F203-V212 HydrophobicContact CE2-CG1 4.46Å; M206-V212 HydrophobicContact CB-CG1 4.2Å; M206-V212 HydrophobicContact CB-CG2 4.45Å; M206-V212 HydrophobicContact SD-CG1 4.48Å; I207-V212 HydrophobicContact CG1-CG2 3.98Å; V212-K214 VanDerWaalsContact C-N 3.29Å; V212-K214 PolarHBondContact O-N 2.91Å; V212-F235 HydrophobicContact CG1-CB 3.92Å
213	D	93.9	Very high	95.1	Very high	81 Å²	81	40 Å²	40	43%	0.433	20%	0.204	S	C	.	.	S	Bend	trans	-65.9	-33.7	-176.8	-74.9	-19	0	0	0	112.5	E18 S19	E18-D213 VanDerWaalsContact CA-OD2 3.23Å; E18-D213 WeakPolarHBondContact CA-OD2 2.99Å; S19-D213 WeakPolarHBondContact CB-OD1 3.37Å; S19-D213 PolarHBondContact N-OD1 2.87Å; S19-D213 PolarHBondContact N-OD2 3.22Å; S19-D213 PolarHBondContact OG-N 3.41Å; S19-D213 PolarHBondContact OG-OD1 2.89Å
214	K	97.3	Very high	93.4	Very high	114 Å²	114	44 Å²	44	50%	0.496	23%	0.225	S	C	.	.	S	Bend	trans	-128.4	143	177	-60.7	179.4	-172.6	173.8	0	109.2	V212 L216 G236	V212-K214 VanDerWaalsContact C-N 3.29Å; V212-K214 PolarHBondContact O-N 2.91Å; K214-L216 HydrophobicContact CB-CD2 4.04Å; K214-L216 HydrophobicContact CB-CG 3.83Å; K214-L216 HydrophobicContact CD-CD2 4.24Å; K214-L216 PolarHBondContact O-N 3.49Å; K214-G236 WeakPolarHBondContact CB-O 3.44Å; K214-G236 PolarHBondContact N-O 2.83Å; K214-G236 WeakPolarHBondContact O-CA 3.33Å
215	P	97.5	Very high	91.2	Very high	52 Å²	52	48.6 Å²	48.6	34%	0.338	25%	0.246	S	C	.	.	S	Bend	trans	-76	55.8	176.8	34.7	-39.2	0	0	0	111.3	I207 F384 G385	I207-P215 HydrophobicContact CD1-CB 3.71Å; I207-P215 HydrophobicContact CG1-CB 4Å; I207-P215 HydrophobicContact CG2-CB 4.37Å; P215-F384 CarbonylContact O-C 3.56Å; P215-F384 WeakPolarHBondContact O-CA 3.14Å; P215-F384 WeakPolarHBondContact O-CB 3.46Å; P215-F384 PolarHBondContact O-N 3.06Å; P215-G385 PolarHBondContact O-N 2.76Å
216	L	98.2	Very high	88.8	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	158.9	176.9	63.8	81.7	0	0	0	110.9	F203 K214 G236 G237 I238 V381 F382 D383	F203-L216 WeakPolarHBondContact CZ-O 3.4Å; K214-L216 HydrophobicContact CB-CD2 4.04Å; K214-L216 HydrophobicContact CB-CG 3.83Å; K214-L216 HydrophobicContact CD-CD2 4.24Å; K214-L216 PolarHBondContact O-N 3.49Å; L216-G236 PolarHBondContact O-N 2.65Å; L216-G237 WeakPolarHBondContact CD1-O 3.28Å; L216-I238 HydrophobicContact CD1-CD1 4.47Å; L216-I238 HydrophobicContact CD1-CG1 3.79Å; L216-I238 HydrophobicContact CD2-CD1 4.16Å; L216-I238 HydrophobicContact CD2-CG1 4.34Å; L216-V381 HydrophobicContact CB-CG1 4.45Å; L216-V381 HydrophobicContact CD1-CG1 4.3Å; L216-V381 HydrophobicContact CD2-CG1 4.31Å; L216-F382 WeakPolarHBondContact CA-O 3.41Å; L216-F382 WeakPolarHBondContact CB-O 3.41Å; L216-D383 HydrophobicContact CB-CB 4.3Å
217	F	98.5	Very high	86.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	158.9	164.2	61.2	-86.6	0	0	0	109.4	T96 M188 F203 V219 I233 M234 F235 W258 F382	T96-F217 HydrophobicContact CG2-CE2 3.8Å; T96-F217 HydrophobicContact CG2-CZ 3.9Å; M188-F217 HydrophobicContact CB-CE2 4.29Å; M188-F217 HydrophobicContact CB-CZ 3.86Å; M188-F217 HydrophobicContact CE-CD1 3.66Å; M188-F217 HydrophobicContact CE-CD2 4.12Å; M188-F217 HydrophobicContact CE-CE1 3.56Å; M188-F217 HydrophobicContact CE-CE2 4.02Å; M188-F217 HydrophobicContact CE-CG 3.95Å; M188-F217 HydrophobicContact CE-CZ 3.76Å; F203-F217 AromaticContact CD1-CD1 3.8Å; F203-F217 HydrophobicContact CD1-CD1 3.8Å; F203-F217 AromaticContact CD1-CE1 3.97Å; F203-F217 HydrophobicContact CD1-CE1 3.97Å; F203-F217 AromaticContact CD2-CD1 3.96Å; F203-F217 HydrophobicContact CD2-CD1 3.96Å; F203-F217 AromaticContact CE1-CD1 3.7Å; F203-F217 HydrophobicContact CE1-CD1 3.7Å; F203-F217 HydrophobicContact CE1-CE1 4.21Å; F203-F217 HydrophobicContact CE2-CB 4.2Å; F203-F217 AromaticContact CE2-CD1 3.9Å; F203-F217 HydrophobicContact CE2-CD1 3.9Å; F203-F217 AromaticContact CG-CD1 3.95Å; F203-F217 HydrophobicContact CG-CD1 3.95Å; F203-F217 HydrophobicContact CG-CE1 4.22Å; F203-F217 HydrophobicContact CZ-CB 4.39Å; F203-F217 AromaticContact CZ-CD1 3.79Å; F203-F217 HydrophobicContact CZ-CD1 3.79Å; F217-V219 HydrophobicContact CD2-CG2 4.21Å; F217-V219 HydrophobicContact CE2-CG2 4.4Å; F217-I233 HydrophobicContact CD2-CD1 3.9Å; F217-I233 HydrophobicContact CD2-CG1 4.3Å; F217-I233 HydrophobicContact CE2-CD1 4.46Å; F217-M234 CarbonylContact C-O 3.59Å; F217-M234 WeakPolarHBondContact CA-O 3.36Å; F217-M234 WeakPolarHBondContact CB-O 3.39Å; F217-F235 HydrophobicContact CB-CD1 3.95Å; F217-F235 HydrophobicContact CB-CE1 4.39Å; F217-W258 AromaticContact CE1-CZ2 3.85Å; F217-W258 HydrophobicContact CE1-CZ2 3.85Å; F217-W258 HydrophobicContact CZ-CZ2 4.11Å; F217-F382 HydrophobicContact CD1-CB 4.11Å; F217-F382 HydrophobicContact CD2-CB 4.04Å; F217-F382 AromaticContact CD2-CD2 3.73Å; F217-F382 HydrophobicContact CD2-CD2 3.73Å; F217-F382 HydrophobicContact CD2-CG 4.2Å; F217-F382 HydrophobicContact CE1-CB 3.66Å; F217-F382 HydrophobicContact CE1-CG 4.38Å; F217-F382 HydrophobicContact CE2-CB 3.59Å; F217-F382 HydrophobicContact CE2-CD1 4.39Å; F217-F382 AromaticContact CE2-CD2 3.22Å; F217-F382 HydrophobicContact CE2-CD2 3.22Å; F217-F382 AromaticContact CE2-CE2 3.93Å; F217-F382 HydrophobicContact CE2-CE2 3.93Å; F217-F382 AromaticContact CE2-CG 3.49Å; F217-F382 HydrophobicContact CE2-CG 3.49Å; F217-F382 VanDerWaalsContact CE2-CG 3.49Å; F217-F382 HydrophobicContact CG-CB 4.28Å; F217-F382 HydrophobicContact CZ-CB 3.37Å; F217-F382 HydrophobicContact CZ-CD1 4.27Å; F217-F382 AromaticContact CZ-CD2 3.86Å; F217-F382 HydrophobicContact CZ-CD2 3.86Å; F217-F382 AromaticContact CZ-CG 3.59Å; F217-F382 HydrophobicContact CZ-CG 3.59Å; F217-F382 PolarHBondContact N-O 3.08Å; F217-F382 VanDerWaalsContact N-O 3.11Å; F217-F382 PolarHBondContact O-N 3.11Å
218	A	98.3	Very high	84.4	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	145.2	-178.2	0	0	0	0	0	111.3	I233 M234 Y379 T380 V381	A218-I233 CarbonylContact O-C 3.59Å; A218-I233 WeakPolarHBondContact O-CA 3.4Å; A218-M234 PolarHBondContact N-O 3.35Å; A218-M234 PolarHBondContact O-N 3.38Å; A218-Y379 HydrophobicContact CB-CE1 3.8Å; A218-Y379 HydrophobicContact CB-CE2 4.44Å; A218-Y379 WeakPolarHBondContact CB-OH 3.41Å; A218-T380 CarbonylContact C-O 3.55Å; A218-T380 WeakPolarHBondContact CA-O 3.37Å; A218-V381 HydrophobicContact CB-CG2 4.02Å
219	V	97.4	Very high	82.7	Confident	5 Å²	5	58 Å²	58	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.6	-172.2	-179.6	0	0	0	0	109.9	F217 L221 E232 I233 T283 T380 F382	F217-V219 HydrophobicContact CD2-CG2 4.21Å; F217-V219 HydrophobicContact CE2-CG2 4.4Å; V219-L221 HydrophobicContact CG1-CD2 3.79Å; V219-L221 HydrophobicContact CG1-CG 3.92Å; V219-E232 WeakPolarHBondContact CA-O 3.49Å; V219-I233 HydrophobicContact CG2-CB 4.42Å; V219-I233 HydrophobicContact CG2-CD1 4.16Å; V219-I233 HydrophobicContact CG2-CG1 4.06Å; V219-T283 HydrophobicContact CG1-CG2 4.09Å; V219-T283 HydrophobicContact CG2-CG2 4.34Å; V219-T380 PolarHBondContact N-O 3.27Å; V219-T380 PolarHBondContact O-N 2.82Å; V219-T380 VanDerWaalsContact O-N 3.09Å; V219-F382 HydrophobicContact CB-CE2 4.24Å; V219-F382 HydrophobicContact CG2-CD2 4.24Å; V219-F382 HydrophobicContact CG2-CE2 3.84Å
220	Y	94.5	Very high	82	Confident	3 Å²	3	55.8 Å²	55.8	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.7	171.4	168.3	-113.9	0	0	0	109.1	N222 G231 E232 Y242 V394	Y220-N222 HydrophobicContact CE1-CB 4.16Å; Y220-N222 HydrophobicContact CE2-CB 4.43Å; Y220-N222 WeakPolarHBondContact OH-CB 3.18Å; Y220-N222 PolarHBondContact OH-ND2 2.85Å; Y220-G231 CarbonylContact O-C 3.49Å; Y220-G231 WeakPolarHBondContact O-CA 3.41Å; Y220-E232 PolarHBondContact N-O 2.82Å; Y220-E232 PolarHBondContact O-N 2.81Å; Y220-Y242 AromaticContact CD1-CD1 3.48Å; Y220-Y242 HydrophobicContact CD1-CD1 3.48Å; Y220-Y242 VanDerWaalsContact CD1-CD1 3.48Å; Y220-Y242 HydrophobicContact CD1-CD2 4.41Å; Y220-Y242 AromaticContact CD1-CE1 3.53Å; Y220-Y242 HydrophobicContact CD1-CE1 3.53Å; Y220-Y242 HydrophobicContact CD1-CE2 4.47Å; Y220-Y242 AromaticContact CD1-CG 3.97Å; Y220-Y242 HydrophobicContact CD1-CG 3.97Å; Y220-Y242 HydrophobicContact CD2-CD1 4Å; Y220-Y242 HydrophobicContact CD2-CG 4.07Å; Y220-Y242 AromaticContact CE1-CD1 3.61Å; Y220-Y242 HydrophobicContact CE1-CD1 3.61Å; Y220-Y242 AromaticContact CE1-CE1 3.64Å; Y220-Y242 HydrophobicContact CE1-CE1 3.64Å; Y220-Y242 HydrophobicContact CE1-CG 4.49Å; Y220-Y242 HydrophobicContact CE2-CD1 4.14Å; Y220-Y242 AromaticContact CG-CD1 3.67Å; Y220-Y242 HydrophobicContact CG-CD1 3.67Å; Y220-Y242 HydrophobicContact CG-CD2 4.22Å; Y220-Y242 HydrophobicContact CG-CE1 4.16Å; Y220-Y242 AromaticContact CG-CG 3.72Å; Y220-Y242 HydrophobicContact CG-CG 3.72Å; Y220-Y242 AromaticContact CZ-CD1 3.94Å; Y220-V394 HydrophobicContact CD2-CG1 4.46Å; Y220-V394 HydrophobicContact CD2-CG2 4.19Å; Y220-V394 HydrophobicContact CE2-CG1 3.65Å; Y220-V394 HydrophobicContact CE2-CG2 4.12Å
221	L	91.4	Very high	81.7	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.016	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.4	176.4	-54.9	-177.1	0	0	0	111.1	L25 Y77 V219 D372 L375 R376	L25-L221 HydrophobicContact CD1-CD2 3.76Å; Y77-L221 HydrophobicContact CD1-CD2 3.8Å; Y77-L221 HydrophobicContact CD2-CD1 3.87Å; Y77-L221 HydrophobicContact CD2-CD2 3.94Å; Y77-L221 HydrophobicContact CD2-CG 4.37Å; Y77-L221 HydrophobicContact CE1-CB 4.27Å; Y77-L221 HydrophobicContact CE1-CD2 4.18Å; Y77-L221 HydrophobicContact CE2-CB 4.18Å; Y77-L221 HydrophobicContact CE2-CD1 3.94Å; Y77-L221 HydrophobicContact CE2-CD2 4.32Å; Y77-L221 HydrophobicContact CE2-CG 4.38Å; Y77-L221 HydrophobicContact CG-CD1 4.44Å; Y77-L221 HydrophobicContact CG-CD2 3.66Å; V219-L221 HydrophobicContact CG1-CD2 3.79Å; V219-L221 HydrophobicContact CG1-CG 3.92Å; L221-D372 HydrophobicContact CD1-CB 4.39Å; L221-D372 VanDerWaalsContact CD1-OD1 3.23Å; L221-D372 WeakPolarHBondContact CD1-OD1 3.16Å; L221-L375 HydrophobicContact CD1-CB 3.75Å; L221-L375 HydrophobicContact CD1-CD1 4.25Å; L221-R376 HydrophobicContact CB-CG 3.78Å
222	N	84.7	Confident	81.5	Confident	21 Å²	21	48 Å²	48	11%	0.112	25%	0.253	C	S	.	.			trans	-151.4	151.5	-179.7	-179.2	22	0	0	0	111.2	Y77 Y220 N224 S230	Y77-N222 WeakPolarHBondContact CE1-O 3.45Å; Y77-N222 VanDerWaalsContact OH-C 3.27Å; Y77-N222 PolarHBondContact OH-O 2.88Å; Y220-N222 HydrophobicContact CE1-CB 4.16Å; Y220-N222 HydrophobicContact CE2-CB 4.43Å; Y220-N222 WeakPolarHBondContact OH-CB 3.18Å; Y220-N222 PolarHBondContact OH-ND2 2.85Å; N222-N224 PolarHBondContact OD1-N 3.42Å; N222-S230 CarbonylContact C-O 3.49Å; N222-S230 WeakPolarHBondContact CA-O 3.06Å; N222-S230 PolarHBondContact N-O 3.48Å
223	L	74.6	Confident	81.5	Confident	72 Å²	72	47.4 Å²	47.4	38%	0.377	25%	0.249	S	C	.	.			trans	-85.2	-24.9	177.4	-71.1	175.6	0	0	0	113.5	I75 E225	I75-L223 HydrophobicContact CD1-CD2 3.26Å; L223-E225 PolarHBondContact O-N 3.09Å; L223-E225 VanDerWaalsContact O-N 3.14Å
224	N	61.3	Low	81.6	Confident	84 Å²	84	43.7 Å²	43.7	45%	0.449	23%	0.229	S	C	.	.			trans	-76.6	108.1	-167.1	-67.3	-38.6	0	0	0	112.2	N222 D226 K227	N222-N224 PolarHBondContact OD1-N 3.42Å; N224-D226 PolarHBondContact O-N 3.24Å; N224-K227 HydrophobicContact CB-CG 4.32Å; N224-K227 PolarHBondContact O-N 3.32Å
225	E	50.1	Low	81.6	Confident	135 Å²	135	38.3 Å²	38.3	63%	0.631	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.6	167	-63.9	-175.9	173.3	0	0	112.3	L223 K227	L223-E225 PolarHBondContact O-N 3.09Å; L223-E225 VanDerWaalsContact O-N 3.14Å; E225-K227 VanDerWaalsContact C-N 3.3Å; E225-K227 PolarHBondContact O-N 3.26Å
226	D	47.6	Very low	81.6	Confident	167 Å²	167	35.9 Å²	35.9	89%	0.893	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-12.6	-179.3	-72.9	-23	0	0	0	114.5	N224	N224-D226 PolarHBondContact O-N 3.24Å
227	K	50.2	Low	81.5	Confident	71 Å²	71	35.6 Å²	35.6	31%	0.309	19%	0.189	S	C	.	.	S	Bend	trans	-89.4	152.5	170.8	-70	-168	-178.3	175.9	0	109.2	N224 E225 T229 A396	N224-K227 HydrophobicContact CB-CG 4.32Å; N224-K227 PolarHBondContact O-N 3.32Å; E225-K227 VanDerWaalsContact C-N 3.3Å; E225-K227 PolarHBondContact O-N 3.26Å; K227-T229 PolarHBondContact O-N 2.58Å; K227-A396 PolarHBondContact NZ-O 3.22Å
228	T	52.2	Low	81.4	Confident	123 Å²	123	37.9 Å²	37.9	76%	0.755	20%	0.201	S	C	*	.	S	Bend	trans	-57.9	-13.4	-176.2	51.5	0	0	0	0	115.1	R24	R24-T228 PolarHBondContact NH1-O 3.41Å; R24-T228 VanDerWaalsContact NH1-O 3.08Å; R24-T228 PolarHBondContact NH2-O 2.79Å
229	T	61.9	Low	81.1	Confident	25 Å²	25	38.1 Å²	38.1	15%	0.153	20%	0.202	C	C	.	.			trans	-147.5	133.9	176.2	54.1	0	0	0	0	111.5	R24 K227 G231	R24-T229 HydrophobicContact CG-CG2 3.84Å; K227-T229 PolarHBondContact O-N 2.58Å; T229-G231 VanDerWaalsContact C-N 3.33Å
230	S	82.2	Confident	80.9	Confident	11 Å²	11	42.2 Å²	42.2	8%	0.077	22%	0.224	C	C	.	.	S	Bend	trans	-75.2	-25.7	171.8	-52.8	0	0	0	0	112	S27 Y77 N222	S27-S230 PolarHBondContact N-OG 2.84Å; S27-S230 WeakPolarHBondContact OG-CB 3.03Å; S27-S230 PolarHBondContact OG-OG 3.34Å; Y77-S230 WeakPolarHBondContact CE1-O 3.32Å; N222-S230 CarbonylContact C-O 3.49Å; N222-S230 WeakPolarHBondContact CA-O 3.06Å; N222-S230 PolarHBondContact N-O 3.48Å
231	G	90.5	Very high	80.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	177.6	171.4	0	0	0	0	0	111.7	L25 Y220 T229	L25-G231 PolarHBondContact N-O 2.97Å; L25-G231 PolarHBondContact O-N 2.82Å; Y220-G231 CarbonylContact O-C 3.49Å; Y220-G231 WeakPolarHBondContact O-CA 3.41Å; T229-G231 VanDerWaalsContact C-N 3.33Å
232	E	93.2	Very high	80.8	Confident	16 Å²	16	43.8 Å²	43.8	8%	0.075	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	140.6	176.3	-171.2	178.7	114.4	0	0	109.7	R22 I23 V219 Y220 Y242	R22-E232 HydrophobicContact CB-CG 4.39Å; R22-E232 IonicContact NE-OE1 3.54Å; I23-E232 WeakPolarHBondContact O-CA 3.37Å; V219-E232 WeakPolarHBondContact CA-O 3.49Å; Y220-E232 PolarHBondContact N-O 2.82Å; Y220-E232 PolarHBondContact O-N 2.81Å; E232-Y242 HydrophobicContact CB-CE2 4.24Å; E232-Y242 PolarHBondContact OE2-OH 2.93Å
233	I	96.4	Very high	81.2	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.6	160.3	-176.1	168.5	0	0	0	109	I23 L25 F94 M188 F217 A218 V219 F235	I23-I233 HydrophobicContact CB-CG2 3.75Å; I23-I233 HydrophobicContact CG1-CG2 4.43Å; I23-I233 HydrophobicContact CG2-CG2 4.4Å; I23-I233 PolarHBondContact N-O 2.81Å; I23-I233 PolarHBondContact O-N 2.93Å; L25-I233 HydrophobicContact CD2-CG2 4.01Å; L25-I233 HydrophobicContact CG-CG2 4.48Å; F94-I233 HydrophobicContact CB-CD1 3.99Å; F94-I233 HydrophobicContact CD1-CD1 4Å; F94-I233 HydrophobicContact CD1-CG2 4.4Å; F94-I233 HydrophobicContact CD2-CG2 4.09Å; F94-I233 HydrophobicContact CE1-CG2 4.39Å; F94-I233 HydrophobicContact CE2-CG2 4.08Å; F94-I233 HydrophobicContact CG-CD1 4.03Å; F94-I233 HydrophobicContact CG-CG2 4.25Å; F94-I233 HydrophobicContact CZ-CG2 4.24Å; M188-I233 HydrophobicContact CE-CD1 4.49Å; F217-I233 HydrophobicContact CD2-CD1 3.9Å; F217-I233 HydrophobicContact CD2-CG1 4.3Å; F217-I233 HydrophobicContact CE2-CD1 4.46Å; A218-I233 CarbonylContact O-C 3.59Å; A218-I233 WeakPolarHBondContact O-CA 3.4Å; V219-I233 HydrophobicContact CG2-CB 4.42Å; V219-I233 HydrophobicContact CG2-CD1 4.16Å; V219-I233 HydrophobicContact CG2-CG1 4.06Å; I233-F235 HydrophobicContact CD1-CE1 3.99Å; I233-F235 HydrophobicContact CD1-CE2 4.3Å; I233-F235 HydrophobicContact CD1-CZ 3.65Å; I233-F235 HydrophobicContact CG1-CE1 4.36Å; I233-F235 HydrophobicContact CG1-CE2 4.12Å; I233-F235 HydrophobicContact CG1-CZ 3.96Å; I233-F235 HydrophobicContact CG2-CE2 3.99Å; I233-F235 HydrophobicContact CG2-CZ 4.27Å
234	M	96.3	Very high	82.2	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.02	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.6	-179.4	-176.8	-175.9	-172.9	0	0	109.3	I20 T21 R22 F217 A218 I238 D239	I20-M234 HydrophobicContact CB-CE 4.33Å; I20-M234 HydrophobicContact CD1-CE 3.9Å; I20-M234 HydrophobicContact CG1-CE 4.21Å; I20-M234 HydrophobicContact CG2-CE 3.23Å; I20-M234 HydrophobicContact CG2-CG 4.17Å; I20-M234 HydrophobicContact CG2-SD 4.49Å; T21-M234 WeakPolarHBondContact O-CA 3.28Å; R22-M234 HydrophobicContact CG-CG 4.18Å; F217-M234 CarbonylContact C-O 3.59Å; F217-M234 WeakPolarHBondContact CA-O 3.36Å; F217-M234 WeakPolarHBondContact CB-O 3.39Å; A218-M234 PolarHBondContact N-O 3.35Å; A218-M234 PolarHBondContact O-N 3.38Å; M234-I238 VanDerWaalsContact SD-C 3.56Å; M234-D239 HydrophobicContact SD-CB 3.8Å
235	F	97.8	Very high	83.8	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	136.8	175.9	-59.6	-84.8	0	0	0	110	T21 I23 F94 I156 L159 M186 M188 F203 M206 V212 F217 I233 G237	T21-F235 PolarHBondContact N-O 3.01Å; T21-F235 PolarHBondContact O-N 2.74Å; I23-F235 HydrophobicContact CG1-CD2 4.45Å; I23-F235 HydrophobicContact CG1-CE2 3.97Å; F94-F235 HydrophobicContact CD1-CZ 4.08Å; F94-F235 HydrophobicContact CE1-CE2 4.37Å; F94-F235 AromaticContact CE1-CZ 3.87Å; F94-F235 HydrophobicContact CE1-CZ 3.87Å; I156-F235 HydrophobicContact CG2-CE2 3.9Å; I156-F235 HydrophobicContact CG2-CZ 4.49Å; L159-F235 HydrophobicContact CD1-CB 4.05Å; L159-F235 HydrophobicContact CD1-CD2 4.25Å; L159-F235 HydrophobicContact CD1-CG 4.14Å; M186-F235 HydrophobicContact CE-CZ 4.36Å; M188-F235 HydrophobicContact CE-CD1 4.49Å; M188-F235 HydrophobicContact CE-CE1 3.62Å; M188-F235 HydrophobicContact CE-CZ 4.45Å; M188-F235 HydrophobicContact SD-CE1 4.26Å; F203-F235 AromaticContact CD2-CD1 3.93Å; F203-F235 HydrophobicContact CD2-CD1 3.93Å; F203-F235 HydrophobicContact CD2-CE1 4.31Å; F203-F235 AromaticContact CE2-CD1 3.92Å; F203-F235 HydrophobicContact CE2-CD1 3.92Å; M206-F235 HydrophobicContact CE-CD1 4.13Å; M206-F235 HydrophobicContact CE-CE1 3.95Å; M206-F235 HydrophobicContact CE-CZ 4.32Å; M206-F235 HydrophobicContact SD-CD1 3.72Å; M206-F235 HydrophobicContact SD-CE1 4.05Å; M206-F235 HydrophobicContact SD-CG 4.32Å; V212-F235 HydrophobicContact CG1-CB 3.92Å; F217-F235 HydrophobicContact CB-CD1 3.95Å; F217-F235 HydrophobicContact CB-CE1 4.39Å; I233-F235 HydrophobicContact CD1-CE1 3.99Å; I233-F235 HydrophobicContact CD1-CE2 4.3Å; I233-F235 HydrophobicContact CD1-CZ 3.65Å; I233-F235 HydrophobicContact CG1-CE1 4.36Å; I233-F235 HydrophobicContact CG1-CE2 4.12Å; I233-F235 HydrophobicContact CG1-CZ 3.96Å; I233-F235 HydrophobicContact CG2-CE2 3.99Å; I233-F235 HydrophobicContact CG2-CZ 4.27Å; F235-G237 VanDerWaalsContact C-N 3.28Å; F235-G237 PolarHBondContact O-N 2.79Å
236	G	96.8	Very high	85.9	Confident	2 Å²	2	44.1 Å²	44.1	2%	0.021	25%	0.251	C	S	.	.	S	Bend	trans	81.7	-1.7	176	0	0	0	0	0	115.5	K214 L216	K214-G236 WeakPolarHBondContact CB-O 3.44Å; K214-G236 PolarHBondContact N-O 2.83Å; K214-G236 WeakPolarHBondContact O-CA 3.33Å; L216-G236 PolarHBondContact O-N 2.65Å
237	G	95.6	Very high	88.4	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.031	22%	0.216	C	C	.	.			trans	-159.3	179.4	-174.8	0	0	0	0	0	114.8	L216 F235	L216-G237 WeakPolarHBondContact CD1-O 3.28Å; F235-G237 VanDerWaalsContact C-N 3.28Å; F235-G237 PolarHBondContact O-N 2.79Å
238	I	96.4	Very high	90.7	Very high	49 Å²	49	35.8 Å²	35.8	25%	0.251	21%	0.211	S	C	.	.			trans	-129.9	135.4	-178.9	-63	176.1	0	0	0	106.4	L216 M234 Y243 L247 Y379 V381	L216-I238 HydrophobicContact CD1-CD1 4.47Å; L216-I238 HydrophobicContact CD1-CG1 3.79Å; L216-I238 HydrophobicContact CD2-CD1 4.16Å; L216-I238 HydrophobicContact CD2-CG1 4.34Å; M234-I238 VanDerWaalsContact SD-C 3.56Å; I238-Y243 HydrophobicContact CG2-CE1 3.76Å; I238-L247 HydrophobicContact CD1-CD1 4.02Å; I238-L247 HydrophobicContact CG2-CD1 4.22Å; I238-Y379 HydrophobicContact CG2-CE1 3.9Å; I238-V381 HydrophobicContact CD1-CG1 3.95Å; I238-V381 HydrophobicContact CD1-CG2 3.98Å; I238-V381 HydrophobicContact CG1-CG1 4.17Å; I238-V381 HydrophobicContact CG1-CG2 4Å; I238-V381 HydrophobicContact CG2-CG2 4.31Å
239	D	92.9	Very high	92.9	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.027	19%	0.185	C	C	.	.			trans	-107.7	108.1	178.8	-162.5	-46.8	0	0	0	111.2	R22 M234 R241 Y242 Y243 Y379	R22-D239 IonicContact CZ-OD2 3.33Å; R22-D239 IonicContact NE-OD2 3.65Å; R22-D239 IonicContact NH2-OD2 2.87Å; M234-D239 HydrophobicContact SD-CB 3.8Å; D239-R241 VanDerWaalsContact CG-NE 3.3Å; D239-R241 PolarHBondContact O-N 2.88Å; D239-R241 WeakPolarHBondContact OD1-CB 3.23Å; D239-R241 WeakPolarHBondContact OD1-CG 2.9Å; D239-R241 IonicContact OD1-CZ 3.6Å; D239-R241 PolarHBondContact OD1-N 2.79Å; D239-R241 IonicContact OD1-NE 3Å; D239-R241 PolarHBondContact OD1-NE 2.88Å; D239-R241 IonicContact OD1-NH2 2.88Å; D239-R241 IonicContact OD2-CZ 3.83Å; D239-R241 VanDerWaalsContact OD2-CZ 3.22Å; D239-R241 IonicContact OD2-NE 4Å; D239-R241 PolarHBondContact OD2-NE 2.92Å; D239-R241 IonicContact OD2-NH2 3.5Å; D239-R241 PolarHBondContact OD2-NH2 2.81Å; D239-Y242 HydrophobicContact CB-CD2 3.77Å; D239-Y242 HydrophobicContact CB-CE2 4.06Å; D239-Y242 PolarHBondContact O-N 2.84Å; D239-Y243 WeakPolarHBondContact O-CD1 3.16Å; D239-Y379 PolarHBondContact N-OH 2.58Å
240	D	92.6	Very high	94.6	Very high	92 Å²	92	31.9 Å²	31.9	49%	0.492	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	2.1	-176.6	76.5	-14.2	0	0	0	114.3	Y243 K399	D240-Y243 VanDerWaalsContact CA-CE1 3.48Å; D240-Y243 HydrophobicContact CB-CE1 4.06Å; D240-K399 PolarHBondContact O-NZ 3.47Å
241	R	91	Very high	95.3	Very high	30 Å²	30	36.9 Å²	36.9	11%	0.113	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-27	173.9	-53.9	175.6	-64.2	140.5	-1.6	111.6	D239 V398 K399	D239-R241 VanDerWaalsContact CG-NE 3.3Å; D239-R241 PolarHBondContact O-N 2.88Å; D239-R241 WeakPolarHBondContact OD1-CB 3.23Å; D239-R241 WeakPolarHBondContact OD1-CG 2.9Å; D239-R241 IonicContact OD1-CZ 3.6Å; D239-R241 PolarHBondContact OD1-N 2.79Å; D239-R241 IonicContact OD1-NE 3Å; D239-R241 PolarHBondContact OD1-NE 2.88Å; D239-R241 IonicContact OD1-NH2 2.88Å; D239-R241 IonicContact OD2-CZ 3.83Å; D239-R241 VanDerWaalsContact OD2-CZ 3.22Å; D239-R241 IonicContact OD2-NE 4Å; D239-R241 PolarHBondContact OD2-NE 2.92Å; D239-R241 IonicContact OD2-NH2 3.5Å; D239-R241 PolarHBondContact OD2-NH2 2.81Å; R241-V398 HydrophobicContact CB-CG1 4.26Å; R241-K399 HydrophobicContact CB-CB 4.03Å; R241-K399 WeakPolarHBondContact CD-O 3.21Å; R241-K399 HydrophobicContact CG-CB 4.04Å
242	Y	91.9	Very high	95.6	Very high	9 Å²	9	37.9 Å²	37.9	4%	0.035	21%	0.213	C	C	.	.	S	Bend	trans	-89.7	-8.1	-174.6	-65.8	-56	0	0	0	114.3	Y220 E232 D239 Y379 V394 A395 V398	Y220-Y242 AromaticContact CD1-CD1 3.48Å; Y220-Y242 HydrophobicContact CD1-CD1 3.48Å; Y220-Y242 VanDerWaalsContact CD1-CD1 3.48Å; Y220-Y242 HydrophobicContact CD1-CD2 4.41Å; Y220-Y242 AromaticContact CD1-CE1 3.53Å; Y220-Y242 HydrophobicContact CD1-CE1 3.53Å; Y220-Y242 HydrophobicContact CD1-CE2 4.47Å; Y220-Y242 AromaticContact CD1-CG 3.97Å; Y220-Y242 HydrophobicContact CD1-CG 3.97Å; Y220-Y242 HydrophobicContact CD2-CD1 4Å; Y220-Y242 HydrophobicContact CD2-CG 4.07Å; Y220-Y242 AromaticContact CE1-CD1 3.61Å; Y220-Y242 HydrophobicContact CE1-CD1 3.61Å; Y220-Y242 AromaticContact CE1-CE1 3.64Å; Y220-Y242 HydrophobicContact CE1-CE1 3.64Å; Y220-Y242 HydrophobicContact CE1-CG 4.49Å; Y220-Y242 HydrophobicContact CE2-CD1 4.14Å; Y220-Y242 AromaticContact CG-CD1 3.67Å; Y220-Y242 HydrophobicContact CG-CD1 3.67Å; Y220-Y242 HydrophobicContact CG-CD2 4.22Å; Y220-Y242 HydrophobicContact CG-CE1 4.16Å; Y220-Y242 AromaticContact CG-CG 3.72Å; Y220-Y242 HydrophobicContact CG-CG 3.72Å; Y220-Y242 AromaticContact CZ-CD1 3.94Å; E232-Y242 HydrophobicContact CB-CE2 4.24Å; E232-Y242 PolarHBondContact OE2-OH 2.93Å; D239-Y242 HydrophobicContact CB-CD2 3.77Å; D239-Y242 HydrophobicContact CB-CE2 4.06Å; D239-Y242 PolarHBondContact O-N 2.84Å; Y242-Y379 HydrophobicContact CD2-CD2 4.48Å; Y242-Y379 AromaticContact CD2-CE2 3.92Å; Y242-Y379 HydrophobicContact CD2-CE2 3.92Å; Y242-Y379 HydrophobicContact CG-CD2 4.41Å; Y242-Y379 HydrophobicContact CG-CE2 4.3Å; Y242-V394 CarbonylContact O-C 3.49Å; Y242-V394 WeakPolarHBondContact O-CA 3.22Å; Y242-A395 PolarHBondContact O-N 3.07Å; Y242-V398 HydrophobicContact CD1-CB 4.46Å; Y242-V398 HydrophobicContact CD1-CG1 3.71Å; Y242-V398 HydrophobicContact CD1-CG2 3.87Å; Y242-V398 HydrophobicContact CE1-CG1 3.56Å; Y242-V398 HydrophobicContact CE1-CG2 4.14Å
243	Y	94.5	Very high	95.6	Very high	42 Å²	42	40.3 Å²	40.3	17%	0.165	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	164.9	-179.4	72.3	-93.8	0	0	0	114.2	I238 D239 D240 L247 Y379 A392 D393	I238-Y243 HydrophobicContact CG2-CE1 3.76Å; D239-Y243 WeakPolarHBondContact O-CD1 3.16Å; D240-Y243 VanDerWaalsContact CA-CE1 3.48Å; D240-Y243 HydrophobicContact CB-CE1 4.06Å; Y243-L247 HydrophobicContact CE2-CG 4.35Å; Y243-Y379 AromaticContact CD1-CD1 3.51Å; Y243-Y379 HydrophobicContact CD1-CD1 3.51Å; Y243-Y379 AromaticContact CD1-CE1 3.91Å; Y243-Y379 HydrophobicContact CD1-CE1 3.91Å; Y243-Y379 AromaticContact CD1-CG 3.86Å; Y243-Y379 HydrophobicContact CD1-CG 3.86Å; Y243-Y379 HydrophobicContact CE1-CD1 4.12Å; Y243-Y379 HydrophobicContact CE1-CE1 4.14Å; Y243-Y379 HydrophobicContact CG-CD1 4.23Å; Y243-Y379 HydrophobicContact CG-CG 4.37Å; Y243-A392 HydrophobicContact CD2-CB 3.53Å; Y243-A392 HydrophobicContact CE2-CB 4.37Å; Y243-A392 HydrophobicContact CG-CB 3.79Å; Y243-D393 CarbonylContact C-O 3.45Å; Y243-D393 VanDerWaalsContact CA-O 3.23Å; Y243-D393 WeakPolarHBondContact CA-O 3.2Å; Y243-D393 WeakPolarHBondContact CB-O 3.39Å
244	T	94.5	Very high	94.9	Very high	73 Å²	73	42.5 Å²	42.5	45%	0.448	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	154.5	174.9	56.3	0	0	0	0	111.3	D393 A395	T244-D393 PolarHBondContact N-O 3.38Å; T244-A395 HydrophobicContact CG2-CB 3.88Å
245	G	94.5	Very high	94.1	Very high	62 Å²	62	47.2 Å²	47.2	64%	0.639	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	72	-152.7	-175.2	0	0	0	0	0	112.6
246	N	96.2	Very high	93.3	Very high	141 Å²	141	51.2 Å²	51.2	75%	0.754	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.8	150.6	-179.7	-65.6	-31.3	0	0	0	110.9	T248	N246-T248 PolarHBondContact O-N 2.89Å
247	L	98.2	Very high	92.9	Very high	31 Å²	31	52.8 Å²	52.8	16%	0.162	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	125.3	167	-71.5	163.1	0	0	0	109.8	I238 Y243 Y249 Y379 V381 I391 A392	I238-L247 HydrophobicContact CD1-CD1 4.02Å; I238-L247 HydrophobicContact CG2-CD1 4.22Å; Y243-L247 HydrophobicContact CE2-CG 4.35Å; L247-Y249 HydrophobicContact CB-CD2 4.29Å; L247-Y249 HydrophobicContact CB-CE2 3.7Å; L247-Y249 HydrophobicContact CD1-CE2 4.4Å; L247-Y249 WeakPolarHBondContact CD1-OH 3.33Å; L247-Y379 HydrophobicContact CD2-CD1 4.34Å; L247-V381 HydrophobicContact CD1-CG2 3.95Å; L247-V381 HydrophobicContact CD2-CG2 3.89Å; L247-I391 WeakPolarHBondContact CA-O 3.48Å; L247-A392 HydrophobicContact CD2-CB 3.79Å; L247-A392 HydrophobicContact CG-CB 4.36Å
248	T	98.4	Very high	92.9	Very high	33 Å²	33	52.6 Å²	52.6	20%	0.202	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	118	168.2	-65.3	0	0	0	0	108.2	N246 N330 K332 G390 I391	N246-T248 PolarHBondContact O-N 2.89Å; T248-N330 HydrophobicContact CG2-CB 3.94Å; T248-N330 WeakPolarHBondContact CG2-O 3.22Å; T248-K332 HydrophobicContact CG2-CB 3.97Å; T248-K332 WeakPolarHBondContact OG1-CD 3.48Å; T248-G390 CarbonylContact O-C 3.55Å; T248-G390 WeakPolarHBondContact O-CA 3.31Å; T248-I391 PolarHBondContact N-O 3.28Å; T248-I391 PolarHBondContact O-N 3.21Å
249	Y	98.6	Very high	92.8	Very high	55 Å²	55	52 Å²	52	22%	0.216	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	142.1	-178.9	-72.8	-82.9	0	0	0	111.9	L247 N330 V381 R388 V389	L247-Y249 HydrophobicContact CB-CD2 4.29Å; L247-Y249 HydrophobicContact CB-CE2 3.7Å; L247-Y249 HydrophobicContact CD1-CE2 4.4Å; L247-Y249 WeakPolarHBondContact CD1-OH 3.33Å; Y249-N330 PolarHBondContact O-ND2 3.13Å; Y249-V381 HydrophobicContact CE1-CG1 4.46Å; Y249-R388 HydrophobicContact CD1-CB 4.42Å; Y249-R388 HydrophobicContact CD1-CG 3.72Å; Y249-R388 HydrophobicContact CE1-CG 4.35Å; Y249-R388 HydrophobicContact CG-CG 4.46Å; Y249-V389 CarbonylContact C-O 3.57Å; Y249-V389 VanDerWaalsContact CA-O 3.32Å; Y249-V389 WeakPolarHBondContact CA-O 3.33Å
250	S	98.3	Very high	93	Very high	10 Å²	10	51.8 Å²	51.8	7%	0.07	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.1	170.4	-54.2	0	0	0	0	109.4	I329 N330 R388 V389	S250-I329 VanDerWaalsContact OG-CG2 3.31Å; S250-I329 WeakPolarHBondContact OG-CG2 3.43Å; S250-N330 WeakPolarHBondContact OG-CB 3.48Å; S250-R388 CarbonylContact O-C 3.55Å; S250-R388 VanDerWaalsContact O-CA 3.23Å; S250-R388 WeakPolarHBondContact O-CA 3.49Å; S250-R388 VanDerWaalsContact O-CB 3.31Å; S250-R388 WeakPolarHBondContact O-CB 3.39Å; S250-V389 PolarHBondContact N-O 3.21Å; S250-V389 PolarHBondContact O-N 3.03Å
251	D	97.8	Very high	93.1	Very high	117 Å²	117	51.4 Å²	51.4	63%	0.626	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	142.9	179.8	-59.4	-27.4	0	0	0	110.6
252	V	95.9	Very high	93.4	Very high	20 Å²	20	50 Å²	50	12%	0.121	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-70.7	139.2	172.6	-68.1	0	0	0	0	110.3	F190 W258 M259 I260 R387 V389	F190-V252 HydrophobicContact CZ-CG1 4.49Å; F190-V252 HydrophobicContact CZ-CG2 4.24Å; V252-W258 HydrophobicContact CG1-CE3 3.76Å; V252-W258 HydrophobicContact CG1-CZ3 4.24Å; V252-M259 CarbonylContact C-O 3.5Å; V252-M259 VanDerWaalsContact CA-O 3.24Å; V252-M259 WeakPolarHBondContact CA-O 3.46Å; V252-I260 HydrophobicContact CG1-CG2 4.42Å; V252-R387 HydrophobicContact CG2-CB 3.75Å; V252-R387 VanDerWaalsContact CG2-O 3.27Å; V252-R387 WeakPolarHBondContact CG2-O 3.01Å; V252-R387 PolarHBondContact N-O 2.87Å; V252-V389 HydrophobicContact CG1-CG2 4.2Å
253	V	92.2	Very high	93.6	Very high	68 Å²	68	52.1 Å²	52.1	41%	0.412	29%	0.289	S	S	.	.	S	Bend	trans	-73.2	-35.5	-175.9	178.3	0	0	0	0	111.7	M259 T278	V253-M259 HydrophobicContact CB-CE 4.09Å; V253-M259 HydrophobicContact CG1-CE 4.11Å; V253-M259 PolarHBondContact N-O 3.28Å; V253-T278 HydrophobicContact CG2-CG2 4.21Å
254	S	83.2	Confident	93.7	Very high	47 Å²	47	50.6 Å²	50.6	33%	0.329	29%	0.286	S	S	.	.			trans	-149.7	142.5	179.5	179.6	0	0	0	0	109.9	E256 Y257	S254-E256 PolarHBondContact O-N 2.96Å; S254-Y257 VanDerWaalsContact O-O 3.07Å
255	E	79.9	Confident	93.9	Very high	103 Å²	103	47.2 Å²	47.2	48%	0.481	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	30.9	177.3	-57.1	-169.5	172.7	0	0	113.4	F190 R387	F190-E255 WeakPolarHBondContact CB-O 3.35Å; F190-E255 HydrophobicContact CD1-CB 4.29Å; F190-E255 WeakPolarHBondContact CG-O 3.47Å; E255-R387 VanDerWaalsContact CD-NH2 3.31Å; E255-R387 IonicContact OE1-CZ 3.77Å; E255-R387 IonicContact OE1-NE 3.22Å; E255-R387 PolarHBondContact OE1-NE 3.32Å; E255-R387 IonicContact OE1-NH2 3.56Å; E255-R387 PolarHBondContact OE1-NH2 2.57Å; E255-R387 IonicContact OE2-CZ 3.38Å; E255-R387 IonicContact OE2-NE 2.66Å; E255-R387 PolarHBondContact OE2-NE 3.11Å; E255-R387 IonicContact OE2-NH2 2.84Å; E255-R387 PolarHBondContact OE2-NH2 3.43Å
256	E	80.1	Confident	94	Very high	83 Å²	83	45.4 Å²	45.4	39%	0.388	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-34.1	172.9	-68.1	174.4	165	0	0	110.7	S254	S254-E256 PolarHBondContact O-N 2.96Å
257	Y	88.7	Confident	94.1	Very high	35 Å²	35	38.7 Å²	38.7	14%	0.137	21%	0.207	C	C	.	.	S	Bend	trans	-145.3	159.4	-174.5	-59.2	-81	0	0	0	111.5	D65 Q192 S254 M259 L280	D65-Y257 WeakPolarHBondContact CB-OH 3.39Å; D65-Y257 PolarHBondContact OD2-OH 3.28Å; Q192-Y257 PolarHBondContact NE2-OH 3.33Å; S254-Y257 VanDerWaalsContact O-O 3.07Å; Y257-M259 PolarHBondContact O-N 2.91Å; Y257-L280 HydrophobicContact CG-CD1 4.46Å
258	W	95.2	Very high	93.9	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-75	59.4	172.2	-66.7	108.5	0	0	0	111.9	M188 F190 F217 V252 I281 F382 F384 V389	M188-W258 PolarHBondContact O-NE1 3Å; F190-W258 HydrophobicContact CD2-CD2 4.47Å; F190-W258 HydrophobicContact CE1-CH2 4.32Å; F190-W258 AromaticContact CE2-CD2 3.53Å; F190-W258 HydrophobicContact CE2-CD2 3.53Å; F190-W258 AromaticContact CE2-CE2 3.71Å; F190-W258 AromaticContact CE2-CE3 3.7Å; F190-W258 HydrophobicContact CE2-CE3 3.7Å; F190-W258 HydrophobicContact CE2-CG 4.05Å; F190-W258 HydrophobicContact CE2-CH2 4.22Å; F190-W258 HydrophobicContact CE2-CZ2 4.07Å; F190-W258 HydrophobicContact CE2-CZ3 4.04Å; F190-W258 AromaticContact CZ-CD2 3.95Å; F190-W258 HydrophobicContact CZ-CD2 3.95Å; F190-W258 AromaticContact CZ-CE2 4Å; F190-W258 AromaticContact CZ-CE3 3.71Å; F190-W258 HydrophobicContact CZ-CE3 3.71Å; F190-W258 AromaticContact CZ-CH2 3.65Å; F190-W258 HydrophobicContact CZ-CH2 3.65Å; F190-W258 AromaticContact CZ-CZ2 3.88Å; F190-W258 HydrophobicContact CZ-CZ2 3.88Å; F190-W258 AromaticContact CZ-CZ3 3.56Å; F190-W258 HydrophobicContact CZ-CZ3 3.56Å; F217-W258 AromaticContact CE1-CZ2 3.85Å; F217-W258 HydrophobicContact CE1-CZ2 3.85Å; F217-W258 HydrophobicContact CZ-CZ2 4.11Å; V252-W258 HydrophobicContact CG1-CE3 3.76Å; V252-W258 HydrophobicContact CG1-CZ3 4.24Å; W258-I281 PolarHBondContact O-N 2.01Å; W258-F382 HydrophobicContact CB-CD1 4.02Å; W258-F382 HydrophobicContact CB-CE1 3.97Å; W258-F382 HydrophobicContact CD2-CB 4.26Å; W258-F382 AromaticContact CD2-CD1 3.5Å; W258-F382 HydrophobicContact CD2-CD1 3.5Å; W258-F382 HydrophobicContact CD2-CE1 4.32Å; W258-F382 HydrophobicContact CD2-CG 4.33Å; W258-F382 AromaticContact CE2-CD1 3.89Å; W258-F382 HydrophobicContact CE3-CB 4.24Å; W258-F382 AromaticContact CE3-CD1 3.82Å; W258-F382 HydrophobicContact CE3-CD1 3.82Å; W258-F382 AromaticContact CG-CD1 3.59Å; W258-F382 HydrophobicContact CG-CD1 3.59Å; W258-F382 AromaticContact CG-CE1 3.94Å; W258-F382 HydrophobicContact CG-CE1 3.94Å; W258-F382 HydrophobicContact CH2-CB 3.79Å; W258-F382 HydrophobicContact CZ2-CB 3.79Å; W258-F382 HydrophobicContact CZ3-CB 4.02Å; W258-F382 HydrophobicContact CZ3-CD1 4.45Å; W258-F384 HydrophobicContact CH2-CB 4.12Å; W258-F384 AromaticContact CH2-CD2 3.84Å; W258-F384 HydrophobicContact CH2-CD2 3.84Å; W258-F384 HydrophobicContact CH2-CG 4.43Å; W258-F384 AromaticContact CZ2-CD2 3.72Å; W258-F384 HydrophobicContact CZ2-CD2 3.72Å; W258-F384 HydrophobicContact CZ2-CE2 4.46Å; W258-V389 HydrophobicContact CE3-CG2 3.87Å
259	M	94.4	Very high	93.6	Very high	36 Å²	36	44.6 Å²	44.6	18%	0.177	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.4	-172	-153.1	176.3	69.8	0	0	109.8	V252 V253 Y257 T278 A279 L280 L367	V252-M259 CarbonylContact C-O 3.5Å; V252-M259 VanDerWaalsContact CA-O 3.24Å; V252-M259 WeakPolarHBondContact CA-O 3.46Å; V253-M259 HydrophobicContact CB-CE 4.09Å; V253-M259 HydrophobicContact CG1-CE 4.11Å; V253-M259 PolarHBondContact N-O 3.28Å; Y257-M259 PolarHBondContact O-N 2.91Å; M259-T278 HydrophobicContact CE-CG2 4.28Å; M259-A279 CarbonylContact C-O 3.49Å; M259-A279 VanDerWaalsContact CA-O 3.31Å; M259-A279 WeakPolarHBondContact CA-O 3.36Å; M259-L280 HydrophobicContact CG-CB 4.44Å; M259-L367 HydrophobicContact CG-CD1 3.94Å; M259-L367 HydrophobicContact SD-CD1 3.46Å; M259-L367 WeakPolarHBondContact SD-CD1 3.39Å; M259-L367 HydrophobicContact SD-CD2 4.44Å
260	I	96.2	Very high	93.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	159.2	-177.6	61.9	173.3	0	0	0	111.2	V252 I262 T278 A279 I281 I329 V389	V252-I260 HydrophobicContact CG1-CG2 4.42Å; I260-I262 HydrophobicContact CG1-CG2 4.47Å; I260-T278 CarbonylContact O-C 3.28Å; I260-T278 WeakPolarHBondContact O-CA 3.23Å; I260-A279 PolarHBondContact N-O 3.46Å; I260-A279 PolarHBondContact O-N 3.29Å; I260-I281 HydrophobicContact CD1-CD1 3.99Å; I260-I281 HydrophobicContact CD1-CG1 4.08Å; I260-I281 HydrophobicContact CG1-CD1 4.16Å; I260-I281 HydrophobicContact CG1-CG1 4.14Å; I260-I329 HydrophobicContact CD1-CD1 4.39Å; I260-I329 HydrophobicContact CD1-CG2 3.79Å; I260-V389 HydrophobicContact CG2-CB 3.94Å; I260-V389 HydrophobicContact CG2-CG2 3.82Å
261	N	95.9	Very high	93.3	Very high	84 Å²	84	52.1 Å²	52.1	45%	0.449	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	142.9	167.2	-68	-43.5	0	0	0	110.5	S277	N261-S277 WeakPolarHBondContact CA-O 3.31Å
262	I	96.6	Very high	93.1	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	147.8	173.5	68.2	173.7	0	0	0	110.6	I260 G264 I265 G276 S277 A279 I329 F370	I260-I262 HydrophobicContact CG1-CG2 4.47Å; I262-G264 VanDerWaalsContact C-N 3.29Å; I262-I265 HydrophobicContact CD1-CD1 4.43Å; I262-I265 HydrophobicContact CD1-CG1 4.26Å; I262-G276 PolarHBondContact O-N 3.05Å; I262-G276 VanDerWaalsContact O-N 3.16Å; I262-S277 WeakPolarHBondContact CG1-O 3.07Å; I262-S277 PolarHBondContact N-O 3.11Å; I262-A279 HydrophobicContact CD1-CB 4.41Å; I262-A279 HydrophobicContact CG2-CB 3.67Å; I262-I329 HydrophobicContact CB-CG1 4.3Å; I262-I329 HydrophobicContact CG2-CD1 4.36Å; I262-I329 HydrophobicContact CG2-CG1 3.9Å; I262-F370 HydrophobicContact CD1-CE2 4.32Å; I262-F370 HydrophobicContact CD1-CZ 3.76Å; I262-F370 HydrophobicContact CG2-CE2 4.01Å; I262-F370 HydrophobicContact CG2-CZ 4.49Å
263	D	96.9	Very high	92.9	Very high	54 Å²	54	46.2 Å²	46.2	29%	0.289	26%	0.258	S	S	.	.			trans	-76.7	-24.1	178.9	-58.4	-12.9	0	0	0	111.2	S275 K328 N330 G331	D263-S275 WeakPolarHBondContact O-CA 3.12Å; D263-S275 WeakPolarHBondContact O-CB 3.25Å; D263-S275 PolarHBondContact O-N 3.39Å; D263-K328 WeakPolarHBondContact CA-O 3.49Å; D263-K328 HydrophobicContact CB-CB 3.9Å; D263-K328 HydrophobicContact CB-CD 4Å; D263-K328 HydrophobicContact CB-CG 3.86Å; D263-K328 WeakPolarHBondContact CB-O 3.27Å; D263-K328 PolarHBondContact N-O 3.34Å; D263-K328 WeakPolarHBondContact OD2-CG 3.43Å; D263-N330 PolarHBondContact OD1-N 3.36Å; D263-N330 PolarHBondContact OD2-N 2.87Å; D263-G331 PolarHBondContact OD2-N 3.14Å
264	G	96.2	Very high	92.7	Very high	9 Å²	9	46.5 Å²	46.5	9%	0.093	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.1	179	170.3	0	0	0	0	0	114.4	I262 C273 K328	I262-G264 VanDerWaalsContact C-N 3.29Å; G264-C273 CarbonylContact C-O 3.57Å; G264-C273 WeakPolarHBondContact CA-O 3.46Å; G264-K328 PolarHBondContact N-O 2.98Å; G264-K328 PolarHBondContact O-N 3.36Å
265	I	98	Very high	93	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.015	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.5	174.6	-54.1	173	0	0	0	107.5	I262 F272 C273 I325 E326 I327 W368 F370	I262-I265 HydrophobicContact CD1-CD1 4.43Å; I262-I265 HydrophobicContact CD1-CG1 4.26Å; I265-F272 PolarHBondContact O-N 2.85Å; I265-C273 HydrophobicContact CB-CB 3.69Å; I265-C273 HydrophobicContact CD1-CB 3.89Å; I265-C273 HydrophobicContact CG1-CB 3.7Å; I265-C273 PolarHBondContact N-O 3.04Å; I265-C273 PolarHBondContact O-N 3.23Å; I265-I325 HydrophobicContact CG2-CG2 3.74Å; I265-E326 CarbonylContact C-O 3.58Å; I265-E326 WeakPolarHBondContact CA-O 3.4Å; I265-I327 HydrophobicContact CG1-CG1 4.21Å; I265-I327 HydrophobicContact CG1-CG2 4.49Å; I265-I327 HydrophobicContact CG2-CG1 4.36Å; I265-W368 HydrophobicContact CD1-CD2 3.76Å; I265-W368 HydrophobicContact CD1-CE3 3.57Å; I265-W368 HydrophobicContact CD1-CH2 3.68Å; I265-W368 HydrophobicContact CD1-CZ2 3.85Å; I265-W368 HydrophobicContact CD1-CZ3 3.52Å; I265-F370 HydrophobicContact CD1-CE1 4.22Å; I265-F370 HydrophobicContact CD1-CZ 4.2Å
266	S	97.3	Very high	93.2	Very high	23 Å²	23	46.6 Å²	46.6	16%	0.161	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	154.2	-179.7	73.4	0	0	0	0	113.4	E270 E326	S266-E270 CarbonylContact C-O 3.6Å; S266-E270 WeakPolarHBondContact CA-O 3.3Å; S266-E270 WeakPolarHBondContact CB-O 3.31Å; S266-E326 PolarHBondContact N-O 3.45Å; S266-E326 PolarHBondContact O-N 2.79Å
267	I	97.4	Very high	93.8	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	117.8	176.9	-48.4	-179.5	0	0	0	107.2	G269 E270 F272 I298 Y301 P323 I325	I267-G269 PolarHBondContact O-N 2.77Å; I267-G269 VanDerWaalsContact O-N 3.1Å; I267-E270 PolarHBondContact N-O 3.5Å; I267-E270 WeakPolarHBondContact O-CB 3.39Å; I267-E270 PolarHBondContact O-N 2.56Å; I267-F272 HydrophobicContact CB-CD2 4.23Å; I267-F272 HydrophobicContact CB-CE2 3.68Å; I267-F272 HydrophobicContact CD1-CD2 4.01Å; I267-F272 HydrophobicContact CD1-CE2 3.78Å; I267-F272 HydrophobicContact CD1-CZ 4.14Å; I267-F272 HydrophobicContact CG1-CD2 3.76Å; I267-F272 HydrophobicContact CG1-CE2 3.64Å; I267-F272 HydrophobicContact CG1-CZ 4.46Å; I267-I298 HydrophobicContact CD1-CG1 4.37Å; I267-I298 HydrophobicContact CD1-CG2 4.12Å; I267-Y301 HydrophobicContact CB-CD1 4.38Å; I267-Y301 HydrophobicContact CB-CE1 4.19Å; I267-Y301 HydrophobicContact CD1-CD1 4.32Å; I267-Y301 HydrophobicContact CG2-CD1 3.81Å; I267-Y301 HydrophobicContact CG2-CE1 3.45Å; I267-Y301 VanDerWaalsContact CG2-CE1 3.45Å; I267-P323 HydrophobicContact CG2-CB 3.53Å; I267-P323 HydrophobicContact CG2-CG 3.33Å; I267-I325 HydrophobicContact CD1-CD1 4.27Å; I267-I325 HydrophobicContact CD1-CG1 3.98Å; I267-I325 HydrophobicContact CG1-CB 4.5Å; I267-I325 HydrophobicContact CG1-CG1 4.03Å; I267-I325 HydrophobicContact CG1-CG2 4.3Å
268	N	94.9	Very high	94.1	Very high	122 Å²	122	43.4 Å²	43.4	65%	0.652	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	34.2	-175.4	-60.7	-33.6	0	0	0	114.1	E270 Y301	N268-E270 VanDerWaalsContact C-N 3.35Å; N268-Y301 PolarHBondContact ND2-OH 3.46Å
269	G	91.6	Very high	94	Very high	65 Å²	65	43.4 Å²	43.4	67%	0.67	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-8.1	-178.5	0	0	0	0	0	115.7	I267	I267-G269 PolarHBondContact O-N 2.77Å; I267-G269 VanDerWaalsContact O-N 3.1Å
270	E	95.3	Very high	94	Very high	104 Å²	104	42.3 Å²	42.3	49%	0.486	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	132.9	171.2	-175	174.6	170.4	0	0	110.3	S266 I267 N268 F272 Y301	S266-E270 CarbonylContact C-O 3.6Å; S266-E270 WeakPolarHBondContact CA-O 3.3Å; S266-E270 WeakPolarHBondContact CB-O 3.31Å; I267-E270 PolarHBondContact N-O 3.5Å; I267-E270 WeakPolarHBondContact O-CB 3.39Å; I267-E270 PolarHBondContact O-N 2.56Å; N268-E270 VanDerWaalsContact C-N 3.35Å; E270-F272 HydrophobicContact CB-CE2 3.9Å; E270-F272 HydrophobicContact CB-CZ 4.44Å; E270-F272 HydrophobicContact CG-CE2 3.83Å; E270-F272 HydrophobicContact CG-CZ 4.04Å; E270-F272 WeakPolarHBondContact O-CD2 3.41Å; E270-F272 WeakPolarHBondContact O-CE2 3.24Å; E270-Y301 WeakPolarHBondContact OE2-CE2 3.39Å
271	I	94.8	Very high	94	Very high	119 Å²	119	42.3 Å²	42.3	61%	0.61	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.8	-173.7	-59.7	171.8	0	0	0	110.1	C273 P274	I271-C273 WeakPolarHBondContact CG2-O 3.44Å; I271-P274 HydrophobicContact CG2-CB 4.39Å
272	F	94	Very high	93.9	Very high	12 Å²	12	38.3 Å²	38.3	5%	0.053	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-25.2	177.7	-68.6	-93.9	0	0	0	112.6	I265 I267 E270 K294 N297 I298 Y301	I265-F272 PolarHBondContact O-N 2.85Å; I267-F272 HydrophobicContact CB-CD2 4.23Å; I267-F272 HydrophobicContact CB-CE2 3.68Å; I267-F272 HydrophobicContact CD1-CD2 4.01Å; I267-F272 HydrophobicContact CD1-CE2 3.78Å; I267-F272 HydrophobicContact CD1-CZ 4.14Å; I267-F272 HydrophobicContact CG1-CD2 3.76Å; I267-F272 HydrophobicContact CG1-CE2 3.64Å; I267-F272 HydrophobicContact CG1-CZ 4.46Å; E270-F272 HydrophobicContact CB-CE2 3.9Å; E270-F272 HydrophobicContact CB-CZ 4.44Å; E270-F272 HydrophobicContact CG-CE2 3.83Å; E270-F272 HydrophobicContact CG-CZ 4.04Å; E270-F272 WeakPolarHBondContact O-CD2 3.41Å; E270-F272 WeakPolarHBondContact O-CE2 3.24Å; F272-K294 WeakPolarHBondContact O-CD 3.49Å; F272-K294 WeakPolarHBondContact O-CG 3.34Å; F272-N297 HydrophobicContact CD1-CB 3.91Å; F272-N297 HydrophobicContact CE1-CB 4.01Å; F272-I298 HydrophobicContact CB-CD1 4.12Å; F272-I298 HydrophobicContact CB-CG1 3.79Å; F272-I298 HydrophobicContact CD1-CB 4.36Å; F272-I298 HydrophobicContact CD1-CG1 3.51Å; F272-I298 HydrophobicContact CE1-CG1 4.27Å; F272-I298 HydrophobicContact CG-CG1 3.68Å; F272-Y301 AromaticContact CZ-CD2 3.69Å; F272-Y301 HydrophobicContact CZ-CD2 3.69Å; F272-Y301 HydrophobicContact CZ-CE2 4.4Å; F272-Y301 AromaticContact CZ-CG 3.82Å; F272-Y301 HydrophobicContact CZ-CG 3.82Å
273	C	92	Very high	93.7	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.007	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	113.6	173.5	169.9	0	0	0	0	107.4	G264 I265 I271 S277 W368	G264-C273 CarbonylContact C-O 3.57Å; G264-C273 WeakPolarHBondContact CA-O 3.46Å; I265-C273 HydrophobicContact CB-CB 3.69Å; I265-C273 HydrophobicContact CD1-CB 3.89Å; I265-C273 HydrophobicContact CG1-CB 3.7Å; I265-C273 PolarHBondContact N-O 3.04Å; I265-C273 PolarHBondContact O-N 3.23Å; I271-C273 WeakPolarHBondContact CG2-O 3.44Å; C273-S277 WeakPolarHBondContact SG-CB 3.4Å; C273-S277 PolarHBondContact SG-OG 2.91Å; C273-W368 HydrophobicContact CB-CZ2 3.7Å; C273-W368 PolarHBondContact SG-NE1 2.96Å
274	P	89	Confident	93.3	Very high	74 Å²	74	36.8 Å²	36.8	48%	0.481	24%	0.241	S	C	.	.			trans	-75.5	162.5	-179	32.1	-34.9	0	0	0	111.7	I271 S277	I271-P274 HydrophobicContact CG2-CB 4.39Å; P274-S277 PolarHBondContact O-N 2.96Å; P274-S277 PolarHBondContact O-OG 3.36Å
275	S	88.2	Confident	92.7	Very high	97 Å²	97	36.4 Å²	36.4	68%	0.678	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	142	175.1	-174.5	0	0	0	0	112.4	D263	D263-S275 WeakPolarHBondContact O-CA 3.12Å; D263-S275 WeakPolarHBondContact O-CB 3.25Å; D263-S275 PolarHBondContact O-N 3.39Å
276	G	84.7	Confident	92	Very high	55 Å²	55	36.4 Å²	36.4	57%	0.567	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	89	4.8	-176.8	0	0	0	0	0	113.8	I262	I262-G276 PolarHBondContact O-N 3.05Å; I262-G276 VanDerWaalsContact O-N 3.16Å
277	S	93	Very high	91.5	Very high	25 Å²	25	35.6 Å²	35.6	18%	0.175	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	154.5	167.6	-58.2	0	0	0	0	110.3	N261 I262 C273 P274	N261-S277 WeakPolarHBondContact CA-O 3.31Å; I262-S277 WeakPolarHBondContact CG1-O 3.07Å; I262-S277 PolarHBondContact N-O 3.11Å; C273-S277 WeakPolarHBondContact SG-CB 3.4Å; C273-S277 PolarHBondContact SG-OG 2.91Å; P274-S277 PolarHBondContact O-N 2.96Å; P274-S277 PolarHBondContact O-OG 3.36Å
278	T	93.6	Very high	91.2	Very high	27 Å²	27	35.6 Å²	35.6	17%	0.166	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	145.9	177.2	51.5	0	0	0	0	111.1	V253 M259 I260 W368	V253-T278 HydrophobicContact CG2-CG2 4.21Å; M259-T278 HydrophobicContact CE-CG2 4.28Å; I260-T278 CarbonylContact O-C 3.28Å; I260-T278 WeakPolarHBondContact O-CA 3.23Å; T278-W368 PolarHBondContact O-N 2.89Å
279	A	94.9	Very high	90.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130	174	0	0	0	0	0	110.9	M259 I260 I262 W368 F370	M259-A279 CarbonylContact C-O 3.49Å; M259-A279 VanDerWaalsContact CA-O 3.31Å; M259-A279 WeakPolarHBondContact CA-O 3.36Å; I260-A279 PolarHBondContact N-O 3.46Å; I260-A279 PolarHBondContact O-N 3.29Å; I262-A279 HydrophobicContact CD1-CB 4.41Å; I262-A279 HydrophobicContact CG2-CB 3.67Å; A279-W368 CarbonylContact C-O 3.55Å; A279-W368 VanDerWaalsContact CA-O 3.25Å; A279-W368 WeakPolarHBondContact CA-O 3.41Å; A279-W368 HydrophobicContact CB-CB 3.99Å; A279-F370 HydrophobicContact CB-CD1 4.45Å; A279-F370 HydrophobicContact CB-CD2 3.79Å; A279-F370 HydrophobicContact CB-CE1 4.32Å; A279-F370 HydrophobicContact CB-CE2 3.64Å; A279-F370 HydrophobicContact CB-CG 4.2Å; A279-F370 HydrophobicContact CB-CZ 3.92Å
280	L	93.9	Very high	90.9	Very high	12 Å²	12	26.8 Å²	26.8	6%	0.063	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.6	166.4	178.8	61.4	0	0	0	109.2	Y257 M259 D282 L367 W368 I369 F370	Y257-L280 HydrophobicContact CG-CD1 4.46Å; M259-L280 HydrophobicContact CG-CB 4.44Å; L280-D282 HydrophobicContact CD2-CB 4.34Å; L280-D282 HydrophobicContact CG-CB 4.14Å; L280-L367 HydrophobicContact CB-CD1 4.42Å; L280-W368 PolarHBondContact N-O 2.68Å; L280-I369 HydrophobicContact CB-CG1 4.28Å; L280-I369 HydrophobicContact CD2-CD1 4.46Å; L280-I369 HydrophobicContact CD2-CG1 4.43Å; L280-F370 PolarHBondContact O-N 3.43Å
281	I	96.5	Very high	90.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	106.9	176.1	-51.7	-54.1	0	0	0	108.2	T96 W258 I260 F370 F374 L375 T380 F382 V389	T96-I281 PolarHBondContact OG1-O 3.36Å; W258-I281 PolarHBondContact O-N 2.01Å; I260-I281 HydrophobicContact CD1-CD1 3.99Å; I260-I281 HydrophobicContact CD1-CG1 4.08Å; I260-I281 HydrophobicContact CG1-CD1 4.16Å; I260-I281 HydrophobicContact CG1-CG1 4.14Å; I281-F370 HydrophobicContact CD1-CB 4.04Å; I281-F370 HydrophobicContact CD1-CD2 3.85Å; I281-F370 HydrophobicContact CD1-CG 4.39Å; I281-F374 HydrophobicContact CD1-CE1 4.35Å; I281-L375 HydrophobicContact CG2-CD2 3.66Å; I281-T380 HydrophobicContact CG2-CG2 4Å; I281-F382 HydrophobicContact CB-CE1 4.12Å; I281-F382 HydrophobicContact CG2-CE1 3.82Å; I281-F382 HydrophobicContact CG2-CZ 3.79Å; I281-V389 HydrophobicContact CG1-CG1 4.36Å
282	D	93.1	Very high	90.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	13%	0.13	C	C	.	.			trans	-130.5	105	-158.7	-173.4	6.4	0	0	0	113.5	T96 G97 L280 G284 T285 I369 F370 G371	T96-D282 VanDerWaalsContact OG1-CA 3.28Å; T96-D282 WeakPolarHBondContact OG1-CA 3.41Å; G97-D282 WeakPolarHBondContact CA-OD1 3.34Å; G97-D282 PolarHBondContact N-OD1 3.18Å; G97-D282 VanDerWaalsContact N-OD1 3.11Å; L280-D282 HydrophobicContact CD2-CB 4.34Å; L280-D282 HydrophobicContact CG-CB 4.14Å; D282-G284 PolarHBondContact O-N 3.2Å; D282-G284 WeakPolarHBondContact OD1-CA 3.42Å; D282-G284 PolarHBondContact OD1-N 3.42Å; D282-T285 PolarHBondContact O-N 2.82Å; D282-T285 VanDerWaalsContact OD2-CB 3.29Å; D282-T285 WeakPolarHBondContact OD2-CB 3.2Å; D282-T285 PolarHBondContact OD2-OG1 2.86Å; D282-I369 HydrophobicContact CB-CG2 3.53Å; D282-F370 PolarHBondContact N-O 3Å; D282-F370 VanDerWaalsContact N-O 3.12Å; D282-G371 VanDerWaalsContact O-CA 3.31Å; D282-G371 WeakPolarHBondContact O-CA 3.29Å
283	T	92.4	Very high	90.3	Very high	13 Å²	13	23.3 Å²	23.3	8%	0.08	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-9.3	174.1	52.8	0	0	0	0	113.7	F94 T96 V219 T285 L375 F382	F94-T283 WeakPolarHBondContact O-CB 3.11Å; F94-T283 PolarHBondContact O-OG1 3.06Å; T96-T283 HydrophobicContact CG2-CG2 4.16Å; T96-T283 WeakPolarHBondContact CG2-OG1 3.33Å; T96-T283 PolarHBondContact N-OG1 2.81Å; T96-T283 PolarHBondContact OG1-N 3.04Å; T96-T283 PolarHBondContact OG1-OG1 2.77Å; V219-T283 HydrophobicContact CG1-CG2 4.09Å; V219-T283 HydrophobicContact CG2-CG2 4.34Å; T283-T285 VanDerWaalsContact C-N 3.33Å; T283-L375 HydrophobicContact CG2-CD1 3.7Å; T283-F382 HydrophobicContact CG2-CZ 4.47Å
284	G	87.8	Confident	90.4	Very high	10 Å²	10	26.4 Å²	26.4	10%	0.103	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-6.5	172.4	0	0	0	0	0	113.8	L69 D95 D282	L69-G284 VanDerWaalsContact CD2-O 3.25Å; L69-G284 WeakPolarHBondContact CD2-O 3.27Å; D95-G284 WeakPolarHBondContact OD1-CA 3.21Å; D282-G284 PolarHBondContact O-N 3.2Å; D282-G284 WeakPolarHBondContact OD1-CA 3.42Å; D282-G284 PolarHBondContact OD1-N 3.42Å
285	T	84.9	Confident	90.5	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.012	14%	0.144	C	C	.	.			trans	-115.2	137.2	-178.6	-71.9	0	0	0	0	111	Y68 D282 T283 I369 G371 D372	Y68-T285 PolarHBondContact O-OG1 3.48Å; D282-T285 PolarHBondContact O-N 2.82Å; D282-T285 VanDerWaalsContact OD2-CB 3.29Å; D282-T285 WeakPolarHBondContact OD2-CB 3.2Å; D282-T285 PolarHBondContact OD2-OG1 2.86Å; T283-T285 VanDerWaalsContact C-N 3.33Å; T285-I369 HydrophobicContact CG2-CG2 3.99Å; T285-G371 CarbonylContact O-C 3.59Å; T285-G371 WeakPolarHBondContact O-CA 3.29Å; T285-D372 PolarHBondContact O-N 2.99Å
286	A	83.2	Confident	90.8	Very high	3 Å²	3	20.8 Å²	20.8	3%	0.025	13%	0.126	C	C	.	.			trans	-86.3	-30.6	178.3	0	0	0	0	0	113.3	E70 N71 Y72 D372 V373	E70-A286 WeakPolarHBondContact O-CB 3.48Å; E70-A286 PolarHBondContact O-N 3.41Å; N71-A286 HydrophobicContact CB-CB 4.5Å; Y72-A286 WeakPolarHBondContact O-CB 3.42Å; A286-D372 PolarHBondContact O-N 2.88Å; A286-V373 WeakPolarHBondContact O-CG2 3.46Å; A286-V373 PolarHBondContact O-N 3.02Å; A286-V373 VanDerWaalsContact O-N 3.09Å
287	L	87.1	Confident	91.2	Very high	6 Å²	6	21.3 Å²	21.3	3%	0.031	12%	0.115	C	C	.	.	S	Bend	trans	-100	176.4	-168.8	-69.1	-166.7	0	0	0	114	Y72 C356 I358 G371	Y72-L287 VanDerWaalsContact CB-CD1 3.46Å; Y72-L287 HydrophobicContact CG-CD1 4.21Å; Y72-L287 WeakPolarHBondContact O-CD2 3.42Å; L287-C356 HydrophobicContact CD2-CB 3.82Å; L287-I358 HydrophobicContact CB-CG2 4.27Å; L287-I358 HydrophobicContact CD1-CB 4.04Å; L287-I358 HydrophobicContact CD1-CG2 3.85Å; L287-G371 VanDerWaalsContact O-CA 3.27Å; L287-G371 WeakPolarHBondContact O-CA 3.27Å; L287-G371 PolarHBondContact O-N 3.12Å
288	I	90.4	Very high	91.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.5	160.4	-65.1	170.7	0	0	0	107.5	I327 L336 C356 F357 I358 W368 I369 F370 V373 F374	I288-I327 HydrophobicContact CD1-CD1 4.27Å; I288-L336 HydrophobicContact CD1-CD1 3.49Å; I288-L336 VanDerWaalsContact CD1-CD1 3.49Å; I288-C356 PolarHBondContact N-O 2.98Å; I288-F357 HydrophobicContact CB-CD1 3.81Å; I288-F357 HydrophobicContact CB-CE1 3.89Å; I288-F357 HydrophobicContact CD1-CE1 3.76Å; I288-F357 HydrophobicContact CD1-CZ 4.4Å; I288-F357 HydrophobicContact CG1-CE1 4.41Å; I288-F357 HydrophobicContact CG2-CD1 3.81Å; I288-F357 HydrophobicContact CG2-CE1 3.87Å; I288-F357 WeakPolarHBondContact O-CA 3.45Å; I288-I358 PolarHBondContact O-N 2.81Å; I288-I358 VanDerWaalsContact O-N 3.09Å; I288-W368 HydrophobicContact CG2-CE3 4.09Å; I288-W368 HydrophobicContact CG2-CZ3 4.23Å; I288-I369 WeakPolarHBondContact CA-O 3.17Å; I288-F370 HydrophobicContact CG2-CD1 4.07Å; I288-F370 HydrophobicContact CG2-CE1 4.18Å; I288-V373 HydrophobicContact CD1-CB 4.45Å; I288-V373 HydrophobicContact CD1-CG1 3.76Å; I288-V373 HydrophobicContact CG1-CB 4.26Å; I288-V373 HydrophobicContact CG1-CG1 4.08Å; I288-F374 HydrophobicContact CD1-CB 4.33Å; I288-F374 HydrophobicContact CG1-CB 4.39Å
289	S	88.7	Confident	91.4	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.014	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	155	172.9	83.1	0	0	0	0	111.4	I358 W368 I369	S289-I358 VanDerWaalsContact CA-O 3.27Å; S289-I358 WeakPolarHBondContact CA-O 3.44Å; S289-W368 CarbonylContact O-C 3.57Å; S289-W368 VanDerWaalsContact O-CA 3.28Å; S289-W368 WeakPolarHBondContact O-CA 3.44Å; S289-W368 VanDerWaalsContact O-CE3 3.28Å; S289-I369 PolarHBondContact N-O 2.81Å; S289-I369 PolarHBondContact O-N 2.99Å; S289-I369 VanDerWaalsContact OG-CB 3.26Å; S289-I369 WeakPolarHBondContact OG-CB 3.45Å; S289-I369 WeakPolarHBondContact OG-CG1 3.48Å
290	G	90.8	Very high	91.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.4	179.5	177.3	0	0	0	0	0	111.9	T292 I295 I358 T360	G290-T292 PolarHBondContact O-N 2.92Å; G290-I295 WeakPolarHBondContact O-CG1 3.33Å; G290-I358 PolarHBondContact N-O 3.48Å; G290-T360 CarbonylContact C-O 3.51Å; G290-T360 PolarHBondContact O-N 3.47Å; G290-T360 VanDerWaalsContact O-O 3.13Å
291	P	91	Very high	91.4	Very high	16 Å²	16	30.6 Å²	30.6	10%	0.104	15%	0.148	C	C	.	.			trans	-53.2	132	-178.9	-25.6	34.4	0	0	0	111.2	E293 K294 I295 P366	P291-E293 PolarHBondContact O-N 2.92Å; P291-E293 VanDerWaalsContact O-N 3.12Å; P291-K294 HydrophobicContact CB-CG 4.29Å; P291-K294 PolarHBondContact O-N 2.88Å; P291-I295 PolarHBondContact O-N 3.05Å; P291-P366 HydrophobicContact CB-CB 4.48Å; P291-P366 HydrophobicContact CG-CB 3.59Å
292	T	89.1	Confident	91.4	Very high	27 Å²	27	31.2 Å²	31.2	17%	0.166	15%	0.151	C	C	.	.	H	α-helix	trans	-55.4	-40.7	-168.9	-62.1	0	0	0	0	111.9	G290 K294 I295 N296 D361	G290-T292 PolarHBondContact O-N 2.92Å; T292-K294 VanDerWaalsContact C-N 3.34Å; T292-K294 PolarHBondContact O-N 2.95Å; T292-I295 PolarHBondContact O-N 2.87Å; T292-N296 WeakPolarHBondContact O-CB 3.36Å; T292-N296 PolarHBondContact O-N 3.06Å; T292-N296 PolarHBondContact O-ND2 2.9Å; T292-N296 PolarHBondContact O-OD1 2.98Å; T292-N296 VanDerWaalsContact O-OD1 3.06Å; T292-D361 WeakPolarHBondContact CB-OD2 3.44Å; T292-D361 PolarHBondContact N-OD1 3Å; T292-D361 VanDerWaalsContact OG1-CG 3.25Å; T292-D361 PolarHBondContact OG1-OD1 3.47Å; T292-D361 PolarHBondContact OG1-OD2 2.78Å
293	E	92.1	Very high	91.4	Very high	120 Å²	120	33.9 Å²	33.9	56%	0.561	18%	0.179	S	C	*	.	H	α-helix	trans	-57.2	-44.7	176	-171.2	-155.8	121.9	0	0	112.4	P291 N296 N297	P291-E293 PolarHBondContact O-N 2.92Å; P291-E293 VanDerWaalsContact O-N 3.12Å; E293-N296 PolarHBondContact O-N 3.27Å; E293-N297 VanDerWaalsContact O-CG 3.22Å; E293-N297 PolarHBondContact O-N 3.13Å; E293-N297 PolarHBondContact O-ND2 3.44Å
294	K	93.9	Very high	91.3	Very high	66 Å²	66	34.2 Å²	34.2	29%	0.287	18%	0.181	S	C	.	.	H	α-helix	trans	-72.2	-39.5	-177.7	-58.4	-45.5	-174.4	-160.7	0	111.4	F272 P291 T292 N296 N297 I298 W368	F272-K294 WeakPolarHBondContact O-CD 3.49Å; F272-K294 WeakPolarHBondContact O-CG 3.34Å; P291-K294 HydrophobicContact CB-CG 4.29Å; P291-K294 PolarHBondContact O-N 2.88Å; T292-K294 VanDerWaalsContact C-N 3.34Å; T292-K294 PolarHBondContact O-N 2.95Å; K294-N296 VanDerWaalsContact C-N 3.34Å; K294-N297 PolarHBondContact O-N 3.28Å; K294-I298 WeakPolarHBondContact O-CG1 2.93Å; K294-I298 PolarHBondContact O-N 2.9Å; K294-W368 HydrophobicContact CB-CH2 4.14Å; K294-W368 HydrophobicContact CB-CZ2 3.83Å; K294-W368 HydrophobicContact CG-CZ2 4.44Å
295	I	92.1	Very high	91.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-41.5	174.7	-64.8	-73.5	0	0	0	111	G290 P291 T292 N297 I298 N299 Y312 F357 I358 W368	G290-I295 WeakPolarHBondContact O-CG1 3.33Å; P291-I295 PolarHBondContact O-N 3.05Å; T292-I295 PolarHBondContact O-N 2.87Å; I295-N297 VanDerWaalsContact C-N 3.3Å; I295-N297 PolarHBondContact O-N 3.07Å; I295-I298 PolarHBondContact O-N 3.37Å; I295-N299 WeakPolarHBondContact CG2-ND2 3.29Å; I295-N299 WeakPolarHBondContact O-CB 3.27Å; I295-N299 PolarHBondContact O-N 3.04Å; I295-N299 PolarHBondContact O-ND2 2.9Å; I295-N299 VanDerWaalsContact O-ND2 3.14Å; I295-Y312 HydrophobicContact CG2-CE2 4.4Å; I295-F357 HydrophobicContact CD1-CB 4.01Å; I295-F357 HydrophobicContact CD1-CD1 4.37Å; I295-F357 HydrophobicContact CG2-CB 4.13Å; I295-I358 WeakPolarHBondContact CG1-O 2.99Å; I295-W368 HydrophobicContact CD1-CH2 4.07Å; I295-W368 HydrophobicContact CD1-CZ3 3.68Å
296	N	92.9	Very high	91.2	Very high	53 Å²	53	44.1 Å²	44.1	28%	0.283	23%	0.228	S	C	.	.	H	α-helix	trans	-62.6	-39.4	176	-66.4	-1.7	0	0	0	111.2	T292 E293 K294 N299 K300 Y312	T292-N296 WeakPolarHBondContact O-CB 3.36Å; T292-N296 PolarHBondContact O-N 3.06Å; T292-N296 PolarHBondContact O-ND2 2.9Å; T292-N296 PolarHBondContact O-OD1 2.98Å; T292-N296 VanDerWaalsContact O-OD1 3.06Å; E293-N296 PolarHBondContact O-N 3.27Å; K294-N296 VanDerWaalsContact C-N 3.34Å; N296-N299 PolarHBondContact O-N 2.77Å; N296-K300 VanDerWaalsContact O-CB 3.22Å; N296-K300 WeakPolarHBondContact O-CB 3.47Å; N296-K300 PolarHBondContact O-N 2.99Å; N296-Y312 PolarHBondContact OD1-OH 2.79Å
297	N	94.5	Very high	90.7	Very high	65 Å²	65	47.6 Å²	47.6	35%	0.348	24%	0.244	S	C	.	.	H	α-helix	trans	-65.7	-44.7	176.3	-68.9	-23.3	0	0	0	112.1	F272 E293 K294 I295 N299 K300 Y301	F272-N297 HydrophobicContact CD1-CB 3.91Å; F272-N297 HydrophobicContact CE1-CB 4.01Å; E293-N297 VanDerWaalsContact O-CG 3.22Å; E293-N297 PolarHBondContact O-N 3.13Å; E293-N297 PolarHBondContact O-ND2 3.44Å; K294-N297 PolarHBondContact O-N 3.28Å; I295-N297 VanDerWaalsContact C-N 3.3Å; I295-N297 PolarHBondContact O-N 3.07Å; N297-N299 PolarHBondContact O-N 2.89Å; N297-K300 PolarHBondContact O-N 2.87Å; N297-Y301 WeakPolarHBondContact O-CB 3.31Å; N297-Y301 PolarHBondContact O-N 3.03Å
298	I	96.1	Very high	89.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.1	-51.2	174.1	-70.4	171.4	0	0	0	109.7	I267 F272 K294 I295 K300 Y301 L302 I325 F357 W368	I267-I298 HydrophobicContact CD1-CG1 4.37Å; I267-I298 HydrophobicContact CD1-CG2 4.12Å; F272-I298 HydrophobicContact CB-CD1 4.12Å; F272-I298 HydrophobicContact CB-CG1 3.79Å; F272-I298 HydrophobicContact CD1-CB 4.36Å; F272-I298 HydrophobicContact CD1-CG1 3.51Å; F272-I298 HydrophobicContact CE1-CG1 4.27Å; F272-I298 HydrophobicContact CG-CG1 3.68Å; K294-I298 WeakPolarHBondContact O-CG1 2.93Å; K294-I298 PolarHBondContact O-N 2.9Å; I295-I298 PolarHBondContact O-N 3.37Å; I298-K300 PolarHBondContact O-N 2.89Å; I298-Y301 WeakPolarHBondContact O-CB 3.41Å; I298-Y301 PolarHBondContact O-N 3.35Å; I298-Y301 VanDerWaalsContact O-N 3.09Å; I298-L302 HydrophobicContact CG2-CD1 4.09Å; I298-L302 HydrophobicContact CG2-CG 4.46Å; I298-L302 WeakPolarHBondContact O-CG 3.41Å; I298-L302 PolarHBondContact O-N 3.36Å; I298-I325 HydrophobicContact CG2-CD1 4.49Å; I298-F357 HydrophobicContact CG2-CD2 4.08Å; I298-F357 HydrophobicContact CG2-CE2 4.3Å; I298-F357 HydrophobicContact CG2-CG 4.35Å; I298-W368 HydrophobicContact CD1-CH2 3.8Å; I298-W368 HydrophobicContact CD1-CZ3 4.29Å
299	N	94.6	Very high	88.8	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-43.3	-178.3	-91.5	-60.4	0	0	0	113.1	I295 N296 N297 Y301 L302 G303 S304 Y312 T355	I295-N299 WeakPolarHBondContact CG2-ND2 3.29Å; I295-N299 WeakPolarHBondContact O-CB 3.27Å; I295-N299 PolarHBondContact O-N 3.04Å; I295-N299 PolarHBondContact O-ND2 2.9Å; I295-N299 VanDerWaalsContact O-ND2 3.14Å; N296-N299 PolarHBondContact O-N 2.77Å; N297-N299 PolarHBondContact O-N 2.89Å; N299-Y301 VanDerWaalsContact C-N 3.29Å; N299-Y301 PolarHBondContact O-N 3.04Å; N299-L302 PolarHBondContact O-N 2.55Å; N299-G303 PolarHBondContact O-N 2.95Å; N299-S304 VanDerWaalsContact C-OG 3.27Å; N299-S304 WeakPolarHBondContact CA-OG 3.27Å; N299-S304 WeakPolarHBondContact CB-OG 3.14Å; N299-S304 PolarHBondContact O-N 2.93Å; N299-S304 PolarHBondContact O-OG 3.09Å; N299-S304 PolarHBondContact OD1-OG 3.1Å; N299-Y312 HydrophobicContact CB-CD1 3.57Å; N299-Y312 HydrophobicContact CB-CD2 4.27Å; N299-Y312 HydrophobicContact CB-CE1 3.82Å; N299-Y312 HydrophobicContact CB-CE2 4.48Å; N299-Y312 HydrophobicContact CB-CG 3.83Å; N299-Y312 WeakPolarHBondContact ND2-CD2 3.06Å; N299-Y312 WeakPolarHBondContact OD1-CB 3.27Å; N299-Y312 VanDerWaalsContact OD1-CG 3.31Å; N299-T355 WeakPolarHBondContact OD1-CG2 3.43Å; N299-T355 PolarHBondContact OD1-OG1 3.48Å; N299-T355 VanDerWaalsContact OD1-OG1 3.13Å
300	K	93.7	Very high	87.9	Confident	169 Å²	169	57.7 Å²	57.7	74%	0.735	30%	0.304	S	S	*	.	H	α-helix	trans	-58.6	-41.3	172.5	-176.3	-179.9	178.2	-176.4	0	111.7	N296 N297 I298 G303	N296-K300 VanDerWaalsContact O-CB 3.22Å; N296-K300 WeakPolarHBondContact O-CB 3.47Å; N296-K300 PolarHBondContact O-N 2.99Å; N297-K300 PolarHBondContact O-N 2.87Å; I298-K300 PolarHBondContact O-N 2.89Å; K300-G303 PolarHBondContact O-N 2.8Å; K300-G303 VanDerWaalsContact O-N 3.11Å
301	Y	95	Very high	87.1	Confident	90 Å²	90	59.2 Å²	59.2	35%	0.353	31%	0.312	S	S	.	.	H	α-helix	trans	-64.6	-39.6	176.9	-168.7	-82	0	0	0	112.2	I267 N268 E270 F272 N297 I298 N299 G303 P323	I267-Y301 HydrophobicContact CB-CD1 4.38Å; I267-Y301 HydrophobicContact CB-CE1 4.19Å; I267-Y301 HydrophobicContact CD1-CD1 4.32Å; I267-Y301 HydrophobicContact CG2-CD1 3.81Å; I267-Y301 HydrophobicContact CG2-CE1 3.45Å; I267-Y301 VanDerWaalsContact CG2-CE1 3.45Å; N268-Y301 PolarHBondContact ND2-OH 3.46Å; E270-Y301 WeakPolarHBondContact OE2-CE2 3.39Å; F272-Y301 AromaticContact CZ-CD2 3.69Å; F272-Y301 HydrophobicContact CZ-CD2 3.69Å; F272-Y301 HydrophobicContact CZ-CE2 4.4Å; F272-Y301 AromaticContact CZ-CG 3.82Å; F272-Y301 HydrophobicContact CZ-CG 3.82Å; N297-Y301 WeakPolarHBondContact O-CB 3.31Å; N297-Y301 PolarHBondContact O-N 3.03Å; I298-Y301 WeakPolarHBondContact O-CB 3.41Å; I298-Y301 PolarHBondContact O-N 3.35Å; I298-Y301 VanDerWaalsContact O-N 3.09Å; N299-Y301 VanDerWaalsContact C-N 3.29Å; N299-Y301 PolarHBondContact O-N 3.04Å; Y301-G303 PolarHBondContact O-N 3.33Å; Y301-G303 VanDerWaalsContact O-N 3.17Å; Y301-P323 HydrophobicContact CD1-CG 4.33Å; Y301-P323 HydrophobicContact CE1-CG 4.07Å
302	L	95	Very high	86.9	Confident	13 Å²	13	59 Å²	59	7%	0.068	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-7.5	174.6	-62.8	176.9	0	0	0	113.2	I298 N299 S304 L322 P323 Y341 T355 F357	I298-L302 HydrophobicContact CG2-CD1 4.09Å; I298-L302 HydrophobicContact CG2-CG 4.46Å; I298-L302 WeakPolarHBondContact O-CG 3.41Å; I298-L302 PolarHBondContact O-N 3.36Å; N299-L302 PolarHBondContact O-N 2.55Å; L302-S304 VanDerWaalsContact C-N 3.27Å; L302-L322 HydrophobicContact CB-CD2 4.45Å; L302-L322 HydrophobicContact CD2-CD2 4.4Å; L302-P323 HydrophobicContact CD2-CG 3.79Å; L302-Y341 HydrophobicContact CD1-CD2 4.48Å; L302-Y341 HydrophobicContact CD1-CE2 4.09Å; L302-Y341 HydrophobicContact CD2-CE2 4.18Å; L302-T355 HydrophobicContact CD1-CG2 4.26Å; L302-F357 HydrophobicContact CD1-CD2 4.34Å; L302-F357 HydrophobicContact CD1-CE2 4.34Å
303	G	93.2	Very high	86.9	Confident	57 Å²	57	59.9 Å²	59.9	59%	0.588	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	28.3	-174.6	0	0	0	0	0	112.6	N299 K300 Y301	N299-G303 PolarHBondContact O-N 2.95Å; K300-G303 PolarHBondContact O-N 2.8Å; K300-G303 VanDerWaalsContact O-N 3.11Å; Y301-G303 PolarHBondContact O-N 3.33Å; Y301-G303 VanDerWaalsContact O-N 3.17Å
304	S	91.6	Very high	86.9	Confident	19 Å²	19	54.7 Å²	54.7	13%	0.133	29%	0.289	C	S	.	.			trans	-78.1	154.9	178.6	73.5	0	0	0	0	111.8	N299 L302 Y312 I313	N299-S304 VanDerWaalsContact C-OG 3.27Å; N299-S304 WeakPolarHBondContact CA-OG 3.27Å; N299-S304 WeakPolarHBondContact CB-OG 3.14Å; N299-S304 PolarHBondContact O-N 2.93Å; N299-S304 PolarHBondContact O-OG 3.09Å; N299-S304 PolarHBondContact OD1-OG 3.1Å; L302-S304 VanDerWaalsContact C-N 3.27Å; S304-Y312 WeakPolarHBondContact OG-CD1 3.2Å; S304-I313 CarbonylContact C-O 3.45Å; S304-I313 WeakPolarHBondContact CA-O 3.22Å; S304-I313 VanDerWaalsContact CB-O 3.27Å; S304-I313 WeakPolarHBondContact CB-O 3.37Å
305	I	87.2	Confident	86.8	Confident	117 Å²	117	54.9 Å²	54.9	60%	0.6	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.7	174.7	-59.5	171	0	0	0	107.3	M307 Y312 I313	I305-M307 PolarHBondContact O-N 2.92Å; I305-Y312 WeakPolarHBondContact O-CA 3.01Å; I305-I313 HydrophobicContact CB-CG1 4.18Å; I305-I313 PolarHBondContact N-O 2.63Å; I305-I313 PolarHBondContact O-N 3.37Å
306	Q	83	Confident	86.8	Confident	104 Å²	104	55.7 Å²	55.7	49%	0.486	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.4	173.5	-165.4	175.2	9.2	0	0	109.7	E311 Y312	Q306-E311 CarbonylContact C-O 3.52Å; Q306-E311 WeakPolarHBondContact CA-O 3.42Å; Q306-Y312 HydrophobicContact CB-CD1 3.9Å; Q306-Y312 HydrophobicContact CB-CE1 3.52Å; Q306-Y312 HydrophobicContact CG-CD1 4.19Å; Q306-Y312 HydrophobicContact CG-CE1 3.59Å; Q306-Y312 PolarHBondContact NE2-OH 3.15Å
307	M	72.7	Confident	86.9	Confident	75 Å²	75	59.3 Å²	59.3	37%	0.369	32%	0.317	S	S	.	.			trans	-88.7	178.5	165.1	-64.3	-157.8	71.2	0	0	109.8	I305 E311 I313	I305-M307 PolarHBondContact O-N 2.92Å; M307-E311 HydrophobicContact CB-CB 4.05Å; M307-E311 PolarHBondContact N-O 3.38Å; M307-I313 HydrophobicContact CG-CD1 4.08Å; M307-I313 HydrophobicContact CG-CG1 3.97Å; M307-I313 HydrophobicContact CG-CG2 3.96Å; M307-I313 HydrophobicContact SD-CB 4.46Å; M307-I313 HydrophobicContact SD-CD1 3.9Å; M307-I313 HydrophobicContact SD-CG1 4.21Å; M307-I313 HydrophobicContact SD-CG2 3.48Å; M307-I313 WeakPolarHBondContact SD-CG2 3.12Å
308	S	71	Confident	86.8	Confident	83 Å²	83	61.7 Å²	61.7	58%	0.58	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-54.3	145.3	171.5	51.6	0	0	0	0	111.6
309	N	66.8	Low	86.6	Confident	81 Å²	81	62.2 Å²	62.2	43%	0.433	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	66.1	45.7	169.7	-47.6	-31.5	0	0	0	116.2	Y35 E311	Y35-N309 WeakPolarHBondContact CE1-ND2 3.08Å; N309-E311 PolarHBondContact O-N 2.9Å; N309-E311 VanDerWaalsContact O-N 3.12Å
310	N	70.2	Confident	86.5	Confident	56 Å²	56	69.7 Å²	69.7	30%	0.299	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	62.1	16.5	176.5	-62.9	-13.2	0	0	0	115.3	Y312 I358 G359	N310-Y312 VanDerWaalsContact O-CD2 3.24Å; N310-Y312 WeakPolarHBondContact O-CD2 3.22Å; N310-Y312 WeakPolarHBondContact O-CE2 3.37Å; N310-I358 HydrophobicContact CB-CG1 4.41Å; N310-G359 PolarHBondContact ND2-O 3.08Å
311	E	73.7	Confident	86.5	Confident	33 Å²	33	70.2 Å²	70.2	15%	0.154	37%	0.365	C	S	.	.			trans	-83	147.8	169.6	-71	-179.2	-156.7	0	0	111	Y72 Q306 M307 N309 R354	Y72-E311 HydrophobicContact CE2-CG 4.4Å; Y72-E311 VanDerWaalsContact CZ-OE1 3.27Å; Y72-E311 PolarHBondContact OH-OE1 3.21Å; Y72-E311 PolarHBondContact OH-OE2 2.58Å; Q306-E311 CarbonylContact C-O 3.52Å; Q306-E311 WeakPolarHBondContact CA-O 3.42Å; M307-E311 HydrophobicContact CB-CB 4.05Å; M307-E311 PolarHBondContact N-O 3.38Å; N309-E311 PolarHBondContact O-N 2.9Å; N309-E311 VanDerWaalsContact O-N 3.12Å; E311-R354 IonicContact OE2-NE 3.69Å; E311-R354 PolarHBondContact OE2-NE 2.65Å
312	Y	85.4	Confident	86.6	Confident	12 Å²	12	67.2 Å²	67.2	5%	0.047	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	133.2	-179.9	-65.8	-88.8	0	0	0	111	I295 N296 N299 S304 I305 Q306 N310 R354 T355	I295-Y312 HydrophobicContact CG2-CE2 4.4Å; N296-Y312 PolarHBondContact OD1-OH 2.79Å; N299-Y312 HydrophobicContact CB-CD1 3.57Å; N299-Y312 HydrophobicContact CB-CD2 4.27Å; N299-Y312 HydrophobicContact CB-CE1 3.82Å; N299-Y312 HydrophobicContact CB-CE2 4.48Å; N299-Y312 HydrophobicContact CB-CG 3.83Å; N299-Y312 WeakPolarHBondContact ND2-CD2 3.06Å; N299-Y312 WeakPolarHBondContact OD1-CB 3.27Å; N299-Y312 VanDerWaalsContact OD1-CG 3.31Å; S304-Y312 WeakPolarHBondContact OG-CD1 3.2Å; I305-Y312 WeakPolarHBondContact O-CA 3.01Å; Q306-Y312 HydrophobicContact CB-CD1 3.9Å; Q306-Y312 HydrophobicContact CB-CE1 3.52Å; Q306-Y312 HydrophobicContact CG-CD1 4.19Å; Q306-Y312 HydrophobicContact CG-CE1 3.59Å; Q306-Y312 PolarHBondContact NE2-OH 3.15Å; N310-Y312 VanDerWaalsContact O-CD2 3.24Å; N310-Y312 WeakPolarHBondContact O-CD2 3.22Å; N310-Y312 WeakPolarHBondContact O-CE2 3.37Å; Y312-R354 CarbonylContact O-C 3.52Å; Y312-R354 WeakPolarHBondContact O-CA 3.41Å; Y312-T355 WeakPolarHBondContact CB-OG1 3.41Å; Y312-T355 PolarHBondContact O-N 3.42Å
313	I	89.5	Confident	86.7	Confident	44 Å²	44	67.7 Å²	67.7	23%	0.226	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	145.5	177.4	60.2	170	0	0	0	111.7	S304 I305 M307 I352 C353 R354	S304-I313 CarbonylContact C-O 3.45Å; S304-I313 WeakPolarHBondContact CA-O 3.22Å; S304-I313 VanDerWaalsContact CB-O 3.27Å; S304-I313 WeakPolarHBondContact CB-O 3.37Å; I305-I313 HydrophobicContact CB-CG1 4.18Å; I305-I313 PolarHBondContact N-O 2.63Å; I305-I313 PolarHBondContact O-N 3.37Å; M307-I313 HydrophobicContact CG-CD1 4.08Å; M307-I313 HydrophobicContact CG-CG1 3.97Å; M307-I313 HydrophobicContact CG-CG2 3.96Å; M307-I313 HydrophobicContact SD-CB 4.46Å; M307-I313 HydrophobicContact SD-CD1 3.9Å; M307-I313 HydrophobicContact SD-CG1 4.21Å; M307-I313 HydrophobicContact SD-CG2 3.48Å; M307-I313 WeakPolarHBondContact SD-CG2 3.12Å; I313-I352 HydrophobicContact CG2-CG2 3.86Å; I313-C353 CarbonylContact C-O 3.47Å; I313-C353 VanDerWaalsContact CA-O 3.25Å; I313-C353 WeakPolarHBondContact CA-O 3.15Å; I313-R354 HydrophobicContact CG2-CG 3.93Å
314	V	92	Very high	87	Confident	12 Å²	12	68.4 Å²	68.4	7%	0.073	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	160	173	-65	0	0	0	0	110.1	C316 L322 I342 C353 T355	V314-C316 PolarHBondContact O-N 2.95Å; V314-L322 HydrophobicContact CG1-CD1 4.45Å; V314-L322 HydrophobicContact CG2-CD1 4.17Å; V314-I342 HydrophobicContact CG1-CD1 4.34Å; V314-I342 HydrophobicContact CG2-CD1 3.76Å; V314-I342 HydrophobicContact CG2-CG1 4.38Å; V314-I342 HydrophobicContact CG2-CG2 4.2Å; V314-C353 HydrophobicContact CG2-CB 3.87Å; V314-C353 PolarHBondContact N-O 3.36Å; V314-T355 HydrophobicContact CG1-CG2 3.91Å
315	D	92.2	Very high	87.2	Confident	70 Å²	70	67.5 Å²	67.5	37%	0.374	34%	0.342	S	S	.	.			trans	-65.1	114.8	168.6	179.6	-3.5	0	0	0	109.5	N317 K318	D315-N317 PolarHBondContact O-N 3.15Å; D315-N317 WeakPolarHBondContact OD1-CB 3.41Å; D315-N317 PolarHBondContact OD1-N 2.86Å; D315-N317 PolarHBondContact OD1-ND2 3.48Å; D315-K318 HydrophobicContact CB-CB 4.28Å; D315-K318 HydrophobicContact CB-CD 3.96Å; D315-K318 HydrophobicContact CB-CG 4.01Å; D315-K318 PolarHBondContact O-N 3.4Å; D315-K318 VanDerWaalsContact OD2-CE 3.26Å; D315-K318 WeakPolarHBondContact OD2-CE 3.4Å; D315-K318 IonicContact OD2-NZ 3.66Å
316	C	92.7	Very high	87.8	Confident	16 Å²	16	65 Å²	65	11%	0.108	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-54.1	-26.3	178.2	-67.3	0	0	0	0	113.9	V314 K318 I319 R351 C353	V314-C316 PolarHBondContact O-N 2.95Å; C316-K318 PolarHBondContact O-N 3.02Å; C316-I319 WeakPolarHBondContact O-CG1 3.43Å; C316-R351 HydrophobicContact CB-CB 4.37Å; C316-C353 WeakPolarHBondContact CA-SG 3.16Å; C316-C353 HydrophobicContact CB-CB 4.04Å; C316-C353 WeakPolarHBondContact CB-SG 3.14Å; C316-C353 WeakPolarHBondContact SG-CB 3.2Å; C316-C353 PolarHBondContact SG-N 3.14Å; C316-C353 CovalentContact SG-SG 2.03Å; C316-C353 PolarHBondContact SG-SG 2.88Å
317	N	94.2	Very high	88.5	Confident	129 Å²	129	60.1 Å²	60.1	69%	0.69	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-78.7	-10	178	-55.7	-60.2	0	0	0	113	D315	D315-N317 PolarHBondContact O-N 3.15Å; D315-N317 WeakPolarHBondContact OD1-CB 3.41Å; D315-N317 PolarHBondContact OD1-N 2.86Å; D315-N317 PolarHBondContact OD1-ND2 3.48Å
318	K	93	Very high	89.6	Confident	116 Å²	116	60.6 Å²	60.6	50%	0.504	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-105.9	0.1	-178.5	-63.2	-177.3	-172.3	169.5	0	113.7	D315 C316 Q320 K321 L322	D315-K318 HydrophobicContact CB-CB 4.28Å; D315-K318 HydrophobicContact CB-CD 3.96Å; D315-K318 HydrophobicContact CB-CG 4.01Å; D315-K318 PolarHBondContact O-N 3.4Å; D315-K318 VanDerWaalsContact OD2-CE 3.26Å; D315-K318 WeakPolarHBondContact OD2-CE 3.4Å; D315-K318 IonicContact OD2-NZ 3.66Å; C316-K318 PolarHBondContact O-N 3.02Å; K318-Q320 VanDerWaalsContact C-N 3.28Å; K318-Q320 PolarHBondContact O-N 3.1Å; K318-K321 WeakPolarHBondContact O-CA 3.37Å; K318-K321 WeakPolarHBondContact O-CB 3.29Å; K318-K321 PolarHBondContact O-N 3.09Å; K318-L322 PolarHBondContact O-N 2.53Å
319	I	92.2	Very high	90.9	Very high	11 Å²	11	56.6 Å²	56.6	6%	0.056	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-49.7	-49.6	-178.8	-66.4	175.3	0	0	0	111.4	C316 K321 L322 A338 I342 C353	C316-I319 WeakPolarHBondContact O-CG1 3.43Å; I319-K321 PolarHBondContact O-N 2.85Å; I319-L322 WeakPolarHBondContact O-CB 3.27Å; I319-L322 PolarHBondContact O-N 2.93Å; I319-A338 HydrophobicContact CG2-CB 3.79Å; I319-A338 WeakPolarHBondContact O-CB 3.37Å; I319-I342 HydrophobicContact CD1-CG2 3.93Å; I319-I342 HydrophobicContact CG1-CG2 4.18Å; I319-C353 HydrophobicContact CD1-CB 4.11Å
320	Q	91.7	Very high	92.3	Very high	156 Å²	156	57.3 Å²	57.3	73%	0.729	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-65.4	-9.7	-178.6	-62.8	-60.7	-31.9	0	0	114.4	K318	K318-Q320 VanDerWaalsContact C-N 3.28Å; K318-Q320 PolarHBondContact O-N 3.1Å
321	K	94.8	Very high	93.5	Very high	181 Å²	181	57.1 Å²	57.1	79%	0.787	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-104.2	-5.9	175.8	-62.4	-178.8	178.9	178.4	0	112.9	K318 I319	K318-K321 WeakPolarHBondContact O-CA 3.37Å; K318-K321 WeakPolarHBondContact O-CB 3.29Å; K318-K321 PolarHBondContact O-N 3.09Å; I319-K321 PolarHBondContact O-N 2.85Å
322	L	96.9	Very high	94.6	Very high	26 Å²	26	57.3 Å²	57.3	14%	0.136	29%	0.292	C	S	.	.	S	Bend	trans	-69.1	143.6	178.6	-62.7	173.7	0	0	0	109.8	L302 V314 K318 I319 A338 Y341 I342	L302-L322 HydrophobicContact CB-CD2 4.45Å; L302-L322 HydrophobicContact CD2-CD2 4.4Å; V314-L322 HydrophobicContact CG1-CD1 4.45Å; V314-L322 HydrophobicContact CG2-CD1 4.17Å; K318-L322 PolarHBondContact O-N 2.53Å; I319-L322 WeakPolarHBondContact O-CB 3.27Å; I319-L322 PolarHBondContact O-N 2.93Å; L322-A338 HydrophobicContact CB-CB 3.92Å; L322-A338 HydrophobicContact CD1-CB 4.4Å; L322-Y341 HydrophobicContact CB-CE2 4.45Å; L322-Y341 WeakPolarHBondContact CB-OH 3.19Å; L322-Y341 HydrophobicContact CD1-CE2 4.2Å; L322-I342 HydrophobicContact CD1-CD1 3.85Å; L322-I342 HydrophobicContact CD1-CG1 3.68Å
323	P	97.5	Very high	95.2	Very high	23 Å²	23	58.6 Å²	58.6	15%	0.149	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-71.6	163	-171.6	31.5	-38.1	0	0	0	112.4	I267 Y301 L302 Y341	I267-P323 HydrophobicContact CG2-CB 3.53Å; I267-P323 HydrophobicContact CG2-CG 3.33Å; Y301-P323 HydrophobicContact CD1-CG 4.33Å; Y301-P323 HydrophobicContact CE1-CG 4.07Å; L302-P323 HydrophobicContact CD2-CG 3.79Å; P323-Y341 PolarHBondContact O-OH 2.79Å
324	I	97.7	Very high	95.5	Very high	73 Å²	73	56.6 Å²	56.6	37%	0.374	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-73.3	132.9	165	-66.2	171.3	0	0	0	108	Q335 L336 K337	I324-Q335 HydrophobicContact CG2-CB 3.7Å; I324-Q335 HydrophobicContact CG2-CG 3.87Å; I324-L336 WeakPolarHBondContact CA-O 3.48Å; I324-K337 HydrophobicContact CG1-CG 4.47Å
325	I	97.9	Very high	95.8	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	122.1	170.8	-57.7	176.1	0	0	0	107.1	I265 I267 I298 L336 Y341 F357	I265-I325 HydrophobicContact CG2-CG2 3.74Å; I267-I325 HydrophobicContact CD1-CD1 4.27Å; I267-I325 HydrophobicContact CD1-CG1 3.98Å; I267-I325 HydrophobicContact CG1-CB 4.5Å; I267-I325 HydrophobicContact CG1-CG1 4.03Å; I267-I325 HydrophobicContact CG1-CG2 4.3Å; I298-I325 HydrophobicContact CG2-CD1 4.49Å; I325-L336 HydrophobicContact CB-CB 4.32Å; I325-L336 PolarHBondContact N-O 3.48Å; I325-L336 PolarHBondContact O-N 2.83Å; I325-Y341 HydrophobicContact CD1-CD1 3.87Å; I325-Y341 HydrophobicContact CD1-CD2 4.3Å; I325-Y341 HydrophobicContact CD1-CE1 3.76Å; I325-Y341 HydrophobicContact CD1-CE2 4.23Å; I325-Y341 HydrophobicContact CD1-CG 4.14Å; I325-Y341 HydrophobicContact CG1-CD1 4.32Å; I325-Y341 HydrophobicContact CG1-CE1 3.88Å; I325-F357 HydrophobicContact CD1-CE1 4.49Å; I325-F357 HydrophobicContact CD1-CE2 3.41Å; I325-F357 VanDerWaalsContact CD1-CE2 3.41Å; I325-F357 HydrophobicContact CD1-CZ 3.36Å
326	E	97.9	Very high	96	Very high	64 Å²	64	57.2 Å²	57.2	30%	0.299	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119.9	179.2	179.1	169	-86.8	0	0	109.9	I265 S266 S333	I265-E326 CarbonylContact C-O 3.58Å; I265-E326 WeakPolarHBondContact CA-O 3.4Å; S266-E326 PolarHBondContact N-O 3.45Å; S266-E326 PolarHBondContact O-N 2.79Å; E326-S333 VanDerWaalsContact CG-OG 3.27Å; E326-S333 WeakPolarHBondContact CG-OG 3.23Å; E326-S333 WeakPolarHBondContact OE1-CB 3.3Å; E326-S333 PolarHBondContact OE1-OG 2.61Å
327	I	97.9	Very high	96.1	Very high	1 Å²	1	62.5 Å²	62.5	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.9	169.8	-57.2	179.7	0	0	0	107	I265 I288 I329 I334 L336 F370 F374	I265-I327 HydrophobicContact CG1-CG1 4.21Å; I265-I327 HydrophobicContact CG1-CG2 4.49Å; I265-I327 HydrophobicContact CG2-CG1 4.36Å; I288-I327 HydrophobicContact CD1-CD1 4.27Å; I327-I329 HydrophobicContact CG2-CD1 4.19Å; I327-I329 HydrophobicContact CG2-CG1 4.17Å; I327-I334 PolarHBondContact N-O 3.3Å; I327-I334 PolarHBondContact O-N 3.05Å; I327-L336 HydrophobicContact CD1-CD1 3.79Å; I327-L336 HydrophobicContact CD1-CG 4.34Å; I327-L336 HydrophobicContact CG1-CD1 4.5Å; I327-F370 HydrophobicContact CD1-CE1 4.36Å; I327-F370 HydrophobicContact CD1-CZ 4.19Å; I327-F370 HydrophobicContact CG2-CE2 3.66Å; I327-F370 HydrophobicContact CG2-CZ 3.74Å; I327-F374 HydrophobicContact CD1-CD2 3.92Å; I327-F374 HydrophobicContact CD1-CE2 4.38Å; I327-F374 HydrophobicContact CG2-CE2 4.33Å
328	K	97.6	Very high	96.1	Very high	85 Å²	85	56.7 Å²	56.7	37%	0.37	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.2	-177.9	-166.1	-177.3	177.1	175.2	0	110.9	D263 G264 G331 K332	D263-K328 WeakPolarHBondContact CA-O 3.49Å; D263-K328 HydrophobicContact CB-CB 3.9Å; D263-K328 HydrophobicContact CB-CD 4Å; D263-K328 HydrophobicContact CB-CG 3.86Å; D263-K328 WeakPolarHBondContact CB-O 3.27Å; D263-K328 PolarHBondContact N-O 3.34Å; D263-K328 WeakPolarHBondContact OD2-CG 3.43Å; G264-K328 PolarHBondContact N-O 2.98Å; G264-K328 PolarHBondContact O-N 3.36Å; K328-G331 WeakPolarHBondContact CE-O 3.47Å; K328-K332 CarbonylContact C-O 3.46Å; K328-K332 WeakPolarHBondContact CA-O 3.44Å
329	I	97.5	Very high	95.9	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	115.1	-175.6	-60.4	172.5	0	0	0	108.1	S250 I260 I262 I327 G331 K332 F370 F374 I391	S250-I329 VanDerWaalsContact OG-CG2 3.31Å; S250-I329 WeakPolarHBondContact OG-CG2 3.43Å; I260-I329 HydrophobicContact CD1-CD1 4.39Å; I260-I329 HydrophobicContact CD1-CG2 3.79Å; I262-I329 HydrophobicContact CB-CG1 4.3Å; I262-I329 HydrophobicContact CG2-CD1 4.36Å; I262-I329 HydrophobicContact CG2-CG1 3.9Å; I327-I329 HydrophobicContact CG2-CD1 4.19Å; I327-I329 HydrophobicContact CG2-CG1 4.17Å; I329-G331 VanDerWaalsContact C-N 3.28Å; I329-G331 PolarHBondContact O-N 3.36Å; I329-K332 PolarHBondContact N-O 3.28Å; I329-K332 WeakPolarHBondContact O-CB 3.4Å; I329-K332 PolarHBondContact O-N 3.16Å; I329-F370 HydrophobicContact CD1-CE2 4.18Å; I329-F374 HydrophobicContact CD1-CE2 4.11Å; I329-F374 HydrophobicContact CD1-CZ 3.61Å; I329-I391 HydrophobicContact CB-CD1 3.84Å; I329-I391 HydrophobicContact CD1-CD1 3.73Å; I329-I391 HydrophobicContact CG1-CD1 4.33Å; I329-I391 HydrophobicContact CG2-CD1 3.96Å
330	N	96.4	Very high	95.8	Very high	96 Å²	96	57 Å²	57	51%	0.513	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.3	51.9	-179.1	-167.6	22.3	0	0	0	113.1	T248 Y249 S250 D263 K332	T248-N330 HydrophobicContact CG2-CB 3.94Å; T248-N330 WeakPolarHBondContact CG2-O 3.22Å; Y249-N330 PolarHBondContact O-ND2 3.13Å; S250-N330 WeakPolarHBondContact OG-CB 3.48Å; D263-N330 PolarHBondContact OD1-N 3.36Å; D263-N330 PolarHBondContact OD2-N 2.87Å; N330-K332 VanDerWaalsContact C-N 3.26Å; N330-K332 PolarHBondContact O-N 2.76Å
331	G	95.3	Very high	95.8	Very high	52 Å²	52	49.5 Å²	49.5	54%	0.536	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-22.5	-179.9	0	0	0	0	0	115.4	D263 K328 I329	D263-G331 PolarHBondContact OD2-N 3.14Å; K328-G331 WeakPolarHBondContact CE-O 3.47Å; I329-G331 VanDerWaalsContact C-N 3.28Å; I329-G331 PolarHBondContact O-N 3.36Å
332	K	96.9	Very high	95.6	Very high	36 Å²	36	41.4 Å²	41.4	16%	0.157	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	125.9	179.8	-175.7	172.7	175.1	62	0	110.7	T248 K328 I329 N330 I334 I391 D393	T248-K332 HydrophobicContact CG2-CB 3.97Å; T248-K332 WeakPolarHBondContact OG1-CD 3.48Å; K328-K332 CarbonylContact C-O 3.46Å; K328-K332 WeakPolarHBondContact CA-O 3.44Å; I329-K332 PolarHBondContact N-O 3.28Å; I329-K332 WeakPolarHBondContact O-CB 3.4Å; I329-K332 PolarHBondContact O-N 3.16Å; N330-K332 VanDerWaalsContact C-N 3.26Å; N330-K332 PolarHBondContact O-N 2.76Å; K332-I334 HydrophobicContact CD-CD1 4Å; K332-I334 HydrophobicContact CG-CD1 3.98Å; K332-I391 HydrophobicContact CD-CD1 4.49Å; K332-I391 HydrophobicContact CD-CG1 4.36Å; K332-D393 IonicContact NZ-OD1 3.22Å; K332-D393 IonicContact NZ-OD2 3.97Å; K332-D393 PolarHBondContact NZ-OD2 3.02Å
333	S	96.8	Very high	95	Very high	40 Å²	40	41.1 Å²	41.1	28%	0.28	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	125.4	172.7	165.5	0	0	0	0	110	E326	E326-S333 VanDerWaalsContact CG-OG 3.27Å; E326-S333 WeakPolarHBondContact CG-OG 3.23Å; E326-S333 WeakPolarHBondContact OE1-CB 3.3Å; E326-S333 PolarHBondContact OE1-OG 2.61Å
334	I	97.5	Very high	94.4	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	123	171.1	-52.7	-56.2	0	0	0	107.8	I327 K332 F374 K377 V378 I391	I327-I334 PolarHBondContact N-O 3.3Å; I327-I334 PolarHBondContact O-N 3.05Å; K332-I334 HydrophobicContact CD-CD1 4Å; K332-I334 HydrophobicContact CG-CD1 3.98Å; I334-F374 HydrophobicContact CB-CE2 4.2Å; I334-F374 HydrophobicContact CG1-CE2 4.14Å; I334-F374 HydrophobicContact CG1-CZ 4.49Å; I334-F374 HydrophobicContact CG2-CD2 4.43Å; I334-F374 HydrophobicContact CG2-CE2 3.97Å; I334-K377 HydrophobicContact CG2-CB 4.16Å; I334-V378 HydrophobicContact CD1-CG1 3.56Å; I334-V378 HydrophobicContact CG1-CG1 3.97Å; I334-V378 HydrophobicContact CG2-CG1 3.97Å; I334-I391 HydrophobicContact CD1-CD1 4.26Å; I334-I391 HydrophobicContact CG1-CD1 4.2Å
335	Q	96.8	Very high	93.5	Very high	95 Å²	95	43.6 Å²	43.6	44%	0.444	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	120.4	-176.8	-67.6	-175.9	1.6	0	0	111	I324	I324-Q335 HydrophobicContact CG2-CB 3.7Å; I324-Q335 HydrophobicContact CG2-CG 3.87Å
336	L	96.1	Very high	92.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	118	168.9	-48.4	-176.5	0	0	0	108.8	I288 I324 I325 I327 D340 Y341 K377	I288-L336 HydrophobicContact CD1-CD1 3.49Å; I288-L336 VanDerWaalsContact CD1-CD1 3.49Å; I324-L336 WeakPolarHBondContact CA-O 3.48Å; I325-L336 HydrophobicContact CB-CB 4.32Å; I325-L336 PolarHBondContact N-O 3.48Å; I325-L336 PolarHBondContact O-N 2.83Å; I327-L336 HydrophobicContact CD1-CD1 3.79Å; I327-L336 HydrophobicContact CD1-CG 4.34Å; I327-L336 HydrophobicContact CG1-CD1 4.5Å; L336-D340 HydrophobicContact CB-CB 4.39Å; L336-Y341 HydrophobicContact CB-CD1 3.87Å; L336-Y341 WeakPolarHBondContact O-CE1 3.45Å; L336-K377 HydrophobicContact CD2-CB 4.35Å; L336-K377 HydrophobicContact CD2-CG 3.56Å
337	K	95.3	Very high	91.3	Very high	127 Å²	127	48.2 Å²	48.2	55%	0.552	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-84.8	165.2	171.1	-64.4	176.8	-179.4	177.9	0	109.8	I324 D339 D340 Y341	I324-K337 HydrophobicContact CG1-CG 4.47Å; K337-D339 VanDerWaalsContact C-N 3.26Å; K337-D339 PolarHBondContact O-N 2.75Å; K337-D340 PolarHBondContact N-OD2 3.05Å; K337-D340 WeakPolarHBondContact O-CA 3.44Å; K337-D340 VanDerWaalsContact O-CB 3.27Å; K337-D340 WeakPolarHBondContact O-CB 3.18Å; K337-D340 PolarHBondContact O-N 2.86Å; K337-Y341 WeakPolarHBondContact O-CD1 3.37Å; K337-Y341 VanDerWaalsContact O-CE1 3.26Å; K337-Y341 WeakPolarHBondContact O-CE1 3.48Å; K337-Y341 PolarHBondContact O-N 2.99Å
338	A	94.6	Very high	90.3	Very high	8 Å²	8	56 Å²	56	7%	0.066	30%	0.304	C	S	.	.	H	α-helix	trans	-49.9	-44.4	-179.3	0	0	0	0	0	113.6	I319 L322 D340 Y341 I342	I319-A338 HydrophobicContact CG2-CB 3.79Å; I319-A338 WeakPolarHBondContact O-CB 3.37Å; L322-A338 HydrophobicContact CB-CB 3.92Å; L322-A338 HydrophobicContact CD1-CB 4.4Å; A338-D340 PolarHBondContact O-N 2.97Å; A338-Y341 PolarHBondContact O-N 3.21Å; A338-I342 VanDerWaalsContact O-CB 3.29Å; A338-I342 WeakPolarHBondContact O-CB 3.46Å; A338-I342 VanDerWaalsContact O-CG1 3.3Å; A338-I342 WeakPolarHBondContact O-CG1 3.49Å; A338-I342 PolarHBondContact O-N 3.41Å
339	D	89.8	Confident	89.5	Confident	101 Å²	101	55.4 Å²	55.4	54%	0.54	32%	0.322	S	S	.	.	H	α-helix	trans	-67.8	-17	179.7	-59.6	-26.4	0	0	0	113.4	K337	K337-D339 VanDerWaalsContact C-N 3.26Å; K337-D339 PolarHBondContact O-N 2.75Å
340	D	89.7	Confident	88.8	Confident	31 Å²	31	59 Å²	59	17%	0.166	35%	0.347	C	S	.	.	H	α-helix	trans	-80.1	-38.3	176.6	-57.7	-50.5	0	0	0	111.3	L336 K337 A338 K377	L336-D340 HydrophobicContact CB-CB 4.39Å; K337-D340 PolarHBondContact N-OD2 3.05Å; K337-D340 WeakPolarHBondContact O-CA 3.44Å; K337-D340 VanDerWaalsContact O-CB 3.27Å; K337-D340 WeakPolarHBondContact O-CB 3.18Å; K337-D340 PolarHBondContact O-N 2.86Å; A338-D340 PolarHBondContact O-N 2.97Å; D340-K377 HydrophobicContact CB-CD 4.19Å; D340-K377 WeakPolarHBondContact OD1-CD 3.24Å; D340-K377 IonicContact OD1-NZ 3.58Å; D340-K377 PolarHBondContact OD1-NZ 3.28Å; D340-K377 WeakPolarHBondContact OD2-CE 3.32Å; D340-K377 IonicContact OD2-NZ 3.96Å; D340-K377 PolarHBondContact OD2-NZ 3.36Å
341	Y	91.4	Very high	88.4	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-110.6	5.4	-173	65.3	-106.1	0	0	0	114.8	L302 L322 P323 I325 L336 K337 A338 T355 C356 F357	L302-Y341 HydrophobicContact CD1-CD2 4.48Å; L302-Y341 HydrophobicContact CD1-CE2 4.09Å; L302-Y341 HydrophobicContact CD2-CE2 4.18Å; L322-Y341 HydrophobicContact CB-CE2 4.45Å; L322-Y341 WeakPolarHBondContact CB-OH 3.19Å; L322-Y341 HydrophobicContact CD1-CE2 4.2Å; P323-Y341 PolarHBondContact O-OH 2.79Å; I325-Y341 HydrophobicContact CD1-CD1 3.87Å; I325-Y341 HydrophobicContact CD1-CD2 4.3Å; I325-Y341 HydrophobicContact CD1-CE1 3.76Å; I325-Y341 HydrophobicContact CD1-CE2 4.23Å; I325-Y341 HydrophobicContact CD1-CG 4.14Å; I325-Y341 HydrophobicContact CG1-CD1 4.32Å; I325-Y341 HydrophobicContact CG1-CE1 3.88Å; L336-Y341 HydrophobicContact CB-CD1 3.87Å; L336-Y341 WeakPolarHBondContact O-CE1 3.45Å; K337-Y341 WeakPolarHBondContact O-CD1 3.37Å; K337-Y341 VanDerWaalsContact O-CE1 3.26Å; K337-Y341 WeakPolarHBondContact O-CE1 3.48Å; K337-Y341 PolarHBondContact O-N 2.99Å; A338-Y341 PolarHBondContact O-N 3.21Å; Y341-T355 CarbonylContact O-C 3.55Å; Y341-T355 WeakPolarHBondContact O-CA 3.42Å; Y341-C356 VanDerWaalsContact C-SG 3.53Å; Y341-C356 WeakPolarHBondContact O-CB 3.29Å; Y341-C356 PolarHBondContact O-N 2.8Å; Y341-C356 PolarHBondContact O-SG 3.3Å; Y341-F357 AromaticContact CD2-CE2 3.82Å; Y341-F357 HydrophobicContact CD2-CE2 3.82Å; Y341-F357 AromaticContact CG-CE2 3.82Å; Y341-F357 HydrophobicContact CG-CE2 3.82Å; Y341-F357 HydrophobicContact CG-CZ 4.2Å
342	I	90.8	Very high	88	Confident	11 Å²	11	59.4 Å²	59.4	6%	0.056	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.2	172.4	-59	-59.5	0	0	0	110.4	V314 I319 L322 A338 C353 R354 T355	V314-I342 HydrophobicContact CG1-CD1 4.34Å; V314-I342 HydrophobicContact CG2-CD1 3.76Å; V314-I342 HydrophobicContact CG2-CG1 4.38Å; V314-I342 HydrophobicContact CG2-CG2 4.2Å; I319-I342 HydrophobicContact CD1-CG2 3.93Å; I319-I342 HydrophobicContact CG1-CG2 4.18Å; L322-I342 HydrophobicContact CD1-CD1 3.85Å; L322-I342 HydrophobicContact CD1-CG1 3.68Å; A338-I342 VanDerWaalsContact O-CB 3.29Å; A338-I342 WeakPolarHBondContact O-CB 3.46Å; A338-I342 VanDerWaalsContact O-CG1 3.3Å; A338-I342 WeakPolarHBondContact O-CG1 3.49Å; A338-I342 PolarHBondContact O-N 3.41Å; I342-C353 HydrophobicContact CG2-CB 3.91Å; I342-R354 CarbonylContact C-O 3.55Å; I342-R354 VanDerWaalsContact CA-O 3.3Å; I342-R354 WeakPolarHBondContact CA-O 3.39Å; I342-T355 HydrophobicContact CD1-CG2 3.87Å
343	V	84.6	Confident	87.6	Confident	19 Å²	19	57.8 Å²	57.8	12%	0.115	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.9	168.3	-173.6	0	0	0	0	109.6	Q73 K345 C353 R354	Q73-V343 HydrophobicContact CB-CG2 4.04Å; Q73-V343 HydrophobicContact CG-CG2 3.27Å; V343-K345 HydrophobicContact CG1-CG 3.95Å; V343-C353 CarbonylContact O-C 3.14Å; V343-C353 VanDerWaalsContact O-CA 3.28Å; V343-C353 WeakPolarHBondContact O-CA 3.4Å; V343-R354 PolarHBondContact N-O 3.37Å; V343-R354 PolarHBondContact O-N 2.86Å
344	E	84.1	Confident	87.2	Confident	92 Å²	92	58 Å²	58	43%	0.43	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.1	164.8	-174.5	170.4	155.7	0	0	111.2	R351	E344-R351 VanDerWaalsContact CD-NH2 3.29Å; E344-R351 IonicContact OE1-CZ 3.55Å; E344-R351 IonicContact OE1-NE 3.33Å; E344-R351 PolarHBondContact OE1-NE 3.47Å; E344-R351 IonicContact OE1-NH2 2.81Å; E344-R351 PolarHBondContact OE1-NH2 2.74Å; E344-R351 IonicContact OE2-CZ 3.98Å; E344-R351 IonicContact OE2-NE 2.67Å; E344-R351 IonicContact OE2-NH2 3.62Å; E344-R351 PolarHBondContact OE2-NH2 3.46Å
345	K	78.5	Confident	86.8	Confident	56 Å²	56	58.4 Å²	58.4	24%	0.243	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.8	167.7	-69.3	-171.3	179.5	-178	0	110.4	N74 V343 I352	N74-K345 PolarHBondContact ND2-NZ 2.87Å; N74-K345 PolarHBondContact OD1-NZ 2.87Å; V343-K345 HydrophobicContact CG1-CG 3.95Å; K345-I352 PolarHBondContact N-O 2.89Å; K345-I352 PolarHBondContact O-N 3.12Å
346	V	76.7	Confident	86.5	Confident	105 Å²	105	53.9 Å²	53.9	64%	0.636	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	117.8	168.4	-177.2	0	0	0	0	108.5	S350 R351	V346-S350 WeakPolarHBondContact CA-O 2.96Å; V346-R351 HydrophobicContact CG2-CG 4.38Å
347	S	72.6	Confident	86.2	Confident	56 Å²	56	54.1 Å²	54.1	39%	0.392	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.4	175.6	-171.7	0	0	0	0	109.5	G349 S350	S347-G349 PolarHBondContact O-N 3.37Å; S347-G349 VanDerWaalsContact O-N 3.15Å; S347-S350 PolarHBondContact N-O 2.93Å; S347-S350 PolarHBondContact O-N 3.3Å
348	N	77.1	Confident	85.8	Confident	165 Å²	165	49.3 Å²	49.3	88%	0.882	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	41.2	-177.6	-63.2	-18	0	0	0	113.5	S350	N348-S350 PolarHBondContact O-N 2.83Å
349	G	80.8	Confident	85.4	Confident	73 Å²	73	49.2 Å²	49.2	75%	0.753	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	-2.9	-178.5	0	0	0	0	0	115.5	S347	S347-G349 PolarHBondContact O-N 3.37Å; S347-G349 VanDerWaalsContact O-N 3.15Å
350	S	82.4	Confident	85	Confident	75 Å²	75	45.1 Å²	45.1	52%	0.524	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.6	176.4	-61.5	0	0	0	0	111.3	V346 S347 N348	V346-S350 WeakPolarHBondContact CA-O 2.96Å; S347-S350 PolarHBondContact N-O 2.93Å; S347-S350 PolarHBondContact O-N 3.3Å; N348-S350 PolarHBondContact O-N 2.83Å
351	R	88.4	Confident	84.7	Confident	116 Å²	116	48.6 Å²	48.6	44%	0.438	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	126.2	170.7	-66.7	173.3	62.9	-158.3	-1.2	109.2	C316 E344 V346	C316-R351 HydrophobicContact CB-CB 4.37Å; E344-R351 VanDerWaalsContact CD-NH2 3.29Å; E344-R351 IonicContact OE1-CZ 3.55Å; E344-R351 IonicContact OE1-NE 3.33Å; E344-R351 PolarHBondContact OE1-NE 3.47Å; E344-R351 IonicContact OE1-NH2 2.81Å; E344-R351 PolarHBondContact OE1-NH2 2.74Å; E344-R351 IonicContact OE2-CZ 3.98Å; E344-R351 IonicContact OE2-NE 2.67Å; E344-R351 IonicContact OE2-NH2 3.62Å; E344-R351 PolarHBondContact OE2-NH2 3.46Å; V346-R351 HydrophobicContact CG2-CG 4.38Å
352	I	86.1	Confident	84.1	Confident	41 Å²	41	50 Å²	50	21%	0.21	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	121.5	173.2	-55.4	177.5	0	0	0	107.5	I313 K345 R354	I313-I352 HydrophobicContact CG2-CG2 3.86Å; K345-I352 PolarHBondContact N-O 2.89Å; K345-I352 PolarHBondContact O-N 3.12Å; I352-R354 HydrophobicContact CG2-CG 3.96Å
353	C	89.3	Confident	83.3	Confident	1 Å²	1	56 Å²	56	1%	0.007	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	107.5	-179.3	-60.9	0	0	0	0	109.2	I313 V314 C316 I319 I342 V343	I313-C353 CarbonylContact C-O 3.47Å; I313-C353 VanDerWaalsContact CA-O 3.25Å; I313-C353 WeakPolarHBondContact CA-O 3.15Å; V314-C353 HydrophobicContact CG2-CB 3.87Å; V314-C353 PolarHBondContact N-O 3.36Å; C316-C353 WeakPolarHBondContact CA-SG 3.16Å; C316-C353 HydrophobicContact CB-CB 4.04Å; C316-C353 WeakPolarHBondContact CB-SG 3.14Å; C316-C353 WeakPolarHBondContact SG-CB 3.2Å; C316-C353 PolarHBondContact SG-N 3.14Å; C316-C353 CovalentContact SG-SG 2.03Å; C316-C353 PolarHBondContact SG-SG 2.88Å; I319-C353 HydrophobicContact CD1-CB 4.11Å; I342-C353 HydrophobicContact CG2-CB 3.91Å; V343-C353 CarbonylContact O-C 3.14Å; V343-C353 VanDerWaalsContact O-CA 3.28Å; V343-C353 WeakPolarHBondContact O-CA 3.4Å
354	R	88.2	Confident	82.8	Confident	44 Å²	44	60.2 Å²	60.2	17%	0.166	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	143.2	-173.5	-65	-173.9	167.9	85.8	-3.2	110.7	E311 Y312 I313 I342 V343 I352	E311-R354 IonicContact OE2-NE 3.69Å; E311-R354 PolarHBondContact OE2-NE 2.65Å; Y312-R354 CarbonylContact O-C 3.52Å; Y312-R354 WeakPolarHBondContact O-CA 3.41Å; I313-R354 HydrophobicContact CG2-CG 3.93Å; I342-R354 CarbonylContact C-O 3.55Å; I342-R354 VanDerWaalsContact CA-O 3.3Å; I342-R354 WeakPolarHBondContact CA-O 3.39Å; V343-R354 PolarHBondContact N-O 3.37Å; V343-R354 PolarHBondContact O-N 2.86Å; I352-R354 HydrophobicContact CG2-CG 3.96Å
355	T	90.5	Very high	82.5	Confident	10 Å²	10	57.2 Å²	57.2	6%	0.061	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	149.8	169.8	75	0	0	0	0	111	N299 L302 Y312 V314 Y341 I342 F357	N299-T355 WeakPolarHBondContact OD1-CG2 3.43Å; N299-T355 PolarHBondContact OD1-OG1 3.48Å; N299-T355 VanDerWaalsContact OD1-OG1 3.13Å; L302-T355 HydrophobicContact CD1-CG2 4.26Å; Y312-T355 WeakPolarHBondContact CB-OG1 3.41Å; Y312-T355 PolarHBondContact O-N 3.42Å; V314-T355 HydrophobicContact CG1-CG2 3.91Å; Y341-T355 CarbonylContact O-C 3.55Å; Y341-T355 WeakPolarHBondContact O-CA 3.42Å; I342-T355 HydrophobicContact CD1-CG2 3.87Å; T355-F357 VanDerWaalsContact C-N 3.26Å; T355-F357 PolarHBondContact O-N 3Å
356	C	89.9	Confident	82.9	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.007	37%	0.365	C	S	.	.	S	Bend	trans	-87.8	16.3	175.9	-64.9	0	0	0	0	114.5	Q73 L287 I288 Y341 V373	Q73-C356 PolarHBondContact NE2-SG 3.04Å; L287-C356 HydrophobicContact CD2-CB 3.82Å; I288-C356 PolarHBondContact N-O 2.98Å; Y341-C356 VanDerWaalsContact C-SG 3.53Å; Y341-C356 WeakPolarHBondContact O-CB 3.29Å; Y341-C356 PolarHBondContact O-N 2.8Å; Y341-C356 PolarHBondContact O-SG 3.3Å; C356-V373 HydrophobicContact CB-CB 4.4Å; C356-V373 HydrophobicContact CB-CG1 4.08Å; C356-V373 HydrophobicContact CB-CG2 3.66Å
357	F	89.9	Confident	83.5	Confident	5 Å²	5	55.5 Å²	55.5	2%	0.022	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.3	-178	-62.6	-70.8	0	0	0	110.4	I288 I295 I298 L302 I325 Y341 T355	I288-F357 HydrophobicContact CB-CD1 3.81Å; I288-F357 HydrophobicContact CB-CE1 3.89Å; I288-F357 HydrophobicContact CD1-CE1 3.76Å; I288-F357 HydrophobicContact CD1-CZ 4.4Å; I288-F357 HydrophobicContact CG1-CE1 4.41Å; I288-F357 HydrophobicContact CG2-CD1 3.81Å; I288-F357 HydrophobicContact CG2-CE1 3.87Å; I288-F357 WeakPolarHBondContact O-CA 3.45Å; I295-F357 HydrophobicContact CD1-CB 4.01Å; I295-F357 HydrophobicContact CD1-CD1 4.37Å; I295-F357 HydrophobicContact CG2-CB 4.13Å; I298-F357 HydrophobicContact CG2-CD2 4.08Å; I298-F357 HydrophobicContact CG2-CE2 4.3Å; I298-F357 HydrophobicContact CG2-CG 4.35Å; L302-F357 HydrophobicContact CD1-CD2 4.34Å; L302-F357 HydrophobicContact CD1-CE2 4.34Å; I325-F357 HydrophobicContact CD1-CE1 4.49Å; I325-F357 HydrophobicContact CD1-CE2 3.41Å; I325-F357 VanDerWaalsContact CD1-CE2 3.41Å; I325-F357 HydrophobicContact CD1-CZ 3.36Å; Y341-F357 AromaticContact CD2-CE2 3.82Å; Y341-F357 HydrophobicContact CD2-CE2 3.82Å; Y341-F357 AromaticContact CG-CE2 3.82Å; Y341-F357 HydrophobicContact CG-CE2 3.82Å; Y341-F357 HydrophobicContact CG-CZ 4.2Å; T355-F357 VanDerWaalsContact C-N 3.26Å; T355-F357 PolarHBondContact O-N 3Å
358	I	86.2	Confident	84.5	Confident	26 Å²	26	53 Å²	53	13%	0.133	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.5	-179.5	-169.3	162.8	0	0	0	112.1	E70 L287 I288 S289 G290 I295 N310	E70-I358 VanDerWaalsContact OE2-CG2 3.26Å; E70-I358 WeakPolarHBondContact OE2-CG2 3.44Å; L287-I358 HydrophobicContact CB-CG2 4.27Å; L287-I358 HydrophobicContact CD1-CB 4.04Å; L287-I358 HydrophobicContact CD1-CG2 3.85Å; I288-I358 PolarHBondContact O-N 2.81Å; I288-I358 VanDerWaalsContact O-N 3.09Å; S289-I358 VanDerWaalsContact CA-O 3.27Å; S289-I358 WeakPolarHBondContact CA-O 3.44Å; G290-I358 PolarHBondContact N-O 3.48Å; I295-I358 WeakPolarHBondContact CG1-O 2.99Å; N310-I358 HydrophobicContact CB-CG1 4.41Å
359	G	85.7	Confident	85.2	Confident	6 Å²	6	45.3 Å²	45.3	6%	0.062	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	121.4	-179.8	0	0	0	0	0	111.2	N310	N310-G359 PolarHBondContact ND2-O 3.08Å
360	T	83	Confident	85.9	Confident	14 Å²	14	41.8 Å²	41.8	9%	0.086	25%	0.245	C	C	.	.			trans	-138.9	125	179.5	-53.3	0	0	0	0	109.3	Y68 G290 F362	Y68-T360 HydrophobicContact CD1-CG2 4.04Å; Y68-T360 HydrophobicContact CE1-CG2 3.34Å; G290-T360 CarbonylContact C-O 3.51Å; G290-T360 PolarHBondContact O-N 3.47Å; G290-T360 VanDerWaalsContact O-O 3.13Å; T360-F362 HydrophobicContact CG2-CD2 4.28Å; T360-F362 HydrophobicContact CG2-CE2 3.57Å; T360-F362 HydrophobicContact CG2-CZ 3.72Å
361	D	83	Confident	86.3	Confident	105 Å²	105	38.2 Å²	38.2	56%	0.561	22%	0.22	S	C	*	.			trans	-113.7	129.2	179.6	-60.8	-54.3	0	0	0	110.5	T292	T292-D361 WeakPolarHBondContact CB-OD2 3.44Å; T292-D361 PolarHBondContact N-OD1 3Å; T292-D361 VanDerWaalsContact OG1-CG 3.25Å; T292-D361 PolarHBondContact OG1-OD1 3.47Å; T292-D361 PolarHBondContact OG1-OD2 2.78Å
362	F	78.2	Confident	86.4	Confident	30 Å²	30	33 Å²	33	13%	0.132	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-107.1	140.9	-175.9	-59.8	-109	0	0	0	110.7	Y68 T360 S364 G365 L367 I369	Y68-F362 HydrophobicContact CD2-CD1 4.41Å; Y68-F362 AromaticContact CD2-CE1 3.38Å; Y68-F362 HydrophobicContact CD2-CE1 3.38Å; Y68-F362 AromaticContact CD2-CZ 3.82Å; Y68-F362 HydrophobicContact CD2-CZ 3.82Å; Y68-F362 HydrophobicContact CE1-CE1 4.42Å; Y68-F362 HydrophobicContact CE1-CZ 4.37Å; Y68-F362 AromaticContact CE2-CD1 3.58Å; Y68-F362 HydrophobicContact CE2-CD1 3.58Å; Y68-F362 AromaticContact CE2-CE1 2.9Å; Y68-F362 HydrophobicContact CE2-CE1 2.9Å; Y68-F362 AromaticContact CE2-CZ 3.57Å; Y68-F362 HydrophobicContact CE2-CZ 3.57Å; Y68-F362 HydrophobicContact CG-CE1 4.32Å; Y68-F362 HydrophobicContact CG-CZ 4.34Å; Y68-F362 AromaticContact CZ-CD1 3.98Å; Y68-F362 AromaticContact CZ-CE1 3.47Å; Y68-F362 VanDerWaalsContact CZ-CE1 3.47Å; Y68-F362 AromaticContact CZ-CZ 3.8Å; T360-F362 HydrophobicContact CG2-CD2 4.28Å; T360-F362 HydrophobicContact CG2-CE2 3.57Å; T360-F362 HydrophobicContact CG2-CZ 3.72Å; F362-S364 PolarHBondContact O-N 3.29Å; F362-G365 PolarHBondContact O-N 3.02Å; F362-L367 HydrophobicContact CD1-CD2 4.43Å; F362-L367 HydrophobicContact CD2-CB 3.99Å; F362-L367 HydrophobicContact CE1-CD2 4.08Å; F362-L367 HydrophobicContact CE2-CB 4.12Å; F362-L367 HydrophobicContact CE2-CD2 4.43Å; F362-L367 HydrophobicContact CG-CB 4.48Å; F362-L367 HydrophobicContact CZ-CD2 4.16Å; F362-I369 HydrophobicContact CE1-CD1 4.43Å; F362-I369 HydrophobicContact CZ-CD1 3.75Å; F362-I369 HydrophobicContact CZ-CG1 4.3Å
363	P	74.7	Confident	86.6	Confident	136 Å²	136	31.1 Å²	31.1	88%	0.883	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-27.8	175.4	-24.8	34.3	0	0	0	114.1	G365	P363-G365 VanDerWaalsContact C-N 3.33Å
364	S	72.5	Confident	86.8	Confident	108 Å²	108	31 Å²	31	76%	0.755	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-12.5	-179.1	48	0	0	0	0	114.1	F362	F362-S364 PolarHBondContact O-N 3.29Å
365	G	78.5	Confident	87.2	Confident	28 Å²	28	29 Å²	29	29%	0.289	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	131	-179	179.1	0	0	0	0	0	113.6	F362 P363 L367	F362-G365 PolarHBondContact O-N 3.02Å; P363-G365 VanDerWaalsContact C-N 3.33Å; G365-L367 PolarHBondContact O-N 3.46Å
366	P	87.2	Confident	87.2	Confident	104 Å²	104	29.7 Å²	29.7	68%	0.675	19%	0.185	S	C	*	.			trans	-68	123.5	178.6	28.3	-33.3	0	0	0	110.8	P291	P291-P366 HydrophobicContact CB-CB 4.48Å; P291-P366 HydrophobicContact CG-CB 3.59Å
367	L	89.1	Confident	87.4	Confident	21 Å²	21	32.2 Å²	32.2	11%	0.11	20%	0.196	C	C	.	.			trans	-134.4	138.6	177.8	175.6	62.6	0	0	0	109.5	M259 L280 F362 G365	M259-L367 HydrophobicContact CG-CD1 3.94Å; M259-L367 HydrophobicContact SD-CD1 3.46Å; M259-L367 WeakPolarHBondContact SD-CD1 3.39Å; M259-L367 HydrophobicContact SD-CD2 4.44Å; L280-L367 HydrophobicContact CB-CD1 4.42Å; F362-L367 HydrophobicContact CD1-CD2 4.43Å; F362-L367 HydrophobicContact CD2-CB 3.99Å; F362-L367 HydrophobicContact CE1-CD2 4.08Å; F362-L367 HydrophobicContact CE2-CB 4.12Å; F362-L367 HydrophobicContact CE2-CD2 4.43Å; F362-L367 HydrophobicContact CG-CB 4.48Å; F362-L367 HydrophobicContact CZ-CD2 4.16Å; G365-L367 PolarHBondContact O-N 3.46Å
368	W	93.8	Very high	87.8	Confident	5 Å²	5	32 Å²	32	2%	0.019	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	147	165	-67.4	81.7	0	0	0	110.5	I265 C273 T278 A279 L280 I288 S289 K294 I295 I298 F370	I265-W368 HydrophobicContact CD1-CD2 3.76Å; I265-W368 HydrophobicContact CD1-CE3 3.57Å; I265-W368 HydrophobicContact CD1-CH2 3.68Å; I265-W368 HydrophobicContact CD1-CZ2 3.85Å; I265-W368 HydrophobicContact CD1-CZ3 3.52Å; C273-W368 HydrophobicContact CB-CZ2 3.7Å; C273-W368 PolarHBondContact SG-NE1 2.96Å; T278-W368 PolarHBondContact O-N 2.89Å; A279-W368 CarbonylContact C-O 3.55Å; A279-W368 VanDerWaalsContact CA-O 3.25Å; A279-W368 WeakPolarHBondContact CA-O 3.41Å; A279-W368 HydrophobicContact CB-CB 3.99Å; L280-W368 PolarHBondContact N-O 2.68Å; I288-W368 HydrophobicContact CG2-CE3 4.09Å; I288-W368 HydrophobicContact CG2-CZ3 4.23Å; S289-W368 CarbonylContact O-C 3.57Å; S289-W368 VanDerWaalsContact O-CA 3.28Å; S289-W368 WeakPolarHBondContact O-CA 3.44Å; S289-W368 VanDerWaalsContact O-CE3 3.28Å; K294-W368 HydrophobicContact CB-CH2 4.14Å; K294-W368 HydrophobicContact CB-CZ2 3.83Å; K294-W368 HydrophobicContact CG-CZ2 4.44Å; I295-W368 HydrophobicContact CD1-CH2 4.07Å; I295-W368 HydrophobicContact CD1-CZ3 3.68Å; I298-W368 HydrophobicContact CD1-CH2 3.8Å; I298-W368 HydrophobicContact CD1-CZ3 4.29Å; W368-F370 HydrophobicContact CB-CD1 4.36Å; W368-F370 HydrophobicContact CB-CE1 3.87Å; W368-F370 HydrophobicContact CB-CZ 4.43Å; W368-F370 HydrophobicContact CD2-CE1 4.48Å; W368-F370 HydrophobicContact CE3-CE1 4.18Å; W368-F370 HydrophobicContact CG-CE1 4.38Å
369	I	91.9	Very high	88.3	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.5	167	-54.5	-178.7	0	0	0	107.8	Y68 L280 D282 T285 I288 S289 F362	Y68-I369 HydrophobicContact CD2-CD1 4.25Å; Y68-I369 HydrophobicContact CG-CD1 4.05Å; L280-I369 HydrophobicContact CB-CG1 4.28Å; L280-I369 HydrophobicContact CD2-CD1 4.46Å; L280-I369 HydrophobicContact CD2-CG1 4.43Å; D282-I369 HydrophobicContact CB-CG2 3.53Å; T285-I369 HydrophobicContact CG2-CG2 3.99Å; I288-I369 WeakPolarHBondContact CA-O 3.17Å; S289-I369 PolarHBondContact N-O 2.81Å; S289-I369 PolarHBondContact O-N 2.99Å; S289-I369 VanDerWaalsContact OG-CB 3.26Å; S289-I369 WeakPolarHBondContact OG-CB 3.45Å; S289-I369 WeakPolarHBondContact OG-CG1 3.48Å; F362-I369 HydrophobicContact CE1-CD1 4.43Å; F362-I369 HydrophobicContact CZ-CD1 3.75Å; F362-I369 HydrophobicContact CZ-CG1 4.3Å
370	F	94.5	Very high	88.9	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	94.5	177.5	-68.9	-9.5	0	0	0	109.4	I262 I265 A279 L280 I281 D282 I288 I327 I329 W368 F374	I262-F370 HydrophobicContact CD1-CE2 4.32Å; I262-F370 HydrophobicContact CD1-CZ 3.76Å; I262-F370 HydrophobicContact CG2-CE2 4.01Å; I262-F370 HydrophobicContact CG2-CZ 4.49Å; I265-F370 HydrophobicContact CD1-CE1 4.22Å; I265-F370 HydrophobicContact CD1-CZ 4.2Å; A279-F370 HydrophobicContact CB-CD1 4.45Å; A279-F370 HydrophobicContact CB-CD2 3.79Å; A279-F370 HydrophobicContact CB-CE1 4.32Å; A279-F370 HydrophobicContact CB-CE2 3.64Å; A279-F370 HydrophobicContact CB-CG 4.2Å; A279-F370 HydrophobicContact CB-CZ 3.92Å; L280-F370 PolarHBondContact O-N 3.43Å; I281-F370 HydrophobicContact CD1-CB 4.04Å; I281-F370 HydrophobicContact CD1-CD2 3.85Å; I281-F370 HydrophobicContact CD1-CG 4.39Å; D282-F370 PolarHBondContact N-O 3Å; D282-F370 VanDerWaalsContact N-O 3.12Å; I288-F370 HydrophobicContact CG2-CD1 4.07Å; I288-F370 HydrophobicContact CG2-CE1 4.18Å; I327-F370 HydrophobicContact CD1-CE1 4.36Å; I327-F370 HydrophobicContact CD1-CZ 4.19Å; I327-F370 HydrophobicContact CG2-CE2 3.66Å; I327-F370 HydrophobicContact CG2-CZ 3.74Å; I329-F370 HydrophobicContact CD1-CE2 4.18Å; W368-F370 HydrophobicContact CB-CD1 4.36Å; W368-F370 HydrophobicContact CB-CE1 3.87Å; W368-F370 HydrophobicContact CB-CZ 4.43Å; W368-F370 HydrophobicContact CD2-CE1 4.48Å; W368-F370 HydrophobicContact CE3-CE1 4.18Å; W368-F370 HydrophobicContact CG-CE1 4.38Å; F370-F374 HydrophobicContact CB-CB 3.9Å; F370-F374 HydrophobicContact CB-CD1 3.64Å; F370-F374 HydrophobicContact CB-CE1 4.36Å; F370-F374 HydrophobicContact CB-CG 3.84Å; F370-F374 HydrophobicContact CD2-CD1 4.08Å; F370-F374 HydrophobicContact CD2-CD2 4.25Å; F370-F374 HydrophobicContact CD2-CE1 4.1Å; F370-F374 HydrophobicContact CD2-CE2 4.28Å; F370-F374 HydrophobicContact CD2-CG 4.14Å; F370-F374 HydrophobicContact CD2-CZ 4.22Å; F370-F374 HydrophobicContact CG-CB 4.38Å; F370-F374 HydrophobicContact CG-CD1 4.19Å; F370-F374 HydrophobicContact CG-CG 4.11Å
371	G	91.8	Very high	89.7	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.182	C	C	.	.			trans	-85.9	-159.2	177.6	0	0	0	0	0	114.7	D282 T285 L287 V373 F374 L375	D282-G371 VanDerWaalsContact O-CA 3.31Å; D282-G371 WeakPolarHBondContact O-CA 3.29Å; T285-G371 CarbonylContact O-C 3.59Å; T285-G371 WeakPolarHBondContact O-CA 3.29Å; L287-G371 VanDerWaalsContact O-CA 3.27Å; L287-G371 WeakPolarHBondContact O-CA 3.27Å; L287-G371 PolarHBondContact O-N 3.12Å; G371-V373 PolarHBondContact O-N 2.76Å; G371-V373 VanDerWaalsContact O-N 3.1Å; G371-F374 WeakPolarHBondContact O-CA 3.42Å; G371-F374 WeakPolarHBondContact O-CB 3.44Å; G371-F374 PolarHBondContact O-N 3.27Å; G371-L375 WeakPolarHBondContact O-CG 3.38Å; G371-L375 PolarHBondContact O-N 3.35Å
372	D	90.2	Very high	90.4	Very high	6 Å²	6	25 Å²	25	3%	0.032	16%	0.155	C	C	.	.	H	α-helix	trans	-50.7	-39.1	-176.3	-64.7	-23.1	0	0	0	113.7	Y77 L221 T285 A286 F374 L375 R376	Y77-D372 WeakPolarHBondContact CD2-OD2 3.19Å; Y77-D372 HydrophobicContact CE2-CB 4.07Å; L221-D372 HydrophobicContact CD1-CB 4.39Å; L221-D372 VanDerWaalsContact CD1-OD1 3.23Å; L221-D372 WeakPolarHBondContact CD1-OD1 3.16Å; T285-D372 PolarHBondContact O-N 2.99Å; A286-D372 PolarHBondContact O-N 2.88Å; D372-F374 PolarHBondContact O-N 3.04Å; D372-L375 PolarHBondContact O-N 3.47Å; D372-R376 WeakPolarHBondContact O-CB 3.22Å; D372-R376 WeakPolarHBondContact O-CG 3.27Å; D372-R376 PolarHBondContact O-N 3.49Å
373	V	90	Very high	91.4	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-54.2	-40.8	176.9	166	0	0	0	0	111.9	A286 I288 C356 G371	A286-V373 WeakPolarHBondContact O-CG2 3.46Å; A286-V373 PolarHBondContact O-N 3.02Å; A286-V373 VanDerWaalsContact O-N 3.09Å; I288-V373 HydrophobicContact CD1-CB 4.45Å; I288-V373 HydrophobicContact CD1-CG1 3.76Å; I288-V373 HydrophobicContact CG1-CB 4.26Å; I288-V373 HydrophobicContact CG1-CG1 4.08Å; C356-V373 HydrophobicContact CB-CB 4.4Å; C356-V373 HydrophobicContact CB-CG1 4.08Å; C356-V373 HydrophobicContact CB-CG2 3.66Å; G371-V373 PolarHBondContact O-N 2.76Å; G371-V373 VanDerWaalsContact O-N 3.1Å
374	F	94.9	Very high	92.4	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-79.7	-47.3	173.3	172.8	-99.1	0	0	0	111.6	I281 I288 I327 I329 I334 F370 G371 D372 R376 K377 V378	I281-F374 HydrophobicContact CD1-CE1 4.35Å; I288-F374 HydrophobicContact CD1-CB 4.33Å; I288-F374 HydrophobicContact CG1-CB 4.39Å; I327-F374 HydrophobicContact CD1-CD2 3.92Å; I327-F374 HydrophobicContact CD1-CE2 4.38Å; I327-F374 HydrophobicContact CG2-CE2 4.33Å; I329-F374 HydrophobicContact CD1-CE2 4.11Å; I329-F374 HydrophobicContact CD1-CZ 3.61Å; I334-F374 HydrophobicContact CB-CE2 4.2Å; I334-F374 HydrophobicContact CG1-CE2 4.14Å; I334-F374 HydrophobicContact CG1-CZ 4.49Å; I334-F374 HydrophobicContact CG2-CD2 4.43Å; I334-F374 HydrophobicContact CG2-CE2 3.97Å; F370-F374 HydrophobicContact CB-CB 3.9Å; F370-F374 HydrophobicContact CB-CD1 3.64Å; F370-F374 HydrophobicContact CB-CE1 4.36Å; F370-F374 HydrophobicContact CB-CG 3.84Å; F370-F374 HydrophobicContact CD2-CD1 4.08Å; F370-F374 HydrophobicContact CD2-CD2 4.25Å; F370-F374 HydrophobicContact CD2-CE1 4.1Å; F370-F374 HydrophobicContact CD2-CE2 4.28Å; F370-F374 HydrophobicContact CD2-CG 4.14Å; F370-F374 HydrophobicContact CD2-CZ 4.22Å; F370-F374 HydrophobicContact CG-CB 4.38Å; F370-F374 HydrophobicContact CG-CD1 4.19Å; F370-F374 HydrophobicContact CG-CG 4.11Å; G371-F374 WeakPolarHBondContact O-CA 3.42Å; G371-F374 WeakPolarHBondContact O-CB 3.44Å; G371-F374 PolarHBondContact O-N 3.27Å; D372-F374 PolarHBondContact O-N 3.04Å; F374-R376 PolarHBondContact O-N 3.09Å; F374-R376 VanDerWaalsContact O-N 3.16Å; F374-K377 WeakPolarHBondContact O-CB 3.48Å; F374-K377 PolarHBondContact O-N 2.95Å; F374-V378 HydrophobicContact CD1-CG2 4.02Å; F374-V378 HydrophobicContact CE1-CG2 3.55Å; F374-V378 HydrophobicContact CZ-CG1 4.24Å; F374-V378 HydrophobicContact CZ-CG2 3.87Å
375	L	95.1	Very high	93.5	Very high	1 Å²	1	15 Å²	15	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-64.5	-19.5	-175.3	-66.8	171.3	0	0	0	113.9	L221 I281 T283 G371 D372 K377 T380	L221-L375 HydrophobicContact CD1-CB 3.75Å; L221-L375 HydrophobicContact CD1-CD1 4.25Å; I281-L375 HydrophobicContact CG2-CD2 3.66Å; T283-L375 HydrophobicContact CG2-CD1 3.7Å; G371-L375 WeakPolarHBondContact O-CG 3.38Å; G371-L375 PolarHBondContact O-N 3.35Å; D372-L375 PolarHBondContact O-N 3.47Å; L375-K377 VanDerWaalsContact C-N 3.26Å; L375-K377 PolarHBondContact O-N 3.23Å; L375-T380 HydrophobicContact CD2-CG2 4.33Å; L375-T380 WeakPolarHBondContact CD2-OG1 3.49Å
376	R	92	Very high	94.4	Very high	24 Å²	24	19 Å²	19	9%	0.091	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-15.1	170.6	-72.9	-172.7	-57.6	-106.1	9.7	113.9	Y77 L221 D372 F374	Y77-R376 WeakPolarHBondContact OH-CD 3.21Å; L221-R376 HydrophobicContact CB-CG 3.78Å; D372-R376 WeakPolarHBondContact O-CB 3.22Å; D372-R376 WeakPolarHBondContact O-CG 3.27Å; D372-R376 PolarHBondContact O-N 3.49Å; F374-R376 PolarHBondContact O-N 3.09Å; F374-R376 VanDerWaalsContact O-N 3.16Å
377	K	94.1	Very high	94.9	Very high	55 Å²	55	17.8 Å²	17.8	24%	0.239	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-23	178	-56.7	-54	-60.6	-166.2	0	112.5	I334 L336 D340 F374 L375 V394	I334-K377 HydrophobicContact CG2-CB 4.16Å; L336-K377 HydrophobicContact CD2-CB 4.35Å; L336-K377 HydrophobicContact CD2-CG 3.56Å; D340-K377 HydrophobicContact CB-CD 4.19Å; D340-K377 WeakPolarHBondContact OD1-CD 3.24Å; D340-K377 IonicContact OD1-NZ 3.58Å; D340-K377 PolarHBondContact OD1-NZ 3.28Å; D340-K377 WeakPolarHBondContact OD2-CE 3.32Å; D340-K377 IonicContact OD2-NZ 3.96Å; D340-K377 PolarHBondContact OD2-NZ 3.36Å; F374-K377 WeakPolarHBondContact O-CB 3.48Å; F374-K377 PolarHBondContact O-N 2.95Å; L375-K377 VanDerWaalsContact C-N 3.26Å; L375-K377 PolarHBondContact O-N 3.23Å; K377-V394 PolarHBondContact O-N 3.38Å; K377-V394 VanDerWaalsContact O-N 3.1Å
378	V	96.8	Very high	95.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	141	-175.5	-64.1	0	0	0	0	111.5	I334 F374 I391 A392	I334-V378 HydrophobicContact CD1-CG1 3.56Å; I334-V378 HydrophobicContact CG1-CG1 3.97Å; I334-V378 HydrophobicContact CG2-CG1 3.97Å; F374-V378 HydrophobicContact CD1-CG2 4.02Å; F374-V378 HydrophobicContact CE1-CG2 3.55Å; F374-V378 HydrophobicContact CZ-CG1 4.24Å; F374-V378 HydrophobicContact CZ-CG2 3.87Å; V378-I391 HydrophobicContact CB-CB 4.27Å; V378-I391 HydrophobicContact CB-CG2 4.5Å; V378-I391 HydrophobicContact CG1-CB 4.43Å; V378-I391 HydrophobicContact CG2-CG2 4.27Å; V378-A392 CarbonylContact C-O 3.53Å; V378-A392 WeakPolarHBondContact CA-O 3.16Å; V378-A392 WeakPolarHBondContact CB-O 3.35Å
379	Y	97.3	Very high	95.5	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.008	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.7	159.8	-177.1	-94.8	0	0	0	108.2	A218 I238 D239 Y242 Y243 L247 V381 I391 A392	A218-Y379 HydrophobicContact CB-CE1 3.8Å; A218-Y379 HydrophobicContact CB-CE2 4.44Å; A218-Y379 WeakPolarHBondContact CB-OH 3.41Å; I238-Y379 HydrophobicContact CG2-CE1 3.9Å; D239-Y379 PolarHBondContact N-OH 2.58Å; Y242-Y379 HydrophobicContact CD2-CD2 4.48Å; Y242-Y379 AromaticContact CD2-CE2 3.92Å; Y242-Y379 HydrophobicContact CD2-CE2 3.92Å; Y242-Y379 HydrophobicContact CG-CD2 4.41Å; Y242-Y379 HydrophobicContact CG-CE2 4.3Å; Y243-Y379 AromaticContact CD1-CD1 3.51Å; Y243-Y379 HydrophobicContact CD1-CD1 3.51Å; Y243-Y379 AromaticContact CD1-CE1 3.91Å; Y243-Y379 HydrophobicContact CD1-CE1 3.91Å; Y243-Y379 AromaticContact CD1-CG 3.86Å; Y243-Y379 HydrophobicContact CD1-CG 3.86Å; Y243-Y379 HydrophobicContact CE1-CD1 4.12Å; Y243-Y379 HydrophobicContact CE1-CE1 4.14Å; Y243-Y379 HydrophobicContact CG-CD1 4.23Å; Y243-Y379 HydrophobicContact CG-CG 4.37Å; L247-Y379 HydrophobicContact CD2-CD1 4.34Å; Y379-V381 HydrophobicContact CD1-CG2 4.11Å; Y379-V381 HydrophobicContact CE1-CG2 3.67Å; Y379-I391 WeakPolarHBondContact O-CA 3.25Å; Y379-A392 PolarHBondContact N-O 3.15Å; Y379-A392 PolarHBondContact O-N 3.43Å; Y379-A392 VanDerWaalsContact O-N 3.09Å
380	T	98.6	Very high	95.9	Very high	1 Å²	1	19 Å²	19	1%	0.006	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.1	-171	-54.2	0	0	0	0	110.8	A218 V219 I281 L375 F382 V389 G390	A218-T380 CarbonylContact C-O 3.55Å; A218-T380 WeakPolarHBondContact CA-O 3.37Å; V219-T380 PolarHBondContact N-O 3.27Å; V219-T380 PolarHBondContact O-N 2.82Å; V219-T380 VanDerWaalsContact O-N 3.09Å; I281-T380 HydrophobicContact CG2-CG2 4Å; L375-T380 HydrophobicContact CD2-CG2 4.33Å; L375-T380 WeakPolarHBondContact CD2-OG1 3.49Å; T380-F382 HydrophobicContact CG2-CD2 4.05Å; T380-F382 HydrophobicContact CG2-CE1 4.11Å; T380-F382 HydrophobicContact CG2-CE2 3.47Å; T380-F382 VanDerWaalsContact CG2-CE2 3.47Å; T380-F382 HydrophobicContact CG2-CZ 3.52Å; T380-V389 HydrophobicContact CG2-CG1 3.7Å; T380-G390 CarbonylContact C-O 3.6Å; T380-G390 WeakPolarHBondContact CA-O 3.28Å
381	V	98.7	Very high	96	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	122.2	174.8	179.3	0	0	0	0	108.6	L216 A218 I238 L247 Y249 Y379 V389 G390	L216-V381 HydrophobicContact CB-CG1 4.45Å; L216-V381 HydrophobicContact CD1-CG1 4.3Å; L216-V381 HydrophobicContact CD2-CG1 4.31Å; A218-V381 HydrophobicContact CB-CG2 4.02Å; I238-V381 HydrophobicContact CD1-CG1 3.95Å; I238-V381 HydrophobicContact CD1-CG2 3.98Å; I238-V381 HydrophobicContact CG1-CG1 4.17Å; I238-V381 HydrophobicContact CG1-CG2 4Å; I238-V381 HydrophobicContact CG2-CG2 4.31Å; L247-V381 HydrophobicContact CD1-CG2 3.95Å; L247-V381 HydrophobicContact CD2-CG2 3.89Å; Y249-V381 HydrophobicContact CE1-CG1 4.46Å; Y379-V381 HydrophobicContact CD1-CG2 4.11Å; Y379-V381 HydrophobicContact CE1-CG2 3.67Å; V381-V389 CarbonylContact O-C 3.56Å; V381-V389 VanDerWaalsContact O-CA 3.3Å; V381-V389 WeakPolarHBondContact O-CA 3.42Å; V381-G390 PolarHBondContact N-O 3.25Å; V381-G390 PolarHBondContact O-N 3.3Å
382	F	98.6	Very high	96.3	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	97.1	174.6	-61.3	-89.5	0	0	0	108.2	T96 L216 F217 V219 W258 I281 T283 T380 F384 V389	T96-F382 HydrophobicContact CG2-CD1 4.27Å; T96-F382 HydrophobicContact CG2-CD2 4.45Å; T96-F382 HydrophobicContact CG2-CE1 3.83Å; T96-F382 HydrophobicContact CG2-CE2 4.04Å; T96-F382 HydrophobicContact CG2-CZ 3.71Å; L216-F382 WeakPolarHBondContact CA-O 3.41Å; L216-F382 WeakPolarHBondContact CB-O 3.41Å; F217-F382 HydrophobicContact CD1-CB 4.11Å; F217-F382 HydrophobicContact CD2-CB 4.04Å; F217-F382 AromaticContact CD2-CD2 3.73Å; F217-F382 HydrophobicContact CD2-CD2 3.73Å; F217-F382 HydrophobicContact CD2-CG 4.2Å; F217-F382 HydrophobicContact CE1-CB 3.66Å; F217-F382 HydrophobicContact CE1-CG 4.38Å; F217-F382 HydrophobicContact CE2-CB 3.59Å; F217-F382 HydrophobicContact CE2-CD1 4.39Å; F217-F382 AromaticContact CE2-CD2 3.22Å; F217-F382 HydrophobicContact CE2-CD2 3.22Å; F217-F382 AromaticContact CE2-CE2 3.93Å; F217-F382 HydrophobicContact CE2-CE2 3.93Å; F217-F382 AromaticContact CE2-CG 3.49Å; F217-F382 HydrophobicContact CE2-CG 3.49Å; F217-F382 VanDerWaalsContact CE2-CG 3.49Å; F217-F382 HydrophobicContact CG-CB 4.28Å; F217-F382 HydrophobicContact CZ-CB 3.37Å; F217-F382 HydrophobicContact CZ-CD1 4.27Å; F217-F382 AromaticContact CZ-CD2 3.86Å; F217-F382 HydrophobicContact CZ-CD2 3.86Å; F217-F382 AromaticContact CZ-CG 3.59Å; F217-F382 HydrophobicContact CZ-CG 3.59Å; F217-F382 PolarHBondContact N-O 3.08Å; F217-F382 VanDerWaalsContact N-O 3.11Å; F217-F382 PolarHBondContact O-N 3.11Å; V219-F382 HydrophobicContact CB-CE2 4.24Å; V219-F382 HydrophobicContact CG2-CD2 4.24Å; V219-F382 HydrophobicContact CG2-CE2 3.84Å; W258-F382 HydrophobicContact CB-CD1 4.02Å; W258-F382 HydrophobicContact CB-CE1 3.97Å; W258-F382 HydrophobicContact CD2-CB 4.26Å; W258-F382 AromaticContact CD2-CD1 3.5Å; W258-F382 HydrophobicContact CD2-CD1 3.5Å; W258-F382 HydrophobicContact CD2-CE1 4.32Å; W258-F382 HydrophobicContact CD2-CG 4.33Å; W258-F382 AromaticContact CE2-CD1 3.89Å; W258-F382 HydrophobicContact CE3-CB 4.24Å; W258-F382 AromaticContact CE3-CD1 3.82Å; W258-F382 HydrophobicContact CE3-CD1 3.82Å; W258-F382 AromaticContact CG-CD1 3.59Å; W258-F382 HydrophobicContact CG-CD1 3.59Å; W258-F382 AromaticContact CG-CE1 3.94Å; W258-F382 HydrophobicContact CG-CE1 3.94Å; W258-F382 HydrophobicContact CH2-CB 3.79Å; W258-F382 HydrophobicContact CZ2-CB 3.79Å; W258-F382 HydrophobicContact CZ3-CB 4.02Å; W258-F382 HydrophobicContact CZ3-CD1 4.45Å; I281-F382 HydrophobicContact CB-CE1 4.12Å; I281-F382 HydrophobicContact CG2-CE1 3.82Å; I281-F382 HydrophobicContact CG2-CZ 3.79Å; T283-F382 HydrophobicContact CG2-CZ 4.47Å; T380-F382 HydrophobicContact CG2-CD2 4.05Å; T380-F382 HydrophobicContact CG2-CE1 4.11Å; T380-F382 HydrophobicContact CG2-CE2 3.47Å; T380-F382 VanDerWaalsContact CG2-CE2 3.47Å; T380-F382 HydrophobicContact CG2-CZ 3.52Å; F382-F384 PolarHBondContact O-N 3.42Å; F382-V389 HydrophobicContact CD1-CG2 4.26Å
383	D	98.3	Very high	96.6	Very high	4 Å²	4	21.6 Å²	21.6	2%	0.021	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	93.1	-173.7	-174	-12.5	0	0	0	109.9	L216 G385 Q386 R387 R388	L216-D383 HydrophobicContact CB-CB 4.3Å; D383-G385 VanDerWaalsContact C-N 3.31Å; D383-G385 PolarHBondContact OD1-N 2.88Å; D383-Q386 PolarHBondContact OD1-N 3.33Å; D383-Q386 PolarHBondContact OD2-NE2 2.81Å; D383-R387 WeakPolarHBondContact O-CA 3.41Å; D383-R387 PolarHBondContact O-N 3.04Å; D383-R388 HydrophobicContact CB-CG 3.79Å; D383-R388 WeakPolarHBondContact CB-O 3.42Å; D383-R388 PolarHBondContact N-O 3.32Å; D383-R388 PolarHBondContact O-N 3.1Å; D383-R388 VanDerWaalsContact O-N 3.13Å; D383-R388 IonicContact OD2-CZ 3.45Å; D383-R388 IonicContact OD2-NE 3.48Å; D383-R388 PolarHBondContact OD2-NE 3.08Å; D383-R388 IonicContact OD2-NH2 2.79Å; D383-R388 PolarHBondContact OD2-NH2 3.47Å
384	F	96.8	Very high	96.8	Very high	15 Å²	15	23.2 Å²	23.2	7%	0.066	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-32.1	-179.6	-154.3	-89	0	0	0	111.3	F190 F203 M204 I207 P215 W258 F382 R387	F190-F384 AromaticContact CD1-CD2 3.97Å; F190-F384 HydrophobicContact CD1-CD2 3.97Å; F190-F384 HydrophobicContact CD1-CE1 4.5Å; F190-F384 AromaticContact CD1-CE2 3.22Å; F190-F384 HydrophobicContact CD1-CE2 3.22Å; F190-F384 AromaticContact CD1-CZ 3.54Å; F190-F384 HydrophobicContact CD1-CZ 3.54Å; F190-F384 AromaticContact CE1-CD2 3.64Å; F190-F384 HydrophobicContact CE1-CD2 3.64Å; F190-F384 AromaticContact CE1-CE2 3.42Å; F190-F384 HydrophobicContact CE1-CE2 3.42Å; F190-F384 VanDerWaalsContact CE1-CE2 3.42Å; F190-F384 HydrophobicContact CE1-CG 4.34Å; F190-F384 AromaticContact CE1-CZ 3.94Å; F190-F384 HydrophobicContact CE1-CZ 3.94Å; F190-F384 AromaticContact CG-CE2 3.99Å; F190-F384 HydrophobicContact CG-CE2 3.99Å; F190-F384 HydrophobicContact CG-CZ 4.48Å; F190-F384 HydrophobicContact CZ-CD2 4.29Å; F190-F384 HydrophobicContact CZ-CE2 4.31Å; F203-F384 HydrophobicContact CD1-CB 4.22Å; F203-F384 HydrophobicContact CD1-CD2 4.13Å; F203-F384 HydrophobicContact CD1-CG 4.27Å; F203-F384 HydrophobicContact CE1-CB 3.77Å; F203-F384 HydrophobicContact CE1-CG 4.29Å; M204-F384 HydrophobicContact CG-CE1 3.9Å; M204-F384 HydrophobicContact CG-CE2 4.28Å; M204-F384 HydrophobicContact CG-CZ 3.52Å; M204-F384 HydrophobicContact SD-CE1 4.48Å; M204-F384 HydrophobicContact SD-CZ 3.87Å; I207-F384 HydrophobicContact CD1-CB 4.14Å; I207-F384 HydrophobicContact CD1-CD1 3.8Å; I207-F384 HydrophobicContact CD1-CG 4.12Å; P215-F384 CarbonylContact O-C 3.56Å; P215-F384 WeakPolarHBondContact O-CA 3.14Å; P215-F384 WeakPolarHBondContact O-CB 3.46Å; P215-F384 PolarHBondContact O-N 3.06Å; W258-F384 HydrophobicContact CH2-CB 4.12Å; W258-F384 AromaticContact CH2-CD2 3.84Å; W258-F384 HydrophobicContact CH2-CD2 3.84Å; W258-F384 HydrophobicContact CH2-CG 4.43Å; W258-F384 AromaticContact CZ2-CD2 3.72Å; W258-F384 HydrophobicContact CZ2-CD2 3.72Å; W258-F384 HydrophobicContact CZ2-CE2 4.46Å; F382-F384 PolarHBondContact O-N 3.42Å; F384-R387 WeakPolarHBondContact O-CD 3.2Å; F384-R387 PolarHBondContact O-NH1 3.02Å
385	G	95.9	Very high	96.5	Very high	46 Å²	46	23.5 Å²	23.5	47%	0.474	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-37.1	178.7	0	0	0	0	0	113.7	P215 D383	P215-G385 PolarHBondContact O-N 2.76Å; D383-G385 VanDerWaalsContact C-N 3.31Å; D383-G385 PolarHBondContact OD1-N 2.88Å
386	Q	97.4	Very high	95.7	Very high	113 Å²	113	27.5 Å²	27.5	53%	0.528	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	7.2	179.7	-65.8	179.1	70.9	0	0	113.9	D383 R388	D383-Q386 PolarHBondContact OD1-N 3.33Å; D383-Q386 PolarHBondContact OD2-NE2 2.81Å; Q386-R388 HydrophobicContact CB-CG 3.95Å; Q386-R388 VanDerWaalsContact CD-NH2 3.26Å; Q386-R388 PolarHBondContact O-N 2.85Å; Q386-R388 VanDerWaalsContact OE1-NH1 3.08Å; Q386-R388 VanDerWaalsContact OE1-NH2 3.11Å
387	R	96.7	Very high	94.7	Very high	78 Å²	78	32.8 Å²	32.8	29%	0.294	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	55.1	176.1	-56.4	-59.3	-155.9	-127.1	12.8	112.2	V252 E255 D383 F384	V252-R387 HydrophobicContact CG2-CB 3.75Å; V252-R387 VanDerWaalsContact CG2-O 3.27Å; V252-R387 WeakPolarHBondContact CG2-O 3.01Å; V252-R387 PolarHBondContact N-O 2.87Å; E255-R387 VanDerWaalsContact CD-NH2 3.31Å; E255-R387 IonicContact OE1-CZ 3.77Å; E255-R387 IonicContact OE1-NE 3.22Å; E255-R387 PolarHBondContact OE1-NE 3.32Å; E255-R387 IonicContact OE1-NH2 3.56Å; E255-R387 PolarHBondContact OE1-NH2 2.57Å; E255-R387 IonicContact OE2-CZ 3.38Å; E255-R387 IonicContact OE2-NE 2.66Å; E255-R387 PolarHBondContact OE2-NE 3.11Å; E255-R387 IonicContact OE2-NH2 2.84Å; E255-R387 PolarHBondContact OE2-NH2 3.43Å; D383-R387 WeakPolarHBondContact O-CA 3.41Å; D383-R387 PolarHBondContact O-N 3.04Å; F384-R387 WeakPolarHBondContact O-CD 3.2Å; F384-R387 PolarHBondContact O-NH1 3.02Å
388	R	98.2	Very high	93.2	Very high	52 Å²	52	32.6 Å²	32.6	20%	0.196	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	155.9	-176	61.4	-172.4	-170.5	173	5.8	112.4	Y249 S250 D383 Q386	Y249-R388 HydrophobicContact CD1-CB 4.42Å; Y249-R388 HydrophobicContact CD1-CG 3.72Å; Y249-R388 HydrophobicContact CE1-CG 4.35Å; Y249-R388 HydrophobicContact CG-CG 4.46Å; S250-R388 CarbonylContact O-C 3.55Å; S250-R388 VanDerWaalsContact O-CA 3.23Å; S250-R388 WeakPolarHBondContact O-CA 3.49Å; S250-R388 VanDerWaalsContact O-CB 3.31Å; S250-R388 WeakPolarHBondContact O-CB 3.39Å; D383-R388 HydrophobicContact CB-CG 3.79Å; D383-R388 WeakPolarHBondContact CB-O 3.42Å; D383-R388 PolarHBondContact N-O 3.32Å; D383-R388 PolarHBondContact O-N 3.1Å; D383-R388 VanDerWaalsContact O-N 3.13Å; D383-R388 IonicContact OD2-CZ 3.45Å; D383-R388 IonicContact OD2-NE 3.48Å; D383-R388 PolarHBondContact OD2-NE 3.08Å; D383-R388 IonicContact OD2-NH2 2.79Å; D383-R388 PolarHBondContact OD2-NH2 3.47Å; Q386-R388 HydrophobicContact CB-CG 3.95Å; Q386-R388 VanDerWaalsContact CD-NH2 3.26Å; Q386-R388 PolarHBondContact O-N 2.85Å; Q386-R388 VanDerWaalsContact OE1-NH1 3.08Å; Q386-R388 VanDerWaalsContact OE1-NH2 3.11Å
389	V	98.6	Very high	91.6	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125.6	171.9	-178.8	0	0	0	0	109.1	Y249 S250 V252 W258 I260 I281 T380 V381 F382 I391	Y249-V389 CarbonylContact C-O 3.57Å; Y249-V389 VanDerWaalsContact CA-O 3.32Å; Y249-V389 WeakPolarHBondContact CA-O 3.33Å; S250-V389 PolarHBondContact N-O 3.21Å; S250-V389 PolarHBondContact O-N 3.03Å; V252-V389 HydrophobicContact CG1-CG2 4.2Å; W258-V389 HydrophobicContact CE3-CG2 3.87Å; I260-V389 HydrophobicContact CG2-CB 3.94Å; I260-V389 HydrophobicContact CG2-CG2 3.82Å; I281-V389 HydrophobicContact CG1-CG1 4.36Å; T380-V389 HydrophobicContact CG2-CG1 3.7Å; V381-V389 CarbonylContact O-C 3.56Å; V381-V389 VanDerWaalsContact O-CA 3.3Å; V381-V389 WeakPolarHBondContact O-CA 3.42Å; F382-V389 HydrophobicContact CD1-CG2 4.26Å; V389-I391 HydrophobicContact CG1-CG2 4.3Å
390	G	98.6	Very high	89.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	135.5	172.6	0	0	0	0	0	111.2	T248 T380 V381	T248-G390 CarbonylContact O-C 3.55Å; T248-G390 WeakPolarHBondContact O-CA 3.31Å; T380-G390 CarbonylContact C-O 3.6Å; T380-G390 WeakPolarHBondContact CA-O 3.28Å; V381-G390 PolarHBondContact N-O 3.25Å; V381-G390 PolarHBondContact O-N 3.3Å
391	I	98.5	Very high	87.3	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	141.6	174.6	60	169.2	0	0	0	111.8	L247 T248 I329 K332 I334 V378 Y379 V389	L247-I391 WeakPolarHBondContact CA-O 3.48Å; T248-I391 PolarHBondContact N-O 3.28Å; T248-I391 PolarHBondContact O-N 3.21Å; I329-I391 HydrophobicContact CB-CD1 3.84Å; I329-I391 HydrophobicContact CD1-CD1 3.73Å; I329-I391 HydrophobicContact CG1-CD1 4.33Å; I329-I391 HydrophobicContact CG2-CD1 3.96Å; K332-I391 HydrophobicContact CD-CD1 4.49Å; K332-I391 HydrophobicContact CD-CG1 4.36Å; I334-I391 HydrophobicContact CD1-CD1 4.26Å; I334-I391 HydrophobicContact CG1-CD1 4.2Å; V378-I391 HydrophobicContact CB-CB 4.27Å; V378-I391 HydrophobicContact CB-CG2 4.5Å; V378-I391 HydrophobicContact CG1-CB 4.43Å; V378-I391 HydrophobicContact CG2-CG2 4.27Å; Y379-I391 WeakPolarHBondContact O-CA 3.25Å; V389-I391 HydrophobicContact CG1-CG2 4.3Å
392	A	97.9	Very high	86.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	157	171.4	0	0	0	0	0	109.9	Y243 L247 V378 Y379 V394	Y243-A392 HydrophobicContact CD2-CB 3.53Å; Y243-A392 HydrophobicContact CE2-CB 4.37Å; Y243-A392 HydrophobicContact CG-CB 3.79Å; L247-A392 HydrophobicContact CD2-CB 3.79Å; L247-A392 HydrophobicContact CG-CB 4.36Å; V378-A392 CarbonylContact C-O 3.53Å; V378-A392 WeakPolarHBondContact CA-O 3.16Å; V378-A392 WeakPolarHBondContact CB-O 3.35Å; Y379-A392 PolarHBondContact N-O 3.15Å; Y379-A392 PolarHBondContact O-N 3.43Å; Y379-A392 VanDerWaalsContact O-N 3.09Å; A392-V394 PolarHBondContact O-N 2.79Å
393	D	95.8	Very high	86.1	Confident	60 Å²	60	57.4 Å²	57.4	32%	0.321	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134	177.9	-61.2	-58.5	0	0	0	110.1	Y243 T244 K332 A395	Y243-D393 CarbonylContact C-O 3.45Å; Y243-D393 VanDerWaalsContact CA-O 3.23Å; Y243-D393 WeakPolarHBondContact CA-O 3.2Å; Y243-D393 WeakPolarHBondContact CB-O 3.39Å; T244-D393 PolarHBondContact N-O 3.38Å; K332-D393 IonicContact NZ-OD1 3.22Å; K332-D393 IonicContact NZ-OD2 3.97Å; K332-D393 PolarHBondContact NZ-OD2 3.02Å; D393-A395 PolarHBondContact O-N 3.32Å
394	V	93.1	Very high	85.4	Confident	35 Å²	35	60.3 Å²	60.3	21%	0.212	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	133.9	172.8	164.8	0	0	0	0	110.2	Y220 Y242 K377 A392 A396	Y220-V394 HydrophobicContact CD2-CG1 4.46Å; Y220-V394 HydrophobicContact CD2-CG2 4.19Å; Y220-V394 HydrophobicContact CE2-CG1 3.65Å; Y220-V394 HydrophobicContact CE2-CG2 4.12Å; Y242-V394 CarbonylContact O-C 3.49Å; Y242-V394 WeakPolarHBondContact O-CA 3.22Å; K377-V394 PolarHBondContact O-N 3.38Å; K377-V394 VanDerWaalsContact O-N 3.1Å; A392-V394 PolarHBondContact O-N 2.79Å; V394-A396 PolarHBondContact O-N 2.66Å
395	A	88.9	Confident	84.8	Confident	6 Å²	6	63 Å²	63	5%	0.05	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-65.5	130.9	176.2	0	0	0	0	0	111.1	Y242 T244 D393 N397	Y242-A395 PolarHBondContact O-N 3.07Å; T244-A395 HydrophobicContact CG2-CB 3.88Å; D393-A395 PolarHBondContact O-N 3.32Å; A395-N397 VanDerWaalsContact C-N 3.26Å; A395-N397 PolarHBondContact O-N 2.84Å
396	A	78.3	Confident	84.1	Confident	85 Å²	85	64.1 Å²	64.1	70%	0.702	35%	0.348	S	S	*	.	S	Bend	trans	-59.1	-40.1	176.7	0	0	0	0	0	112.1	K227 V394	K227-A396 PolarHBondContact NZ-O 3.22Å; V394-A396 PolarHBondContact O-N 2.66Å
397	N	71.5	Confident	83.2	Confident	135 Å²	135	60.8 Å²	60.8	72%	0.722	34%	0.336	S	S	*	.	S	Bend	trans	-118.7	120	173.9	-64.2	-36.8	0	0	0	108.9	A395 K399	A395-N397 VanDerWaalsContact C-N 3.26Å; A395-N397 PolarHBondContact O-N 2.84Å; N397-K399 PolarHBondContact O-N 3.31Å
398	V	63.7	Low	82.2	Confident	51 Å²	51	59.6 Å²	59.6	31%	0.309	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-72	127.1	173.5	-178.4	0	0	0	0	107.8	R241 Y242	R241-V398 HydrophobicContact CB-CG1 4.26Å; Y242-V398 HydrophobicContact CD1-CB 4.46Å; Y242-V398 HydrophobicContact CD1-CG1 3.71Å; Y242-V398 HydrophobicContact CD1-CG2 3.87Å; Y242-V398 HydrophobicContact CE1-CG1 3.56Å; Y242-V398 HydrophobicContact CE1-CG2 4.14Å
399	K	62.9	Low	81	Confident	119 Å²	119	60.2 Å²	60.2	52%	0.517	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-68.4	142.1	177.3	-58	172.2	-170.7	156.7	0	109.8	D240 R241 N397	D240-K399 PolarHBondContact O-NZ 3.47Å; R241-K399 HydrophobicContact CB-CB 4.03Å; R241-K399 WeakPolarHBondContact CD-O 3.21Å; R241-K399 HydrophobicContact CG-CB 4.04Å; N397-K399 PolarHBondContact O-N 3.31Å
400	S	57.3	Low	79.5	Confident	110 Å²	110	65.1 Å²	65.1	77%	0.769	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-66.4	155	170.4	60.3	0	0	0	0	110.8
401	L	47.8	Very low	77.8	Confident	179 Å²	179	71 Å²	71	94%	0.937	41%	0.413	S	S	*	.			trans	-62.3	0	165.8	-80.8	164.2	0	0	0	111.3

Retrieved 401 of 401 residues in 130.6 ms (Link to these results)

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