A0A077YY83_TRITR Loading...

Metalloendopeptidase

AlphaFold DB , UniProt , Accession A0A077YY83, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 976 aa.

						>A0A077YY83_TRITR|A0A077YY83
MDKECEKFDLSKLFFFRSHYKKDNWRRNRRAATGRPERLWEYGVIPYEILANFSGDHHALFRRAMNHWENYTCVSFVPRTSEDVSYIVFTIAECGCCSFVGKRGEGPQAISIGKNCDKFGIVVHELGHVVGFWHEHTRPDRDLYVDIFYKNIQQGQDYNFEKLKPSEVNSLGQSYDFASIMHYARDTFSRAMYLDTILPKPDSSTHERPEIGQRIRLSPGDIIQTNTLYKCAKCGQTFHEASGIFSSPDYDNKVKTQGEPIHCEWRINTARGHRILLNFTYISMLDSTDCSGDNFLEVRDGPYAKSPLIGRYCGKYVEPLIITSSSHRVWIQYHVAQASLEDAPKKNALKEKKKRRGFAAGFEVICGGNITADNGVIENPNYPYDYTPNSDCVWYITVPEDYQVAIIFSMFQLEQHEDCIYDYVEFREGHADDGDVLARVCGYSLPNSIKSNSNKMRVRFGSDASVEKAGFSFNFIKEFDECKTTNHGCRHKCVNTLGGYRCECDIGYELHSDGKSCEDACGGYLKGENGSLTSPNFPNLYPNKKRCVWEIKAHSQYRIFLNFTHFDLEGVLTNCEYDYIKVTSVDGDGEVAKVHGQFCGRIAPQFLLTSETSHLRIEFVTDSSVQKSGFAAVYFTVLARLDRDECEVDNGGCEQICKNMIGSYVCECESGYILASDGHHCKEGIPFCLKSCGGQRYPFRLGGCKFELNAAFGQLTSPSYPEDYPNDKECIWHFVTTPGHRLQLDFIEFEIEPHQDCAYDRIELYDGSSIDSPSLGKYCGPKAPEKITSSKNELYMFFHSDSSVQRKGFQAHYTSVCGGTLRAERSVGYVYSHAMYGGSNYENRVACEWTLLAEEGMSVEIQFTNFELEEEVHCEYDYVEVYDGESENAMRLGRFCGNKLPSMFISSGSVLRVRFRADDTVTAKGFVYEYFLTDQVEGVTYTEQPGPTTRPPLEPVINERANNRFASRIAARSYVH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	29.8	Very low	69 Å²	69	98.3 Å²	98.3	34%	0.34	49%	0.49	S	S	.	.				0	-36.4	0	-76.5	147.3	173.5	0	0	111.6	K3 E4 C5 Y158 N159 F188	M1-K3 PolarHBondContact O-N 2.91Å; M1-E4 PolarHBondContact O-N 3.24Å; M1-C5 PolarHBondContact O-N 3.21Å; M1-Y158 VanDerWaalsContact CA-OH 3.24Å; M1-Y158 WeakPolarHBondContact CA-OH 3.22Å; M1-Y158 PolarHBondContact N-OH 3.22Å; M1-N159 PolarHBondContact N-OD1 2.84Å; M1-F188 HydrophobicContact CE-CE1 3.92Å; M1-F188 HydrophobicContact CE-CZ 4.2Å; M1-F188 HydrophobicContact SD-CE1 4.09Å; M1-F188 HydrophobicContact SD-CZ 3.74Å
2	D	33.1	Very low	29.9	Very low	29 Å²	29	106.3 Å²	106.3	16%	0.155	52%	0.52	C	S	.	.	H	α-helix	trans	-45.1	-43.3	176.5	-50.8	28.5	0	0	0	114.2	H128 W133 H134	D2-H128 IonicContact OD2-CE1 3.27Å; D2-W133 HydrophobicContact CB-CE3 4.42Å; D2-W133 HydrophobicContact CB-CZ3 4.05Å; D2-H134 IonicContact OD1-CE1 3.11Å; D2-H134 PolarHBondContact OD1-CE1 3.21Å; D2-H134 IonicContact OD1-ND1 2.7Å; D2-H134 IonicContact OD2-CE1 3.81Å; D2-H134 IonicContact OD2-ND1 3.15Å; D2-H134 PolarHBondContact OD2-ND1 2.92Å
3	K	34.7	Very low	29.7	Very low	81 Å²	81	109.1 Å²	109.1	35%	0.352	54%	0.537	S	S	.	.	H	α-helix	trans	-78.3	-12.4	180	-70.1	-170.3	177.4	-174	0	115.1	M1 Y158 E161	M1-K3 PolarHBondContact O-N 2.91Å; K3-Y158 HydrophobicContact CB-CD2 4.26Å; K3-Y158 HydrophobicContact CB-CE2 4.19Å; K3-Y158 HydrophobicContact CD-CD2 4.42Å; K3-E161 IonicContact NZ-OE2 2.76Å; K3-E161 PolarHBondContact NZ-OE2 3.47Å
4	E	32.3	Very low	29.7	Very low	84 Å²	84	115.9 Å²	115.9	39%	0.393	56%	0.563	S	S	.	*	H	α-helix	trans	-94.4	-30	180	-61	-157.2	95	0	0	111.4	M1 E6 K7 Y158	M1-E4 PolarHBondContact O-N 3.24Å; E4-E6 PolarHBondContact O-N 3.15Å; E4-K7 WeakPolarHBondContact O-CB 3.35Å; E4-K7 PolarHBondContact O-N 2.9Å; E4-K7 VanDerWaalsContact O-N 3.08Å; E4-K7 IonicContact OE1-NZ 3.47Å; E4-K7 PolarHBondContact OE1-NZ 3.48Å; E4-Y158 HydrophobicContact CG-CE2 4.18Å; E4-Y158 WeakPolarHBondContact CG-OH 3.41Å; E4-Y158 VanDerWaalsContact OE2-CZ 3.29Å; E4-Y158 PolarHBondContact OE2-OH 3.47Å
5	C	33	Very low	29.4	Very low	21 Å²	21	119.2 Å²	119.2	14%	0.142	57%	0.574	C	S	.	*	H	α-helix	trans	-61.5	-26.2	163.1	-55.7	0	0	0	0	112.5	M1 K7 F99	M1-C5 PolarHBondContact O-N 3.21Å; C5-K7 VanDerWaalsContact C-N 3.26Å; C5-K7 PolarHBondContact O-N 3.43Å; C5-F99 HydrophobicContact CB-CD1 4.42Å; C5-F99 HydrophobicContact CB-CE1 3.75Å; C5-F99 HydrophobicContact CB-CZ 4.06Å; C5-F99 WeakPolarHBondContact O-CE1 3.24Å
6	E	31.7	Very low	29.4	Very low	94 Å²	94	125.3 Å²	125.3	44%	0.439	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.7	0.4	173.3	-71.1	-168.1	152.9	0	0	114.2	E4 R38	E4-E6 PolarHBondContact O-N 3.15Å; E6-R38 IonicContact OE1-CZ 3.3Å; E6-R38 IonicContact OE1-NH1 3.74Å; E6-R38 IonicContact OE1-NH2 3.7Å; E6-R38 PolarHBondContact OE1-NH2 2.54Å
7	K	27.8	Very low	29.1	Very low	146 Å²	146	129.6 Å²	129.6	64%	0.635	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-17.5	-179	-77.5	176.2	174.3	170.3	0	115.9	E4 C5	E4-K7 WeakPolarHBondContact O-CB 3.35Å; E4-K7 PolarHBondContact O-N 2.9Å; E4-K7 VanDerWaalsContact O-N 3.08Å; E4-K7 IonicContact OE1-NZ 3.47Å; E4-K7 PolarHBondContact OE1-NZ 3.48Å; C5-K7 VanDerWaalsContact C-N 3.26Å; C5-K7 PolarHBondContact O-N 3.43Å
8	F	25.4	Very low	29.3	Very low	180 Å²	180	129.1 Å²	129.1	79%	0.789	62%	0.619	S	S	*	*	S	Bend	trans	-95.9	121.3	179.7	-96.9	-90.6	0	0	0	112.8	R103	F8-R103 PolarHBondContact O-NH2 3.17Å
9	D	25.6	Very low	29.2	Very low	116 Å²	116	129.4 Å²	129.4	62%	0.62	62%	0.619	S	S	*	*			trans	53.1	116.6	-178.2	-169.4	28.2	0	0	0	118.2	S11	D9-S11 PolarHBondContact OD1-N 3.17Å; D9-S11 VanDerWaalsContact OD1-N 3.11Å; D9-S11 PolarHBondContact OD1-OG 2.88Å
10	L	26.5	Very low	29.1	Very low	170 Å²	170	133.2 Å²	133.2	89%	0.89	63%	0.629	S	S	*	*			trans	-156.6	69.4	146.2	-119.6	-177.6	0	0	0	112.3	K12	L10-K12 PolarHBondContact O-N 3.01Å
11	S	24.3	Very low	29.1	Very low	91 Å²	91	135.8 Å²	135.8	64%	0.636	64%	0.638	S	S	*	*			trans	-93.7	70.7	-176	60.8	0	0	0	0	115.8	D9	D9-S11 PolarHBondContact OD1-N 3.17Å; D9-S11 VanDerWaalsContact OD1-N 3.11Å; D9-S11 PolarHBondContact OD1-OG 2.88Å
12	K	30.7	Very low	28.9	Very low	194 Å²	194	142 Å²	142	84%	0.843	66%	0.663	S	S	*	*			trans	-165.5	147	154.8	-99.6	129.9	-159.8	165.1	0	114	L10	L10-K12 PolarHBondContact O-N 3.01Å
13	L	27.3	Very low	28.8	Very low	143 Å²	143	147.1 Å²	147.1	75%	0.749	69%	0.69	S	S	*	*			trans	-82.4	159.5	175.3	-56.2	81.4	0	0	0	111.3
14	F	30	Very low	28.6	Very low	205 Å²	205	150.7 Å²	150.7	90%	0.899	71%	0.713	S	S	*	*				-159.9	146	102.6	-110.2	-74.2	0	0	0	113.4
15	F	24.2	Very low	28.5	Very low	165 Å²	165	157.9 Å²	157.9	72%	0.724	74%	0.737	S	S	*	*			trans	-86.4	142.5	177.7	-115.1	-104.3	0	0	0	111
16	F	29.6	Very low	28.3	Very low	216 Å²	216	168 Å²	168	95%	0.947	77%	0.772	S	S	*	*			trans	-150.6	153.4	135.4	-110.3	-73.8	0	0	0	111.3
17	R	25	Very low	28.4	Very low	199 Å²	199	174.3 Å²	174.3	75%	0.751	79%	0.792	S	S	*	*			trans	-131.5	131.4	-166.8	-172.6	-176.8	-172.9	177.4	4.6	109.8
18	S	31.7	Very low	28.7	Very low	120 Å²	120	173.8 Å²	173.8	84%	0.839	80%	0.796	S	S	*	*			trans	-139.2	163	172.6	-165.8	0	0	0	0	111.1
19	H	28.2	Very low	29.5	Very low	135 Å²	135	170.4 Å²	170.4	63%	0.625	78%	0.778	S	S	*	*			trans	-130.4	161.2	-167.3	-109.6	-99.4	0	0	0	111.8
20	Y	27.6	Very low	30.9	Very low	205 Å²	205	165 Å²	165	80%	0.804	75%	0.749	S	S	*	*			trans	68.7	154	174	-66.7	-70.5	0	0	0	115.6
21	K	29.6	Very low	32.3	Very low	188 Å²	188	157 Å²	157	82%	0.817	71%	0.707	S	S	*	*			cis	-136.8	168.6	3.9	-131.9	164.3	-162	177.7	0	110.1
22	K	28.6	Very low	34	Very low	200 Å²	200	152.7 Å²	152.7	87%	0.87	68%	0.677	S	S	*	*			trans	-73.2	134.7	170.7	-70.4	-179	175.9	179.9	0	109.8
23	D	31	Very low	35.8	Very low	137 Å²	137	143.7 Å²	143.7	73%	0.733	64%	0.638	S	S	*	*			trans	-148.4	158.2	157.1	-104	-50.6	0	0	0	111.9	W25	D23-W25 HydrophobicContact CB-CE3 4.45Å; D23-W25 HydrophobicContact CB-CZ3 4.15Å
24	N	29.4	Very low	37.7	Very low	155 Å²	155	138.3 Å²	138.3	83%	0.829	62%	0.617	S	S	*	*			trans	-89.1	116.4	-170	-66.2	-68.8	0	0	0	112.4
25	W	30.7	Very low	40	Very low	236 Å²	236	133.4 Å²	133.4	89%	0.894	59%	0.593	S	S	*	*			trans	-131	138.9	166.4	-99.6	-79.2	0	0	0	114.3	D23	D23-W25 HydrophobicContact CB-CE3 4.45Å; D23-W25 HydrophobicContact CB-CZ3 4.15Å
26	R	30.3	Very low	42.7	Very low	232 Å²	232	130.2 Å²	130.2	88%	0.875	59%	0.589	S	S	*	*			trans	-88.2	130.2	175	-71.4	175	168	178.2	-4.5	110.2
27	R	33.9	Very low	45.3	Very low	228 Å²	228	125.2 Å²	125.2	86%	0.86	57%	0.568	S	S	*	*			trans	50	113.2	152.6	-60.7	179.9	177.1	-179.5	-3	118.8
28	N	33.9	Very low	48.3	Very low	134 Å²	134	117.6 Å²	117.6	72%	0.717	54%	0.539	S	S	*	.			trans	-147.1	123.1	146.9	-87.9	-35.3	0	0	0	107.9	S170	N28-S170 VanDerWaalsContact C-OG 3.29Å
29	R	41.9	Very low	51.1	Low	110 Å²	110	113.8 Å²	113.8	42%	0.415	51%	0.509	S	S	.	.			trans	-155.3	105.5	-172.5	-61.7	169.1	144.3	-153.9	-8.4	114.8	R138 D140 L143 S170	R29-R138 PolarHBondContact O-NH2 2.73Å; R29-D140 HydrophobicContact CB-CB 3.87Å; R29-D140 VanDerWaalsContact CB-CG 3.44Å; R29-D140 VanDerWaalsContact CB-OD2 3.27Å; R29-D140 WeakPolarHBondContact CB-OD2 3.45Å; R29-D140 HydrophobicContact CG-CB 3.87Å; R29-D140 VanDerWaalsContact CZ-CB 3.42Å; R29-D140 VanDerWaalsContact NH1-CB 3.33Å; R29-L143 VanDerWaalsContact NH1-CD1 3.25Å; R29-S170 WeakPolarHBondContact CA-OG 3.47Å; R29-S170 VanDerWaalsContact N-CB 3.31Å; R29-S170 PolarHBondContact N-OG 3.09Å
30	R	54.8	Low	54.1	Low	3 Å²	3	107.9 Å²	107.9	1%	0.011	48%	0.481	C	S	.	.			trans	-172.7	-176.4	159	-44.6	-166.1	155	-88.4	-49.4	112.5	E135 R138 V168 N169 S170 Q173 S174 Y175	R30-E135 IonicContact NH1-OE1 3.67Å; R30-E135 PolarHBondContact NH1-OE1 3.43Å; R30-E135 VanDerWaalsContact NH1-OE1 3.15Å; R30-R138 VanDerWaalsContact NH2-NH2 3.15Å; R30-V168 WeakPolarHBondContact O-CG1 3.43Å; R30-N169 CarbonylContact C-O 3.53Å; R30-N169 VanDerWaalsContact C-O 3.3Å; R30-N169 CarbonylContact O-C 3.59Å; R30-N169 VanDerWaalsContact O-C 3.26Å; R30-S170 WeakPolarHBondContact CB-O 3.38Å; R30-S170 WeakPolarHBondContact CD-O 3.35Å; R30-S170 WeakPolarHBondContact CG-O 3.25Å; R30-S170 PolarHBondContact N-OG 3.05Å; R30-Q173 PolarHBondContact NE-O 2.76Å; R30-Q173 PolarHBondContact NH2-O 2.75Å; R30-S174 VanDerWaalsContact CZ-C 3.5Å; R30-S174 PolarHBondContact NH2-O 3.17Å; R30-Y175 VanDerWaalsContact NH1-CA 3.33Å; R30-Y175 VanDerWaalsContact NH2-N 3.16Å
31	A	54.9	Low	57	Low	2 Å²	2	103.5 Å²	103.5	2%	0.017	47%	0.468	C	S	.	.			trans	-97.1	-5.6	-152.9	0	0	0	0	0	120.9	W133 R138	A31-W133 PolarHBondContact O-N 2.69Å; A31-R138 HydrophobicContact CB-CG 3.75Å
32	A	59.9	Low	59.8	Low	0 Å²	0	100.6 Å²	100.6	0%	0	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	163.2	-178.9	0	0	0	0	0	111.9	G34 F132 V168 N169 L171 L228	A32-G34 PolarHBondContact O-N 2.86Å; A32-F132 HydrophobicContact CB-CD1 4.09Å; A32-F132 HydrophobicContact CB-CE1 3.94Å; A32-V168 CarbonylContact O-C 3.57Å; A32-V168 WeakPolarHBondContact O-CA 3.39Å; A32-N169 PolarHBondContact N-O 2.66Å; A32-N169 PolarHBondContact O-N 2.96Å; A32-L171 HydrophobicContact CB-CD1 4.15Å; A32-L228 HydrophobicContact CB-CD1 4.29Å; A32-L228 HydrophobicContact CB-CD2 4.37Å
33	T	69.2	Low	62.7	Low	5 Å²	5	91.1 Å²	91.1	3%	0.031	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	128.8	175	173.6	0	0	0	0	112.3	R35 R38 L39 G131 L228	T33-R35 PolarHBondContact OG1-N 2.96Å; T33-R35 PolarHBondContact OG1-O 2.78Å; T33-R38 HydrophobicContact CG2-CB 4.37Å; T33-L39 HydrophobicContact CG2-CD2 3.76Å; T33-G131 PolarHBondContact N-O 2.97Å; T33-L228 HydrophobicContact CG2-CD2 4.49Å
34	G	66.5	Low	65.7	Low	29 Å²	29	85.2 Å²	85.2	30%	0.299	38%	0.381	S	S	.	.	S	Bend	trans	-79.2	-5.6	170.3	0	0	0	0	0	114.5	A32 E167	A32-G34 PolarHBondContact O-N 2.86Å; G34-E167 PolarHBondContact N-O 2.72Å
35	R	78.6	Confident	68.9	Low	103 Å²	103	77.9 Å²	77.9	39%	0.389	34%	0.342	S	S	.	.			trans	-106.1	111.2	-172.5	-73.4	-178.2	-171	-143.9	15.8	110.8	T33 E37 R38	T33-R35 PolarHBondContact OG1-N 2.96Å; T33-R35 PolarHBondContact OG1-O 2.78Å; R35-E37 HydrophobicContact CB-CG 4.41Å; R35-E37 WeakPolarHBondContact CB-OE1 3.48Å; R35-E37 WeakPolarHBondContact CB-OE2 3.49Å; R35-E37 WeakPolarHBondContact CD-OE1 3.48Å; R35-E37 WeakPolarHBondContact CG-OE1 3.38Å; R35-E37 IonicContact NH1-OE1 3.86Å; R35-E37 PolarHBondContact O-N 3.2Å; R35-R38 HydrophobicContact CB-CB 4.44Å; R35-R38 HydrophobicContact CB-CG 4.27Å; R35-R38 PolarHBondContact O-N 2.97Å
36	P	81.6	Confident	71.9	Confident	98 Å²	98	67 Å²	67	64%	0.636	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-66	-24	-179.7	27.9	-35.6	0	0	0	113.2	R38 L39	P36-R38 PolarHBondContact O-N 2.93Å; P36-L39 WeakPolarHBondContact O-CB 3.43Å; P36-L39 PolarHBondContact O-N 3Å; P36-L39 VanDerWaalsContact O-N 3.14Å
37	E	84.6	Confident	75	Confident	111 Å²	111	56.4 Å²	56.4	52%	0.519	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-64.8	-24.4	175.7	67.3	-85.4	-161.5	0	0	113.2	R35 L39	R35-E37 HydrophobicContact CB-CG 4.41Å; R35-E37 WeakPolarHBondContact CB-OE1 3.48Å; R35-E37 WeakPolarHBondContact CB-OE2 3.49Å; R35-E37 WeakPolarHBondContact CD-OE1 3.48Å; R35-E37 WeakPolarHBondContact CG-OE1 3.38Å; R35-E37 IonicContact NH1-OE1 3.86Å; R35-E37 PolarHBondContact O-N 3.2Å; E37-L39 PolarHBondContact O-N 3.24Å
38	R	87	Confident	77.8	Confident	39 Å²	39	48.9 Å²	48.9	15%	0.147	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-80.5	3.9	174.7	-73.8	-175.9	169.9	-156.5	5.9	113.8	E6 T33 R35 P36 V100 G101 K102 W133	E6-R38 IonicContact OE1-CZ 3.3Å; E6-R38 IonicContact OE1-NH1 3.74Å; E6-R38 IonicContact OE1-NH2 3.7Å; E6-R38 PolarHBondContact OE1-NH2 2.54Å; T33-R38 HydrophobicContact CG2-CB 4.37Å; R35-R38 HydrophobicContact CB-CB 4.44Å; R35-R38 HydrophobicContact CB-CG 4.27Å; R35-R38 PolarHBondContact O-N 2.97Å; P36-R38 PolarHBondContact O-N 2.93Å; R38-V100 WeakPolarHBondContact CD-O 3.11Å; R38-V100 PolarHBondContact NH1-O 2.95Å; R38-G101 CarbonylContact O-C 3.58Å; R38-G101 VanDerWaalsContact O-CA 3.3Å; R38-G101 WeakPolarHBondContact O-CA 3.35Å; R38-K102 WeakPolarHBondContact CA-O 3.43Å; R38-K102 PolarHBondContact O-N 2.89Å; R38-W133 VanDerWaalsContact NH1-CZ2 3.29Å
39	L	90.4	Very high	80.5	Confident	40 Å²	40	43.8 Å²	43.8	21%	0.209	21%	0.209	C	C	.	.	S	Bend	trans	-89.2	142.2	177.8	-59.3	179.4	0	0	0	112.2	T33 P36 E37 K102 L228 Y229	T33-L39 HydrophobicContact CG2-CD2 3.76Å; P36-L39 WeakPolarHBondContact O-CB 3.43Å; P36-L39 PolarHBondContact O-N 3Å; P36-L39 VanDerWaalsContact O-N 3.14Å; E37-L39 PolarHBondContact O-N 3.24Å; L39-K102 WeakPolarHBondContact O-CE 3.06Å; L39-K102 PolarHBondContact O-NZ 3.31Å; L39-L228 HydrophobicContact CD2-CD1 3.93Å; L39-L228 HydrophobicContact CD2-CD2 3.91Å; L39-L228 HydrophobicContact CD2-CG 3.77Å; L39-Y229 HydrophobicContact CB-CE1 4.34Å; L39-Y229 HydrophobicContact CD2-CE1 4.37Å
40	W	92.1	Very high	82.6	Confident	10 Å²	10	41.3 Å²	41.3	4%	0.038	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-74.5	139.6	171.7	-65.1	96.8	0	0	0	111	Y42 G43 I45 I87 K102 V129 Y229	W40-Y42 PolarHBondContact O-N 2.89Å; W40-G43 PolarHBondContact O-N 3.45Å; W40-G43 VanDerWaalsContact O-N 3.14Å; W40-I45 HydrophobicContact CB-CG1 4Å; W40-I45 HydrophobicContact CD2-CB 4.35Å; W40-I45 HydrophobicContact CD2-CD1 4.48Å; W40-I45 HydrophobicContact CD2-CG1 3.95Å; W40-I45 HydrophobicContact CD2-CG2 4.1Å; W40-I45 HydrophobicContact CE3-CG2 4.31Å; W40-I45 HydrophobicContact CG-CD1 4.03Å; W40-I45 HydrophobicContact CG-CG1 3.66Å; W40-I45 HydrophobicContact CH2-CG2 4.33Å; W40-I45 HydrophobicContact CZ2-CG2 4.11Å; W40-I45 HydrophobicContact CZ3-CG2 4.42Å; W40-I87 HydrophobicContact CH2-CG2 3.99Å; W40-I87 HydrophobicContact CZ2-CG2 3.84Å; W40-K102 HydrophobicContact CD2-CB 3.99Å; W40-K102 HydrophobicContact CD2-CG 4.36Å; W40-K102 HydrophobicContact CE3-CB 4.37Å; W40-K102 HydrophobicContact CE3-CD 4.15Å; W40-K102 HydrophobicContact CE3-CG 4.23Å; W40-K102 HydrophobicContact CG-CB 4.43Å; W40-K102 HydrophobicContact CH2-CB 4.42Å; W40-K102 HydrophobicContact CH2-CG 4.17Å; W40-K102 HydrophobicContact CZ2-CB 4.06Å; W40-K102 HydrophobicContact CZ2-CG 4.31Å; W40-K102 HydrophobicContact CZ3-CD 4.33Å; W40-K102 HydrophobicContact CZ3-CG 4.13Å; W40-V129 HydrophobicContact CZ2-CG1 3.95Å; W40-V129 PolarHBondContact NE1-O 3.03Å; W40-Y229 HydrophobicContact CB-CE1 4.22Å
41	E	88.1	Confident	83.6	Confident	113 Å²	113	46.3 Å²	46.3	53%	0.528	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-70	127.3	-175.2	-157.1	-179.9	124.9	0	0	109.8	G43 V44 K305	E41-G43 PolarHBondContact O-N 3.12Å; E41-V44 PolarHBondContact O-N 2.95Å; E41-K305 IonicContact OE1-NZ 2.87Å; E41-K305 PolarHBondContact OE1-NZ 3.06Å
42	Y	88.1	Confident	84.7	Confident	127 Å²	127	50.6 Å²	50.6	50%	0.498	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	53.8	15	-169.5	-51	-78.4	0	0	0	115.6	W40 V44 Y303 K305	W40-Y42 PolarHBondContact O-N 2.89Å; Y42-V44 PolarHBondContact O-N 3.03Å; Y42-Y303 AromaticContact CD2-CD2 3.88Å; Y42-Y303 HydrophobicContact CD2-CD2 3.88Å; Y42-Y303 AromaticContact CD2-CE2 3.77Å; Y42-Y303 HydrophobicContact CD2-CE2 3.77Å; Y42-Y303 HydrophobicContact CE2-CE2 4.37Å; Y42-Y303 HydrophobicContact CG-CD2 4.03Å; Y42-Y303 HydrophobicContact CG-CE2 4.4Å; Y42-K305 HydrophobicContact CD2-CD 4.44Å; Y42-K305 HydrophobicContact CE2-CD 3.68Å; Y42-K305 VanDerWaalsContact CE2-CE 3.44Å; Y42-K305 HydrophobicContact CE2-CG 4Å; Y42-K305 WeakPolarHBondContact OH-CE 3.23Å
43	G	91	Very high	85.8	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.01	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	70.2	15.1	-171	0	0	0	0	0	114.2	W40 E41 V74 S75 Y229	W40-G43 PolarHBondContact O-N 3.45Å; W40-G43 VanDerWaalsContact O-N 3.14Å; E41-G43 PolarHBondContact O-N 3.12Å; G43-V74 CarbonylContact O-C 3.57Å; G43-V74 WeakPolarHBondContact O-CA 3.35Å; G43-S75 PolarHBondContact O-N 2.76Å; G43-Y229 VanDerWaalsContact CA-CD1 3.45Å
44	V	93.4	Very high	86.5	Confident	14 Å²	14	53.7 Å²	53.7	9%	0.085	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	125.9	175.8	179	0	0	0	0	109.6	E41 Y42 S75 V77 Y303	E41-V44 PolarHBondContact O-N 2.95Å; Y42-V44 PolarHBondContact O-N 3.03Å; V44-S75 WeakPolarHBondContact CA-O 3.04Å; V44-V77 HydrophobicContact CG1-CB 4.34Å; V44-V77 HydrophobicContact CG1-CG1 3.82Å; V44-V77 HydrophobicContact CG1-CG2 3.52Å; V44-Y303 HydrophobicContact CG2-CD1 4.01Å; V44-Y303 HydrophobicContact CG2-CD2 3.74Å; V44-Y303 HydrophobicContact CG2-CE2 4.28Å; V44-Y303 HydrophobicContact CG2-CG 3.57Å
45	I	95.3	Very high	87	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	98.1	-175.4	-50	-171	0	0	0	108.3	W40 V74 S75 F76 V77 I87 V129 V130	W40-I45 HydrophobicContact CB-CG1 4Å; W40-I45 HydrophobicContact CD2-CB 4.35Å; W40-I45 HydrophobicContact CD2-CD1 4.48Å; W40-I45 HydrophobicContact CD2-CG1 3.95Å; W40-I45 HydrophobicContact CD2-CG2 4.1Å; W40-I45 HydrophobicContact CE3-CG2 4.31Å; W40-I45 HydrophobicContact CG-CD1 4.03Å; W40-I45 HydrophobicContact CG-CG1 3.66Å; W40-I45 HydrophobicContact CH2-CG2 4.33Å; W40-I45 HydrophobicContact CZ2-CG2 4.11Å; W40-I45 HydrophobicContact CZ3-CG2 4.42Å; I45-V74 HydrophobicContact CD1-CG1 3.5Å; I45-V74 VanDerWaalsContact CD1-CG1 3.5Å; I45-V74 HydrophobicContact CG1-CG1 3.97Å; I45-S75 PolarHBondContact N-O 3.45Å; I45-F76 HydrophobicContact CB-CD1 3.84Å; I45-F76 HydrophobicContact CB-CE1 3.93Å; I45-F76 HydrophobicContact CD1-CE1 3.8Å; I45-F76 HydrophobicContact CD1-CZ 3.9Å; I45-F76 HydrophobicContact CG1-CE1 4.36Å; I45-F76 HydrophobicContact CG2-CD1 3.96Å; I45-F76 HydrophobicContact CG2-CE1 3.84Å; I45-F76 WeakPolarHBondContact O-CA 3.43Å; I45-V77 PolarHBondContact O-N 2.98Å; I45-I87 HydrophobicContact CG2-CD1 4.18Å; I45-I87 HydrophobicContact CG2-CG1 4.44Å; I45-I87 HydrophobicContact CG2-CG2 4.15Å; I45-V129 HydrophobicContact CD1-CG1 4.15Å; I45-V129 HydrophobicContact CG2-CG1 3.78Å; I45-V130 HydrophobicContact CD1-CG2 4.25Å
46	P	95.2	Very high	87.2	Confident	7 Å²	7	51.3 Å²	51.3	5%	0.045	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	135.1	174.2	-18.9	33	0	0	0	110.5	V77 D83 Y86 I87	P46-V77 CarbonylContact C-O 3.52Å; P46-V77 VanDerWaalsContact CA-O 3.3Å; P46-V77 WeakPolarHBondContact CA-O 3.35Å; P46-V77 HydrophobicContact CB-CG2 4.15Å; P46-V77 HydrophobicContact CG-CG2 4.15Å; P46-D83 HydrophobicContact CB-CB 3.81Å; P46-D83 HydrophobicContact CG-CB 3.91Å; P46-D83 WeakPolarHBondContact CG-OD1 3.49Å; P46-Y86 CarbonylContact O-C 3.58Å; P46-Y86 WeakPolarHBondContact O-CA 3.06Å; P46-Y86 WeakPolarHBondContact O-CB 3.32Å; P46-I87 PolarHBondContact O-N 3.19Å
47	Y	94.8	Very high	87.5	Confident	10 Å²	10	49.3 Å²	49.3	4%	0.039	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148.3	-178.6	79.8	-92	0	0	0	113.1	I49 R62 M65 F76 V77 P78 R79 I87 F89 R271	Y47-I49 HydrophobicContact CD2-CD1 4.31Å; Y47-I49 HydrophobicContact CD2-CG1 4Å; Y47-I49 HydrophobicContact CE2-CD1 3.91Å; Y47-I49 HydrophobicContact CE2-CG1 4.07Å; Y47-R62 WeakPolarHBondContact OH-CD 3.43Å; Y47-R62 PolarHBondContact OH-NH1 3.24Å; Y47-M65 HydrophobicContact CD1-CE 4.31Å; Y47-M65 HydrophobicContact CD1-SD 3.7Å; Y47-M65 HydrophobicContact CD2-CE 4Å; Y47-M65 HydrophobicContact CD2-SD 4.26Å; Y47-M65 HydrophobicContact CE1-CE 4.21Å; Y47-M65 HydrophobicContact CE1-SD 3.97Å; Y47-M65 HydrophobicContact CE2-CE 3.88Å; Y47-M65 HydrophobicContact CG-CE 4.24Å; Y47-M65 HydrophobicContact CG-SD 3.88Å; Y47-F76 HydrophobicContact CD1-CB 4.14Å; Y47-F76 HydrophobicContact CE1-CB 4.45Å; Y47-V77 VanDerWaalsContact CD1-C 3.44Å; Y47-V77 WeakPolarHBondContact CD1-O 3.49Å; Y47-V77 VanDerWaalsContact CE1-C 3.44Å; Y47-V77 PolarHBondContact N-O 2.88Å; Y47-P78 HydrophobicContact CE1-CG 4.41Å; Y47-R79 WeakPolarHBondContact O-CB 3.46Å; Y47-R79 PolarHBondContact O-N 3Å; Y47-I87 CarbonylContact C-O 3.54Å; Y47-I87 WeakPolarHBondContact CA-O 3.49Å; Y47-I87 VanDerWaalsContact CB-CG1 3.45Å; Y47-F89 HydrophobicContact CD2-CE2 4.39Å; Y47-R271 PolarHBondContact OH-NH2 2.79Å
48	E	92.2	Very high	87.6	Confident	71 Å²	71	46.2 Å²	46.2	33%	0.332	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.9	170.4	-168.9	174.3	165.9	0	0	108.7	R79 Y86 I87 V88 F89	E48-R79 HydrophobicContact CB-CB 4.43Å; E48-R79 WeakPolarHBondContact OE2-CD 3.35Å; E48-R79 IonicContact OE2-NE 2.74Å; E48-R79 PolarHBondContact OE2-NE 2.82Å; E48-R79 VanDerWaalsContact OE2-NE 3.17Å; E48-Y86 HydrophobicContact CB-CD2 4.32Å; E48-Y86 HydrophobicContact CB-CE2 4.41Å; E48-Y86 VanDerWaalsContact OE2-CE2 3.28Å; E48-Y86 WeakPolarHBondContact OE2-CE2 3.41Å; E48-I87 PolarHBondContact N-O 3.36Å; E48-V88 HydrophobicContact CB-CG2 4.39Å; E48-V88 WeakPolarHBondContact O-CA 3.38Å; E48-F89 PolarHBondContact O-N 2.76Å
49	I	90.2	Very high	87.7	Confident	26 Å²	26	44.4 Å²	44.4	13%	0.133	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	126.2	173.7	-53.9	167.4	0	0	0	106.7	Y47 F53 H58 F61 F89	Y47-I49 HydrophobicContact CD2-CD1 4.31Å; Y47-I49 HydrophobicContact CD2-CG1 4Å; Y47-I49 HydrophobicContact CE2-CD1 3.91Å; Y47-I49 HydrophobicContact CE2-CG1 4.07Å; I49-F53 HydrophobicContact CG2-CB 4.02Å; I49-F53 HydrophobicContact CG2-CD2 3.8Å; I49-F53 HydrophobicContact CG2-CG 4.19Å; I49-H58 VanDerWaalsContact CG2-NE2 3.3Å; I49-H58 WeakPolarHBondContact CG2-NE2 3.36Å; I49-F61 HydrophobicContact CD1-CB 4.39Å; I49-F61 HydrophobicContact CD1-CD2 4.06Å; I49-F61 HydrophobicContact CG1-CD2 4.28Å; I49-F61 HydrophobicContact CG2-CD2 4.09Å; I49-F61 HydrophobicContact CG2-CE2 4.13Å; I49-F89 HydrophobicContact CB-CB 4.33Å; I49-F89 HydrophobicContact CG1-CB 4.17Å; I49-F89 HydrophobicContact CG1-CD2 3.78Å; I49-F89 HydrophobicContact CG1-CE2 4.49Å; I49-F89 HydrophobicContact CG1-CG 4.18Å; I49-F89 HydrophobicContact CG2-CB 4.06Å
50	L	85.9	Confident	87.8	Confident	59 Å²	59	43.3 Å²	43.3	31%	0.309	23%	0.233	S	C	.	.			trans	-69.7	145.6	-180	-67.2	179.9	0	0	0	111.5	N52 F53 V88 F89 T90	L50-N52 WeakPolarHBondContact CB-OD1 3.39Å; L50-N52 PolarHBondContact O-N 2.75Å; L50-N52 PolarHBondContact O-OD1 2.88Å; L50-F53 PolarHBondContact O-N 2.94Å; L50-F53 VanDerWaalsContact O-N 3.16Å; L50-V88 HydrophobicContact CD1-CG1 4.2Å; L50-V88 HydrophobicContact CD2-CG1 3.96Å; L50-V88 HydrophobicContact CG-CG1 3.78Å; L50-F89 WeakPolarHBondContact CG-O 3.5Å; L50-F89 PolarHBondContact N-O 2.79Å; L50-T90 WeakPolarHBondContact CD1-OG1 2.94Å
51	A	76.5	Confident	87.8	Confident	107 Å²	107	42.9 Å²	42.9	88%	0.884	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	5.5	-175.2	0	0	0	0	0	115.2
52	N	78.9	Confident	88	Confident	93 Å²	93	38 Å²	38	50%	0.497	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-9.9	170.4	65.1	-29.7	0	0	0	113	L50	L50-N52 WeakPolarHBondContact CB-OD1 3.39Å; L50-N52 PolarHBondContact O-N 2.75Å; L50-N52 PolarHBondContact O-OD1 2.88Å
53	F	82.6	Confident	88.3	Confident	16 Å²	16	36.1 Å²	36.1	7%	0.07	20%	0.2	C	C	.	.	S	Bend	trans	-87.4	137.6	173.6	-74.1	-72.9	0	0	0	111.7	I49 L50 H57 F61 F89 I91 I112	I49-F53 HydrophobicContact CG2-CB 4.02Å; I49-F53 HydrophobicContact CG2-CD2 3.8Å; I49-F53 HydrophobicContact CG2-CG 4.19Å; L50-F53 PolarHBondContact O-N 2.94Å; L50-F53 VanDerWaalsContact O-N 3.16Å; F53-H57 HydrophobicContact CB-CB 3.89Å; F53-H57 HydrophobicContact CD1-CB 3.82Å; F53-H57 AromaticContact CD1-CD2 3.75Å; F53-H57 AromaticContact CD1-CG 3.78Å; F53-H57 HydrophobicContact CG-CB 4.24Å; F53-F61 AromaticContact CD1-CE2 3.88Å; F53-F61 HydrophobicContact CD1-CE2 3.88Å; F53-F61 AromaticContact CD1-CZ 3.81Å; F53-F61 HydrophobicContact CD1-CZ 3.81Å; F53-F61 HydrophobicContact CD2-CE2 4.18Å; F53-F61 HydrophobicContact CE1-CE2 4.04Å; F53-F61 AromaticContact CE1-CZ 3.72Å; F53-F61 HydrophobicContact CE1-CZ 3.72Å; F53-F61 HydrophobicContact CE2-CE2 4.33Å; F53-F61 AromaticContact CG-CE2 3.94Å; F53-F61 HydrophobicContact CG-CE2 3.94Å; F53-F61 HydrophobicContact CG-CZ 4.36Å; F53-F61 HydrophobicContact CZ-CE2 4.25Å; F53-F61 HydrophobicContact CZ-CZ 4.19Å; F53-F89 HydrophobicContact CE2-CB 4.28Å; F53-I91 HydrophobicContact CE1-CD1 4.25Å; F53-I91 HydrophobicContact CE1-CG1 3.96Å; F53-I91 HydrophobicContact CE2-CG1 4.22Å; F53-I91 HydrophobicContact CZ-CD1 4.28Å; F53-I91 HydrophobicContact CZ-CG1 3.54Å; F53-I112 HydrophobicContact CE1-CB 4.45Å; F53-I112 HydrophobicContact CZ-CB 4.37Å
54	S	82.7	Confident	88.4	Confident	53 Å²	53	36.1 Å²	36.1	37%	0.371	20%	0.2	S	C	.	.			trans	-72.7	166.4	175.3	74.5	0	0	0	0	112.6	D56 H57 H58	S54-D56 PolarHBondContact O-N 3.11Å; S54-H57 WeakPolarHBondContact O-CB 3.33Å; S54-H57 PolarHBondContact O-N 3.01Å; S54-H57 PolarHBondContact OG-ND1 3.19Å; S54-H58 PolarHBondContact O-CD2 2.87Å; S54-H58 PolarHBondContact O-N 2.88Å
55	G	77.4	Confident	88.5	Confident	7 Å²	7	35.5 Å²	35.5	7%	0.072	20%	0.196	C	C	.	.	H	α-helix	trans	-51.2	-40.6	173.8	0	0	0	0	0	113.9	H57 H58 A59 S409 M410	G55-H57 VanDerWaalsContact C-N 3.31Å; G55-H57 PolarHBondContact O-N 3.28Å; G55-H58 WeakPolarHBondContact O-CA 3.48Å; G55-H58 WeakPolarHBondContact O-CB 3.48Å; G55-H58 PolarHBondContact O-N 3.37Å; G55-H58 VanDerWaalsContact O-N 3.1Å; G55-A59 PolarHBondContact O-N 3.13Å; G55-S409 WeakPolarHBondContact CA-O 3.48Å; G55-S409 PolarHBondContact N-O 3Å; G55-M410 VanDerWaalsContact C-SD 3.53Å; G55-M410 VanDerWaalsContact O-SD 3.38Å
56	D	82.7	Confident	88.5	Confident	75 Å²	75	35.8 Å²	35.8	40%	0.401	20%	0.198	S	C	.	.	H	α-helix	trans	-63	-35.8	177.7	-53.1	-80.1	0	0	0	113	S54 A59 L60 Q412	S54-D56 PolarHBondContact O-N 3.11Å; D56-A59 PolarHBondContact O-N 2.98Å; D56-L60 VanDerWaalsContact O-CB 3.28Å; D56-L60 WeakPolarHBondContact O-CB 3.27Å; D56-L60 PolarHBondContact O-N 2.61Å; D56-Q412 PolarHBondContact OD1-NE2 2.9Å
57	H	88.9	Confident	88.5	Confident	56 Å²	56	36.4 Å²	36.4	26%	0.259	20%	0.2	S	C	.	.	H	α-helix	trans	-68.3	-42	172.6	-66.8	90.7	0	0	0	110.9	F53 S54 G55 A59 L60 F61	F53-H57 HydrophobicContact CB-CB 3.89Å; F53-H57 HydrophobicContact CD1-CB 3.82Å; F53-H57 AromaticContact CD1-CD2 3.75Å; F53-H57 AromaticContact CD1-CG 3.78Å; F53-H57 HydrophobicContact CG-CB 4.24Å; S54-H57 WeakPolarHBondContact O-CB 3.33Å; S54-H57 PolarHBondContact O-N 3.01Å; S54-H57 PolarHBondContact OG-ND1 3.19Å; G55-H57 VanDerWaalsContact C-N 3.31Å; G55-H57 PolarHBondContact O-N 3.28Å; H57-A59 VanDerWaalsContact C-N 3.34Å; H57-A59 PolarHBondContact O-N 2.68Å; H57-L60 WeakPolarHBondContact O-CB 3.1Å; H57-L60 PolarHBondContact O-N 2.98Å; H57-F61 HydrophobicContact CB-CE1 4.46Å; H57-F61 HydrophobicContact CB-CE2 4.17Å; H57-F61 HydrophobicContact CB-CZ 4Å; H57-F61 WeakPolarHBondContact O-CB 3.3Å; H57-F61 WeakPolarHBondContact O-CD1 3.49Å; H57-F61 WeakPolarHBondContact O-CD2 3.39Å; H57-F61 WeakPolarHBondContact O-CG 3.41Å; H57-F61 PolarHBondContact O-N 3.28Å
58	H	87.3	Confident	88.5	Confident	46 Å²	46	35.9 Å²	35.9	21%	0.213	20%	0.198	C	C	.	.	H	α-helix	trans	-57.9	-46.4	172.6	-80.1	-131.7	0	0	0	111.2	I49 S54 G55 F61 R62	I49-H58 VanDerWaalsContact CG2-NE2 3.3Å; I49-H58 WeakPolarHBondContact CG2-NE2 3.36Å; S54-H58 PolarHBondContact O-CD2 2.87Å; S54-H58 PolarHBondContact O-N 2.88Å; G55-H58 WeakPolarHBondContact O-CA 3.48Å; G55-H58 WeakPolarHBondContact O-CB 3.48Å; G55-H58 PolarHBondContact O-N 3.37Å; G55-H58 VanDerWaalsContact O-N 3.1Å; H58-F61 PolarHBondContact O-N 2.82Å; H58-R62 WeakPolarHBondContact O-CB 3.43Å; H58-R62 WeakPolarHBondContact O-CG 3.31Å; H58-R62 PolarHBondContact O-N 2.52Å
59	A	88.4	Confident	88.6	Confident	2 Å²	2	32.6 Å²	32.6	2%	0.017	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-40.5	176.6	0	0	0	0	0	112.4	G55 D56 H57 R63 Y382 P383 M410	G55-A59 PolarHBondContact O-N 3.13Å; D56-A59 PolarHBondContact O-N 2.98Å; H57-A59 VanDerWaalsContact C-N 3.34Å; H57-A59 PolarHBondContact O-N 2.68Å; A59-R63 WeakPolarHBondContact O-CB 3.32Å; A59-R63 VanDerWaalsContact O-CG 3.26Å; A59-R63 WeakPolarHBondContact O-CG 3.31Å; A59-R63 PolarHBondContact O-N 3.32Å; A59-R63 PolarHBondContact O-NE 3.47Å; A59-Y382 HydrophobicContact CB-CE2 4.35Å; A59-P383 HydrophobicContact CB-CB 4.13Å; A59-M410 HydrophobicContact CB-CE 4.27Å; A59-M410 HydrophobicContact CB-SD 4.01Å
60	L	91.8	Very high	88.7	Confident	17 Å²	17	34.3 Å²	34.3	9%	0.089	19%	0.192	C	C	.	.	H	α-helix	trans	-58.9	-50.9	173	177.2	72.5	0	0	0	112.1	D56 H57 R62 R63 A64 D117 F119 V122	D56-L60 VanDerWaalsContact O-CB 3.28Å; D56-L60 WeakPolarHBondContact O-CB 3.27Å; D56-L60 PolarHBondContact O-N 2.61Å; H57-L60 WeakPolarHBondContact O-CB 3.1Å; H57-L60 PolarHBondContact O-N 2.98Å; L60-R62 VanDerWaalsContact C-N 3.33Å; L60-R62 PolarHBondContact O-N 2.84Å; L60-R63 PolarHBondContact O-N 2.81Å; L60-A64 PolarHBondContact O-N 2.94Å; L60-D117 VanDerWaalsContact CD2-C 3.5Å; L60-D117 HydrophobicContact CD2-CB 4.29Å; L60-D117 WeakPolarHBondContact CD2-O 3.35Å; L60-F119 HydrophobicContact CD1-CB 4.07Å; L60-V122 HydrophobicContact CD2-CG2 3.97Å; L60-V122 HydrophobicContact CG-CG2 4.29Å
61	F	93.3	Very high	89	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-39.2	-178	-57.1	-15.7	0	0	0	110.6	I49 F53 H57 H58 A64 M65 F89 I112 V122	I49-F61 HydrophobicContact CD1-CB 4.39Å; I49-F61 HydrophobicContact CD1-CD2 4.06Å; I49-F61 HydrophobicContact CG1-CD2 4.28Å; I49-F61 HydrophobicContact CG2-CD2 4.09Å; I49-F61 HydrophobicContact CG2-CE2 4.13Å; F53-F61 AromaticContact CD1-CE2 3.88Å; F53-F61 HydrophobicContact CD1-CE2 3.88Å; F53-F61 AromaticContact CD1-CZ 3.81Å; F53-F61 HydrophobicContact CD1-CZ 3.81Å; F53-F61 HydrophobicContact CD2-CE2 4.18Å; F53-F61 HydrophobicContact CE1-CE2 4.04Å; F53-F61 AromaticContact CE1-CZ 3.72Å; F53-F61 HydrophobicContact CE1-CZ 3.72Å; F53-F61 HydrophobicContact CE2-CE2 4.33Å; F53-F61 AromaticContact CG-CE2 3.94Å; F53-F61 HydrophobicContact CG-CE2 3.94Å; F53-F61 HydrophobicContact CG-CZ 4.36Å; F53-F61 HydrophobicContact CZ-CE2 4.25Å; F53-F61 HydrophobicContact CZ-CZ 4.19Å; H57-F61 HydrophobicContact CB-CE1 4.46Å; H57-F61 HydrophobicContact CB-CE2 4.17Å; H57-F61 HydrophobicContact CB-CZ 4Å; H57-F61 WeakPolarHBondContact O-CB 3.3Å; H57-F61 WeakPolarHBondContact O-CD1 3.49Å; H57-F61 WeakPolarHBondContact O-CD2 3.39Å; H57-F61 WeakPolarHBondContact O-CG 3.41Å; H57-F61 PolarHBondContact O-N 3.28Å; H58-F61 PolarHBondContact O-N 2.82Å; F61-A64 PolarHBondContact O-N 3.08Å; F61-M65 HydrophobicContact CB-CE 4.01Å; F61-M65 WeakPolarHBondContact O-CB 3.43Å; F61-M65 VanDerWaalsContact O-CE 3.28Å; F61-M65 WeakPolarHBondContact O-CE 3.19Å; F61-M65 WeakPolarHBondContact O-CG 3.38Å; F61-M65 PolarHBondContact O-N 2.99Å; F61-F89 HydrophobicContact CB-CD1 4.38Å; F61-F89 HydrophobicContact CB-CE1 3.91Å; F61-F89 HydrophobicContact CB-CZ 3.99Å; F61-F89 HydrophobicContact CD1-CD1 4.2Å; F61-F89 HydrophobicContact CD1-CE1 4.04Å; F61-F89 HydrophobicContact CD2-CB 4.1Å; F61-F89 AromaticContact CD2-CD1 3.4Å; F61-F89 HydrophobicContact CD2-CD1 3.4Å; F61-F89 VanDerWaalsContact CD2-CD1 3.4Å; F61-F89 HydrophobicContact CD2-CD2 4.39Å; F61-F89 AromaticContact CD2-CE1 3.82Å; F61-F89 HydrophobicContact CD2-CE1 3.82Å; F61-F89 AromaticContact CD2-CG 3.73Å; F61-F89 HydrophobicContact CD2-CG 3.73Å; F61-F89 HydrophobicContact CD2-CZ 4.44Å; F61-F89 HydrophobicContact CE1-CD1 4.38Å; F61-F89 HydrophobicContact CE2-CB 3.96Å; F61-F89 AromaticContact CE2-CD1 3.61Å; F61-F89 HydrophobicContact CE2-CD1 3.61Å; F61-F89 HydrophobicContact CE2-CE1 4.36Å; F61-F89 AromaticContact CE2-CG 3.99Å; F61-F89 HydrophobicContact CE2-CG 3.99Å; F61-F89 AromaticContact CG-CD1 3.74Å; F61-F89 HydrophobicContact CG-CD1 3.74Å; F61-F89 AromaticContact CG-CE1 3.64Å; F61-F89 HydrophobicContact CG-CE1 3.64Å; F61-F89 HydrophobicContact CG-CG 4.4Å; F61-F89 HydrophobicContact CG-CZ 4.22Å; F61-F89 HydrophobicContact CZ-CD1 4.11Å; F61-I112 HydrophobicContact CE1-CB 4.17Å; F61-I112 HydrophobicContact CE1-CG1 3.91Å; F61-I112 HydrophobicContact CE1-CG2 3.86Å; F61-I112 HydrophobicContact CZ-CB 3.93Å; F61-I112 HydrophobicContact CZ-CG1 3.92Å; F61-I112 HydrophobicContact CZ-CG2 3.94Å; F61-V122 HydrophobicContact CD1-CG1 3.92Å; F61-V122 HydrophobicContact CD1-CG2 4.07Å; F61-V122 HydrophobicContact CE1-CG2 4.11Å
62	R	91.9	Very high	89.8	Confident	11 Å²	11	32.2 Å²	32.2	4%	0.042	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-42.3	172.8	-68.6	-80.9	-86.1	165.8	-3	112	Y47 H58 L60 M65 N66 E378 P383	Y47-R62 WeakPolarHBondContact OH-CD 3.43Å; Y47-R62 PolarHBondContact OH-NH1 3.24Å; H58-R62 WeakPolarHBondContact O-CB 3.43Å; H58-R62 WeakPolarHBondContact O-CG 3.31Å; H58-R62 PolarHBondContact O-N 2.52Å; L60-R62 VanDerWaalsContact C-N 3.33Å; L60-R62 PolarHBondContact O-N 2.84Å; R62-M65 PolarHBondContact O-N 2.79Å; R62-N66 WeakPolarHBondContact O-CB 3.23Å; R62-N66 PolarHBondContact O-N 3.38Å; R62-N66 PolarHBondContact O-OD1 2.67Å; R62-E378 IonicContact CZ-OE1 2.65Å; R62-E378 IonicContact NE-OE1 3.92Å; R62-E378 IonicContact NH2-OE1 2.71Å; R62-E378 PolarHBondContact NH2-OE1 3.19Å; R62-E378 IonicContact NH2-OE2 3.14Å; R62-E378 PolarHBondContact NH2-OE2 2.63Å; R62-E378 VanDerWaalsContact NH2-OE2 3.07Å; R62-P383 HydrophobicContact CB-CB 3.64Å; R62-P383 HydrophobicContact CB-CG 3.63Å
63	R	93.3	Very high	90.5	Very high	88 Å²	88	29 Å²	29	33%	0.332	14%	0.143	S	C	.	.	H	α-helix	trans	-61.7	-44.3	173.9	-74.1	176.7	-70.3	-176.9	-1	111.8	A59 L60 N66 H67 F119 P383 Y384	A59-R63 WeakPolarHBondContact O-CB 3.32Å; A59-R63 VanDerWaalsContact O-CG 3.26Å; A59-R63 WeakPolarHBondContact O-CG 3.31Å; A59-R63 PolarHBondContact O-N 3.32Å; A59-R63 PolarHBondContact O-NE 3.47Å; L60-R63 PolarHBondContact O-N 2.81Å; R63-N66 PolarHBondContact O-N 2.84Å; R63-H67 WeakPolarHBondContact O-CB 3.37Å; R63-H67 PolarHBondContact O-N 3.3Å; R63-F119 HydrophobicContact CB-CD2 4.36Å; R63-F119 HydrophobicContact CB-CE2 4.2Å; R63-P383 HydrophobicContact CB-CG 4.48Å; R63-P383 HydrophobicContact CG-CB 4.07Å; R63-P383 HydrophobicContact CG-CG 3.6Å; R63-Y384 HydrophobicContact CG-CD1 4.14Å; R63-Y384 HydrophobicContact CG-CE1 3.7Å
64	A	94.9	Very high	91	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-37.3	177.8	0	0	0	0	0	112.8	L60 F61 W68 F119 V122 V123 L126	L60-A64 PolarHBondContact O-N 2.94Å; F61-A64 PolarHBondContact O-N 3.08Å; A64-W68 PolarHBondContact O-N 2.93Å; A64-F119 HydrophobicContact CB-CD2 4.34Å; A64-F119 HydrophobicContact CB-CE2 4.4Å; A64-V122 HydrophobicContact CB-CB 3.84Å; A64-V122 HydrophobicContact CB-CG1 3.53Å; A64-V123 HydrophobicContact CB-CG2 3.79Å; A64-L126 HydrophobicContact CB-CD1 3.9Å
65	M	95.2	Very high	91.5	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-68.1	-49.5	173.2	-74.2	-177.2	-83.6	0	0	111.9	Y47 F61 R62 H67 W68 E69 F76 F89 L126	Y47-M65 HydrophobicContact CD1-CE 4.31Å; Y47-M65 HydrophobicContact CD1-SD 3.7Å; Y47-M65 HydrophobicContact CD2-CE 4Å; Y47-M65 HydrophobicContact CD2-SD 4.26Å; Y47-M65 HydrophobicContact CE1-CE 4.21Å; Y47-M65 HydrophobicContact CE1-SD 3.97Å; Y47-M65 HydrophobicContact CE2-CE 3.88Å; Y47-M65 HydrophobicContact CG-CE 4.24Å; Y47-M65 HydrophobicContact CG-SD 3.88Å; F61-M65 HydrophobicContact CB-CE 4.01Å; F61-M65 WeakPolarHBondContact O-CB 3.43Å; F61-M65 VanDerWaalsContact O-CE 3.28Å; F61-M65 WeakPolarHBondContact O-CE 3.19Å; F61-M65 WeakPolarHBondContact O-CG 3.38Å; F61-M65 PolarHBondContact O-N 2.99Å; R62-M65 PolarHBondContact O-N 2.79Å; M65-H67 PolarHBondContact O-N 3.4Å; M65-W68 PolarHBondContact O-N 2.95Å; M65-E69 WeakPolarHBondContact O-CG 3.29Å; M65-E69 PolarHBondContact O-N 3.11Å; M65-F76 HydrophobicContact CB-CB 3.89Å; M65-F76 HydrophobicContact CB-CD2 3.82Å; M65-F76 HydrophobicContact CB-CG 3.81Å; M65-F76 HydrophobicContact CG-CB 3.89Å; M65-F76 HydrophobicContact CG-CD1 3.78Å; M65-F76 HydrophobicContact CG-CD2 3.92Å; M65-F76 HydrophobicContact CG-CE1 4.3Å; M65-F76 HydrophobicContact CG-CE2 4.43Å; M65-F76 HydrophobicContact CG-CG 3.57Å; M65-F76 HydrophobicContact SD-CB 3.55Å; M65-F76 VanDerWaalsContact SD-CB 3.55Å; M65-F76 HydrophobicContact SD-CD1 3.7Å; M65-F76 HydrophobicContact SD-CG 3.71Å; M65-F89 HydrophobicContact CE-CE2 3.96Å; M65-F89 HydrophobicContact CE-CZ 4.1Å; M65-F89 HydrophobicContact SD-CE2 4.2Å; M65-F89 HydrophobicContact SD-CZ 4.35Å; M65-L126 HydrophobicContact CG-CD1 3.71Å; M65-L126 HydrophobicContact CG-CD2 4.34Å
66	N	94	Very high	92.4	Very high	6 Å²	6	25.6 Å²	25.6	3%	0.032	12%	0.119	C	C	.	.	H	α-helix	trans	-55.4	-35.8	175.6	-72.2	-2.7	0	0	0	112	R62 R63 W68 E69 N70 H239 P383	R62-N66 WeakPolarHBondContact O-CB 3.23Å; R62-N66 PolarHBondContact O-N 3.38Å; R62-N66 PolarHBondContact O-OD1 2.67Å; R63-N66 PolarHBondContact O-N 2.84Å; N66-W68 PolarHBondContact O-N 2.8Å; N66-E69 PolarHBondContact O-N 3.27Å; N66-N70 WeakPolarHBondContact O-CB 3.42Å; N66-N70 PolarHBondContact O-N 2.95Å; N66-N70 PolarHBondContact O-ND2 3.04Å; N66-H239 VanDerWaalsContact CG-CE1 3.44Å; N66-H239 PolarHBondContact OD1-CE1 3.36Å; N66-P383 WeakPolarHBondContact ND2-CD 3.19Å
67	H	95	Very high	92.8	Very high	19 Å²	19	22.6 Å²	22.6	9%	0.088	10%	0.104	C	C	.	.	H	α-helix	trans	-63.6	-36.6	176	-179.3	81	0	0	0	113.3	R63 M65 Y71 F119 L217	R63-H67 WeakPolarHBondContact O-CB 3.37Å; R63-H67 PolarHBondContact O-N 3.3Å; M65-H67 PolarHBondContact O-N 3.4Å; H67-Y71 AromaticContact CE1-CE2 3.82Å; H67-Y71 AromaticContact ND1-CE2 3.83Å; H67-Y71 VanDerWaalsContact O-CD2 3.26Å; H67-Y71 WeakPolarHBondContact O-CD2 3.41Å; H67-F119 HydrophobicContact CB-CE2 4.17Å; H67-F119 HydrophobicContact CB-CZ 3.76Å; H67-F119 AromaticContact CG-CZ 3.64Å; H67-F119 AromaticContact ND1-CZ 3.79Å; H67-L217 PolarHBondContact NE2-N 3.06Å
68	W	95.3	Very high	92.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-71.6	-39.5	169.4	-81.4	100.9	0	0	0	112.4	A64 M65 N66 N70 T72 F76 V123 V130 F132 I180 L217 T225	A64-W68 PolarHBondContact O-N 2.93Å; M65-W68 PolarHBondContact O-N 2.95Å; N66-W68 PolarHBondContact O-N 2.8Å; W68-N70 VanDerWaalsContact C-N 3.34Å; W68-N70 PolarHBondContact O-N 2.92Å; W68-T72 HydrophobicContact CE3-CG2 4.29Å; W68-T72 PolarHBondContact O-N 3.03Å; W68-T72 VanDerWaalsContact O-N 3.13Å; W68-T72 PolarHBondContact O-OG1 3.24Å; W68-F76 HydrophobicContact CB-CE2 3.71Å; W68-F76 HydrophobicContact CG-CE2 4.27Å; W68-V123 PolarHBondContact NE1-O 3.16Å; W68-V130 HydrophobicContact CD2-CG2 4.18Å; W68-V130 HydrophobicContact CE3-CG2 4.07Å; W68-V130 HydrophobicContact CZ3-CB 4.48Å; W68-V130 HydrophobicContact CZ3-CG1 4.12Å; W68-V130 HydrophobicContact CZ3-CG2 4.28Å; W68-F132 HydrophobicContact CH2-CD2 4.24Å; W68-F132 HydrophobicContact CH2-CE2 4.13Å; W68-F132 HydrophobicContact CZ3-CE2 4.27Å; W68-I180 HydrophobicContact CZ2-CG2 4.42Å; W68-L217 HydrophobicContact CD2-CD1 3.84Å; W68-L217 HydrophobicContact CD2-CD2 4.09Å; W68-L217 HydrophobicContact CE3-CD1 3.59Å; W68-L217 HydrophobicContact CE3-CD2 4.23Å; W68-L217 HydrophobicContact CG-CD1 4.4Å; W68-L217 HydrophobicContact CH2-CD1 4.37Å; W68-L217 HydrophobicContact CH2-CD2 3.63Å; W68-L217 HydrophobicContact CZ2-CD2 3.45Å; W68-L217 VanDerWaalsContact CZ2-CD2 3.45Å; W68-L217 HydrophobicContact CZ3-CD1 3.88Å; W68-L217 HydrophobicContact CZ3-CD2 4.01Å; W68-T225 HydrophobicContact CZ3-CG2 4.34Å
69	E	94.4	Very high	93	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-64.7	-35	177.3	-59.5	-158.6	123.8	0	0	112.6	M65 N66 Y71 T72 S75 F76 T237 H239 R266 N268 R328	M65-E69 WeakPolarHBondContact O-CG 3.29Å; M65-E69 PolarHBondContact O-N 3.11Å; N66-E69 PolarHBondContact O-N 3.27Å; E69-Y71 PolarHBondContact O-N 3.49Å; E69-T72 VanDerWaalsContact O-O 3.11Å; E69-S75 WeakPolarHBondContact OE1-CA 3.48Å; E69-S75 WeakPolarHBondContact OE1-CB 3.39Å; E69-S75 PolarHBondContact OE1-OG 3.03Å; E69-F76 HydrophobicContact CG-CD2 4.17Å; E69-F76 PolarHBondContact OE1-N 2.72Å; E69-T237 HydrophobicContact CB-CG2 4.36Å; E69-T237 WeakPolarHBondContact O-CB 3.46Å; E69-T237 PolarHBondContact O-OG1 3.2Å; E69-H239 IonicContact OE2-CE1 2.72Å; E69-H239 PolarHBondContact OE2-CE1 2.94Å; E69-H239 IonicContact OE2-NE2 3.99Å; E69-R266 PolarHBondContact O-NH2 3.4Å; E69-R266 VanDerWaalsContact O-NH2 3.1Å; E69-N268 PolarHBondContact OE2-ND2 3.29Å; E69-R328 IonicContact OE1-CZ 2.73Å; E69-R328 IonicContact OE1-NH1 3.14Å; E69-R328 PolarHBondContact OE1-NH1 2.79Å; E69-R328 IonicContact OE1-NH2 3.52Å; E69-R328 IonicContact OE2-CZ 3.26Å; E69-R328 IonicContact OE2-NH1 3.57Å; E69-R328 PolarHBondContact OE2-NH1 3.44Å; E69-R328 IonicContact OE2-NH2 3.24Å; E69-R328 PolarHBondContact OE2-NH2 3.47Å
70	N	92.4	Very high	93	Very high	62 Å²	62	26.7 Å²	26.7	33%	0.332	13%	0.127	S	C	.	.	H	α-helix	trans	-60.6	-39.6	-179.4	-91.1	-35.5	0	0	0	113.3	N66 W68 H239	N66-N70 WeakPolarHBondContact O-CB 3.42Å; N66-N70 PolarHBondContact O-N 2.95Å; N66-N70 PolarHBondContact O-ND2 3.04Å; W68-N70 VanDerWaalsContact C-N 3.34Å; W68-N70 PolarHBondContact O-N 2.92Å; N70-H239 PolarHBondContact OD1-CD2 2.68Å
71	Y	92.4	Very high	92.6	Very high	118 Å²	118	31.8 Å²	31.8	46%	0.463	16%	0.164	S	C	.	.	H	α-helix	trans	-105.9	-12.1	-173.7	-58.2	-66.2	0	0	0	114.3	H67 E69 L217 I222 N226	H67-Y71 AromaticContact CE1-CE2 3.82Å; H67-Y71 AromaticContact ND1-CE2 3.83Å; H67-Y71 VanDerWaalsContact O-CD2 3.26Å; H67-Y71 WeakPolarHBondContact O-CD2 3.41Å; E69-Y71 PolarHBondContact O-N 3.49Å; Y71-L217 HydrophobicContact CD2-CD1 4.36Å; Y71-I222 HydrophobicContact CD1-CD1 4.06Å; Y71-I222 HydrophobicContact CD2-CD1 4.32Å; Y71-I222 HydrophobicContact CG-CD1 3.77Å; Y71-I222 HydrophobicContact CG-CG1 4.31Å; Y71-I222 WeakPolarHBondContact O-CG2 3.33Å; Y71-N226 PolarHBondContact O-ND2 3.23Å; Y71-N226 VanDerWaalsContact O-ND2 3.13Å
72	T	93.6	Very high	92.2	Very high	4 Å²	4	40 Å²	40	3%	0.025	20%	0.202	C	C	.	.	S	Bend	trans	-138.6	154.1	-172.6	78.6	0	0	0	0	112.9	W68 E69 V74 T225 N226 R266	W68-T72 HydrophobicContact CE3-CG2 4.29Å; W68-T72 PolarHBondContact O-N 3.03Å; W68-T72 VanDerWaalsContact O-N 3.13Å; W68-T72 PolarHBondContact O-OG1 3.24Å; E69-T72 VanDerWaalsContact O-O 3.11Å; T72-V74 PolarHBondContact O-N 2.82Å; T72-V74 PolarHBondContact OG1-N 2.94Å; T72-T225 HydrophobicContact CG2-CG2 3.75Å; T72-N226 WeakPolarHBondContact CA-OD1 3.39Å; T72-N226 WeakPolarHBondContact CB-OD1 3.13Å; T72-R266 PolarHBondContact O-NH2 3.18Å
73	C	92.2	Very high	92	Very high	27 Å²	27	41.2 Å²	41.2	18%	0.182	21%	0.21	C	C	.	.	S	Bend	trans	-74.4	3.7	176.9	76.4	0	0	0	0	115	N226 C231 R266	C73-N226 PolarHBondContact N-OD1 2.96Å; C73-C231 HydrophobicContact CB-CB 3.52Å; C73-C231 WeakPolarHBondContact CB-SG 3.27Å; C73-C231 PolarHBondContact N-SG 3.34Å; C73-C231 VanDerWaalsContact N-SG 3.38Å; C73-C231 WeakPolarHBondContact SG-CA 3.38Å; C73-C231 WeakPolarHBondContact SG-CB 3.37Å; C73-C231 CovalentContact SG-SG 2.01Å; C73-C231 PolarHBondContact SG-SG 3.47Å; C73-R266 VanDerWaalsContact C-NH1 3.33Å; C73-R266 PolarHBondContact O-NH1 3.32Å
74	V	94	Very high	91.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.			trans	-60.2	142.7	166.7	177.5	0	0	0	0	108.8	G43 I45 T72 F76 V130 T225 Y229 R266	G43-V74 CarbonylContact O-C 3.57Å; G43-V74 WeakPolarHBondContact O-CA 3.35Å; I45-V74 HydrophobicContact CD1-CG1 3.5Å; I45-V74 VanDerWaalsContact CD1-CG1 3.5Å; I45-V74 HydrophobicContact CG1-CG1 3.97Å; T72-V74 PolarHBondContact O-N 2.82Å; T72-V74 PolarHBondContact OG1-N 2.94Å; V74-F76 HydrophobicContact CG1-CD2 4.31Å; V74-F76 HydrophobicContact CG1-CE2 3.75Å; V74-F76 HydrophobicContact CG1-CZ 4.07Å; V74-V130 HydrophobicContact CG1-CG2 4.23Å; V74-V130 HydrophobicContact CG2-CG1 4.27Å; V74-V130 HydrophobicContact CG2-CG2 4.38Å; V74-T225 HydrophobicContact CG2-CG2 3.73Å; V74-Y229 HydrophobicContact CG2-CD2 3.83Å; V74-Y229 HydrophobicContact CG2-CE2 4.04Å; V74-Y229 HydrophobicContact CG2-CG 4.34Å; V74-R266 PolarHBondContact O-NH1 3.18Å
75	S	93.8	Very high	91.6	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.014	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	133.3	173.6	-165.7	0	0	0	0	111.7	G43 V44 I45 E69 R328	G43-S75 PolarHBondContact O-N 2.76Å; V44-S75 WeakPolarHBondContact CA-O 3.04Å; I45-S75 PolarHBondContact N-O 3.45Å; E69-S75 WeakPolarHBondContact OE1-CA 3.48Å; E69-S75 WeakPolarHBondContact OE1-CB 3.39Å; E69-S75 PolarHBondContact OE1-OG 3.03Å; S75-R328 PolarHBondContact OG-NH1 2.84Å; S75-R328 VanDerWaalsContact OG-NH1 3.08Å
76	F	94.9	Very high	91.5	Very high	1 Å²	1	43.9 Å²	43.9	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	118.8	177.6	-69	-87.7	0	0	0	109.6	I45 Y47 M65 W68 E69 V74 I87 L126 V130 R328	I45-F76 HydrophobicContact CB-CD1 3.84Å; I45-F76 HydrophobicContact CB-CE1 3.93Å; I45-F76 HydrophobicContact CD1-CE1 3.8Å; I45-F76 HydrophobicContact CD1-CZ 3.9Å; I45-F76 HydrophobicContact CG1-CE1 4.36Å; I45-F76 HydrophobicContact CG2-CD1 3.96Å; I45-F76 HydrophobicContact CG2-CE1 3.84Å; I45-F76 WeakPolarHBondContact O-CA 3.43Å; Y47-F76 HydrophobicContact CD1-CB 4.14Å; Y47-F76 HydrophobicContact CE1-CB 4.45Å; M65-F76 HydrophobicContact CB-CB 3.89Å; M65-F76 HydrophobicContact CB-CD2 3.82Å; M65-F76 HydrophobicContact CB-CG 3.81Å; M65-F76 HydrophobicContact CG-CB 3.89Å; M65-F76 HydrophobicContact CG-CD1 3.78Å; M65-F76 HydrophobicContact CG-CD2 3.92Å; M65-F76 HydrophobicContact CG-CE1 4.3Å; M65-F76 HydrophobicContact CG-CE2 4.43Å; M65-F76 HydrophobicContact CG-CG 3.57Å; M65-F76 HydrophobicContact SD-CB 3.55Å; M65-F76 VanDerWaalsContact SD-CB 3.55Å; M65-F76 HydrophobicContact SD-CD1 3.7Å; M65-F76 HydrophobicContact SD-CG 3.71Å; W68-F76 HydrophobicContact CB-CE2 3.71Å; W68-F76 HydrophobicContact CG-CE2 4.27Å; E69-F76 HydrophobicContact CG-CD2 4.17Å; E69-F76 PolarHBondContact OE1-N 2.72Å; V74-F76 HydrophobicContact CG1-CD2 4.31Å; V74-F76 HydrophobicContact CG1-CE2 3.75Å; V74-F76 HydrophobicContact CG1-CZ 4.07Å; F76-I87 HydrophobicContact CD1-CD1 4.44Å; F76-I87 HydrophobicContact CE1-CD1 4.33Å; F76-L126 HydrophobicContact CD1-CD2 4.46Å; F76-L126 HydrophobicContact CE1-CD2 3.67Å; F76-L126 HydrophobicContact CZ-CD2 3.99Å; F76-V130 HydrophobicContact CZ-CG2 4.23Å; F76-R328 PolarHBondContact O-NH1 2.86Å
77	V	92.5	Very high	91.6	Very high	13 Å²	13	43.6 Å²	43.6	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.2	-171.5	-56.3	0	0	0	0	110.8	V44 I45 P46 Y47 R79 P302	V44-V77 HydrophobicContact CG1-CB 4.34Å; V44-V77 HydrophobicContact CG1-CG1 3.82Å; V44-V77 HydrophobicContact CG1-CG2 3.52Å; I45-V77 PolarHBondContact O-N 2.98Å; P46-V77 CarbonylContact C-O 3.52Å; P46-V77 VanDerWaalsContact CA-O 3.3Å; P46-V77 WeakPolarHBondContact CA-O 3.35Å; P46-V77 HydrophobicContact CB-CG2 4.15Å; P46-V77 HydrophobicContact CG-CG2 4.15Å; Y47-V77 VanDerWaalsContact CD1-C 3.44Å; Y47-V77 WeakPolarHBondContact CD1-O 3.49Å; Y47-V77 VanDerWaalsContact CE1-C 3.44Å; Y47-V77 PolarHBondContact N-O 2.88Å; V77-R79 PolarHBondContact O-N 2.88Å; V77-P302 HydrophobicContact CG1-CB 3.85Å; V77-P302 HydrophobicContact CG1-CG 3.48Å; V77-P302 VanDerWaalsContact CG1-CG 3.48Å
78	P	90.5	Very high	91.5	Very high	34 Å²	34	43.5 Å²	43.5	22%	0.221	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	133.2	172.9	-18.8	32.2	0	0	0	109.6	Y47 T80 R271	Y47-P78 HydrophobicContact CE1-CG 4.41Å; P78-T80 PolarHBondContact O-N 3.02Å; P78-R271 VanDerWaalsContact CG-NH2 3.34Å
79	R	90.2	Very high	91.4	Very high	85 Å²	85	43.5 Å²	43.5	32%	0.321	23%	0.233	S	C	.	.			trans	-52.5	134	175.2	170.2	176.3	174	55.3	2.5	112.3	Y47 E48 V77 D83 Y86	Y47-R79 WeakPolarHBondContact O-CB 3.46Å; Y47-R79 PolarHBondContact O-N 3Å; E48-R79 HydrophobicContact CB-CB 4.43Å; E48-R79 WeakPolarHBondContact OE2-CD 3.35Å; E48-R79 IonicContact OE2-NE 2.74Å; E48-R79 PolarHBondContact OE2-NE 2.82Å; E48-R79 VanDerWaalsContact OE2-NE 3.17Å; V77-R79 PolarHBondContact O-N 2.88Å; R79-D83 PolarHBondContact NH1-O 3.23Å; R79-Y86 PolarHBondContact NH2-OH 3.18Å
80	T	86.8	Confident	91.2	Very high	70 Å²	70	44.8 Å²	44.8	43%	0.429	24%	0.241	S	C	.	.			trans	-105.9	174.2	166.2	71.2	0	0	0	0	111	P78 E82 D83	P78-T80 PolarHBondContact O-N 3.02Å; T80-E82 PolarHBondContact O-N 2.94Å; T80-E82 PolarHBondContact OG1-N 2.83Å; T80-D83 WeakPolarHBondContact CA-OD2 2.84Å; T80-D83 WeakPolarHBondContact CB-OD2 3.41Å; T80-D83 PolarHBondContact N-OD2 3.38Å; T80-D83 PolarHBondContact O-N 2.77Å; T80-D83 PolarHBondContact OG1-N 3.29Å; T80-D83 PolarHBondContact OG1-OD2 3.32Å
81	S	83.4	Confident	90.8	Very high	125 Å²	125	45.8 Å²	45.8	87%	0.874	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-15.2	171.1	46.5	0	0	0	0	114
82	E	86	Confident	90.1	Very high	171 Å²	171	42.2 Å²	42.2	80%	0.799	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-20	178.6	-59.6	-174.8	-179.3	0	0	112.6	T80 V84	T80-E82 PolarHBondContact O-N 2.94Å; T80-E82 PolarHBondContact OG1-N 2.83Å; E82-V84 PolarHBondContact O-N 2.89Å
83	D	87.3	Confident	89.2	Confident	38 Å²	38	51.6 Å²	51.6	20%	0.203	28%	0.284	C	S	.	.			trans	-74.5	95.2	-177.3	-66.8	-63.1	0	0	0	111.6	P46 R79 T80 S85	P46-D83 HydrophobicContact CB-CB 3.81Å; P46-D83 HydrophobicContact CG-CB 3.91Å; P46-D83 WeakPolarHBondContact CG-OD1 3.49Å; R79-D83 PolarHBondContact NH1-O 3.23Å; T80-D83 WeakPolarHBondContact CA-OD2 2.84Å; T80-D83 WeakPolarHBondContact CB-OD2 3.41Å; T80-D83 PolarHBondContact N-OD2 3.38Å; T80-D83 PolarHBondContact O-N 2.77Å; T80-D83 PolarHBondContact OG1-N 3.29Å; T80-D83 PolarHBondContact OG1-OD2 3.32Å; D83-S85 VanDerWaalsContact C-N 3.34Å; D83-S85 PolarHBondContact O-N 3.42Å
84	V	87.8	Confident	88.3	Confident	88 Å²	88	52.2 Å²	52.2	53%	0.533	29%	0.288	S	S	.	.	S	Bend	trans	-69	-32.9	178.6	-175.3	0	0	0	0	112.1	E82 E105 G106	E82-V84 PolarHBondContact O-N 2.89Å; V84-E105 HydrophobicContact CG1-CB 3.75Å; V84-E105 HydrophobicContact CG1-CG 3.78Å; V84-G106 VanDerWaalsContact O-CA 3.29Å; V84-G106 WeakPolarHBondContact O-CA 3.4Å; V84-G106 PolarHBondContact O-N 3.09Å
85	S	92.1	Very high	87.6	Confident	28 Å²	28	53.5 Å²	53.5	20%	0.196	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	125.9	-178.7	-44	0	0	0	0	110	D83 G104	D83-S85 VanDerWaalsContact C-N 3.34Å; D83-S85 PolarHBondContact O-N 3.42Å; S85-G104 WeakPolarHBondContact CB-O 3.38Å; S85-G104 PolarHBondContact OG-O 2.89Å; S85-G104 VanDerWaalsContact OG-O 3.13Å
86	Y	93.9	Very high	87.1	Confident	30 Å²	30	55.6 Å²	55.6	12%	0.118	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	157.1	-172.3	63.1	-76.9	0	0	0	112.6	P46 E48 R79 V88 G106 P107 Q108	P46-Y86 CarbonylContact O-C 3.58Å; P46-Y86 WeakPolarHBondContact O-CA 3.06Å; P46-Y86 WeakPolarHBondContact O-CB 3.32Å; E48-Y86 HydrophobicContact CB-CD2 4.32Å; E48-Y86 HydrophobicContact CB-CE2 4.41Å; E48-Y86 VanDerWaalsContact OE2-CE2 3.28Å; E48-Y86 WeakPolarHBondContact OE2-CE2 3.41Å; R79-Y86 PolarHBondContact NH2-OH 3.18Å; Y86-V88 HydrophobicContact CD2-CG2 3.65Å; Y86-V88 HydrophobicContact CE2-CG2 3.36Å; Y86-G106 PolarHBondContact N-O 2.56Å; Y86-P107 HydrophobicContact CD2-CB 4.38Å; Y86-P107 HydrophobicContact CE1-CB 3.95Å; Y86-P107 HydrophobicContact CE1-CG 4.39Å; Y86-P107 HydrophobicContact CE2-CB 3.78Å; Y86-P107 CarbonylContact O-C 3.59Å; Y86-P107 WeakPolarHBondContact O-CA 2.86Å; Y86-Q108 PolarHBondContact O-N 2.93Å
87	I	94.6	Very high	86.7	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	146.8	170.8	69.8	179.6	0	0	0	111.7	W40 I45 P46 Y47 E48 F76 F89 Q108 I110 L126 V129	W40-I87 HydrophobicContact CH2-CG2 3.99Å; W40-I87 HydrophobicContact CZ2-CG2 3.84Å; I45-I87 HydrophobicContact CG2-CD1 4.18Å; I45-I87 HydrophobicContact CG2-CG1 4.44Å; I45-I87 HydrophobicContact CG2-CG2 4.15Å; P46-I87 PolarHBondContact O-N 3.19Å; Y47-I87 CarbonylContact C-O 3.54Å; Y47-I87 WeakPolarHBondContact CA-O 3.49Å; Y47-I87 VanDerWaalsContact CB-CG1 3.45Å; E48-I87 PolarHBondContact N-O 3.36Å; F76-I87 HydrophobicContact CD1-CD1 4.44Å; F76-I87 HydrophobicContact CE1-CD1 4.33Å; I87-F89 HydrophobicContact CD1-CE2 3.97Å; I87-F89 HydrophobicContact CD1-CZ 4.48Å; I87-F89 HydrophobicContact CG1-CE2 4.5Å; I87-Q108 CarbonylContact C-O 3.59Å; I87-Q108 WeakPolarHBondContact CA-O 3.26Å; I87-Q108 HydrophobicContact CG2-CG 3.87Å; I87-I110 HydrophobicContact CB-CG2 4.24Å; I87-I110 HydrophobicContact CD1-CG2 4.31Å; I87-I110 HydrophobicContact CG1-CG2 4.47Å; I87-L126 HydrophobicContact CD1-CD2 4.14Å; I87-V129 HydrophobicContact CD1-CG1 4.29Å; I87-V129 HydrophobicContact CD1-CG2 4.46Å; I87-V129 HydrophobicContact CG2-CB 4.48Å; I87-V129 HydrophobicContact CG2-CG1 3.46Å; I87-V129 VanDerWaalsContact CG2-CG1 3.46Å; I87-V129 HydrophobicContact CG2-CG2 4.11Å
88	V	93.3	Very high	86.5	Confident	17 Å²	17	56 Å²	56	10%	0.103	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	115.2	174	-176.3	0	0	0	0	108.9	E48 L50 Y86 T90 P107 Q108 I110	E48-V88 HydrophobicContact CB-CG2 4.39Å; E48-V88 WeakPolarHBondContact O-CA 3.38Å; L50-V88 HydrophobicContact CD1-CG1 4.2Å; L50-V88 HydrophobicContact CD2-CG1 3.96Å; L50-V88 HydrophobicContact CG-CG1 3.78Å; Y86-V88 HydrophobicContact CD2-CG2 3.65Å; Y86-V88 HydrophobicContact CE2-CG2 3.36Å; V88-T90 PolarHBondContact O-N 3.45Å; V88-P107 HydrophobicContact CG2-CB 3.66Å; V88-Q108 PolarHBondContact N-O 2.88Å; V88-I110 WeakPolarHBondContact O-CG2 3.25Å; V88-I110 PolarHBondContact O-N 3.15Å
89	F	92.7	Very high	86.4	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	119.6	168.2	-72.2	-97.3	0	0	0	108.8	Y47 E48 I49 L50 F53 F61 M65 I87 I110 I112 V122 L126	Y47-F89 HydrophobicContact CD2-CE2 4.39Å; E48-F89 PolarHBondContact O-N 2.76Å; I49-F89 HydrophobicContact CB-CB 4.33Å; I49-F89 HydrophobicContact CG1-CB 4.17Å; I49-F89 HydrophobicContact CG1-CD2 3.78Å; I49-F89 HydrophobicContact CG1-CE2 4.49Å; I49-F89 HydrophobicContact CG1-CG 4.18Å; I49-F89 HydrophobicContact CG2-CB 4.06Å; L50-F89 WeakPolarHBondContact CG-O 3.5Å; L50-F89 PolarHBondContact N-O 2.79Å; F53-F89 HydrophobicContact CE2-CB 4.28Å; F61-F89 HydrophobicContact CB-CD1 4.38Å; F61-F89 HydrophobicContact CB-CE1 3.91Å; F61-F89 HydrophobicContact CB-CZ 3.99Å; F61-F89 HydrophobicContact CD1-CD1 4.2Å; F61-F89 HydrophobicContact CD1-CE1 4.04Å; F61-F89 HydrophobicContact CD2-CB 4.1Å; F61-F89 AromaticContact CD2-CD1 3.4Å; F61-F89 HydrophobicContact CD2-CD1 3.4Å; F61-F89 VanDerWaalsContact CD2-CD1 3.4Å; F61-F89 HydrophobicContact CD2-CD2 4.39Å; F61-F89 AromaticContact CD2-CE1 3.82Å; F61-F89 HydrophobicContact CD2-CE1 3.82Å; F61-F89 AromaticContact CD2-CG 3.73Å; F61-F89 HydrophobicContact CD2-CG 3.73Å; F61-F89 HydrophobicContact CD2-CZ 4.44Å; F61-F89 HydrophobicContact CE1-CD1 4.38Å; F61-F89 HydrophobicContact CE2-CB 3.96Å; F61-F89 AromaticContact CE2-CD1 3.61Å; F61-F89 HydrophobicContact CE2-CD1 3.61Å; F61-F89 HydrophobicContact CE2-CE1 4.36Å; F61-F89 AromaticContact CE2-CG 3.99Å; F61-F89 HydrophobicContact CE2-CG 3.99Å; F61-F89 AromaticContact CG-CD1 3.74Å; F61-F89 HydrophobicContact CG-CD1 3.74Å; F61-F89 AromaticContact CG-CE1 3.64Å; F61-F89 HydrophobicContact CG-CE1 3.64Å; F61-F89 HydrophobicContact CG-CG 4.4Å; F61-F89 HydrophobicContact CG-CZ 4.22Å; F61-F89 HydrophobicContact CZ-CD1 4.11Å; M65-F89 HydrophobicContact CE-CE2 3.96Å; M65-F89 HydrophobicContact CE-CZ 4.1Å; M65-F89 HydrophobicContact SD-CE2 4.2Å; M65-F89 HydrophobicContact SD-CZ 4.35Å; I87-F89 HydrophobicContact CD1-CE2 3.97Å; I87-F89 HydrophobicContact CD1-CZ 4.48Å; I87-F89 HydrophobicContact CG1-CE2 4.5Å; F89-I110 WeakPolarHBondContact CA-O 3.28Å; F89-I110 HydrophobicContact CB-CG2 4.4Å; F89-I110 HydrophobicContact CD1-CG2 3.9Å; F89-I110 HydrophobicContact CD2-CG2 4.02Å; F89-I110 HydrophobicContact CE1-CD1 4Å; F89-I110 HydrophobicContact CE1-CG2 4.17Å; F89-I110 HydrophobicContact CE2-CG2 4.29Å; F89-I110 HydrophobicContact CG-CG2 3.83Å; F89-I110 HydrophobicContact CZ-CD1 4.38Å; F89-I110 HydrophobicContact CZ-CG2 4.37Å; F89-I112 HydrophobicContact CD1-CG1 3.84Å; F89-I112 HydrophobicContact CE1-CG1 4.24Å; F89-V122 HydrophobicContact CE1-CG1 4.16Å; F89-L126 HydrophobicContact CZ-CD2 4.05Å
90	T	90	Very high	86.3	Confident	27 Å²	27	52.5 Å²	52.5	17%	0.166	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	172.7	-175.1	-169	0	0	0	0	110.9	L50 V88 A109 I110 S111 I112	L50-T90 WeakPolarHBondContact CD1-OG1 2.94Å; V88-T90 PolarHBondContact O-N 3.45Å; T90-A109 HydrophobicContact CG2-CB 3.72Å; T90-I110 PolarHBondContact N-O 2.86Å; T90-S111 WeakPolarHBondContact O-CA 3.27Å; T90-I112 PolarHBondContact O-N 3.47Å
91	I	84.7	Confident	86.5	Confident	84 Å²	84	49.1 Å²	49.1	43%	0.431	28%	0.283	S	S	.	.			trans	-111.4	122.6	168.1	-53.3	-179.8	0	0	0	106.5	F53	F53-I91 HydrophobicContact CE1-CD1 4.25Å; F53-I91 HydrophobicContact CE1-CG1 3.96Å; F53-I91 HydrophobicContact CE2-CG1 4.22Å; F53-I91 HydrophobicContact CZ-CD1 4.28Å; F53-I91 HydrophobicContact CZ-CG1 3.54Å
92	A	77.7	Confident	86.9	Confident	42 Å²	42	45.5 Å²	45.5	35%	0.347	25%	0.251	S	S	.	.			trans	-139.1	157.2	179.8	0	0	0	0	0	112.1	C94 G95 S111	A92-C94 PolarHBondContact O-N 3.06Å; A92-G95 PolarHBondContact O-N 2.78Å; A92-G95 VanDerWaalsContact O-N 3.07Å; A92-S111 PolarHBondContact N-OG 3.42Å; A92-S111 PolarHBondContact O-OG 3.18Å
93	E	74.7	Confident	86.8	Confident	202 Å²	202	42.9 Å²	42.9	94%	0.944	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-12.9	-177.8	-62.9	163.2	-167	0	0	114.8	G95	E93-G95 PolarHBondContact O-N 3.11Å
94	C	74.3	Confident	86.3	Confident	40 Å²	40	42.8 Å²	42.8	27%	0.27	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-3.6	174.8	68.4	0	0	0	0	114.5	A92 C96 C97 S111	A92-C94 PolarHBondContact O-N 3.06Å; C94-C96 PolarHBondContact O-N 3.05Å; C94-C97 HydrophobicContact CB-CB 3.68Å; C94-C97 WeakPolarHBondContact CB-SG 3.42Å; C94-C97 WeakPolarHBondContact SG-CB 3.22Å; C94-C97 CovalentContact SG-SG 2.03Å; C94-C97 PolarHBondContact SG-SG 3.26Å; C94-S111 WeakPolarHBondContact SG-CB 3.42Å
95	G	78.8	Confident	86	Confident	26 Å²	26	46.9 Å²	46.9	27%	0.268	26%	0.255	S	S	.	.	S	Bend	trans	70.7	-124	-173.4	0	0	0	0	0	111.6	A92 E93 C97 S111 G113	A92-G95 PolarHBondContact O-N 2.78Å; A92-G95 VanDerWaalsContact O-N 3.07Å; E93-G95 PolarHBondContact O-N 3.11Å; G95-C97 PolarHBondContact O-N 2.7Å; G95-S111 WeakPolarHBondContact O-CB 3.17Å; G95-S111 PolarHBondContact O-OG 2.97Å; G95-G113 PolarHBondContact O-N 2.9Å
96	C	84	Confident	85.7	Confident	47 Å²	47	46.6 Å²	46.6	32%	0.318	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	108.7	170.9	-37.9	0	0	0	0	108.5	C94 C116 I121	C94-C96 PolarHBondContact O-N 3.05Å; C96-C116 WeakPolarHBondContact CA-SG 3.25Å; C96-C116 HydrophobicContact CB-CB 3.93Å; C96-C116 WeakPolarHBondContact CB-SG 3.16Å; C96-C116 PolarHBondContact N-SG 3Å; C96-C116 WeakPolarHBondContact SG-CB 3.38Å; C96-C116 CovalentContact SG-SG 2.03Å; C96-C116 PolarHBondContact SG-SG 2.73Å; C96-I121 HydrophobicContact CB-CG2 4.23Å
97	C	85.1	Confident	85.4	Confident	13 Å²	13	49.2 Å²	49.2	9%	0.088	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	149.8	177.5	87.4	0	0	0	0	114.3	C94 G95 S111 E125	C94-C97 HydrophobicContact CB-CB 3.68Å; C94-C97 WeakPolarHBondContact CB-SG 3.42Å; C94-C97 WeakPolarHBondContact SG-CB 3.22Å; C94-C97 CovalentContact SG-SG 2.03Å; C94-C97 PolarHBondContact SG-SG 3.26Å; G95-C97 PolarHBondContact O-N 2.7Å; C97-S111 PolarHBondContact N-O 3.3Å; C97-S111 VanDerWaalsContact N-O 3.17Å; C97-S111 PolarHBondContact O-N 3.15Å; C97-E125 VanDerWaalsContact C-OE2 3.24Å; C97-E125 WeakPolarHBondContact CA-OE2 3.24Å
98	S	88.9	Confident	85.3	Confident	8 Å²	8	49.5 Å²	49.5	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	150.7	-176.5	179.7	0	0	0	0	111.8	E125 V129	S98-E125 VanDerWaalsContact CB-O 3.31Å; S98-E125 WeakPolarHBondContact CB-O 3.47Å; S98-E125 WeakPolarHBondContact CB-OE2 3.4Å; S98-E125 PolarHBondContact N-OE2 2.04Å; S98-E125 PolarHBondContact OG-O 2.97Å; S98-V129 VanDerWaalsContact OG-CG2 3.28Å; S98-V129 WeakPolarHBondContact OG-CG2 3.21Å
99	F	87.8	Confident	85.1	Confident	35 Å²	35	50.4 Å²	50.4	15%	0.154	29%	0.288	C	S	.	.			trans	-83.9	133.6	178.1	-71.3	-76.7	0	0	0	111.9	C5 G101 Q108 A109 H128	C5-F99 HydrophobicContact CB-CD1 4.42Å; C5-F99 HydrophobicContact CB-CE1 3.75Å; C5-F99 HydrophobicContact CB-CZ 4.06Å; C5-F99 WeakPolarHBondContact O-CE1 3.24Å; F99-G101 PolarHBondContact O-N 3.5Å; F99-G101 VanDerWaalsContact O-N 3.08Å; F99-Q108 HydrophobicContact CD2-CB 4Å; F99-A109 WeakPolarHBondContact CD2-O 3.44Å; F99-A109 HydrophobicContact CE2-CB 4.42Å; F99-H128 CarbonylContact O-C 3.42Å
100	V	88.9	Confident	85	Confident	11 Å²	11	50.4 Å²	50.4	7%	0.067	29%	0.288	C	S	.	.	S	Bend	trans	-74.1	100.9	179.8	-178.7	0	0	0	0	111.4	R38 H128 F132 W133	R38-V100 WeakPolarHBondContact CD-O 3.11Å; R38-V100 PolarHBondContact NH1-O 2.95Å; V100-H128 CarbonylContact C-O 3.54Å; V100-H128 VanDerWaalsContact CA-O 3.3Å; V100-H128 WeakPolarHBondContact CA-O 3.09Å; V100-H128 HydrophobicContact CG2-CB 4.28Å; V100-F132 WeakPolarHBondContact CG1-O 3.03Å; V100-W133 HydrophobicContact CB-CD2 4.34Å; V100-W133 HydrophobicContact CB-CE3 4.43Å; V100-W133 HydrophobicContact CB-CZ2 4.5Å; V100-W133 HydrophobicContact CG1-CD2 3.96Å; V100-W133 HydrophobicContact CG1-CG 4.15Å; V100-W133 HydrophobicContact CG1-CZ2 4.42Å; V100-W133 HydrophobicContact CG2-CD2 4.03Å; V100-W133 HydrophobicContact CG2-CE3 3.77Å; V100-W133 HydrophobicContact CG2-CZ3 4.05Å
101	G	90.5	Very high	85.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	78.3	-172.6	-176.6	0	0	0	0	0	113.7	R38 F99 R103 Q108 H128 V129	R38-G101 CarbonylContact O-C 3.58Å; R38-G101 VanDerWaalsContact O-CA 3.3Å; R38-G101 WeakPolarHBondContact O-CA 3.35Å; F99-G101 PolarHBondContact O-N 3.5Å; F99-G101 VanDerWaalsContact O-N 3.08Å; G101-R103 PolarHBondContact O-N 2.93Å; G101-Q108 PolarHBondContact O-NE2 3.22Å; G101-Q108 PolarHBondContact O-OE1 3.17Å; G101-H128 PolarHBondContact N-O 3.39Å; G101-V129 WeakPolarHBondContact CA-O 3.13Å
102	K	92.1	Very high	85.2	Confident	48 Å²	48	45.2 Å²	45.2	21%	0.209	26%	0.26	C	S	.	.			trans	-67.2	121.6	172.6	-171	179.9	72.9	-154.2	0	110.3	R38 L39 W40	R38-K102 WeakPolarHBondContact CA-O 3.43Å; R38-K102 PolarHBondContact O-N 2.89Å; L39-K102 WeakPolarHBondContact O-CE 3.06Å; L39-K102 PolarHBondContact O-NZ 3.31Å; W40-K102 HydrophobicContact CD2-CB 3.99Å; W40-K102 HydrophobicContact CD2-CG 4.36Å; W40-K102 HydrophobicContact CE3-CB 4.37Å; W40-K102 HydrophobicContact CE3-CD 4.15Å; W40-K102 HydrophobicContact CE3-CG 4.23Å; W40-K102 HydrophobicContact CG-CB 4.43Å; W40-K102 HydrophobicContact CH2-CB 4.42Å; W40-K102 HydrophobicContact CH2-CG 4.17Å; W40-K102 HydrophobicContact CZ2-CB 4.06Å; W40-K102 HydrophobicContact CZ2-CG 4.31Å; W40-K102 HydrophobicContact CZ3-CD 4.33Å; W40-K102 HydrophobicContact CZ3-CG 4.13Å
103	R	83.3	Confident	85.2	Confident	117 Å²	117	43.6 Å²	43.6	44%	0.442	25%	0.247	S	C	.	.			trans	-81	-32.4	-175.9	-175.3	174.6	171.7	172	-2	113.4	F8 G101 Q108	F8-R103 PolarHBondContact O-NH2 3.17Å; G101-R103 PolarHBondContact O-N 2.93Å; R103-Q108 HydrophobicContact CB-CB 4.43Å
104	G	77.6	Confident	85.1	Confident	36 Å²	36	38.2 Å²	38.2	37%	0.371	22%	0.22	S	C	.	.	S	Bend	trans	164.5	-158.6	-175.5	0	0	0	0	0	110.9	S85	S85-G104 WeakPolarHBondContact CB-O 3.38Å; S85-G104 PolarHBondContact OG-O 2.89Å; S85-G104 VanDerWaalsContact OG-O 3.13Å
105	E	82	Confident	85.3	Confident	174 Å²	174	38.6 Å²	38.6	81%	0.813	22%	0.22	S	C	*	.	S	Bend	trans	-79.7	139.4	167.2	-71.6	174.5	-172.8	0	0	110.1	V84	V84-E105 HydrophobicContact CG1-CB 3.75Å; V84-E105 HydrophobicContact CG1-CG 3.78Å
106	G	84.1	Confident	85.5	Confident	22 Å²	22	37.4 Å²	37.4	23%	0.227	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	110.2	179.9	-176.4	0	0	0	0	0	114.6	V84 Y86	V84-G106 VanDerWaalsContact O-CA 3.29Å; V84-G106 WeakPolarHBondContact O-CA 3.4Å; V84-G106 PolarHBondContact O-N 3.09Å; Y86-G106 PolarHBondContact N-O 2.56Å
107	P	89	Confident	85.4	Confident	84 Å²	84	38.6 Å²	38.6	55%	0.545	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	141.8	171.2	26.1	-32.2	0	0	0	111.7	Y86 V88	Y86-P107 HydrophobicContact CD2-CB 4.38Å; Y86-P107 HydrophobicContact CE1-CB 3.95Å; Y86-P107 HydrophobicContact CE1-CG 4.39Å; Y86-P107 HydrophobicContact CE2-CB 3.78Å; Y86-P107 CarbonylContact O-C 3.59Å; Y86-P107 WeakPolarHBondContact O-CA 2.86Å; V88-P107 HydrophobicContact CG2-CB 3.66Å
108	Q	91.2	Very high	85.6	Confident	6 Å²	6	42.7 Å²	42.7	3%	0.028	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.1	161.2	65.5	-177.1	67.7	0	0	110.5	Y86 I87 V88 F99 G101 R103	Y86-Q108 PolarHBondContact O-N 2.93Å; I87-Q108 CarbonylContact C-O 3.59Å; I87-Q108 WeakPolarHBondContact CA-O 3.26Å; I87-Q108 HydrophobicContact CG2-CG 3.87Å; V88-Q108 PolarHBondContact N-O 2.88Å; F99-Q108 HydrophobicContact CD2-CB 4Å; G101-Q108 PolarHBondContact O-NE2 3.22Å; G101-Q108 PolarHBondContact O-OE1 3.17Å; R103-Q108 HydrophobicContact CB-CB 4.43Å
109	A	89.1	Confident	85.8	Confident	36 Å²	36	45.5 Å²	45.5	30%	0.298	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	137	179.2	0	0	0	0	0	111.7	T90 F99	T90-A109 HydrophobicContact CG2-CB 3.72Å; F99-A109 WeakPolarHBondContact CD2-O 3.44Å; F99-A109 HydrophobicContact CE2-CB 4.42Å
110	I	92.4	Very high	86	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	108	154	172.9	170.2	0	0	0	105.9	I87 V88 F89 T90 I112 E125 L126 V129	I87-I110 HydrophobicContact CB-CG2 4.24Å; I87-I110 HydrophobicContact CD1-CG2 4.31Å; I87-I110 HydrophobicContact CG1-CG2 4.47Å; V88-I110 WeakPolarHBondContact O-CG2 3.25Å; V88-I110 PolarHBondContact O-N 3.15Å; F89-I110 WeakPolarHBondContact CA-O 3.28Å; F89-I110 HydrophobicContact CB-CG2 4.4Å; F89-I110 HydrophobicContact CD1-CG2 3.9Å; F89-I110 HydrophobicContact CD2-CG2 4.02Å; F89-I110 HydrophobicContact CE1-CD1 4Å; F89-I110 HydrophobicContact CE1-CG2 4.17Å; F89-I110 HydrophobicContact CE2-CG2 4.29Å; F89-I110 HydrophobicContact CG-CG2 3.83Å; F89-I110 HydrophobicContact CZ-CD1 4.38Å; F89-I110 HydrophobicContact CZ-CG2 4.37Å; T90-I110 PolarHBondContact N-O 2.86Å; I110-I112 HydrophobicContact CD1-CD1 4.39Å; I110-I112 HydrophobicContact CG1-CD1 4.14Å; I110-I112 PolarHBondContact O-N 2.69Å; I110-E125 HydrophobicContact CD1-CB 3.64Å; I110-E125 HydrophobicContact CG1-CB 4.01Å; I110-L126 HydrophobicContact CD1-CD2 3.98Å; I110-L126 HydrophobicContact CD1-CG 4.27Å; I110-V129 HydrophobicContact CD1-CG2 4.16Å
111	S	90.7	Very high	86.1	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	110	-179.5	-174.2	0	0	0	0	109.3	T90 A92 C94 G95 C97	T90-S111 WeakPolarHBondContact O-CA 3.27Å; A92-S111 PolarHBondContact N-OG 3.42Å; A92-S111 PolarHBondContact O-OG 3.18Å; C94-S111 WeakPolarHBondContact SG-CB 3.42Å; G95-S111 WeakPolarHBondContact O-CB 3.17Å; G95-S111 PolarHBondContact O-OG 2.97Å; C97-S111 PolarHBondContact N-O 3.3Å; C97-S111 VanDerWaalsContact N-O 3.17Å; C97-S111 PolarHBondContact O-N 3.15Å
112	I	87.1	Confident	86.2	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	83.6	163.3	-54.2	-55.8	0	0	0	105.8	F53 F61 F89 T90 I110 C116 V122 E125	F53-I112 HydrophobicContact CE1-CB 4.45Å; F53-I112 HydrophobicContact CZ-CB 4.37Å; F61-I112 HydrophobicContact CE1-CB 4.17Å; F61-I112 HydrophobicContact CE1-CG1 3.91Å; F61-I112 HydrophobicContact CE1-CG2 3.86Å; F61-I112 HydrophobicContact CZ-CB 3.93Å; F61-I112 HydrophobicContact CZ-CG1 3.92Å; F61-I112 HydrophobicContact CZ-CG2 3.94Å; F89-I112 HydrophobicContact CD1-CG1 3.84Å; F89-I112 HydrophobicContact CE1-CG1 4.24Å; T90-I112 PolarHBondContact O-N 3.47Å; I110-I112 HydrophobicContact CD1-CD1 4.39Å; I110-I112 HydrophobicContact CG1-CD1 4.14Å; I110-I112 PolarHBondContact O-N 2.69Å; I112-C116 HydrophobicContact CG2-CB 3.79Å; I112-V122 HydrophobicContact CD1-CG1 4.42Å; I112-V122 HydrophobicContact CD1-CG2 4.16Å; I112-E125 HydrophobicContact CD1-CB 4.29Å; I112-E125 HydrophobicContact CD1-CG 4.13Å
113	G	76.7	Confident	86.4	Confident	7 Å²	7	42.9 Å²	42.9	7%	0.072	23%	0.228	C	C	.	.			trans	-59.8	170	171.9	0	0	0	0	0	112.6	G95 N115 C116	G95-G113 PolarHBondContact O-N 2.9Å; G113-N115 PolarHBondContact O-N 3.13Å; G113-C116 PolarHBondContact N-SG 2.93Å; G113-C116 WeakPolarHBondContact O-CB 3.39Å; G113-C116 PolarHBondContact O-N 3.33Å; G113-C116 PolarHBondContact O-SG 3.19Å; G113-C116 VanDerWaalsContact O-SG 3.38Å
114	K	73.1	Confident	86.9	Confident	89 Å²	89	37.7 Å²	37.7	39%	0.387	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	140.6	168.3	-108.1	141.7	151.4	-75.6	0	109.2	C116 N843 D919 T920	K114-C116 PolarHBondContact O-N 2.79Å; K114-N843 PolarHBondContact NZ-OD1 3.35Å; K114-D919 PolarHBondContact NZ-O 2.9Å; K114-T920 HydrophobicContact CB-CG2 3.63Å; K114-T920 VanDerWaalsContact NZ-C 3.29Å; K114-T920 PolarHBondContact NZ-O 3.01Å
115	N	78.5	Confident	87.7	Confident	48 Å²	48	36.6 Å²	36.6	26%	0.257	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	-5.2	-174.1	-138.5	13.4	0	0	0	116.9	G113 D117 K118 D919	G113-N115 PolarHBondContact O-N 3.13Å; N115-D117 VanDerWaalsContact C-N 3.34Å; N115-D117 WeakPolarHBondContact CA-OD1 3.43Å; N115-K118 VanDerWaalsContact CG-NZ 3.32Å; N115-K118 PolarHBondContact O-NZ 2.98Å; N115-K118 PolarHBondContact OD1-NZ 2.04Å; N115-D919 HydrophobicContact CB-CB 4.29Å; N115-D919 VanDerWaalsContact CG-OD1 3.27Å; N115-D919 VanDerWaalsContact CG-OD2 3.27Å; N115-D919 PolarHBondContact ND2-OD1 3.2Å; N115-D919 PolarHBondContact ND2-OD2 2.97Å; N115-D919 PolarHBondContact OD1-OD2 2.93Å
116	C	83.8	Confident	88.3	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.014	16%	0.156	C	C	.	.			trans	-85.6	-4.1	172.8	-49.3	0	0	0	0	113.4	C96 I112 G113 K114 K118 I121	C96-C116 WeakPolarHBondContact CA-SG 3.25Å; C96-C116 HydrophobicContact CB-CB 3.93Å; C96-C116 WeakPolarHBondContact CB-SG 3.16Å; C96-C116 PolarHBondContact N-SG 3Å; C96-C116 WeakPolarHBondContact SG-CB 3.38Å; C96-C116 CovalentContact SG-SG 2.03Å; C96-C116 PolarHBondContact SG-SG 2.73Å; I112-C116 HydrophobicContact CG2-CB 3.79Å; G113-C116 PolarHBondContact N-SG 2.93Å; G113-C116 WeakPolarHBondContact O-CB 3.39Å; G113-C116 PolarHBondContact O-N 3.33Å; G113-C116 PolarHBondContact O-SG 3.19Å; G113-C116 VanDerWaalsContact O-SG 3.38Å; K114-C116 PolarHBondContact O-N 2.79Å; C116-K118 PolarHBondContact O-N 3.01Å; C116-I121 HydrophobicContact CB-CG2 4.12Å
117	D	82.6	Confident	88.8	Confident	71 Å²	71	27.2 Å²	27.2	38%	0.38	15%	0.145	S	C	.	.			trans	-68.2	22.4	-179	63.2	-50	0	0	0	114.6	L60 N115	L60-D117 VanDerWaalsContact CD2-C 3.5Å; L60-D117 HydrophobicContact CD2-CB 4.29Å; L60-D117 WeakPolarHBondContact CD2-O 3.35Å; N115-D117 VanDerWaalsContact C-N 3.34Å; N115-D117 WeakPolarHBondContact CA-OD1 3.43Å
118	K	89.1	Confident	89	Confident	99 Å²	99	23.5 Å²	23.5	43%	0.43	12%	0.12	S	C	.	.	S	Bend	trans	-103.5	131.6	179.4	-65.3	162.3	-166.2	137.6	0	109.3	N115 C116 G120 I121 V122	N115-K118 VanDerWaalsContact CG-NZ 3.32Å; N115-K118 PolarHBondContact O-NZ 2.98Å; N115-K118 PolarHBondContact OD1-NZ 2.04Å; C116-K118 PolarHBondContact O-N 3.01Å; K118-G120 VanDerWaalsContact C-N 3.3Å; K118-G120 PolarHBondContact O-N 2.91Å; K118-G120 VanDerWaalsContact O-N 3.09Å; K118-I121 HydrophobicContact CB-CD1 4.03Å; K118-I121 HydrophobicContact CB-CG1 4.15Å; K118-I121 HydrophobicContact CD-CD1 4.09Å; K118-I121 WeakPolarHBondContact O-CA 3.1Å; K118-I121 WeakPolarHBondContact O-CB 3.33Å; K118-I121 PolarHBondContact O-N 2.88Å; K118-V122 PolarHBondContact O-N 2.84Å; K118-V122 VanDerWaalsContact O-N 3.09Å
119	F	92.3	Very high	89.2	Confident	67 Å²	67	23.2 Å²	23.2	29%	0.294	12%	0.119	S	C	.	.	H	α-helix	trans	-44.5	-49.5	-174.3	173.2	-98.9	0	0	0	113.8	L60 R63 A64 H67 I121 V122 V123 I215	L60-F119 HydrophobicContact CD1-CB 4.07Å; R63-F119 HydrophobicContact CB-CD2 4.36Å; R63-F119 HydrophobicContact CB-CE2 4.2Å; A64-F119 HydrophobicContact CB-CD2 4.34Å; A64-F119 HydrophobicContact CB-CE2 4.4Å; H67-F119 HydrophobicContact CB-CE2 4.17Å; H67-F119 HydrophobicContact CB-CZ 3.76Å; H67-F119 AromaticContact CG-CZ 3.64Å; H67-F119 AromaticContact ND1-CZ 3.79Å; F119-I121 VanDerWaalsContact C-N 3.32Å; F119-I121 PolarHBondContact O-N 3.29Å; F119-V122 PolarHBondContact O-N 2.86Å; F119-V123 HydrophobicContact CD1-CG2 4.39Å; F119-V123 HydrophobicContact CD2-CG2 4.45Å; F119-V123 HydrophobicContact CE1-CG2 4.09Å; F119-V123 HydrophobicContact CE2-CG2 4.16Å; F119-V123 HydrophobicContact CZ-CG2 3.98Å; F119-V123 VanDerWaalsContact O-CG2 3.3Å; F119-V123 WeakPolarHBondContact O-CG2 3.45Å; F119-V123 PolarHBondContact O-N 3.14Å; F119-I215 WeakPolarHBondContact CE1-O 3.39Å
120	G	91.3	Very high	89.4	Confident	4 Å²	4	21.5 Å²	21.5	4%	0.041	11%	0.105	C	C	.	.	H	α-helix	trans	-69.7	-20.6	179.5	0	0	0	0	0	115.8	K118 H124 R214	K118-G120 VanDerWaalsContact C-N 3.3Å; K118-G120 PolarHBondContact O-N 2.91Å; K118-G120 VanDerWaalsContact O-N 3.09Å; G120-H124 WeakPolarHBondContact O-CB 3.29Å; G120-H124 PolarHBondContact O-N 3.31Å; G120-R214 WeakPolarHBondContact CA-O 3.39Å; G120-R214 WeakPolarHBondContact O-CD 3.39Å
121	I	91.3	Very high	89.4	Confident	34 Å²	34	21.5 Å²	21.5	17%	0.174	11%	0.105	C	C	.	.	H	α-helix	trans	-77	-47.8	170.7	-58.4	178.9	0	0	0	108.8	C96 C116 K118 F119 V123 H124 E125	C96-I121 HydrophobicContact CB-CG2 4.23Å; C116-I121 HydrophobicContact CB-CG2 4.12Å; K118-I121 HydrophobicContact CB-CD1 4.03Å; K118-I121 HydrophobicContact CB-CG1 4.15Å; K118-I121 HydrophobicContact CD-CD1 4.09Å; K118-I121 WeakPolarHBondContact O-CA 3.1Å; K118-I121 WeakPolarHBondContact O-CB 3.33Å; K118-I121 PolarHBondContact O-N 2.88Å; F119-I121 VanDerWaalsContact C-N 3.32Å; F119-I121 PolarHBondContact O-N 3.29Å; I121-V123 VanDerWaalsContact C-N 3.27Å; I121-V123 PolarHBondContact O-N 2.96Å; I121-H124 WeakPolarHBondContact O-CA 3.1Å; I121-H124 VanDerWaalsContact O-CB 3.26Å; I121-H124 WeakPolarHBondContact O-CB 3.47Å; I121-H124 PolarHBondContact O-N 2.8Å; I121-E125 HydrophobicContact CG2-CG 4.42Å; I121-E125 PolarHBondContact O-N 3.07Å
122	V	93.7	Very high	89.4	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.9	-39.7	175.6	-172.4	0	0	0	0	111.4	L60 F61 A64 F89 I112 K118 F119 H124 E125 L126	L60-V122 HydrophobicContact CD2-CG2 3.97Å; L60-V122 HydrophobicContact CG-CG2 4.29Å; F61-V122 HydrophobicContact CD1-CG1 3.92Å; F61-V122 HydrophobicContact CD1-CG2 4.07Å; F61-V122 HydrophobicContact CE1-CG2 4.11Å; A64-V122 HydrophobicContact CB-CB 3.84Å; A64-V122 HydrophobicContact CB-CG1 3.53Å; F89-V122 HydrophobicContact CE1-CG1 4.16Å; I112-V122 HydrophobicContact CD1-CG1 4.42Å; I112-V122 HydrophobicContact CD1-CG2 4.16Å; K118-V122 PolarHBondContact O-N 2.84Å; K118-V122 VanDerWaalsContact O-N 3.09Å; F119-V122 PolarHBondContact O-N 2.86Å; V122-H124 VanDerWaalsContact C-N 3.32Å; V122-H124 PolarHBondContact O-N 3.16Å; V122-E125 PolarHBondContact O-N 3.27Å; V122-L126 HydrophobicContact CG1-CD1 4.24Å; V122-L126 HydrophobicContact CG1-CG 4.49Å; V122-L126 WeakPolarHBondContact O-CB 3.41Å; V122-L126 VanDerWaalsContact O-CG 3.24Å; V122-L126 WeakPolarHBondContact O-CG 3.11Å; V122-L126 PolarHBondContact O-N 2.9Å
123	V	95.2	Very high	89.5	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.006	11%	0.107	C	C	.	.	H	α-helix	trans	-64.3	-33.8	173.9	174.3	0	0	0	0	112.2	A64 W68 F119 I121 G127 I180 L217	A64-V123 HydrophobicContact CB-CG2 3.79Å; W68-V123 PolarHBondContact NE1-O 3.16Å; F119-V123 HydrophobicContact CD1-CG2 4.39Å; F119-V123 HydrophobicContact CD2-CG2 4.45Å; F119-V123 HydrophobicContact CE1-CG2 4.09Å; F119-V123 HydrophobicContact CE2-CG2 4.16Å; F119-V123 HydrophobicContact CZ-CG2 3.98Å; F119-V123 VanDerWaalsContact O-CG2 3.3Å; F119-V123 WeakPolarHBondContact O-CG2 3.45Å; F119-V123 PolarHBondContact O-N 3.14Å; I121-V123 VanDerWaalsContact C-N 3.27Å; I121-V123 PolarHBondContact O-N 2.96Å; V123-G127 PolarHBondContact O-N 3.42Å; V123-G127 VanDerWaalsContact O-N 3.1Å; V123-I180 HydrophobicContact CG1-CG1 4.12Å; V123-L217 HydrophobicContact CG1-CD2 3.64Å; V123-L217 HydrophobicContact CG1-CG 4.4Å
124	H	93.8	Very high	90.2	Very high	9 Å²	9	22.2 Å²	22.2	4%	0.042	11%	0.105	C	C	.	.	H	α-helix	trans	-68.3	-49.4	174.3	-176.5	95.6	0	0	0	111.9	G120 I121 V122 L126 G127 H128 H134 I180 R214	G120-H124 WeakPolarHBondContact O-CB 3.29Å; G120-H124 PolarHBondContact O-N 3.31Å; I121-H124 WeakPolarHBondContact O-CA 3.1Å; I121-H124 VanDerWaalsContact O-CB 3.26Å; I121-H124 WeakPolarHBondContact O-CB 3.47Å; I121-H124 PolarHBondContact O-N 2.8Å; V122-H124 VanDerWaalsContact C-N 3.32Å; V122-H124 PolarHBondContact O-N 3.16Å; H124-L126 VanDerWaalsContact C-N 3.29Å; H124-L126 PolarHBondContact O-N 2.81Å; H124-G127 WeakPolarHBondContact O-CA 3.25Å; H124-G127 PolarHBondContact O-N 3.48Å; H124-H128 AromaticContact NE2-NE2 3.79Å; H124-H128 PolarHBondContact O-N 3.34Å; H124-H134 AromaticContact CE1-CD2 3.49Å; H124-H134 PolarHBondContact CE1-CD2 3.3Å; H124-H134 VanDerWaalsContact CE1-CD2 3.49Å; H124-H134 AromaticContact CE1-NE2 3.57Å; H124-H134 AromaticContact NE2-CD2 3.49Å; H124-H134 PolarHBondContact NE2-CD2 3.16Å; H124-H134 AromaticContact NE2-NE2 3.04Å; H124-H134 PolarHBondContact NE2-NE2 2.96Å; H124-I180 HydrophobicContact CB-CG1 4.21Å; H124-I180 PolarHBondContact CE1-O 2.81Å; H124-I180 PolarHBondContact ND1-O 3.29Å; H124-R214 PolarHBondContact CE1-NH2 3.35Å; H124-R214 VanDerWaalsContact CE1-NH2 3.35Å
125	E	94.3	Very high	91.1	Very high	12 Å²	12	18 Å²	18	6%	0.056	9%	0.087	C	C	.	.	H	α-helix	trans	-62.8	-36.1	177.7	-63	-47.2	134.6	0	0	112.2	C97 S98 I110 I112 I121 V122 G127 H128 V129	C97-E125 VanDerWaalsContact C-OE2 3.24Å; C97-E125 WeakPolarHBondContact CA-OE2 3.24Å; S98-E125 VanDerWaalsContact CB-O 3.31Å; S98-E125 WeakPolarHBondContact CB-O 3.47Å; S98-E125 WeakPolarHBondContact CB-OE2 3.4Å; S98-E125 PolarHBondContact N-OE2 2.04Å; S98-E125 PolarHBondContact OG-O 2.97Å; I110-E125 HydrophobicContact CD1-CB 3.64Å; I110-E125 HydrophobicContact CG1-CB 4.01Å; I112-E125 HydrophobicContact CD1-CB 4.29Å; I112-E125 HydrophobicContact CD1-CG 4.13Å; I121-E125 HydrophobicContact CG2-CG 4.42Å; I121-E125 PolarHBondContact O-N 3.07Å; V122-E125 PolarHBondContact O-N 3.27Å; E125-G127 VanDerWaalsContact C-N 3.29Å; E125-G127 PolarHBondContact O-N 3.22Å; E125-H128 WeakPolarHBondContact O-CB 3.4Å; E125-H128 PolarHBondContact O-N 2.78Å; E125-H128 IonicContact OE2-CD2 2.95Å; E125-V129 PolarHBondContact O-N 3.16Å
126	L	95.3	Very high	91.7	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-66.1	-29.1	169.9	-73.1	175.6	0	0	0	112.6	A64 M65 F76 I87 F89 I110 V122 H124 H128 V129 V130	A64-L126 HydrophobicContact CB-CD1 3.9Å; M65-L126 HydrophobicContact CG-CD1 3.71Å; M65-L126 HydrophobicContact CG-CD2 4.34Å; F76-L126 HydrophobicContact CD1-CD2 4.46Å; F76-L126 HydrophobicContact CE1-CD2 3.67Å; F76-L126 HydrophobicContact CZ-CD2 3.99Å; I87-L126 HydrophobicContact CD1-CD2 4.14Å; F89-L126 HydrophobicContact CZ-CD2 4.05Å; I110-L126 HydrophobicContact CD1-CD2 3.98Å; I110-L126 HydrophobicContact CD1-CG 4.27Å; V122-L126 HydrophobicContact CG1-CD1 4.24Å; V122-L126 HydrophobicContact CG1-CG 4.49Å; V122-L126 WeakPolarHBondContact O-CB 3.41Å; V122-L126 VanDerWaalsContact O-CG 3.24Å; V122-L126 WeakPolarHBondContact O-CG 3.11Å; V122-L126 PolarHBondContact O-N 2.9Å; H124-L126 VanDerWaalsContact C-N 3.29Å; H124-L126 PolarHBondContact O-N 2.81Å; L126-H128 VanDerWaalsContact C-N 3.34Å; L126-V129 HydrophobicContact CD2-CG2 4.47Å; L126-V129 WeakPolarHBondContact O-CB 3.41Å; L126-V129 PolarHBondContact O-N 3.38Å; L126-V129 VanDerWaalsContact O-N 3.16Å; L126-V130 VanDerWaalsContact O-CG2 3.29Å; L126-V130 WeakPolarHBondContact O-CG2 3.45Å; L126-V130 PolarHBondContact O-N 3.18Å
127	G	94.6	Very high	92	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.2	-35.4	172.9	0	0	0	0	0	113.2	V123 H124 E125 V130 G131 F132	V123-G127 PolarHBondContact O-N 3.42Å; V123-G127 VanDerWaalsContact O-N 3.1Å; H124-G127 WeakPolarHBondContact O-CA 3.25Å; H124-G127 PolarHBondContact O-N 3.48Å; E125-G127 VanDerWaalsContact C-N 3.29Å; E125-G127 PolarHBondContact O-N 3.22Å; G127-V130 PolarHBondContact O-N 3.21Å; G127-G131 PolarHBondContact O-N 3.05Å; G127-F132 WeakPolarHBondContact O-CB 3.33Å; G127-F132 WeakPolarHBondContact O-CD2 3.01Å; G127-F132 PolarHBondContact O-N 3.36Å
128	H	93.5	Very high	92.3	Very high	5 Å²	5	12.8 Å²	12.8	2%	0.023	6%	0.059	C	C	.	.	H	α-helix	trans	-61.4	-49.6	166.5	-70.2	-52.2	0	0	0	111	D2 F99 V100 G101 H124 E125 L126 V130 G131 F132 H134 M181	D2-H128 IonicContact OD2-CE1 3.27Å; F99-H128 CarbonylContact O-C 3.42Å; V100-H128 CarbonylContact C-O 3.54Å; V100-H128 VanDerWaalsContact CA-O 3.3Å; V100-H128 WeakPolarHBondContact CA-O 3.09Å; V100-H128 HydrophobicContact CG2-CB 4.28Å; G101-H128 PolarHBondContact N-O 3.39Å; H124-H128 AromaticContact NE2-NE2 3.79Å; H124-H128 PolarHBondContact O-N 3.34Å; E125-H128 WeakPolarHBondContact O-CB 3.4Å; E125-H128 PolarHBondContact O-N 2.78Å; E125-H128 IonicContact OE2-CD2 2.95Å; L126-H128 VanDerWaalsContact C-N 3.34Å; H128-V130 VanDerWaalsContact C-N 3.29Å; H128-V130 PolarHBondContact O-N 2.91Å; H128-G131 WeakPolarHBondContact O-CA 3.32Å; H128-G131 PolarHBondContact O-N 2.85Å; H128-F132 PolarHBondContact ND1-O 2.83Å; H128-H134 AromaticContact CE1-CD2 3.81Å; H128-H134 AromaticContact CE1-CE1 3.33Å; H128-H134 PolarHBondContact CE1-CE1 2.79Å; H128-H134 AromaticContact CE1-ND1 3.98Å; H128-H134 AromaticContact CE1-NE2 3.22Å; H128-H134 PolarHBondContact CE1-NE2 3.35Å; H128-H134 AromaticContact NE2-CD2 3.94Å; H128-H134 AromaticContact NE2-CE1 3.35Å; H128-H134 PolarHBondContact NE2-CE1 3.28Å; H128-H134 VanDerWaalsContact NE2-CE1 3.35Å; H128-H134 AromaticContact NE2-NE2 3.01Å; H128-H134 PolarHBondContact NE2-NE2 2.84Å; H128-M181 VanDerWaalsContact CE1-CE 3.42Å; H128-M181 WeakPolarHBondContact CE1-CE 3.39Å; H128-M181 WeakPolarHBondContact ND1-CE 3.38Å
129	V	94.5	Very high	92.2	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.006	5%	0.048	C	C	.	.	H	α-helix	trans	-55.5	-43	177.2	-177.7	0	0	0	0	112	W40 I45 I87 S98 G101 I110 E125 L126 G131	W40-V129 HydrophobicContact CZ2-CG1 3.95Å; W40-V129 PolarHBondContact NE1-O 3.03Å; I45-V129 HydrophobicContact CD1-CG1 4.15Å; I45-V129 HydrophobicContact CG2-CG1 3.78Å; I87-V129 HydrophobicContact CD1-CG1 4.29Å; I87-V129 HydrophobicContact CD1-CG2 4.46Å; I87-V129 HydrophobicContact CG2-CB 4.48Å; I87-V129 HydrophobicContact CG2-CG1 3.46Å; I87-V129 VanDerWaalsContact CG2-CG1 3.46Å; I87-V129 HydrophobicContact CG2-CG2 4.11Å; S98-V129 VanDerWaalsContact OG-CG2 3.28Å; S98-V129 WeakPolarHBondContact OG-CG2 3.21Å; G101-V129 WeakPolarHBondContact CA-O 3.13Å; I110-V129 HydrophobicContact CD1-CG2 4.16Å; E125-V129 PolarHBondContact O-N 3.16Å; L126-V129 HydrophobicContact CD2-CG2 4.47Å; L126-V129 WeakPolarHBondContact O-CB 3.41Å; L126-V129 PolarHBondContact O-N 3.38Å; L126-V129 VanDerWaalsContact O-N 3.16Å; V129-G131 PolarHBondContact O-N 2.75Å
130	V	94	Very high	92	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-61.7	-26.8	177	168.1	0	0	0	0	112.1	I45 W68 V74 F76 L126 G127 H128 F132 T225 Y229	I45-V130 HydrophobicContact CD1-CG2 4.25Å; W68-V130 HydrophobicContact CD2-CG2 4.18Å; W68-V130 HydrophobicContact CE3-CG2 4.07Å; W68-V130 HydrophobicContact CZ3-CB 4.48Å; W68-V130 HydrophobicContact CZ3-CG1 4.12Å; W68-V130 HydrophobicContact CZ3-CG2 4.28Å; V74-V130 HydrophobicContact CG1-CG2 4.23Å; V74-V130 HydrophobicContact CG2-CG1 4.27Å; V74-V130 HydrophobicContact CG2-CG2 4.38Å; F76-V130 HydrophobicContact CZ-CG2 4.23Å; L126-V130 VanDerWaalsContact O-CG2 3.29Å; L126-V130 WeakPolarHBondContact O-CG2 3.45Å; L126-V130 PolarHBondContact O-N 3.18Å; G127-V130 PolarHBondContact O-N 3.21Å; H128-V130 VanDerWaalsContact C-N 3.29Å; H128-V130 PolarHBondContact O-N 2.91Å; V130-F132 HydrophobicContact CB-CD2 4.43Å; V130-F132 HydrophobicContact CG1-CD2 4.03Å; V130-F132 HydrophobicContact CG1-CE2 3.71Å; V130-T225 HydrophobicContact CG1-CG2 3.75Å; V130-Y229 HydrophobicContact CG1-CE2 3.97Å; V130-Y229 VanDerWaalsContact O-CE2 3.31Å; V130-Y229 WeakPolarHBondContact O-CE2 3.27Å; V130-Y229 PolarHBondContact O-OH 2.94Å
131	G	91.3	Very high	92	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	122	22.1	172	0	0	0	0	0	115.3	T33 G127 H128 V129	T33-G131 PolarHBondContact N-O 2.97Å; G127-G131 PolarHBondContact O-N 3.05Å; H128-G131 WeakPolarHBondContact O-CA 3.32Å; H128-G131 PolarHBondContact O-N 2.85Å; V129-G131 PolarHBondContact O-N 2.75Å
132	F	91.3	Very high	92	Very high	3 Å²	3	8.6 Å²	8.6	1%	0.013	5%	0.045	C	C	.	.	B	Isolated β-bridge	trans	-95.5	142	177.2	-67.3	-75.8	0	0	0	113.7	A32 W68 V100 G127 H128 V130 M181 Q224 T225	A32-F132 HydrophobicContact CB-CD1 4.09Å; A32-F132 HydrophobicContact CB-CE1 3.94Å; W68-F132 HydrophobicContact CH2-CD2 4.24Å; W68-F132 HydrophobicContact CH2-CE2 4.13Å; W68-F132 HydrophobicContact CZ3-CE2 4.27Å; V100-F132 WeakPolarHBondContact CG1-O 3.03Å; G127-F132 WeakPolarHBondContact O-CB 3.33Å; G127-F132 WeakPolarHBondContact O-CD2 3.01Å; G127-F132 PolarHBondContact O-N 3.36Å; H128-F132 PolarHBondContact ND1-O 2.83Å; V130-F132 HydrophobicContact CB-CD2 4.43Å; V130-F132 HydrophobicContact CG1-CD2 4.03Å; V130-F132 HydrophobicContact CG1-CE2 3.71Å; F132-M181 HydrophobicContact CB-CE 4.25Å; F132-M181 HydrophobicContact CB-CG 3.83Å; F132-M181 HydrophobicContact CB-SD 4.39Å; F132-M181 HydrophobicContact CG-CG 4.31Å; F132-Q224 HydrophobicContact CE1-CB 3.74Å; F132-Q224 HydrophobicContact CZ-CB 3.89Å; F132-T225 VanDerWaalsContact CE2-OG1 3.23Å; F132-T225 WeakPolarHBondContact CE2-OG1 3.36Å; F132-T225 WeakPolarHBondContact CZ-OG1 3.05Å
133	W	89.3	Confident	91.9	Very high	16 Å²	16	13.8 Å²	13.8	6%	0.061	7%	0.072	C	C	.	.	P	Polyproline II helix	trans	-93.7	164.6	158.6	-57.6	94.3	0	0	0	109.7	D2 A31 R38 V100 L163 E167 V168	D2-W133 HydrophobicContact CB-CE3 4.42Å; D2-W133 HydrophobicContact CB-CZ3 4.05Å; A31-W133 PolarHBondContact O-N 2.69Å; R38-W133 VanDerWaalsContact NH1-CZ2 3.29Å; V100-W133 HydrophobicContact CB-CD2 4.34Å; V100-W133 HydrophobicContact CB-CE3 4.43Å; V100-W133 HydrophobicContact CB-CZ2 4.5Å; V100-W133 HydrophobicContact CG1-CD2 3.96Å; V100-W133 HydrophobicContact CG1-CG 4.15Å; V100-W133 HydrophobicContact CG1-CZ2 4.42Å; V100-W133 HydrophobicContact CG2-CD2 4.03Å; V100-W133 HydrophobicContact CG2-CE3 3.77Å; V100-W133 HydrophobicContact CG2-CZ3 4.05Å; W133-L163 HydrophobicContact CB-CD1 3.56Å; W133-L163 HydrophobicContact CD2-CD1 3.35Å; W133-L163 HydrophobicContact CE3-CD1 3.6Å; W133-L163 HydrophobicContact CG-CD1 3.38Å; W133-L163 HydrophobicContact CZ3-CD1 4.35Å; W133-E167 PolarHBondContact NE1-O 2.85Å; W133-V168 HydrophobicContact CB-CG2 4.36Å; W133-V168 HydrophobicContact CG-CG2 3.92Å
134	H	91.1	Very high	91.7	Very high	5 Å²	5	16.8 Å²	16.8	2%	0.023	8%	0.084	C	C	.	.	P	Polyproline II helix	trans	-61.9	137	178.7	-59.3	111.4	0	0	0	113.4	D2 H124 H128 H136 T137 M181 Y183	D2-H134 IonicContact OD1-CE1 3.11Å; D2-H134 PolarHBondContact OD1-CE1 3.21Å; D2-H134 IonicContact OD1-ND1 2.7Å; D2-H134 IonicContact OD2-CE1 3.81Å; D2-H134 IonicContact OD2-ND1 3.15Å; D2-H134 PolarHBondContact OD2-ND1 2.92Å; H124-H134 AromaticContact CE1-CD2 3.49Å; H124-H134 PolarHBondContact CE1-CD2 3.3Å; H124-H134 VanDerWaalsContact CE1-CD2 3.49Å; H124-H134 AromaticContact CE1-NE2 3.57Å; H124-H134 AromaticContact NE2-CD2 3.49Å; H124-H134 PolarHBondContact NE2-CD2 3.16Å; H124-H134 AromaticContact NE2-NE2 3.04Å; H124-H134 PolarHBondContact NE2-NE2 2.96Å; H128-H134 AromaticContact CE1-CD2 3.81Å; H128-H134 AromaticContact CE1-CE1 3.33Å; H128-H134 PolarHBondContact CE1-CE1 2.79Å; H128-H134 AromaticContact CE1-ND1 3.98Å; H128-H134 AromaticContact CE1-NE2 3.22Å; H128-H134 PolarHBondContact CE1-NE2 3.35Å; H128-H134 AromaticContact NE2-CD2 3.94Å; H128-H134 AromaticContact NE2-CE1 3.35Å; H128-H134 PolarHBondContact NE2-CE1 3.28Å; H128-H134 VanDerWaalsContact NE2-CE1 3.35Å; H128-H134 AromaticContact NE2-NE2 3.01Å; H128-H134 PolarHBondContact NE2-NE2 2.84Å; H134-H136 WeakPolarHBondContact CB-CE1 3.39Å; H134-H136 WeakPolarHBondContact CB-ND1 3.48Å; H134-H136 AromaticContact CG-CE1 3.8Å; H134-H136 PolarHBondContact O-N 3.32Å; H134-T137 HydrophobicContact CB-CG2 4Å; H134-T137 WeakPolarHBondContact O-CB 3.06Å; H134-T137 PolarHBondContact O-N 3.09Å; H134-T137 PolarHBondContact O-OG1 3.1Å; H134-M181 CarbonylContact C-O 3.3Å; H134-M181 WeakPolarHBondContact CA-O 3.24Å; H134-M181 WeakPolarHBondContact CB-O 3.32Å; H134-M181 PolarHBondContact CD2-O 2.97Å; H134-Y183 AromaticContact CD2-CD1 3.97Å; H134-Y183 AromaticContact CD2-CE1 3.55Å; H134-Y183 AromaticContact CE1-CE1 3.59Å; H134-Y183 AromaticContact CE1-CZ 3.84Å; H134-Y183 PolarHBondContact CE1-OH 2.8Å; H134-Y183 AromaticContact CG-CE1 3.8Å; H134-Y183 AromaticContact ND1-CE1 3.83Å; H134-Y183 AromaticContact ND1-CZ 3.9Å; H134-Y183 AromaticContact NE2-CE1 3.41Å; H134-Y183 WeakPolarHBondContact NE2-CE1 3.34Å
135	E	92.3	Very high	91.7	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.009	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-61.2	-29.8	-175.9	178.3	78.5	162.2	0	0	111.8	R30 T137 R138 Y175 D176 M181	R30-E135 IonicContact NH1-OE1 3.67Å; R30-E135 PolarHBondContact NH1-OE1 3.43Å; R30-E135 VanDerWaalsContact NH1-OE1 3.15Å; E135-T137 VanDerWaalsContact C-N 3.27Å; E135-T137 PolarHBondContact O-N 3.25Å; E135-R138 VanDerWaalsContact O-CD 3.24Å; E135-R138 WeakPolarHBondContact O-CD 3.39Å; E135-R138 VanDerWaalsContact O-CG 3.22Å; E135-R138 WeakPolarHBondContact O-CG 3.28Å; E135-R138 PolarHBondContact O-N 3.17Å; E135-R138 IonicContact OE1-CZ 3.18Å; E135-R138 IonicContact OE1-NH1 2.73Å; E135-R138 PolarHBondContact OE1-NH1 3.49Å; E135-R138 WeakPolarHBondContact OE2-CD 3.32Å; E135-R138 IonicContact OE2-CZ 2.76Å; E135-R138 IonicContact OE2-NE 3.87Å; E135-R138 IonicContact OE2-NH1 2.77Å; E135-R138 PolarHBondContact OE2-NH1 2.93Å; E135-R138 VanDerWaalsContact OE2-NH1 3.11Å; E135-Y175 HydrophobicContact CG-CE1 4.38Å; E135-Y175 HydrophobicContact CG-CE2 4.3Å; E135-D176 PolarHBondContact OE1-N 3.49Å; E135-M181 PolarHBondContact N-O 3.46Å
136	H	90.7	Very high	91.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-77.1	-1.6	175	76.9	-79	0	0	0	114.6	H134 R141 N159 Y183 I197	H134-H136 WeakPolarHBondContact CB-CE1 3.39Å; H134-H136 WeakPolarHBondContact CB-ND1 3.48Å; H134-H136 AromaticContact CG-CE1 3.8Å; H134-H136 PolarHBondContact O-N 3.32Å; H136-R141 WeakPolarHBondContact O-CD 3.41Å; H136-R141 PolarHBondContact O-NH1 2.9Å; H136-N159 PolarHBondContact NE2-O 3.1Å; H136-Y183 AromaticContact CE1-CD1 3.78Å; H136-Y183 AromaticContact CE1-CD2 3.16Å; H136-Y183 WeakPolarHBondContact CE1-CD2 3.39Å; H136-Y183 AromaticContact CE1-CE1 3.99Å; H136-Y183 AromaticContact CE1-CE2 3.38Å; H136-Y183 WeakPolarHBondContact CE1-CE2 3.34Å; H136-Y183 AromaticContact CE1-CG 3.36Å; H136-Y183 AromaticContact CE1-CZ 3.8Å; H136-Y183 AromaticContact ND1-CD2 3.87Å; H136-Y183 AromaticContact ND1-CG 3.71Å; H136-Y183 AromaticContact NE2-CD2 3.5Å; H136-Y183 WeakPolarHBondContact NE2-CD2 3.18Å; H136-Y183 AromaticContact NE2-CE2 3.61Å; H136-I197 HydrophobicContact CB-CD1 3.99Å
137	T	90.9	Very high	91.6	Very high	10 Å²	10	20 Å²	20	6%	0.061	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-92.9	2.2	174.8	66.5	0	0	0	0	113	H134 E135 K162 L163	H134-T137 HydrophobicContact CB-CG2 4Å; H134-T137 WeakPolarHBondContact O-CB 3.06Å; H134-T137 PolarHBondContact O-N 3.09Å; H134-T137 PolarHBondContact O-OG1 3.1Å; E135-T137 VanDerWaalsContact C-N 3.27Å; E135-T137 PolarHBondContact O-N 3.25Å; T137-K162 CarbonylContact O-C 3.52Å; T137-K162 VanDerWaalsContact O-CA 3.26Å; T137-K162 WeakPolarHBondContact O-CA 3.33Å; T137-L163 PolarHBondContact O-N 3.22Å; T137-L163 WeakPolarHBondContact OG1-CD1 3.23Å
138	R	88.4	Confident	91.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-64	148.9	-173.3	-78.4	171.5	43.9	164.1	0.8	114.9	R29 R30 A31 E135 D140 R141 K162	R29-R138 PolarHBondContact O-NH2 2.73Å; R30-R138 VanDerWaalsContact NH2-NH2 3.15Å; A31-R138 HydrophobicContact CB-CG 3.75Å; E135-R138 VanDerWaalsContact O-CD 3.24Å; E135-R138 WeakPolarHBondContact O-CD 3.39Å; E135-R138 VanDerWaalsContact O-CG 3.22Å; E135-R138 WeakPolarHBondContact O-CG 3.28Å; E135-R138 PolarHBondContact O-N 3.17Å; E135-R138 IonicContact OE1-CZ 3.18Å; E135-R138 IonicContact OE1-NH1 2.73Å; E135-R138 PolarHBondContact OE1-NH1 3.49Å; E135-R138 WeakPolarHBondContact OE2-CD 3.32Å; E135-R138 IonicContact OE2-CZ 2.76Å; E135-R138 IonicContact OE2-NE 3.87Å; E135-R138 IonicContact OE2-NH1 2.77Å; E135-R138 PolarHBondContact OE2-NH1 2.93Å; E135-R138 VanDerWaalsContact OE2-NH1 3.11Å; R138-D140 WeakPolarHBondContact CB-OD1 3.25Å; R138-D140 IonicContact CZ-OD1 2.67Å; R138-D140 VanDerWaalsContact CZ-OD1 3.27Å; R138-D140 IonicContact CZ-OD2 3.16Å; R138-D140 IonicContact NE-OD1 3.65Å; R138-D140 PolarHBondContact NE-OD1 3.45Å; R138-D140 IonicContact NH2-OD1 3.89Å; R138-D140 PolarHBondContact NH2-OD1 2.67Å; R138-D140 IonicContact NH2-OD2 2.71Å; R138-D140 PolarHBondContact NH2-OD2 2.88Å; R138-D140 PolarHBondContact O-N 3.02Å; R138-R141 HydrophobicContact CB-CB 4.41Å; R138-R141 PolarHBondContact O-N 2.91Å; R138-K162 WeakPolarHBondContact O-CD 3.39Å; R138-K162 WeakPolarHBondContact O-CG 3.43Å
139	P	87.4	Confident	91.4	Very high	29 Å²	29	29.3 Å²	29.3	19%	0.188	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-16.4	173.1	-25.8	32.2	0	0	0	116.2	P165 V168	P139-P165 HydrophobicContact CB-CG 4.38Å; P139-P165 HydrophobicContact CG-CG 4.23Å; P139-V168 HydrophobicContact CG-CG1 4.32Å
140	D	88.8	Confident	91.2	Very high	7 Å²	7	38.1 Å²	38.1	4%	0.037	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.3	5.3	-171.5	73.2	-39.8	0	0	0	116.1	R29 R138 D142 L143	R29-D140 HydrophobicContact CB-CB 3.87Å; R29-D140 VanDerWaalsContact CB-CG 3.44Å; R29-D140 VanDerWaalsContact CB-OD2 3.27Å; R29-D140 WeakPolarHBondContact CB-OD2 3.45Å; R29-D140 HydrophobicContact CG-CB 3.87Å; R29-D140 VanDerWaalsContact CZ-CB 3.42Å; R29-D140 VanDerWaalsContact NH1-CB 3.33Å; R138-D140 WeakPolarHBondContact CB-OD1 3.25Å; R138-D140 IonicContact CZ-OD1 2.67Å; R138-D140 VanDerWaalsContact CZ-OD1 3.27Å; R138-D140 IonicContact CZ-OD2 3.16Å; R138-D140 IonicContact NE-OD1 3.65Å; R138-D140 PolarHBondContact NE-OD1 3.45Å; R138-D140 IonicContact NH2-OD1 3.89Å; R138-D140 PolarHBondContact NH2-OD1 2.67Å; R138-D140 IonicContact NH2-OD2 2.71Å; R138-D140 PolarHBondContact NH2-OD2 2.88Å; R138-D140 PolarHBondContact O-N 3.02Å; D140-D142 PolarHBondContact O-N 2.92Å; D140-L143 PolarHBondContact O-N 2.75Å; D140-L143 VanDerWaalsContact O-N 3.11Å
141	R	90.6	Very high	91.1	Very high	5 Å²	5	39.8 Å²	39.8	2%	0.019	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-49.1	-30.6	-179.6	76.2	-172.8	-177.8	-169.5	2.2	113.7	H136 R138 L143 Y144 V145 Y149 F160 E161 K162	H136-R141 WeakPolarHBondContact O-CD 3.41Å; H136-R141 PolarHBondContact O-NH1 2.9Å; R138-R141 HydrophobicContact CB-CB 4.41Å; R138-R141 PolarHBondContact O-N 2.91Å; R141-L143 PolarHBondContact O-N 3.27Å; R141-Y144 CarbonylContact O-C 3.47Å; R141-Y144 WeakPolarHBondContact O-CA 3.34Å; R141-Y144 PolarHBondContact O-N 3.33Å; R141-V145 HydrophobicContact CB-CG2 3.93Å; R141-V145 HydrophobicContact CG-CG2 4.17Å; R141-V145 PolarHBondContact O-N 3.21Å; R141-Y149 PolarHBondContact NH2-OH 3.47Å; R141-F160 PolarHBondContact NH1-O 2.01Å; R141-F160 PolarHBondContact NH2-O 3.12Å; R141-E161 PolarHBondContact NH1-O 3.25Å; R141-K162 HydrophobicContact CG-CD 4.24Å; R141-K162 VanDerWaalsContact CZ-CG 3.41Å
142	D	91.9	Very high	91	Very high	76 Å²	76	39.9 Å²	39.9	41%	0.406	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-66.6	-8	-174.4	-39.1	-29.9	0	0	0	112.5	D140 K162 K200	D140-D142 PolarHBondContact O-N 2.92Å; D142-K162 IonicContact OD1-NZ 3.99Å; D142-K162 IonicContact OD2-NZ 2.73Å; D142-K162 PolarHBondContact OD2-NZ 3.26Å; D142-K200 WeakPolarHBondContact O-CE 3.1Å
143	L	90.5	Very high	90.8	Very high	108 Å²	108	43 Å²	43	57%	0.565	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-82.6	-11	167.9	-62.8	-174	0	0	0	113.7	R29 D140 R141	R29-L143 VanDerWaalsContact NH1-CD1 3.25Å; D140-L143 PolarHBondContact O-N 2.75Å; D140-L143 VanDerWaalsContact O-N 3.11Å; R141-L143 PolarHBondContact O-N 3.27Å
144	Y	91.6	Very high	90.7	Very high	64 Å²	64	50.7 Å²	50.7	25%	0.251	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132	-35	-165.6	-57	-77.4	0	0	0	113.4	R141 Y175 F177 K200	R141-Y144 CarbonylContact O-C 3.47Å; R141-Y144 WeakPolarHBondContact O-CA 3.34Å; R141-Y144 PolarHBondContact O-N 3.33Å; Y144-Y175 HydrophobicContact CD1-CD1 4.12Å; Y144-Y175 AromaticContact CD1-CD2 3.86Å; Y144-Y175 HydrophobicContact CD1-CD2 3.86Å; Y144-Y175 AromaticContact CD1-CG 3.54Å; Y144-Y175 HydrophobicContact CD1-CG 3.54Å; Y144-Y175 AromaticContact CD2-CD2 3.16Å; Y144-Y175 HydrophobicContact CD2-CD2 3.16Å; Y144-Y175 AromaticContact CD2-CE2 3.58Å; Y144-Y175 HydrophobicContact CD2-CE2 3.58Å; Y144-Y175 AromaticContact CD2-CG 3.78Å; Y144-Y175 HydrophobicContact CD2-CG 3.78Å; Y144-Y175 VanDerWaalsContact CE1-CB 3.44Å; Y144-Y175 HydrophobicContact CE1-CD2 4.18Å; Y144-Y175 AromaticContact CE1-CG 3.91Å; Y144-Y175 HydrophobicContact CE1-CG 3.91Å; Y144-Y175 AromaticContact CE2-CD2 3.53Å; Y144-Y175 HydrophobicContact CE2-CD2 3.53Å; Y144-Y175 HydrophobicContact CE2-CE2 4.31Å; Y144-Y175 HydrophobicContact CE2-CG 4.13Å; Y144-Y175 AromaticContact CG-CD1 4Å; Y144-Y175 HydrophobicContact CG-CD1 4Å; Y144-Y175 AromaticContact CG-CD2 3.33Å; Y144-Y175 HydrophobicContact CG-CD2 3.33Å; Y144-Y175 HydrophobicContact CG-CE1 4.41Å; Y144-Y175 AromaticContact CG-CE2 3.78Å; Y144-Y175 HydrophobicContact CG-CE2 3.78Å; Y144-Y175 AromaticContact CG-CG 3.46Å; Y144-Y175 HydrophobicContact CG-CG 3.46Å; Y144-Y175 VanDerWaalsContact CG-CG 3.46Å; Y144-F177 HydrophobicContact CD1-CZ 4.27Å; Y144-F177 WeakPolarHBondContact O-CE1 3.34Å; Y144-K200 WeakPolarHBondContact O-CB 3.31Å; Y144-K200 WeakPolarHBondContact O-CG 3.4Å; Y144-K200 PolarHBondContact O-N 3.12Å
145	V	93.4	Very high	90.4	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.3	177.5	-60.1	0	0	0	0	111	R141 I147 F177 I197 L198	R141-V145 HydrophobicContact CB-CG2 3.93Å; R141-V145 HydrophobicContact CG-CG2 4.17Å; R141-V145 PolarHBondContact O-N 3.21Å; V145-I147 HydrophobicContact CG2-CD1 4.01Å; V145-F177 HydrophobicContact CG1-CE1 4.13Å; V145-I197 HydrophobicContact CB-CG2 3.91Å; V145-I197 HydrophobicContact CG1-CG2 4.07Å; V145-I197 HydrophobicContact CG2-CG2 4.29Å; V145-L198 WeakPolarHBondContact CA-O 3.28Å
146	D	93.5	Very high	90.1	Very high	63 Å²	63	54.5 Å²	54.5	34%	0.337	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	137.4	166.8	-70	-62	0	0	0	109.8	L198 K200	D146-L198 PolarHBondContact N-O 2.73Å; D146-L198 PolarHBondContact O-N 3Å; D146-K200 IonicContact OD1-NZ 2.69Å; D146-K200 PolarHBondContact OD1-NZ 3.05Å; D146-K200 IonicContact OD2-NZ 3.94Å; D146-K200 PolarHBondContact OD2-NZ 3.32Å
147	I	93.4	Very high	89.9	Confident	26 Å²	26	58.5 Å²	58.5	13%	0.133	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	118.1	179.8	-51.2	-55.2	0	0	0	109.3	V145 Y149 I152 F160 T196 I197	V145-I147 HydrophobicContact CG2-CD1 4.01Å; I147-Y149 HydrophobicContact CB-CD2 4.32Å; I147-Y149 HydrophobicContact CB-CE2 3.98Å; I147-Y149 HydrophobicContact CG2-CD2 3.98Å; I147-Y149 HydrophobicContact CG2-CE1 4.3Å; I147-Y149 HydrophobicContact CG2-CE2 3.75Å; I147-Y149 HydrophobicContact CG2-CG 4.36Å; I147-Y149 PolarHBondContact O-N 3.42Å; I147-I152 HydrophobicContact CG2-CD1 4.13Å; I147-F160 HydrophobicContact CG2-CB 3.98Å; I147-F160 HydrophobicContact CG2-CD1 3.98Å; I147-F160 HydrophobicContact CG2-CG 4.25Å; I147-T196 WeakPolarHBondContact CA-O 3.49Å; I147-I197 HydrophobicContact CD1-CB 4.39Å; I147-I197 HydrophobicContact CD1-CG1 4.02Å; I147-I197 HydrophobicContact CD1-CG2 3.99Å
148	F	93.1	Very high	89.6	Confident	87 Å²	87	60.1 Å²	60.1	38%	0.382	30%	0.295	S	S	.	.			trans	-90.5	77.1	179.4	-69.8	-74.5	0	0	0	111.7	K150 N151 D195 T196 L198	F148-K150 PolarHBondContact O-N 3.1Å; F148-N151 HydrophobicContact CB-CB 4.12Å; F148-N151 WeakPolarHBondContact O-CB 3.5Å; F148-N151 PolarHBondContact O-N 2.77Å; F148-D195 WeakPolarHBondContact CB-O 3.3Å; F148-D195 HydrophobicContact CD2-CB 4.49Å; F148-T196 PolarHBondContact N-O 2.81Å; F148-L198 HydrophobicContact CD2-CB 4.33Å; F148-L198 HydrophobicContact CE2-CB 3.67Å; F148-L198 HydrophobicContact CE2-CD2 3.85Å; F148-L198 HydrophobicContact CE2-CG 4.43Å; F148-L198 HydrophobicContact CZ-CD2 4.26Å
149	Y	91.3	Very high	89.5	Confident	113 Å²	113	60.5 Å²	60.5	44%	0.443	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-23.3	180	-74.5	-82.4	0	0	0	115.8	R141 I147 N151 I152 D157 F160	R141-Y149 PolarHBondContact NH2-OH 3.47Å; I147-Y149 HydrophobicContact CB-CD2 4.32Å; I147-Y149 HydrophobicContact CB-CE2 3.98Å; I147-Y149 HydrophobicContact CG2-CD2 3.98Å; I147-Y149 HydrophobicContact CG2-CE1 4.3Å; I147-Y149 HydrophobicContact CG2-CE2 3.75Å; I147-Y149 HydrophobicContact CG2-CG 4.36Å; I147-Y149 PolarHBondContact O-N 3.42Å; Y149-N151 VanDerWaalsContact C-N 3.33Å; Y149-I152 HydrophobicContact CD1-CD1 3.76Å; Y149-I152 HydrophobicContact CE1-CD1 4.29Å; Y149-I152 HydrophobicContact CG-CD1 4.28Å; Y149-D157 HydrophobicContact CD1-CB 4.3Å; Y149-F160 HydrophobicContact CE1-CB 4.2Å; Y149-F160 PolarHBondContact OH-O 2.82Å
150	K	91	Very high	89.6	Confident	185 Å²	185	59.1 Å²	59.1	80%	0.804	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-23.1	174.6	-64.2	-173.8	179.3	-176.6	0	113.8	F148 R190	F148-K150 PolarHBondContact O-N 3.1Å; K150-R190 PolarHBondContact O-NE 2.61Å
151	N	92.1	Very high	89.6	Confident	36 Å²	36	63.2 Å²	63.2	19%	0.193	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-14.5	-176.4	-61.6	0.8	0	0	0	111.9	F148 Y149 S189 R190 L194 D195 T196	F148-N151 HydrophobicContact CB-CB 4.12Å; F148-N151 WeakPolarHBondContact O-CB 3.5Å; F148-N151 PolarHBondContact O-N 2.77Å; Y149-N151 VanDerWaalsContact C-N 3.33Å; N151-S189 WeakPolarHBondContact O-CA 3.37Å; N151-R190 WeakPolarHBondContact O-CG 3.26Å; N151-R190 PolarHBondContact O-N 3.42Å; N151-L194 HydrophobicContact CB-CB 4.19Å; N151-D195 PolarHBondContact ND2-O 3.13Å; N151-T196 HydrophobicContact CB-CG2 4.31Å
152	I	89.2	Confident	89.6	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-74.7	137.5	179.7	-51	169.6	0	0	0	110.2	I147 Y149 Q156 F160 F188 R190 T196	I147-I152 HydrophobicContact CG2-CD1 4.13Å; Y149-I152 HydrophobicContact CD1-CD1 3.76Å; Y149-I152 HydrophobicContact CE1-CD1 4.29Å; Y149-I152 HydrophobicContact CG-CD1 4.28Å; I152-Q156 HydrophobicContact CG2-CB 4Å; I152-F160 HydrophobicContact CD1-CB 4.13Å; I152-F160 HydrophobicContact CD1-CD1 4.2Å; I152-F160 HydrophobicContact CD1-CD2 3.55Å; I152-F160 HydrophobicContact CD1-CE1 4.5Å; I152-F160 HydrophobicContact CD1-CE2 3.92Å; I152-F160 HydrophobicContact CD1-CG 3.7Å; I152-F160 HydrophobicContact CD1-CZ 4.37Å; I152-F160 HydrophobicContact CG1-CD2 4.29Å; I152-F160 HydrophobicContact CG1-CE2 4.14Å; I152-F160 HydrophobicContact CG1-CZ 4.37Å; I152-F160 HydrophobicContact CG2-CD2 4.07Å; I152-F160 HydrophobicContact CG2-CE2 3.65Å; I152-F160 HydrophobicContact CG2-CZ 4.41Å; I152-F188 CarbonylContact C-O 3.57Å; I152-F188 WeakPolarHBondContact CA-O 3.45Å; I152-F188 HydrophobicContact CG2-CB 4.19Å; I152-R190 PolarHBondContact O-NE 2.69Å; I152-R190 PolarHBondContact O-NH2 3.39Å; I152-T196 HydrophobicContact CB-CG2 4.43Å; I152-T196 HydrophobicContact CG1-CG2 3.87Å
153	Q	87.2	Confident	89.3	Confident	68 Å²	68	64.6 Å²	64.6	32%	0.318	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-49.4	147.2	171.4	-71.2	162	-2.6	0	0	111.9	G155 Q156 F188 S189	Q153-G155 PolarHBondContact O-N 3.38Å; Q153-Q156 HydrophobicContact CB-CB 4.11Å; Q153-Q156 HydrophobicContact CB-CG 3.9Å; Q153-Q156 PolarHBondContact O-N 3.18Å; Q153-Q156 VanDerWaalsContact O-N 3.14Å; Q153-F188 WeakPolarHBondContact CG-O 3.38Å; Q153-F188 PolarHBondContact N-O 3.4Å; Q153-S189 WeakPolarHBondContact CG-O 3.32Å; Q153-S189 PolarHBondContact NE2-O 3.11Å
154	Q	86.5	Confident	88.9	Confident	179 Å²	179	65 Å²	65	84%	0.836	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	122.6	-174.7	-178.9	166.9	-29.5	0	0	110.6
155	G	84.9	Confident	88.1	Confident	45 Å²	45	67.1 Å²	67.1	46%	0.464	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	-7.3	-176.6	0	0	0	0	0	114.9	Q153 Y158	Q153-G155 PolarHBondContact O-N 3.38Å; G155-Y158 VanDerWaalsContact O-CD1 3.24Å; G155-Y158 WeakPolarHBondContact O-CD1 3.16Å
156	Q	86.5	Confident	87.3	Confident	42 Å²	42	71 Å²	71	20%	0.196	36%	0.357	C	S	.	.			trans	-94	5.3	176.4	-62.6	-65	-5.5	0	0	113.4	I152 Q153 Y158 N159 F160 F188	I152-Q156 HydrophobicContact CG2-CB 4Å; Q153-Q156 HydrophobicContact CB-CB 4.11Å; Q153-Q156 HydrophobicContact CB-CG 3.9Å; Q153-Q156 PolarHBondContact O-N 3.18Å; Q153-Q156 VanDerWaalsContact O-N 3.14Å; Q156-Y158 VanDerWaalsContact C-N 3.27Å; Q156-Y158 PolarHBondContact O-N 3.49Å; Q156-N159 WeakPolarHBondContact O-CB 3.5Å; Q156-N159 PolarHBondContact O-N 3.18Å; Q156-N159 PolarHBondContact O-ND2 2.73Å; Q156-N159 PolarHBondContact OE1-ND2 3.01Å; Q156-F160 WeakPolarHBondContact O-CD2 3.49Å; Q156-F188 HydrophobicContact CB-CB 3.91Å; Q156-F188 HydrophobicContact CB-CD1 3.97Å; Q156-F188 HydrophobicContact CB-CG 3.96Å; Q156-F188 HydrophobicContact CG-CB 4.44Å; Q156-F188 HydrophobicContact CG-CD1 3.77Å; Q156-F188 HydrophobicContact CG-CE1 4.38Å; Q156-F188 HydrophobicContact CG-CG 4.29Å
157	D	85.3	Confident	86.3	Confident	83 Å²	83	69.8 Å²	69.8	44%	0.444	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-68.7	-22.4	-178.9	59.2	-59.5	0	0	0	113.7	Y149 N159 F160	Y149-D157 HydrophobicContact CD1-CB 4.3Å; D157-N159 PolarHBondContact O-N 3.32Å; D157-F160 PolarHBondContact O-N 2.79Å
158	Y	86.1	Confident	85.6	Confident	44 Å²	44	68.7 Å²	68.7	17%	0.173	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-63.5	-26.9	176.2	80.6	-92.6	0	0	0	113.2	M1 K3 E4 G155 Q156 F160 E161	M1-Y158 VanDerWaalsContact CA-OH 3.24Å; M1-Y158 WeakPolarHBondContact CA-OH 3.22Å; M1-Y158 PolarHBondContact N-OH 3.22Å; K3-Y158 HydrophobicContact CB-CD2 4.26Å; K3-Y158 HydrophobicContact CB-CE2 4.19Å; K3-Y158 HydrophobicContact CD-CD2 4.42Å; E4-Y158 HydrophobicContact CG-CE2 4.18Å; E4-Y158 WeakPolarHBondContact CG-OH 3.41Å; E4-Y158 VanDerWaalsContact OE2-CZ 3.29Å; E4-Y158 PolarHBondContact OE2-OH 3.47Å; G155-Y158 VanDerWaalsContact O-CD1 3.24Å; G155-Y158 WeakPolarHBondContact O-CD1 3.16Å; Q156-Y158 VanDerWaalsContact C-N 3.27Å; Q156-Y158 PolarHBondContact O-N 3.49Å; Y158-F160 PolarHBondContact O-N 2.74Å; Y158-F160 VanDerWaalsContact O-N 3.16Å; Y158-E161 PolarHBondContact O-N 2.96Å
159	N	85.1	Confident	84.9	Confident	8 Å²	8	67.8 Å²	67.8	4%	0.043	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-62.7	-16.6	172.6	-61.1	-68.3	0	0	0	113	M1 H136 Q156 D157 Y183 F188	M1-N159 PolarHBondContact N-OD1 2.84Å; H136-N159 PolarHBondContact NE2-O 3.1Å; Q156-N159 WeakPolarHBondContact O-CB 3.5Å; Q156-N159 PolarHBondContact O-N 3.18Å; Q156-N159 PolarHBondContact O-ND2 2.73Å; Q156-N159 PolarHBondContact OE1-ND2 3.01Å; D157-N159 PolarHBondContact O-N 3.32Å; N159-Y183 HydrophobicContact CB-CE2 4.19Å; N159-F188 HydrophobicContact CB-CD2 4.09Å; N159-F188 HydrophobicContact CB-CE2 3.94Å
160	F	90.6	Very high	84	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-114.5	18.5	-177.1	-53.4	-102	0	0	0	111.1	R141 I147 Y149 I152 Q156 D157 Y158 Y183 T187 F188 I197	R141-F160 PolarHBondContact NH1-O 2.01Å; R141-F160 PolarHBondContact NH2-O 3.12Å; I147-F160 HydrophobicContact CG2-CB 3.98Å; I147-F160 HydrophobicContact CG2-CD1 3.98Å; I147-F160 HydrophobicContact CG2-CG 4.25Å; Y149-F160 HydrophobicContact CE1-CB 4.2Å; Y149-F160 PolarHBondContact OH-O 2.82Å; I152-F160 HydrophobicContact CD1-CB 4.13Å; I152-F160 HydrophobicContact CD1-CD1 4.2Å; I152-F160 HydrophobicContact CD1-CD2 3.55Å; I152-F160 HydrophobicContact CD1-CE1 4.5Å; I152-F160 HydrophobicContact CD1-CE2 3.92Å; I152-F160 HydrophobicContact CD1-CG 3.7Å; I152-F160 HydrophobicContact CD1-CZ 4.37Å; I152-F160 HydrophobicContact CG1-CD2 4.29Å; I152-F160 HydrophobicContact CG1-CE2 4.14Å; I152-F160 HydrophobicContact CG1-CZ 4.37Å; I152-F160 HydrophobicContact CG2-CD2 4.07Å; I152-F160 HydrophobicContact CG2-CE2 3.65Å; I152-F160 HydrophobicContact CG2-CZ 4.41Å; Q156-F160 WeakPolarHBondContact O-CD2 3.49Å; D157-F160 PolarHBondContact O-N 2.79Å; Y158-F160 PolarHBondContact O-N 2.74Å; Y158-F160 VanDerWaalsContact O-N 3.16Å; F160-Y183 HydrophobicContact CE1-CD2 4.41Å; F160-Y183 HydrophobicContact CZ-CD2 4.42Å; F160-T187 WeakPolarHBondContact CZ-O 3.35Å; F160-F188 HydrophobicContact CE2-CB 3.98Å; F160-F188 AromaticContact CE2-CD2 3.79Å; F160-F188 HydrophobicContact CE2-CD2 3.79Å; F160-F188 HydrophobicContact CE2-CG 4.31Å; F160-F188 HydrophobicContact CZ-CB 4.11Å; F160-F188 AromaticContact CZ-CD2 3.95Å; F160-F188 HydrophobicContact CZ-CD2 3.95Å; F160-I197 HydrophobicContact CD1-CD1 4.28Å; F160-I197 HydrophobicContact CD1-CG1 4.16Å; F160-I197 HydrophobicContact CE1-CD1 3.87Å; F160-I197 HydrophobicContact CE1-CG1 3.71Å
161	E	88.5	Confident	83.4	Confident	94 Å²	94	55.6 Å²	55.6	44%	0.439	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-68.9	163.6	165.2	-74.2	-171.4	144.5	0	0	111.7	K3 R141 Y158	K3-E161 IonicContact NZ-OE2 2.76Å; K3-E161 PolarHBondContact NZ-OE2 3.47Å; R141-E161 PolarHBondContact NH1-O 3.25Å; Y158-E161 PolarHBondContact O-N 2.96Å
162	K	89.7	Confident	82.6	Confident	93 Å²	93	57 Å²	57	40%	0.404	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-99.7	127.1	170.2	-69.4	-178.7	-68.8	-174.4	0	109.9	T137 R138 R141 D142	T137-K162 CarbonylContact O-C 3.52Å; T137-K162 VanDerWaalsContact O-CA 3.26Å; T137-K162 WeakPolarHBondContact O-CA 3.33Å; R138-K162 WeakPolarHBondContact O-CD 3.39Å; R138-K162 WeakPolarHBondContact O-CG 3.43Å; R141-K162 HydrophobicContact CG-CD 4.24Å; R141-K162 VanDerWaalsContact CZ-CG 3.41Å; D142-K162 IonicContact OD1-NZ 3.99Å; D142-K162 IonicContact OD2-NZ 2.73Å; D142-K162 PolarHBondContact OD2-NZ 3.26Å
163	L	85.3	Confident	82.3	Confident	17 Å²	17	60 Å²	60	9%	0.089	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-68.8	155.8	175.6	-68.5	172	0	0	0	111.1	W133 T137 V168	W133-L163 HydrophobicContact CB-CD1 3.56Å; W133-L163 HydrophobicContact CD2-CD1 3.35Å; W133-L163 HydrophobicContact CE3-CD1 3.6Å; W133-L163 HydrophobicContact CG-CD1 3.38Å; W133-L163 HydrophobicContact CZ3-CD1 4.35Å; T137-L163 PolarHBondContact O-N 3.22Å; T137-L163 WeakPolarHBondContact OG1-CD1 3.23Å; L163-V168 HydrophobicContact CB-CB 4.2Å; L163-V168 HydrophobicContact CB-CG2 3.59Å; L163-V168 HydrophobicContact CD1-CG2 3.5Å; L163-V168 VanDerWaalsContact CD1-CG2 3.5Å; L163-V168 HydrophobicContact CG-CG2 4.18Å
164	K	82.1	Confident	82.3	Confident	115 Å²	115	61 Å²	61	50%	0.5	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-77.3	148.6	-176.6	-57	177.2	-151.7	75.5	0	110.4	S166 E167 V168	K164-S166 PolarHBondContact O-N 2.86Å; K164-E167 HydrophobicContact CB-CG 4.45Å; K164-E167 VanDerWaalsContact CB-OE2 3.24Å; K164-E167 WeakPolarHBondContact CB-OE2 3.49Å; K164-E167 WeakPolarHBondContact CG-OE2 3.26Å; K164-E167 PolarHBondContact N-OE2 3.05Å; K164-E167 VanDerWaalsContact N-OE2 3.12Å; K164-E167 IonicContact NZ-OE1 2.88Å; K164-E167 PolarHBondContact NZ-OE1 2.86Å; K164-E167 IonicContact NZ-OE2 2.65Å; K164-E167 PolarHBondContact NZ-OE2 2.93Å; K164-E167 PolarHBondContact O-N 3.26Å; K164-V168 PolarHBondContact O-N 3.09Å
165	P	75.9	Confident	82.4	Confident	109 Å²	109	53.5 Å²	53.5	71%	0.708	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-7.1	173.2	-25.2	35	0	0	0	116	P139	P139-P165 HydrophobicContact CB-CG 4.38Å; P139-P165 HydrophobicContact CG-CG 4.23Å
166	S	75.2	Confident	82.8	Confident	84 Å²	84	52.1 Å²	52.1	59%	0.587	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-17.2	172.5	54.6	0	0	0	0	114	K164	K164-S166 PolarHBondContact O-N 2.86Å
167	E	72.8	Confident	83	Confident	36 Å²	36	52 Å²	52	17%	0.168	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-21.1	-179.4	-72.3	150.4	-177.5	0	0	111.3	G34 W133 K164	G34-E167 PolarHBondContact N-O 2.72Å; W133-E167 PolarHBondContact NE1-O 2.85Å; K164-E167 HydrophobicContact CB-CG 4.45Å; K164-E167 VanDerWaalsContact CB-OE2 3.24Å; K164-E167 WeakPolarHBondContact CB-OE2 3.49Å; K164-E167 WeakPolarHBondContact CG-OE2 3.26Å; K164-E167 PolarHBondContact N-OE2 3.05Å; K164-E167 VanDerWaalsContact N-OE2 3.12Å; K164-E167 IonicContact NZ-OE1 2.88Å; K164-E167 PolarHBondContact NZ-OE1 2.86Å; K164-E167 IonicContact NZ-OE2 2.65Å; K164-E167 PolarHBondContact NZ-OE2 2.93Å; K164-E167 PolarHBondContact O-N 3.26Å
168	V	78.7	Confident	83.4	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.018	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	118.5	-164.9	154.2	0	0	0	0	110.3	R30 A32 W133 P139 L163 K164	R30-V168 WeakPolarHBondContact O-CG1 3.43Å; A32-V168 CarbonylContact O-C 3.57Å; A32-V168 WeakPolarHBondContact O-CA 3.39Å; W133-V168 HydrophobicContact CB-CG2 4.36Å; W133-V168 HydrophobicContact CG-CG2 3.92Å; P139-V168 HydrophobicContact CG-CG1 4.32Å; L163-V168 HydrophobicContact CB-CB 4.2Å; L163-V168 HydrophobicContact CB-CG2 3.59Å; L163-V168 HydrophobicContact CD1-CG2 3.5Å; L163-V168 VanDerWaalsContact CD1-CG2 3.5Å; L163-V168 HydrophobicContact CG-CG2 4.18Å; K164-V168 PolarHBondContact O-N 3.09Å
169	N	79.2	Confident	83.8	Confident	68 Å²	68	48.3 Å²	48.3	36%	0.364	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	152.1	-175.8	-176.9	20.1	0	0	0	112.1	R30 A32	R30-N169 CarbonylContact C-O 3.53Å; R30-N169 VanDerWaalsContact C-O 3.3Å; R30-N169 CarbonylContact O-C 3.59Å; R30-N169 VanDerWaalsContact O-C 3.26Å; A32-N169 PolarHBondContact N-O 2.66Å; A32-N169 PolarHBondContact O-N 2.96Å
170	S	71.8	Confident	84.1	Confident	6 Å²	6	48 Å²	48	4%	0.042	28%	0.279	C	S	.	.			trans	-106.8	-33.1	-147.6	-51.6	0	0	0	0	114.7	N28 R29 R30 G172	N28-S170 VanDerWaalsContact C-OG 3.29Å; R29-S170 WeakPolarHBondContact CA-OG 3.47Å; R29-S170 VanDerWaalsContact N-CB 3.31Å; R29-S170 PolarHBondContact N-OG 3.09Å; R30-S170 WeakPolarHBondContact CB-O 3.38Å; R30-S170 WeakPolarHBondContact CD-O 3.35Å; R30-S170 WeakPolarHBondContact CG-O 3.25Å; R30-S170 PolarHBondContact N-OG 3.05Å; S170-G172 PolarHBondContact O-N 2.9Å
171	L	79.4	Confident	84.3	Confident	37 Å²	37	48 Å²	48	19%	0.194	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	13.2	-179.7	-46.1	-176.9	0	0	0	115.8	A32 Q173 Q224 T227 L228	A32-L171 HydrophobicContact CB-CD1 4.15Å; L171-Q173 PolarHBondContact O-NE2 3Å; L171-Q224 HydrophobicContact CD1-CB 4.36Å; L171-Q224 VanDerWaalsContact CD1-O 3.24Å; L171-Q224 WeakPolarHBondContact CD1-O 3.16Å; L171-T227 HydrophobicContact CB-CG2 3.95Å; L171-T227 HydrophobicContact CD1-CG2 4.31Å; L171-T227 HydrophobicContact CD2-CG2 4.29Å; L171-T227 HydrophobicContact CG-CG2 4.4Å; L171-L228 HydrophobicContact CD1-CB 3.84Å; L171-L228 HydrophobicContact CD1-CD1 4.16Å
172	G	74.9	Confident	84.5	Confident	64 Å²	64	43.6 Å²	43.6	66%	0.66	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-0.1	166	0	0	0	0	0	119.4	S170	S170-G172 PolarHBondContact O-N 2.9Å
173	Q	83	Confident	84.6	Confident	66 Å²	66	40 Å²	40	31%	0.308	24%	0.242	S	C	.	.			trans	-84.2	-174.7	-161.9	-46.9	-58.2	-38.2	0	0	116.1	R30 L171 I223 Q224	R30-Q173 PolarHBondContact NE-O 2.76Å; R30-Q173 PolarHBondContact NH2-O 2.75Å; L171-Q173 PolarHBondContact O-NE2 3Å; Q173-I223 VanDerWaalsContact CD-CG2 3.48Å; Q173-I223 HydrophobicContact CG-CG2 4.13Å; Q173-Q224 HydrophobicContact CG-CG 3.86Å
174	S	86.6	Confident	84.9	Confident	89 Å²	89	40.3 Å²	40.3	62%	0.622	25%	0.247	S	C	*	.			trans	-70.9	-88.4	-166.2	53.5	0	0	0	0	118.5	R30	R30-S174 VanDerWaalsContact CZ-C 3.5Å; R30-S174 PolarHBondContact NH2-O 3.17Å
175	Y	89.6	Confident	85.4	Confident	20 Å²	20	40.3 Å²	40.3	8%	0.078	24%	0.244	C	C	.	.			trans	-171.3	134.9	154	-175.7	-85.1	0	0	0	105.5	R30 E135 Y144 F177 H182	R30-Y175 VanDerWaalsContact NH1-CA 3.33Å; R30-Y175 VanDerWaalsContact NH2-N 3.16Å; E135-Y175 HydrophobicContact CG-CE1 4.38Å; E135-Y175 HydrophobicContact CG-CE2 4.3Å; Y144-Y175 HydrophobicContact CD1-CD1 4.12Å; Y144-Y175 AromaticContact CD1-CD2 3.86Å; Y144-Y175 HydrophobicContact CD1-CD2 3.86Å; Y144-Y175 AromaticContact CD1-CG 3.54Å; Y144-Y175 HydrophobicContact CD1-CG 3.54Å; Y144-Y175 AromaticContact CD2-CD2 3.16Å; Y144-Y175 HydrophobicContact CD2-CD2 3.16Å; Y144-Y175 AromaticContact CD2-CE2 3.58Å; Y144-Y175 HydrophobicContact CD2-CE2 3.58Å; Y144-Y175 AromaticContact CD2-CG 3.78Å; Y144-Y175 HydrophobicContact CD2-CG 3.78Å; Y144-Y175 VanDerWaalsContact CE1-CB 3.44Å; Y144-Y175 HydrophobicContact CE1-CD2 4.18Å; Y144-Y175 AromaticContact CE1-CG 3.91Å; Y144-Y175 HydrophobicContact CE1-CG 3.91Å; Y144-Y175 AromaticContact CE2-CD2 3.53Å; Y144-Y175 HydrophobicContact CE2-CD2 3.53Å; Y144-Y175 HydrophobicContact CE2-CE2 4.31Å; Y144-Y175 HydrophobicContact CE2-CG 4.13Å; Y144-Y175 AromaticContact CG-CD1 4Å; Y144-Y175 HydrophobicContact CG-CD1 4Å; Y144-Y175 AromaticContact CG-CD2 3.33Å; Y144-Y175 HydrophobicContact CG-CD2 3.33Å; Y144-Y175 HydrophobicContact CG-CE1 4.41Å; Y144-Y175 AromaticContact CG-CE2 3.78Å; Y144-Y175 HydrophobicContact CG-CE2 3.78Å; Y144-Y175 AromaticContact CG-CG 3.46Å; Y144-Y175 HydrophobicContact CG-CG 3.46Å; Y144-Y175 VanDerWaalsContact CG-CG 3.46Å; Y175-F177 AromaticContact CD1-CD1 3.86Å; Y175-F177 HydrophobicContact CD1-CD1 3.86Å; Y175-F177 AromaticContact CD1-CD2 3.7Å; Y175-F177 HydrophobicContact CD1-CD2 3.7Å; Y175-F177 AromaticContact CD1-CE1 3.74Å; Y175-F177 HydrophobicContact CD1-CE1 3.74Å; Y175-F177 AromaticContact CD1-CE2 3.57Å; Y175-F177 HydrophobicContact CD1-CE2 3.57Å; Y175-F177 AromaticContact CD1-CG 3.85Å; Y175-F177 HydrophobicContact CD1-CG 3.85Å; Y175-F177 AromaticContact CD1-CZ 3.59Å; Y175-F177 HydrophobicContact CD1-CZ 3.59Å; Y175-F177 AromaticContact CE1-CD1 3.55Å; Y175-F177 HydrophobicContact CE1-CD1 3.55Å; Y175-F177 HydrophobicContact CE1-CD2 4.24Å; Y175-F177 AromaticContact CE1-CE1 3.57Å; Y175-F177 HydrophobicContact CE1-CE1 3.57Å; Y175-F177 HydrophobicContact CE1-CE2 4.26Å; Y175-F177 AromaticContact CE1-CG 3.91Å; Y175-F177 HydrophobicContact CE1-CG 3.91Å; Y175-F177 AromaticContact CE1-CZ 3.95Å; Y175-F177 HydrophobicContact CE1-CZ 3.95Å; Y175-F177 HydrophobicContact CG-CE2 4.45Å; Y175-F177 HydrophobicContact CG-CZ 4.5Å; Y175-H182 PolarHBondContact OH-NE2 2.8Å
176	D	91.7	Very high	86	Confident	16 Å²	16	38.8 Å²	38.8	9%	0.086	23%	0.23	C	C	.	.			trans	-119.3	82.8	-167.5	-154	-21.4	0	0	0	113.6	E135 A178 S179 S218 G220	E135-D176 PolarHBondContact OE1-N 3.49Å; D176-A178 PolarHBondContact O-N 2.93Å; D176-A178 WeakPolarHBondContact OD1-CA 3.48Å; D176-A178 PolarHBondContact OD1-N 2.87Å; D176-S179 VanDerWaalsContact O-CB 3.31Å; D176-S179 WeakPolarHBondContact O-CB 3.38Å; D176-S179 PolarHBondContact O-N 2.85Å; D176-S179 PolarHBondContact OD1-N 3.14Å; D176-S218 VanDerWaalsContact CG-OG 3.3Å; D176-S218 VanDerWaalsContact OD2-CB 3.3Å; D176-S218 WeakPolarHBondContact OD2-CB 3.48Å; D176-S218 PolarHBondContact OD2-OG 3.14Å; D176-G220 WeakPolarHBondContact OD2-CA 3.46Å; D176-G220 PolarHBondContact OD2-N 2.91Å; D176-G220 VanDerWaalsContact OD2-N 3.13Å
177	F	92.2	Very high	86.6	Confident	41 Å²	41	36.5 Å²	36.5	18%	0.18	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.6	170	-59.4	-78.5	0	0	0	112.6	Y144 V145 Y175 P199 P209 I211	Y144-F177 HydrophobicContact CD1-CZ 4.27Å; Y144-F177 WeakPolarHBondContact O-CE1 3.34Å; V145-F177 HydrophobicContact CG1-CE1 4.13Å; Y175-F177 AromaticContact CD1-CD1 3.86Å; Y175-F177 HydrophobicContact CD1-CD1 3.86Å; Y175-F177 AromaticContact CD1-CD2 3.7Å; Y175-F177 HydrophobicContact CD1-CD2 3.7Å; Y175-F177 AromaticContact CD1-CE1 3.74Å; Y175-F177 HydrophobicContact CD1-CE1 3.74Å; Y175-F177 AromaticContact CD1-CE2 3.57Å; Y175-F177 HydrophobicContact CD1-CE2 3.57Å; Y175-F177 AromaticContact CD1-CG 3.85Å; Y175-F177 HydrophobicContact CD1-CG 3.85Å; Y175-F177 AromaticContact CD1-CZ 3.59Å; Y175-F177 HydrophobicContact CD1-CZ 3.59Å; Y175-F177 AromaticContact CE1-CD1 3.55Å; Y175-F177 HydrophobicContact CE1-CD1 3.55Å; Y175-F177 HydrophobicContact CE1-CD2 4.24Å; Y175-F177 AromaticContact CE1-CE1 3.57Å; Y175-F177 HydrophobicContact CE1-CE1 3.57Å; Y175-F177 HydrophobicContact CE1-CE2 4.26Å; Y175-F177 AromaticContact CE1-CG 3.91Å; Y175-F177 HydrophobicContact CE1-CG 3.91Å; Y175-F177 AromaticContact CE1-CZ 3.95Å; Y175-F177 HydrophobicContact CE1-CZ 3.95Å; Y175-F177 HydrophobicContact CG-CE2 4.45Å; Y175-F177 HydrophobicContact CG-CZ 4.5Å; F177-P199 HydrophobicContact CD1-CB 4.11Å; F177-P199 HydrophobicContact CD1-CG 4.43Å; F177-P199 HydrophobicContact CE1-CB 3.99Å; F177-P209 HydrophobicContact CB-CB 4.02Å; F177-P209 HydrophobicContact CB-CG 4.15Å; F177-P209 HydrophobicContact CD1-CB 4.44Å; F177-P209 HydrophobicContact CD1-CG 3.64Å; F177-P209 HydrophobicContact CD2-CB 4.01Å; F177-P209 HydrophobicContact CD2-CG 3.58Å; F177-P209 HydrophobicContact CE1-CG 3.82Å; F177-P209 HydrophobicContact CE2-CG 3.76Å; F177-P209 HydrophobicContact CG-CB 3.91Å; F177-P209 HydrophobicContact CG-CG 3.51Å; F177-P209 HydrophobicContact CZ-CG 3.88Å; F177-I211 HydrophobicContact CB-CG2 3.81Å; F177-I211 HydrophobicContact CD1-CG2 3.82Å; F177-I211 HydrophobicContact CG-CG2 4.32Å; F177-I211 WeakPolarHBondContact O-CA 3.37Å
178	A	92.6	Very high	87.3	Confident	47 Å²	47	36.3 Å²	36.3	39%	0.388	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.4	-178.6	0	0	0	0	0	113.6	D176 I180 Q213	D176-A178 PolarHBondContact O-N 2.93Å; D176-A178 WeakPolarHBondContact OD1-CA 3.48Å; D176-A178 PolarHBondContact OD1-N 2.87Å; A178-I180 PolarHBondContact O-N 3.03Å; A178-Q213 WeakPolarHBondContact O-CG 3.35Å; A178-Q213 PolarHBondContact O-NE2 2.83Å
179	S	94.2	Very high	87.7	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.014	22%	0.215	C	C	.	.			trans	-53.4	135.7	177.6	175.9	0	0	0	0	111.2	D176 M181 H182 D221	D176-S179 VanDerWaalsContact O-CB 3.31Å; D176-S179 WeakPolarHBondContact O-CB 3.38Å; D176-S179 PolarHBondContact O-N 2.85Å; D176-S179 PolarHBondContact OD1-N 3.14Å; S179-M181 PolarHBondContact O-N 2.87Å; S179-M181 PolarHBondContact OG-N 3.05Å; S179-M181 VanDerWaalsContact OG-N 3.1Å; S179-H182 WeakPolarHBondContact O-CB 3.23Å; S179-H182 PolarHBondContact O-N 3.1Å; S179-D221 WeakPolarHBondContact CA-OD1 3.4Å; S179-D221 WeakPolarHBondContact CA-OD2 3.4Å; S179-D221 VanDerWaalsContact CB-OD1 3.27Å; S179-D221 WeakPolarHBondContact CB-OD1 3.33Å; S179-D221 PolarHBondContact OG-OD1 3.15Å
180	I	93.2	Very high	88	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.1	172	-163.9	73.2	0	0	0	110.5	W68 V123 H124 A178 H182 R214 L217 D221	W68-I180 HydrophobicContact CZ2-CG2 4.42Å; V123-I180 HydrophobicContact CG1-CG1 4.12Å; H124-I180 HydrophobicContact CB-CG1 4.21Å; H124-I180 PolarHBondContact CE1-O 2.81Å; H124-I180 PolarHBondContact ND1-O 3.29Å; A178-I180 PolarHBondContact O-N 3.03Å; I180-H182 PolarHBondContact O-N 3.46Å; I180-R214 PolarHBondContact O-NH1 2.82Å; I180-L217 HydrophobicContact CB-CD2 4.4Å; I180-L217 HydrophobicContact CG2-CD2 3.81Å; I180-D221 PolarHBondContact N-OD2 2.72Å
181	M	93	Very high	88.5	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	8.8	179.5	-52.5	-51.5	-60.2	0	0	113.8	H128 F132 H134 E135 S179	H128-M181 VanDerWaalsContact CE1-CE 3.42Å; H128-M181 WeakPolarHBondContact CE1-CE 3.39Å; H128-M181 WeakPolarHBondContact ND1-CE 3.38Å; F132-M181 HydrophobicContact CB-CE 4.25Å; F132-M181 HydrophobicContact CB-CG 3.83Å; F132-M181 HydrophobicContact CB-SD 4.39Å; F132-M181 HydrophobicContact CG-CG 4.31Å; H134-M181 CarbonylContact C-O 3.3Å; H134-M181 WeakPolarHBondContact CA-O 3.24Å; H134-M181 WeakPolarHBondContact CB-O 3.32Å; H134-M181 PolarHBondContact CD2-O 2.97Å; E135-M181 PolarHBondContact N-O 3.46Å; S179-M181 PolarHBondContact O-N 2.87Å; S179-M181 PolarHBondContact OG-N 3.05Å; S179-M181 VanDerWaalsContact OG-N 3.1Å
182	H	93.9	Very high	88.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-88.8	140.8	173.2	-150.6	-68	0	0	0	111	Y175 S179 I180 R214	Y175-H182 PolarHBondContact OH-NE2 2.8Å; S179-H182 WeakPolarHBondContact O-CB 3.23Å; S179-H182 PolarHBondContact O-N 3.1Å; I180-H182 PolarHBondContact O-N 3.46Å; H182-R214 PolarHBondContact O-NH1 3.35Å; H182-R214 PolarHBondContact O-NH2 2.65Å
183	Y	91.9	Very high	88.9	Confident	17 Å²	17	54.1 Å²	54.1	7%	0.067	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-71.2	159.3	166.1	-78.9	0.7	0	0	0	111.7	H134 H136 N159 F160 T187 F188 G212	H134-Y183 AromaticContact CD2-CD1 3.97Å; H134-Y183 AromaticContact CD2-CE1 3.55Å; H134-Y183 AromaticContact CE1-CE1 3.59Å; H134-Y183 AromaticContact CE1-CZ 3.84Å; H134-Y183 PolarHBondContact CE1-OH 2.8Å; H134-Y183 AromaticContact CG-CE1 3.8Å; H134-Y183 AromaticContact ND1-CE1 3.83Å; H134-Y183 AromaticContact ND1-CZ 3.9Å; H134-Y183 AromaticContact NE2-CE1 3.41Å; H134-Y183 WeakPolarHBondContact NE2-CE1 3.34Å; H136-Y183 AromaticContact CE1-CD1 3.78Å; H136-Y183 AromaticContact CE1-CD2 3.16Å; H136-Y183 WeakPolarHBondContact CE1-CD2 3.39Å; H136-Y183 AromaticContact CE1-CE1 3.99Å; H136-Y183 AromaticContact CE1-CE2 3.38Å; H136-Y183 WeakPolarHBondContact CE1-CE2 3.34Å; H136-Y183 AromaticContact CE1-CG 3.36Å; H136-Y183 AromaticContact CE1-CZ 3.8Å; H136-Y183 AromaticContact ND1-CD2 3.87Å; H136-Y183 AromaticContact ND1-CG 3.71Å; H136-Y183 AromaticContact NE2-CD2 3.5Å; H136-Y183 WeakPolarHBondContact NE2-CD2 3.18Å; H136-Y183 AromaticContact NE2-CE2 3.61Å; N159-Y183 HydrophobicContact CB-CE2 4.19Å; F160-Y183 HydrophobicContact CE1-CD2 4.41Å; F160-Y183 HydrophobicContact CZ-CD2 4.42Å; Y183-T187 HydrophobicContact CD1-CG2 4.45Å; Y183-T187 HydrophobicContact CD2-CG2 3.79Å; Y183-T187 HydrophobicContact CE2-CG2 4.16Å; Y183-T187 HydrophobicContact CG-CG2 3.96Å; Y183-F188 HydrophobicContact CD2-CE2 4.49Å; Y183-F188 AromaticContact CE2-CD2 4Å; Y183-F188 HydrophobicContact CE2-CD2 4Å; Y183-F188 AromaticContact CE2-CE2 3.62Å; Y183-F188 HydrophobicContact CE2-CE2 3.62Å; Y183-F188 AromaticContact CZ-CE2 3.94Å; Y183-G212 WeakPolarHBondContact O-CA 3.09Å; Y183-G212 PolarHBondContact O-N 3.27Å
184	A	91.2	Very high	89.2	Confident	24 Å²	24	53.4 Å²	53.4	20%	0.198	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-74	172.2	170.4	0	0	0	0	0	110.9	D186 T187	A184-D186 WeakPolarHBondContact CB-OD1 3Å; A184-D186 PolarHBondContact O-N 2.72Å; A184-T187 WeakPolarHBondContact CB-OG1 2.97Å; A184-T187 PolarHBondContact N-OG1 2.94Å; A184-T187 PolarHBondContact O-OG1 3.14Å
185	R	92.4	Very high	89.3	Confident	116 Å²	116	51 Å²	51	44%	0.438	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-28.5	-176.1	-68.8	173.6	54.9	174.8	-4.5	113.2	D195 T196 I197 I211	R185-D195 WeakPolarHBondContact CB-OD1 3.41Å; R185-D195 IonicContact CZ-OD1 3.36Å; R185-D195 IonicContact CZ-OD2 3.69Å; R185-D195 IonicContact NE-OD1 3.67Å; R185-D195 PolarHBondContact NE-OD1 2.99Å; R185-D195 VanDerWaalsContact NH2-CG 3.25Å; R185-D195 IonicContact NH2-OD1 3.07Å; R185-D195 PolarHBondContact NH2-OD1 2.87Å; R185-D195 IonicContact NH2-OD2 2.66Å; R185-D195 PolarHBondContact NH2-OD2 3.16Å; R185-D195 CarbonylContact O-C 3.55Å; R185-D195 WeakPolarHBondContact O-CA 3.33Å; R185-T196 PolarHBondContact O-N 2.93Å; R185-T196 PolarHBondContact O-OG1 3.02Å; R185-I197 WeakPolarHBondContact CA-O 3.48Å; R185-I197 PolarHBondContact O-N 3.37Å; R185-I211 HydrophobicContact CG-CD1 3.83Å; R185-I211 HydrophobicContact CG-CG1 3.65Å
186	D	88.9	Confident	89.5	Confident	76 Å²	76	50.1 Å²	50.1	41%	0.406	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114	3.6	-168.7	61.7	-31.4	0	0	0	113.3	A184 F188 S189	A184-D186 WeakPolarHBondContact CB-OD1 3Å; A184-D186 PolarHBondContact O-N 2.72Å; D186-F188 PolarHBondContact O-N 2.85Å; D186-S189 WeakPolarHBondContact O-CB 3.48Å; D186-S189 PolarHBondContact O-N 2.9Å
187	T	87.3	Confident	89.6	Confident	37 Å²	37	49.3 Å²	49.3	23%	0.227	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	132.9	178.9	-50	0	0	0	0	110.4	F160 Y183 A184 S189 T196	F160-T187 WeakPolarHBondContact CZ-O 3.35Å; Y183-T187 HydrophobicContact CD1-CG2 4.45Å; Y183-T187 HydrophobicContact CD2-CG2 3.79Å; Y183-T187 HydrophobicContact CE2-CG2 4.16Å; Y183-T187 HydrophobicContact CG-CG2 3.96Å; A184-T187 WeakPolarHBondContact CB-OG1 2.97Å; A184-T187 PolarHBondContact N-OG1 2.94Å; A184-T187 PolarHBondContact O-OG1 3.14Å; T187-S189 PolarHBondContact O-N 2.9Å; T187-T196 WeakPolarHBondContact O-CG2 3.27Å; T187-T196 PolarHBondContact O-OG1 2.71Å
188	F	88	Confident	89.7	Confident	31 Å²	31	48.4 Å²	48.4	14%	0.136	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	30.3	-171.2	-55.7	-66.8	0	0	0	115.1	M1 I152 Q153 Q156 N159 F160 Y183 D186	M1-F188 HydrophobicContact CE-CE1 3.92Å; M1-F188 HydrophobicContact CE-CZ 4.2Å; M1-F188 HydrophobicContact SD-CE1 4.09Å; M1-F188 HydrophobicContact SD-CZ 3.74Å; I152-F188 CarbonylContact C-O 3.57Å; I152-F188 WeakPolarHBondContact CA-O 3.45Å; I152-F188 HydrophobicContact CG2-CB 4.19Å; Q153-F188 WeakPolarHBondContact CG-O 3.38Å; Q153-F188 PolarHBondContact N-O 3.4Å; Q156-F188 HydrophobicContact CB-CB 3.91Å; Q156-F188 HydrophobicContact CB-CD1 3.97Å; Q156-F188 HydrophobicContact CB-CG 3.96Å; Q156-F188 HydrophobicContact CG-CB 4.44Å; Q156-F188 HydrophobicContact CG-CD1 3.77Å; Q156-F188 HydrophobicContact CG-CE1 4.38Å; Q156-F188 HydrophobicContact CG-CG 4.29Å; N159-F188 HydrophobicContact CB-CD2 4.09Å; N159-F188 HydrophobicContact CB-CE2 3.94Å; F160-F188 HydrophobicContact CE2-CB 3.98Å; F160-F188 AromaticContact CE2-CD2 3.79Å; F160-F188 HydrophobicContact CE2-CD2 3.79Å; F160-F188 HydrophobicContact CE2-CG 4.31Å; F160-F188 HydrophobicContact CZ-CB 4.11Å; F160-F188 AromaticContact CZ-CD2 3.95Å; F160-F188 HydrophobicContact CZ-CD2 3.95Å; Y183-F188 HydrophobicContact CD2-CE2 4.49Å; Y183-F188 AromaticContact CE2-CD2 4Å; Y183-F188 HydrophobicContact CE2-CD2 4Å; Y183-F188 AromaticContact CE2-CE2 3.62Å; Y183-F188 HydrophobicContact CE2-CE2 3.62Å; Y183-F188 AromaticContact CZ-CE2 3.94Å; D186-F188 PolarHBondContact O-N 2.85Å
189	S	87.3	Confident	89.7	Confident	13 Å²	13	46.2 Å²	46.2	9%	0.091	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-78.7	147.2	177.5	-165.9	0	0	0	0	113.6	N151 Q153 D186 T187 A191 L194	N151-S189 WeakPolarHBondContact O-CA 3.37Å; Q153-S189 WeakPolarHBondContact CG-O 3.32Å; Q153-S189 PolarHBondContact NE2-O 3.11Å; D186-S189 WeakPolarHBondContact O-CB 3.48Å; D186-S189 PolarHBondContact O-N 2.9Å; T187-S189 PolarHBondContact O-N 2.9Å; S189-A191 PolarHBondContact O-N 3.16Å; S189-A191 PolarHBondContact OG-N 2.83Å; S189-A191 PolarHBondContact OG-O 2.86Å; S189-L194 WeakPolarHBondContact CB-O 3.3Å; S189-L194 WeakPolarHBondContact OG-CB 3.46Å; S189-L194 PolarHBondContact OG-O 2.99Å
190	R	85.2	Confident	89.6	Confident	144 Å²	144	49 Å²	49	54%	0.543	23%	0.229	S	C	.	.	S	Bend	trans	-67.4	-19.5	172.4	-70.9	173.9	-167.4	-139.3	-4.9	113.6	K150 N151 I152	K150-R190 PolarHBondContact O-NE 2.61Å; N151-R190 WeakPolarHBondContact O-CG 3.26Å; N151-R190 PolarHBondContact O-N 3.42Å; I152-R190 PolarHBondContact O-NE 2.69Å; I152-R190 PolarHBondContact O-NH2 3.39Å
191	A	81.7	Confident	89.3	Confident	25 Å²	25	52.1 Å²	52.1	21%	0.207	25%	0.249	C	C	.	.	S	Bend	trans	-157.8	146	176.2	0	0	0	0	0	110.7	S189 Y193 L194	S189-A191 PolarHBondContact O-N 3.16Å; S189-A191 PolarHBondContact OG-N 2.83Å; S189-A191 PolarHBondContact OG-O 2.86Å; A191-Y193 HydrophobicContact CB-CD1 3.97Å; A191-Y193 HydrophobicContact CB-CE1 3.54Å; A191-Y193 HydrophobicContact CB-CE2 4.31Å; A191-Y193 PolarHBondContact O-N 2.74Å; A191-L194 HydrophobicContact CB-CD1 4.11Å; A191-L194 HydrophobicContact CB-CG 4.29Å; A191-L194 PolarHBondContact O-N 2.67Å
192	M	79	Confident	88.7	Confident	175 Å²	175	55.1 Å²	55.1	86%	0.862	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-14.8	-175.5	-164.9	177.1	74	0	0	115.1
193	Y	84.9	Confident	87.9	Confident	195 Å²	195	60.4 Å²	60.4	77%	0.765	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	4.5	178.6	60.3	-97.7	0	0	0	114.3	A191	A191-Y193 HydrophobicContact CB-CD1 3.97Å; A191-Y193 HydrophobicContact CB-CE1 3.54Å; A191-Y193 HydrophobicContact CB-CE2 4.31Å; A191-Y193 PolarHBondContact O-N 2.74Å
194	L	87.8	Confident	87.2	Confident	51 Å²	51	63.9 Å²	63.9	27%	0.267	33%	0.329	S	S	.	.			trans	-109.2	119.4	-178.7	-67.2	176.6	0	0	0	111.4	N151 S189 A191 T196	N151-L194 HydrophobicContact CB-CB 4.19Å; S189-L194 WeakPolarHBondContact CB-O 3.3Å; S189-L194 WeakPolarHBondContact OG-CB 3.46Å; S189-L194 PolarHBondContact OG-O 2.99Å; A191-L194 HydrophobicContact CB-CD1 4.11Å; A191-L194 HydrophobicContact CB-CG 4.29Å; A191-L194 PolarHBondContact O-N 2.67Å; L194-T196 PolarHBondContact O-N 3.07Å
195	D	90.3	Very high	86.7	Confident	40 Å²	40	66.3 Å²	66.3	21%	0.214	34%	0.342	C	S	.	.			trans	-66	126.3	169.6	-64.7	-53.2	0	0	0	110.7	F148 N151 R185	F148-D195 WeakPolarHBondContact CB-O 3.3Å; F148-D195 HydrophobicContact CD2-CB 4.49Å; N151-D195 PolarHBondContact ND2-O 3.13Å; R185-D195 WeakPolarHBondContact CB-OD1 3.41Å; R185-D195 IonicContact CZ-OD1 3.36Å; R185-D195 IonicContact CZ-OD2 3.69Å; R185-D195 IonicContact NE-OD1 3.67Å; R185-D195 PolarHBondContact NE-OD1 2.99Å; R185-D195 VanDerWaalsContact NH2-CG 3.25Å; R185-D195 IonicContact NH2-OD1 3.07Å; R185-D195 PolarHBondContact NH2-OD1 2.87Å; R185-D195 IonicContact NH2-OD2 2.66Å; R185-D195 PolarHBondContact NH2-OD2 3.16Å; R185-D195 CarbonylContact O-C 3.55Å; R185-D195 WeakPolarHBondContact O-CA 3.33Å
196	T	93.1	Very high	86	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.355	C	S	.	.	S	Bend	trans	-87.3	-32.8	161.4	55.4	0	0	0	0	111.6	I147 F148 N151 I152 R185 T187 L194	I147-T196 WeakPolarHBondContact CA-O 3.49Å; F148-T196 PolarHBondContact N-O 2.81Å; N151-T196 HydrophobicContact CB-CG2 4.31Å; I152-T196 HydrophobicContact CB-CG2 4.43Å; I152-T196 HydrophobicContact CG1-CG2 3.87Å; R185-T196 PolarHBondContact O-N 2.93Å; R185-T196 PolarHBondContact O-OG1 3.02Å; T187-T196 WeakPolarHBondContact O-CG2 3.27Å; T187-T196 PolarHBondContact O-OG1 2.71Å; L194-T196 PolarHBondContact O-N 3.07Å
197	I	94.3	Very high	85.7	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.2	175.5	-48.2	-178.3	0	0	0	109.8	H136 V145 I147 F160 R185 I211	H136-I197 HydrophobicContact CB-CD1 3.99Å; V145-I197 HydrophobicContact CB-CG2 3.91Å; V145-I197 HydrophobicContact CG1-CG2 4.07Å; V145-I197 HydrophobicContact CG2-CG2 4.29Å; I147-I197 HydrophobicContact CD1-CB 4.39Å; I147-I197 HydrophobicContact CD1-CG1 4.02Å; I147-I197 HydrophobicContact CD1-CG2 3.99Å; F160-I197 HydrophobicContact CD1-CD1 4.28Å; F160-I197 HydrophobicContact CD1-CG1 4.16Å; F160-I197 HydrophobicContact CE1-CD1 3.87Å; F160-I197 HydrophobicContact CE1-CG1 3.71Å; R185-I197 WeakPolarHBondContact CA-O 3.48Å; R185-I197 PolarHBondContact O-N 3.37Å; I197-I211 HydrophobicContact CB-CD1 3.96Å; I197-I211 HydrophobicContact CG2-CD1 3.69Å
198	L	93.5	Very high	85.8	Confident	21 Å²	21	75 Å²	75	11%	0.11	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	116.4	175.8	-174.1	64.3	0	0	0	111.3	V145 D146 F148	V145-L198 WeakPolarHBondContact CA-O 3.28Å; D146-L198 PolarHBondContact N-O 2.73Å; D146-L198 PolarHBondContact O-N 3Å; F148-L198 HydrophobicContact CD2-CB 4.33Å; F148-L198 HydrophobicContact CE2-CB 3.67Å; F148-L198 HydrophobicContact CE2-CD2 3.85Å; F148-L198 HydrophobicContact CE2-CG 4.43Å; F148-L198 HydrophobicContact CZ-CD2 4.26Å
199	P	93.6	Very high	85.8	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.013	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	137.9	173	-26.8	37.9	0	0	0	112.3	F177 R208 P209 I211	F177-P199 HydrophobicContact CD1-CB 4.11Å; F177-P199 HydrophobicContact CD1-CG 4.43Å; F177-P199 HydrophobicContact CE1-CB 3.99Å; P199-R208 WeakPolarHBondContact O-CD 3.02Å; P199-R208 WeakPolarHBondContact O-CG 3.3Å; P199-R208 PolarHBondContact O-NH1 2.65Å; P199-P209 HydrophobicContact CB-CG 3.93Å; P199-P209 WeakPolarHBondContact CG-O 3.32Å; P199-I211 HydrophobicContact CG-CB 4.28Å; P199-I211 HydrophobicContact CG-CD1 3.79Å; P199-I211 HydrophobicContact CG-CG1 3.79Å; P199-I211 HydrophobicContact CG-CG2 3.54Å
200	K	92	Very high	85.9	Confident	59 Å²	59	83.5 Å²	83.5	26%	0.257	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-69.1	142.1	171.3	-65	179.3	-170.8	-64.4	0	109	D142 Y144 D146	D142-K200 WeakPolarHBondContact O-CE 3.1Å; Y144-K200 WeakPolarHBondContact O-CB 3.31Å; Y144-K200 WeakPolarHBondContact O-CG 3.4Å; Y144-K200 PolarHBondContact O-N 3.12Å; D146-K200 IonicContact OD1-NZ 2.69Å; D146-K200 PolarHBondContact OD1-NZ 3.05Å; D146-K200 IonicContact OD2-NZ 3.94Å; D146-K200 PolarHBondContact OD2-NZ 3.32Å
201	P	86.9	Confident	86.2	Confident	66 Å²	66	77.5 Å²	77.5	43%	0.429	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-64.6	146.4	177.5	28.8	-34.8	0	0	0	110.4	H206 E207 R208	P201-H206 WeakPolarHBondContact CB-O 2.87Å; P201-E207 CarbonylContact C-O 3.53Å; P201-E207 VanDerWaalsContact CA-O 3.25Å; P201-E207 WeakPolarHBondContact CA-O 3.1Å; P201-R208 HydrophobicContact CB-CG 4.17Å
202	D	79.8	Confident	86.5	Confident	66 Å²	66	77 Å²	77	35%	0.353	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-67.6	139.7	172.7	173.6	44.3	0	0	0	111.2	S204 T205 H206 E207	D202-S204 VanDerWaalsContact CG-N 3.3Å; D202-S204 PolarHBondContact O-N 2.89Å; D202-S204 PolarHBondContact OD1-N 3.06Å; D202-S204 WeakPolarHBondContact OD2-CA 3.48Å; D202-S204 VanDerWaalsContact OD2-CB 3.24Å; D202-S204 WeakPolarHBondContact OD2-CB 3.3Å; D202-S204 PolarHBondContact OD2-N 3.11Å; D202-S204 PolarHBondContact OD2-OG 3.22Å; D202-T205 PolarHBondContact OD2-N 2.91Å; D202-T205 VanDerWaalsContact OD2-N 3.15Å; D202-H206 VanDerWaalsContact O-CA 3.22Å; D202-H206 WeakPolarHBondContact O-CA 3.39Å; D202-H206 PolarHBondContact O-N 3.28Å; D202-E207 PolarHBondContact N-O 3.04Å
203	S	76.1	Confident	87.1	Confident	110 Å²	110	70.9 Å²	70.9	77%	0.769	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.8	173.3	58.3	0	0	0	0	115.4
204	S	77.5	Confident	87.3	Confident	90 Å²	90	65.2 Å²	65.2	63%	0.629	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-51.9	178.9	81.8	0	0	0	0	112.7	D202	D202-S204 VanDerWaalsContact CG-N 3.3Å; D202-S204 PolarHBondContact O-N 2.89Å; D202-S204 PolarHBondContact OD1-N 3.06Å; D202-S204 WeakPolarHBondContact OD2-CA 3.48Å; D202-S204 VanDerWaalsContact OD2-CB 3.24Å; D202-S204 WeakPolarHBondContact OD2-CB 3.3Å; D202-S204 PolarHBondContact OD2-N 3.11Å; D202-S204 PolarHBondContact OD2-OG 3.22Å
205	T	81.3	Confident	87.4	Confident	75 Å²	75	68.7 Å²	68.7	46%	0.46	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-20.1	-177.1	67.5	0	0	0	0	114.3	D202 E207	D202-T205 PolarHBondContact OD2-N 2.91Å; D202-T205 VanDerWaalsContact OD2-N 3.15Å; T205-E207 PolarHBondContact O-N 2.95Å; T205-E207 WeakPolarHBondContact OG1-CB 3.4Å; T205-E207 PolarHBondContact OG1-N 2.85Å; T205-E207 PolarHBondContact OG1-OE2 2.84Å
206	H	76.6	Confident	87.4	Confident	153 Å²	153	74.8 Å²	74.8	71%	0.708	38%	0.379	S	S	*	.			trans	63.2	2.8	-166.7	-60.6	61.4	0	0	0	114.8	P201 D202	P201-H206 WeakPolarHBondContact CB-O 2.87Å; D202-H206 VanDerWaalsContact O-CA 3.22Å; D202-H206 WeakPolarHBondContact O-CA 3.39Å; D202-H206 PolarHBondContact O-N 3.28Å
207	E	84.2	Confident	87.5	Confident	134 Å²	134	75.1 Å²	75.1	63%	0.626	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-83.3	153	175.3	-59.8	169.8	141.3	0	0	110.4	P201 D202 T205	P201-E207 CarbonylContact C-O 3.53Å; P201-E207 VanDerWaalsContact CA-O 3.25Å; P201-E207 WeakPolarHBondContact CA-O 3.1Å; D202-E207 PolarHBondContact N-O 3.04Å; T205-E207 PolarHBondContact O-N 2.95Å; T205-E207 WeakPolarHBondContact OG1-CB 3.4Å; T205-E207 PolarHBondContact OG1-N 2.85Å; T205-E207 PolarHBondContact OG1-OE2 2.84Å
208	R	87.8	Confident	87.5	Confident	125 Å²	125	75.3 Å²	75.3	47%	0.472	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-92.3	128.3	172.6	-63.3	-179.3	-170.9	-96.2	6.6	108.7	P199 P201	P199-R208 WeakPolarHBondContact O-CD 3.02Å; P199-R208 WeakPolarHBondContact O-CG 3.3Å; P199-R208 PolarHBondContact O-NH1 2.65Å; P201-R208 HydrophobicContact CB-CG 4.17Å
209	P	88.5	Confident	87.4	Confident	43 Å²	43	79 Å²	79	28%	0.279	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-66.7	149.9	174.8	28.6	-34.1	0	0	0	110.9	F177 P199	F177-P209 HydrophobicContact CB-CB 4.02Å; F177-P209 HydrophobicContact CB-CG 4.15Å; F177-P209 HydrophobicContact CD1-CB 4.44Å; F177-P209 HydrophobicContact CD1-CG 3.64Å; F177-P209 HydrophobicContact CD2-CB 4.01Å; F177-P209 HydrophobicContact CD2-CG 3.58Å; F177-P209 HydrophobicContact CE1-CG 3.82Å; F177-P209 HydrophobicContact CE2-CG 3.76Å; F177-P209 HydrophobicContact CG-CB 3.91Å; F177-P209 HydrophobicContact CG-CG 3.51Å; F177-P209 HydrophobicContact CZ-CG 3.88Å; P199-P209 HydrophobicContact CB-CG 3.93Å; P199-P209 WeakPolarHBondContact CG-O 3.32Å
210	E	89.6	Confident	87.3	Confident	180 Å²	180	79.2 Å²	79.2	84%	0.841	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-72.1	151.2	172.3	-62.1	-175.9	157	0	0	111.2
211	I	92.5	Very high	87.4	Confident	18 Å²	18	76.4 Å²	76.4	9%	0.092	40%	0.398	C	S	.	.			trans	-137.9	156.4	178.5	55.6	164.1	0	0	0	111.2	F177 R185 I197 P199	F177-I211 HydrophobicContact CB-CG2 3.81Å; F177-I211 HydrophobicContact CD1-CG2 3.82Å; F177-I211 HydrophobicContact CG-CG2 4.32Å; F177-I211 WeakPolarHBondContact O-CA 3.37Å; R185-I211 HydrophobicContact CG-CD1 3.83Å; R185-I211 HydrophobicContact CG-CG1 3.65Å; I197-I211 HydrophobicContact CB-CD1 3.96Å; I197-I211 HydrophobicContact CG2-CD1 3.69Å; P199-I211 HydrophobicContact CG-CB 4.28Å; P199-I211 HydrophobicContact CG-CD1 3.79Å; P199-I211 HydrophobicContact CG-CG1 3.79Å; P199-I211 HydrophobicContact CG-CG2 3.54Å
212	G	87.6	Confident	87.7	Confident	14 Å²	14	74.9 Å²	74.9	14%	0.144	39%	0.385	C	S	.	.			trans	83.4	19.6	172.8	0	0	0	0	0	115.5	Y183 R214	Y183-G212 WeakPolarHBondContact O-CA 3.09Å; Y183-G212 PolarHBondContact O-N 3.27Å; G212-R214 PolarHBondContact O-NH1 3.14Å
213	Q	91.3	Very high	88.2	Confident	47 Å²	47	75.4 Å²	75.4	22%	0.22	39%	0.388	C	S	.	.			trans	-56.6	148	175	68.2	82.7	17.9	0	0	112	A178 R216	A178-Q213 WeakPolarHBondContact O-CG 3.35Å; A178-Q213 PolarHBondContact O-NE2 2.83Å; Q213-R216 PolarHBondContact NE2-O 2.74Å; Q213-R216 VanDerWaalsContact OE1-N 3.16Å; Q213-R216 PolarHBondContact OE1-O 2.83Å
214	R	88.8	Confident	88.9	Confident	76 Å²	76	70.3 Å²	70.3	29%	0.287	35%	0.352	S	S	.	.			trans	-133	50	178.8	-66	-66.4	-179.6	-86.7	4.7	110.5	G120 H124 I180 H182 G212	G120-R214 WeakPolarHBondContact CA-O 3.39Å; G120-R214 WeakPolarHBondContact O-CD 3.39Å; H124-R214 PolarHBondContact CE1-NH2 3.35Å; H124-R214 VanDerWaalsContact CE1-NH2 3.35Å; I180-R214 PolarHBondContact O-NH1 2.82Å; H182-R214 PolarHBondContact O-NH1 3.35Å; H182-R214 PolarHBondContact O-NH2 2.65Å; G212-R214 PolarHBondContact O-NH1 3.14Å
215	I	89.2	Confident	89.7	Confident	124 Å²	124	66 Å²	66	64%	0.636	32%	0.322	S	S	*	.	S	Bend	trans	-120.2	-46.7	-173.5	-57.9	175.5	0	0	0	111.6	F119	F119-I215 WeakPolarHBondContact CE1-O 3.39Å
216	R	92.1	Very high	90.2	Very high	167 Å²	167	64.6 Å²	64.6	63%	0.63	31%	0.311	S	S	*	.	S	Bend	trans	-157.9	175	-174.7	58.8	176.7	176.4	173.3	-2	112.9	Q213	Q213-R216 PolarHBondContact NE2-O 2.74Å; Q213-R216 VanDerWaalsContact OE1-N 3.16Å; Q213-R216 PolarHBondContact OE1-O 2.83Å
217	L	93.9	Very high	90.8	Very high	8 Å²	8	60.3 Å²	60.3	4%	0.042	30%	0.296	C	S	.	.			trans	-72.4	143	168.4	-59.6	-177.9	0	0	0	109.8	H67 W68 Y71 V123 I180 D221 I222	H67-L217 PolarHBondContact NE2-N 3.06Å; W68-L217 HydrophobicContact CD2-CD1 3.84Å; W68-L217 HydrophobicContact CD2-CD2 4.09Å; W68-L217 HydrophobicContact CE3-CD1 3.59Å; W68-L217 HydrophobicContact CE3-CD2 4.23Å; W68-L217 HydrophobicContact CG-CD1 4.4Å; W68-L217 HydrophobicContact CH2-CD1 4.37Å; W68-L217 HydrophobicContact CH2-CD2 3.63Å; W68-L217 HydrophobicContact CZ2-CD2 3.45Å; W68-L217 VanDerWaalsContact CZ2-CD2 3.45Å; W68-L217 HydrophobicContact CZ3-CD1 3.88Å; W68-L217 HydrophobicContact CZ3-CD2 4.01Å; Y71-L217 HydrophobicContact CD2-CD1 4.36Å; V123-L217 HydrophobicContact CG1-CD2 3.64Å; V123-L217 HydrophobicContact CG1-CG 4.4Å; I180-L217 HydrophobicContact CB-CD2 4.4Å; I180-L217 HydrophobicContact CG2-CD2 3.81Å; L217-D221 HydrophobicContact CB-CB 4.25Å; L217-D221 HydrophobicContact CD2-CB 4.46Å; L217-I222 HydrophobicContact CB-CD1 4.15Å; L217-I222 HydrophobicContact CB-CG1 3.92Å; L217-I222 HydrophobicContact CD1-CG1 4.22Å
218	S	94.4	Very high	91.1	Very high	4 Å²	4	54.8 Å²	54.8	3%	0.028	27%	0.27	C	S	.	.			trans	-78.5	163.5	169.7	80.2	0	0	0	0	111.3	D176 G220 D221 I222	D176-S218 VanDerWaalsContact CG-OG 3.3Å; D176-S218 VanDerWaalsContact OD2-CB 3.3Å; D176-S218 WeakPolarHBondContact OD2-CB 3.48Å; D176-S218 PolarHBondContact OD2-OG 3.14Å; S218-G220 PolarHBondContact O-N 3.01Å; S218-G220 PolarHBondContact OG-N 2.57Å; S218-D221 PolarHBondContact N-OD2 3.35Å; S218-D221 PolarHBondContact O-N 2.59Å; S218-D221 PolarHBondContact OG-N 2.9Å; S218-D221 PolarHBondContact OG-OD2 3.33Å; S218-I222 WeakPolarHBondContact O-CD1 3.28Å; S218-I222 VanDerWaalsContact O-CG1 3.28Å; S218-I222 WeakPolarHBondContact O-CG1 3.44Å; S218-I222 PolarHBondContact O-N 3.47Å; S218-I222 VanDerWaalsContact O-N 3.15Å
219	P	92.4	Very high	91.3	Very high	98 Å²	98	50.1 Å²	50.1	64%	0.636	25%	0.253	S	S	*	.	H	α-helix	trans	-57.6	-32	168.8	-24.9	35.5	0	0	0	113.4	I223	P219-I223 WeakPolarHBondContact O-CB 3.3Å; P219-I223 WeakPolarHBondContact O-CD1 3.46Å; P219-I223 WeakPolarHBondContact O-CG1 2.9Å; P219-I223 PolarHBondContact O-N 3.45Å
220	G	91.2	Very high	91.4	Very high	7 Å²	7	57 Å²	57	7%	0.072	28%	0.278	C	S	.	.	H	α-helix	trans	-78.5	-30.9	178.1	0	0	0	0	0	113.9	D176 S218 I222 Q224	D176-G220 WeakPolarHBondContact OD2-CA 3.46Å; D176-G220 PolarHBondContact OD2-N 2.91Å; D176-G220 VanDerWaalsContact OD2-N 3.13Å; S218-G220 PolarHBondContact O-N 3.01Å; S218-G220 PolarHBondContact OG-N 2.57Å; G220-I222 VanDerWaalsContact C-N 3.35Å; G220-Q224 VanDerWaalsContact O-CB 3.25Å; G220-Q224 WeakPolarHBondContact O-CB 3.14Å; G220-Q224 WeakPolarHBondContact O-CG 3.29Å; G220-Q224 PolarHBondContact O-N 3.09Å; G220-Q224 PolarHBondContact O-NE2 3.29Å; G220-Q224 VanDerWaalsContact O-NE2 3.09Å
221	D	93.6	Very high	91.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-49.6	168.8	-62.3	-31.1	0	0	0	109.3	S179 I180 L217 S218 Q224 T225	S179-D221 WeakPolarHBondContact CA-OD1 3.4Å; S179-D221 WeakPolarHBondContact CA-OD2 3.4Å; S179-D221 VanDerWaalsContact CB-OD1 3.27Å; S179-D221 WeakPolarHBondContact CB-OD1 3.33Å; S179-D221 PolarHBondContact OG-OD1 3.15Å; I180-D221 PolarHBondContact N-OD2 2.72Å; L217-D221 HydrophobicContact CB-CB 4.25Å; L217-D221 HydrophobicContact CD2-CB 4.46Å; S218-D221 PolarHBondContact N-OD2 3.35Å; S218-D221 PolarHBondContact O-N 2.59Å; S218-D221 PolarHBondContact OG-N 2.9Å; S218-D221 PolarHBondContact OG-OD2 3.33Å; D221-Q224 PolarHBondContact O-N 2.82Å; D221-T225 WeakPolarHBondContact O-CB 3.3Å; D221-T225 PolarHBondContact O-N 3.22Å; D221-T225 PolarHBondContact O-OG1 3.04Å
222	I	93.3	Very high	91.3	Very high	33 Å²	33	49.9 Å²	49.9	17%	0.169	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-51.6	-179.8	-65.9	166	0	0	0	111.1	Y71 L217 S218 G220 Q224 T225 N226	Y71-I222 HydrophobicContact CD1-CD1 4.06Å; Y71-I222 HydrophobicContact CD2-CD1 4.32Å; Y71-I222 HydrophobicContact CG-CD1 3.77Å; Y71-I222 HydrophobicContact CG-CG1 4.31Å; Y71-I222 WeakPolarHBondContact O-CG2 3.33Å; L217-I222 HydrophobicContact CB-CD1 4.15Å; L217-I222 HydrophobicContact CB-CG1 3.92Å; L217-I222 HydrophobicContact CD1-CG1 4.22Å; S218-I222 WeakPolarHBondContact O-CD1 3.28Å; S218-I222 VanDerWaalsContact O-CG1 3.28Å; S218-I222 WeakPolarHBondContact O-CG1 3.44Å; S218-I222 PolarHBondContact O-N 3.47Å; S218-I222 VanDerWaalsContact O-N 3.15Å; G220-I222 VanDerWaalsContact C-N 3.35Å; I222-Q224 PolarHBondContact O-N 2.95Å; I222-T225 PolarHBondContact O-N 2.9Å; I222-N226 WeakPolarHBondContact O-CB 3.16Å; I222-N226 PolarHBondContact O-N 2.91Å; I222-N226 PolarHBondContact O-ND2 2.9Å
223	I	91.4	Very high	91.1	Very high	78 Å²	78	57.1 Å²	57.1	40%	0.4	28%	0.279	S	S	.	.	H	α-helix	trans	-65	-40	-179.2	-68	164.5	0	0	0	111.4	Q173 P219 T227	Q173-I223 VanDerWaalsContact CD-CG2 3.48Å; Q173-I223 HydrophobicContact CG-CG2 4.13Å; P219-I223 WeakPolarHBondContact O-CB 3.3Å; P219-I223 WeakPolarHBondContact O-CD1 3.46Å; P219-I223 WeakPolarHBondContact O-CG1 2.9Å; P219-I223 PolarHBondContact O-N 3.45Å; I223-T227 WeakPolarHBondContact O-CB 3.04Å; I223-T227 PolarHBondContact O-N 3.29Å; I223-T227 PolarHBondContact O-OG1 3.37Å
224	Q	90.6	Very high	91	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-43.9	176.3	-72.7	176.7	110.1	0	0	111.3	F132 L171 Q173 G220 D221 I222 N226 T227 L228	F132-Q224 HydrophobicContact CE1-CB 3.74Å; F132-Q224 HydrophobicContact CZ-CB 3.89Å; L171-Q224 HydrophobicContact CD1-CB 4.36Å; L171-Q224 VanDerWaalsContact CD1-O 3.24Å; L171-Q224 WeakPolarHBondContact CD1-O 3.16Å; Q173-Q224 HydrophobicContact CG-CG 3.86Å; G220-Q224 VanDerWaalsContact O-CB 3.25Å; G220-Q224 WeakPolarHBondContact O-CB 3.14Å; G220-Q224 WeakPolarHBondContact O-CG 3.29Å; G220-Q224 PolarHBondContact O-N 3.09Å; G220-Q224 PolarHBondContact O-NE2 3.29Å; G220-Q224 VanDerWaalsContact O-NE2 3.09Å; D221-Q224 PolarHBondContact O-N 2.82Å; I222-Q224 PolarHBondContact O-N 2.95Å; Q224-N226 PolarHBondContact O-N 2.89Å; Q224-T227 PolarHBondContact O-N 3.1Å; Q224-L228 WeakPolarHBondContact O-CB 3.35Å; Q224-L228 PolarHBondContact O-N 3.44Å
225	T	92.8	Very high	90.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-47	177.9	-50.8	0	0	0	0	111.1	W68 T72 V74 V130 F132 D221 I222 T227 L228 Y229	W68-T225 HydrophobicContact CZ3-CG2 4.34Å; T72-T225 HydrophobicContact CG2-CG2 3.75Å; V74-T225 HydrophobicContact CG2-CG2 3.73Å; V130-T225 HydrophobicContact CG1-CG2 3.75Å; F132-T225 VanDerWaalsContact CE2-OG1 3.23Å; F132-T225 WeakPolarHBondContact CE2-OG1 3.36Å; F132-T225 WeakPolarHBondContact CZ-OG1 3.05Å; D221-T225 WeakPolarHBondContact O-CB 3.3Å; D221-T225 PolarHBondContact O-N 3.22Å; D221-T225 PolarHBondContact O-OG1 3.04Å; I222-T225 PolarHBondContact O-N 2.9Å; T225-T227 VanDerWaalsContact C-N 3.25Å; T225-T227 PolarHBondContact O-N 3.19Å; T225-L228 PolarHBondContact O-N 3.45Å; T225-L228 VanDerWaalsContact O-N 3.1Å; T225-Y229 HydrophobicContact CG2-CD2 4.11Å; T225-Y229 PolarHBondContact O-N 3.33Å
226	N	91.9	Very high	91	Very high	46 Å²	46	53.6 Å²	53.6	25%	0.246	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-29.4	179.9	-71.1	-24.9	0	0	0	112.6	Y71 T72 C73 I222 Q224 K230 C231	Y71-N226 PolarHBondContact O-ND2 3.23Å; Y71-N226 VanDerWaalsContact O-ND2 3.13Å; T72-N226 WeakPolarHBondContact CA-OD1 3.39Å; T72-N226 WeakPolarHBondContact CB-OD1 3.13Å; C73-N226 PolarHBondContact N-OD1 2.96Å; I222-N226 WeakPolarHBondContact O-CB 3.16Å; I222-N226 PolarHBondContact O-N 2.91Å; I222-N226 PolarHBondContact O-ND2 2.9Å; Q224-N226 PolarHBondContact O-N 2.89Å; N226-K230 WeakPolarHBondContact O-CA 2.9Å; N226-K230 PolarHBondContact O-N 3.37Å; N226-C231 VanDerWaalsContact CA-SG 3.59Å; N226-C231 HydrophobicContact CB-CB 4.03Å; N226-C231 PolarHBondContact O-N 2.96Å; N226-C231 PolarHBondContact OD1-SG 2.61Å
227	T	90.7	Very high	91	Very high	63 Å²	63	46.3 Å²	46.3	39%	0.387	25%	0.25	S	S	.	.	H	α-helix	trans	-76.6	-35.5	171.9	-51.8	0	0	0	0	112.4	L171 I223 Q224 T225	L171-T227 HydrophobicContact CB-CG2 3.95Å; L171-T227 HydrophobicContact CD1-CG2 4.31Å; L171-T227 HydrophobicContact CD2-CG2 4.29Å; L171-T227 HydrophobicContact CG-CG2 4.4Å; I223-T227 WeakPolarHBondContact O-CB 3.04Å; I223-T227 PolarHBondContact O-N 3.29Å; I223-T227 PolarHBondContact O-OG1 3.37Å; Q224-T227 PolarHBondContact O-N 3.1Å; T225-T227 VanDerWaalsContact C-N 3.25Å; T225-T227 PolarHBondContact O-N 3.19Å
228	L	90.7	Very high	91	Very high	17 Å²	17	46.3 Å²	46.3	9%	0.089	25%	0.25	C	S	.	.	H	α-helix	trans	-67.7	-47.1	-178.7	-171.7	65.1	0	0	0	111.7	A32 T33 L39 L171 Q224 T225	A32-L228 HydrophobicContact CB-CD1 4.29Å; A32-L228 HydrophobicContact CB-CD2 4.37Å; T33-L228 HydrophobicContact CG2-CD2 4.49Å; L39-L228 HydrophobicContact CD2-CD1 3.93Å; L39-L228 HydrophobicContact CD2-CD2 3.91Å; L39-L228 HydrophobicContact CD2-CG 3.77Å; L171-L228 HydrophobicContact CD1-CB 3.84Å; L171-L228 HydrophobicContact CD1-CD1 4.16Å; Q224-L228 WeakPolarHBondContact O-CB 3.35Å; Q224-L228 PolarHBondContact O-N 3.44Å; T225-L228 PolarHBondContact O-N 3.45Å; T225-L228 VanDerWaalsContact O-N 3.1Å
229	Y	91.5	Very high	90.7	Very high	28 Å²	28	47.5 Å²	47.5	11%	0.11	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	1	179.5	-72.3	-79.7	0	0	0	114.2	L39 W40 G43 V74 V130 T225 C231	L39-Y229 HydrophobicContact CB-CE1 4.34Å; L39-Y229 HydrophobicContact CD2-CE1 4.37Å; W40-Y229 HydrophobicContact CB-CE1 4.22Å; G43-Y229 VanDerWaalsContact CA-CD1 3.45Å; V74-Y229 HydrophobicContact CG2-CD2 3.83Å; V74-Y229 HydrophobicContact CG2-CE2 4.04Å; V74-Y229 HydrophobicContact CG2-CG 4.34Å; V130-Y229 HydrophobicContact CG1-CE2 3.97Å; V130-Y229 VanDerWaalsContact O-CE2 3.31Å; V130-Y229 WeakPolarHBondContact O-CE2 3.27Å; V130-Y229 PolarHBondContact O-OH 2.94Å; T225-Y229 HydrophobicContact CG2-CD2 4.11Å; T225-Y229 PolarHBondContact O-N 3.33Å; Y229-C231 VanDerWaalsContact C-N 3.34Å; Y229-C231 PolarHBondContact O-N 3.1Å
230	K	90.1	Very high	90.5	Very high	186 Å²	186	48.8 Å²	48.8	81%	0.809	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	42	178.7	-50.5	173.6	-172.9	168.2	0	113.3	N226	N226-K230 WeakPolarHBondContact O-CA 2.9Å; N226-K230 PolarHBondContact O-N 3.37Å
231	C	91.2	Very high	90.3	Very high	24 Å²	24	51.1 Å²	51.1	16%	0.162	27%	0.271	C	S	.	.			trans	-59.3	153.2	-176.3	-57.6	0	0	0	0	113	C73 N226 Y229	C73-C231 HydrophobicContact CB-CB 3.52Å; C73-C231 WeakPolarHBondContact CB-SG 3.27Å; C73-C231 PolarHBondContact N-SG 3.34Å; C73-C231 VanDerWaalsContact N-SG 3.38Å; C73-C231 WeakPolarHBondContact SG-CA 3.38Å; C73-C231 WeakPolarHBondContact SG-CB 3.37Å; C73-C231 CovalentContact SG-SG 2.01Å; C73-C231 PolarHBondContact SG-SG 3.47Å; N226-C231 VanDerWaalsContact CA-SG 3.59Å; N226-C231 HydrophobicContact CB-CB 4.03Å; N226-C231 PolarHBondContact O-N 2.96Å; N226-C231 PolarHBondContact OD1-SG 2.61Å; Y229-C231 VanDerWaalsContact C-N 3.34Å; Y229-C231 PolarHBondContact O-N 3.1Å
232	A	89.4	Confident	90.3	Very high	26 Å²	26	54.7 Å²	54.7	22%	0.215	30%	0.296	C	S	.	.			trans	-55.1	146.4	176.6	0	0	0	0	0	112.5	C234 E264	A232-C234 PolarHBondContact O-N 3.16Å; A232-E264 HydrophobicContact CB-CB 3.94Å; A232-E264 HydrophobicContact CB-CG 3.94Å
233	K	83.8	Confident	90.3	Very high	166 Å²	166	53.9 Å²	53.9	72%	0.722	30%	0.296	S	S	*	.	S	Bend	trans	-68.7	-12.5	179.4	-74.5	-176.7	175.9	173.2	0	113.4	E259	K233-E259 IonicContact NZ-OE2 2.75Å; K233-E259 PolarHBondContact NZ-OE2 2.85Å
234	C	87.5	Confident	90.4	Very high	31 Å²	31	57.2 Å²	57.2	21%	0.209	31%	0.313	C	S	.	.	S	Bend	trans	-158.8	162.2	-168.4	43.2	0	0	0	0	110.9	A232 P248 H262 C263 E264	A232-C234 PolarHBondContact O-N 3.16Å; C234-P248 HydrophobicContact CB-CG 4.21Å; C234-H262 PolarHBondContact SG-O 3Å; C234-C263 HydrophobicContact CB-CB 3.88Å; C234-C263 WeakPolarHBondContact CB-SG 3.23Å; C234-C263 CarbonylContact O-C 3.4Å; C234-C263 WeakPolarHBondContact O-CA 3.46Å; C234-C263 WeakPolarHBondContact O-CB 3.29Å; C234-C263 WeakPolarHBondContact SG-CA 3.21Å; C234-C263 WeakPolarHBondContact SG-CB 3.24Å; C234-C263 CovalentContact SG-SG 2.04Å; C234-C263 PolarHBondContact SG-SG 3.44Å; C234-E264 PolarHBondContact O-N 2.99Å
235	G	87.9	Confident	90.5	Very high	37 Å²	37	57.5 Å²	57.5	38%	0.381	31%	0.314	S	S	.	.			trans	94.3	177.6	-167.8	0	0	0	0	0	111.6	E264	G235-E264 CarbonylContact C-O 3.54Å; G235-E264 VanDerWaalsContact CA-O 3.25Å; G235-E264 WeakPolarHBondContact CA-O 3.27Å
236	Q	91.1	Very high	90.4	Very high	105 Å²	105	58.8 Å²	58.8	49%	0.491	32%	0.323	S	S	.	.			trans	-161.6	165.4	-172.5	66.2	-166.1	32	0	0	111.7	F238 E264 W265 R266	Q236-F238 HydrophobicContact CG-CD2 4.41Å; Q236-F238 HydrophobicContact CG-CE2 4.04Å; Q236-F238 HydrophobicContact CG-CZ 4.14Å; Q236-E264 PolarHBondContact N-O 3.45Å; Q236-W265 VanDerWaalsContact O-CA 3.3Å; Q236-W265 WeakPolarHBondContact O-CA 3.4Å; Q236-R266 PolarHBondContact O-N 3.3Å; Q236-R266 VanDerWaalsContact O-N 3.09Å
237	T	92.8	Very high	90.3	Very high	13 Å²	13	56.6 Å²	56.6	8%	0.08	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	141.6	168.1	-43.6	0	0	0	0	109.8	E69 H239 R266	E69-T237 HydrophobicContact CB-CG2 4.36Å; E69-T237 WeakPolarHBondContact O-CB 3.46Å; E69-T237 PolarHBondContact O-OG1 3.2Å; T237-H239 WeakPolarHBondContact CG2-NE2 3.3Å; T237-R266 CarbonylContact C-O 3.44Å; T237-R266 WeakPolarHBondContact CA-O 3.34Å; T237-R266 HydrophobicContact CG2-CB 4.17Å; T237-R266 PolarHBondContact OG1-NH2 3.22Å
238	F	92.5	Very high	89.9	Confident	8 Å²	8	54.7 Å²	54.7	4%	0.035	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	132.7	168.9	-68.9	-80.8	0	0	0	109.8	Q236 F245 R266 I267 N268 F362	Q236-F238 HydrophobicContact CG-CD2 4.41Å; Q236-F238 HydrophobicContact CG-CE2 4.04Å; Q236-F238 HydrophobicContact CG-CZ 4.14Å; F238-F245 HydrophobicContact CE2-CB 3.95Å; F238-F245 HydrophobicContact CE2-CD1 4.09Å; F238-F245 HydrophobicContact CE2-CG 4.14Å; F238-F245 HydrophobicContact CZ-CB 3.95Å; F238-F245 HydrophobicContact CZ-CD1 4.45Å; F238-R266 PolarHBondContact N-O 3.48Å; F238-I267 HydrophobicContact CB-CG1 4.2Å; F238-I267 HydrophobicContact CD2-CG1 3.98Å; F238-N268 PolarHBondContact O-N 3.42Å; F238-F362 HydrophobicContact CB-CE1 3.87Å; F238-F362 HydrophobicContact CB-CE2 4.45Å; F238-F362 HydrophobicContact CB-CZ 3.57Å; F238-F362 AromaticContact CD1-CE1 3.56Å; F238-F362 HydrophobicContact CD1-CE1 3.56Å; F238-F362 AromaticContact CD1-CZ 3.76Å; F238-F362 HydrophobicContact CD1-CZ 3.76Å; F238-F362 HydrophobicContact CD2-CD1 4.37Å; F238-F362 AromaticContact CD2-CE1 3.64Å; F238-F362 HydrophobicContact CD2-CE1 3.64Å; F238-F362 HydrophobicContact CD2-CZ 4.26Å; F238-F362 AromaticContact CE1-CE1 3.82Å; F238-F362 HydrophobicContact CE1-CE1 3.82Å; F238-F362 HydrophobicContact CE1-CZ 4.42Å; F238-F362 HydrophobicContact CE2-CD1 4.47Å; F238-F362 AromaticContact CE2-CE1 3.9Å; F238-F362 HydrophobicContact CE2-CE1 3.9Å; F238-F362 AromaticContact CG-CE1 3.43Å; F238-F362 HydrophobicContact CG-CE1 3.43Å; F238-F362 VanDerWaalsContact CG-CE1 3.43Å; F238-F362 AromaticContact CG-CZ 3.64Å; F238-F362 HydrophobicContact CG-CZ 3.64Å; F238-F362 AromaticContact CZ-CE1 3.97Å; F238-F362 HydrophobicContact CZ-CE1 3.97Å
239	H	88.9	Confident	89.3	Confident	30 Å²	30	55.2 Å²	55.2	14%	0.139	30%	0.303	C	S	.	.			trans	-118.7	0.7	166.8	-66.5	-98.2	0	0	0	111.9	N66 E69 N70 T237 N268	N66-H239 VanDerWaalsContact CG-CE1 3.44Å; N66-H239 PolarHBondContact OD1-CE1 3.36Å; E69-H239 IonicContact OE2-CE1 2.72Å; E69-H239 PolarHBondContact OE2-CE1 2.94Å; E69-H239 IonicContact OE2-NE2 3.99Å; N70-H239 PolarHBondContact OD1-CD2 2.68Å; T237-H239 WeakPolarHBondContact CG2-NE2 3.3Å; H239-N268 PolarHBondContact ND1-O 2.86Å
240	E	87.8	Confident	88.7	Confident	125 Å²	125	58.6 Å²	58.6	58%	0.584	32%	0.317	S	S	*	.	S	Bend	trans	-74.6	154.1	179.5	-62.1	169.5	157.3	0	0	111.1	S242 F362	E240-S242 VanDerWaalsContact C-N 3.26Å; E240-S242 PolarHBondContact O-N 2.65Å; E240-F362 WeakPolarHBondContact O-CE2 3.43Å
241	A	87.3	Confident	87.8	Confident	56 Å²	56	53 Å²	53	46%	0.463	30%	0.295	S	S	.	.	S	Bend	trans	-70.1	-18.1	-179.1	0	0	0	0	0	114.2	V364	A241-V364 VanDerWaalsContact O-CB 3.29Å; A241-V364 WeakPolarHBondContact O-CB 3.47Å; A241-V364 WeakPolarHBondContact O-CG2 3.37Å; A241-V364 PolarHBondContact O-N 2.84Å
242	S	92.8	Very high	86.6	Confident	75 Å²	75	58.4 Å²	58.4	52%	0.524	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	164.5	168.7	62.3	0	0	0	0	110	E240 F362	E240-S242 VanDerWaalsContact C-N 3.26Å; E240-S242 PolarHBondContact O-N 2.65Å; S242-F362 VanDerWaalsContact C-CZ 3.46Å; S242-F362 VanDerWaalsContact CA-O 3.26Å; S242-F362 WeakPolarHBondContact CA-O 3.27Å; S242-F362 WeakPolarHBondContact CB-O 3.44Å
243	G	93	Very high	84.9	Confident	16 Å²	16	64.8 Å²	64.8	17%	0.165	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	170.9	177.9	0	0	0	0	0	114	G361 F362	G243-G361 CarbonylContact O-C 3.44Å; G243-G361 VanDerWaalsContact O-CA 3.3Å; G243-G361 WeakPolarHBondContact O-CA 3.38Å; G243-F362 PolarHBondContact N-O 2.89Å; G243-F362 WeakPolarHBondContact O-CD1 3.43Å; G243-F362 PolarHBondContact O-N 2.87Å
244	I	93.8	Very high	83.6	Confident	147 Å²	147	60.5 Å²	60.5	75%	0.754	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.4	-177.5	-57.3	177.6	0	0	0	109.2	A360	I244-A360 WeakPolarHBondContact CA-O 3.4Å
245	F	93.2	Very high	81.7	Confident	9 Å²	9	68.5 Å²	68.5	4%	0.039	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	151.4	179.3	60.5	-71.8	0	0	0	111.8	F238 W265 I267 F279 I331 F358 A360 F362	F238-F245 HydrophobicContact CE2-CB 3.95Å; F238-F245 HydrophobicContact CE2-CD1 4.09Å; F238-F245 HydrophobicContact CE2-CG 4.14Å; F238-F245 HydrophobicContact CZ-CB 3.95Å; F238-F245 HydrophobicContact CZ-CD1 4.45Å; F245-W265 HydrophobicContact CD2-CB 4.46Å; F245-W265 AromaticContact CD2-CD1 3.87Å; F245-W265 AromaticContact CD2-CD2 3.94Å; F245-W265 HydrophobicContact CD2-CD2 3.94Å; F245-W265 AromaticContact CD2-CG 3.86Å; F245-W265 HydrophobicContact CD2-CG 3.86Å; F245-W265 AromaticContact CD2-NE1 3.95Å; F245-W265 HydrophobicContact CE2-CD2 4.49Å; F245-W265 HydrophobicContact CE2-CG 4.38Å; F245-I267 HydrophobicContact CE1-CD1 4.35Å; F245-F279 HydrophobicContact CE2-CE1 4.42Å; F245-F279 HydrophobicContact CZ-CE1 4.44Å; F245-F279 HydrophobicContact CZ-CZ 4.41Å; F245-I331 HydrophobicContact CE2-CD1 3.72Å; F245-I331 HydrophobicContact CZ-CD1 3.51Å; F245-F358 AromaticContact CD2-CE2 3.62Å; F245-F358 HydrophobicContact CD2-CE2 3.62Å; F245-F358 AromaticContact CD2-CZ 3.87Å; F245-F358 HydrophobicContact CD2-CZ 3.87Å; F245-F358 AromaticContact CE2-CE2 3.62Å; F245-F358 HydrophobicContact CE2-CE2 3.62Å; F245-F358 AromaticContact CE2-CZ 4Å; F245-F358 HydrophobicContact CE2-CZ 4Å; F245-A360 HydrophobicContact CD1-CB 4.25Å; F245-A360 HydrophobicContact CE1-CB 3.76Å; F245-A360 HydrophobicContact CE2-CB 4.06Å; F245-A360 HydrophobicContact CZ-CB 3.64Å; F245-A360 PolarHBondContact N-O 3.46Å; F245-A360 PolarHBondContact O-N 2.85Å; F245-A360 VanDerWaalsContact O-O 3.06Å; F245-F362 HydrophobicContact CD1-CD1 4.13Å; F245-F362 HydrophobicContact CE1-CB 4.41Å; F245-F362 HydrophobicContact CE1-CD1 4.04Å
246	S	91.5	Very high	79.9	Confident	27 Å²	27	69.4 Å²	69.4	19%	0.189	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	155.5	177.4	70.4	0	0	0	0	111	F358	S246-F358 WeakPolarHBondContact CA-O 3.24Å; S246-F358 VanDerWaalsContact CB-O 3.29Å; S246-F358 WeakPolarHBondContact CB-O 3.06Å
247	S	88.8	Confident	77.8	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.382	C	S	.	.			trans	-66.1	151.1	174.3	59.6	0	0	0	0	112	D249 Y250 D251 G357 F358	S247-D249 PolarHBondContact O-N 3.44Å; S247-D249 VanDerWaalsContact O-N 3.08Å; S247-Y250 WeakPolarHBondContact O-CB 3.3Å; S247-Y250 PolarHBondContact O-N 3.1Å; S247-D251 PolarHBondContact O-N 2.83Å; S247-G357 VanDerWaalsContact OG-CA 3.25Å; S247-G357 WeakPolarHBondContact OG-CA 3.41Å; S247-F358 PolarHBondContact N-O 3.36Å; S247-F358 PolarHBondContact OG-N 2.95Å; S247-F358 PolarHBondContact OG-O 2.87Å
248	P	82.9	Confident	76	Confident	23 Å²	23	74.5 Å²	74.5	15%	0.149	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.4	178.8	-27.8	35.4	0	0	0	115.3	C234 V254 I261	C234-P248 HydrophobicContact CB-CG 4.21Å; P248-V254 HydrophobicContact CB-CB 4.41Å; P248-V254 HydrophobicContact CB-CG2 3.91Å; P248-I261 HydrophobicContact CG-CG2 4.49Å
249	D	77.2	Confident	74.7	Confident	27 Å²	27	79.5 Å²	79.5	14%	0.144	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-21.8	178.1	-75.1	-14.6	0	0	0	113.4	S247 T256 I261	S247-D249 PolarHBondContact O-N 3.44Å; S247-D249 VanDerWaalsContact O-N 3.08Å; D249-T256 PolarHBondContact OD1-OG1 2.99Å; D249-I261 VanDerWaalsContact OD1-CD1 3.31Å; D249-I261 WeakPolarHBondContact OD1-CD1 3.44Å; D249-I261 VanDerWaalsContact OD2-CD1 3.32Å; D249-I261 WeakPolarHBondContact OD2-CD1 3.22Å
250	Y	79.6	Confident	74.2	Confident	100 Å²	100	81.1 Å²	81.1	39%	0.392	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-47.8	176.5	179.6	-84.1	0	0	0	110.8	S247 N252 Y281 R356 F358 A359	S247-Y250 WeakPolarHBondContact O-CB 3.3Å; S247-Y250 PolarHBondContact O-N 3.1Å; Y250-N252 PolarHBondContact O-N 3.01Å; Y250-N252 PolarHBondContact O-ND2 3.2Å; Y250-Y281 AromaticContact CD2-CD1 3.77Å; Y250-Y281 HydrophobicContact CD2-CD1 3.77Å; Y250-Y281 HydrophobicContact CD2-CE1 4.29Å; Y250-Y281 AromaticContact CE2-CD1 3.62Å; Y250-Y281 HydrophobicContact CE2-CD1 3.62Å; Y250-Y281 HydrophobicContact CE2-CE1 4.29Å; Y250-Y281 AromaticContact CE2-CG 3.95Å; Y250-Y281 HydrophobicContact CE2-CG 3.95Å; Y250-R356 WeakPolarHBondContact CD2-O 3.26Å; Y250-F358 WeakPolarHBondContact CB-O 3.43Å; Y250-A359 HydrophobicContact CD1-CB 3.99Å; Y250-A359 HydrophobicContact CD2-CB 3.99Å; Y250-A359 HydrophobicContact CE1-CB 3.71Å; Y250-A359 HydrophobicContact CE2-CB 3.69Å; Y250-A359 HydrophobicContact CG-CB 4.14Å
251	D	71.1	Confident	73.9	Confident	67 Å²	67	75.8 Å²	75.8	36%	0.358	41%	0.406	S	S	.	.	S	Bend	trans	-72.9	-9.8	-175.2	-147	-26.5	0	0	0	113	S247 K253	S247-D251 PolarHBondContact O-N 2.83Å; D251-K253 HydrophobicContact CB-CB 4.43Å; D251-K253 HydrophobicContact CB-CD 4.18Å; D251-K253 HydrophobicContact CB-CG 4.09Å; D251-K253 VanDerWaalsContact CG-CD 3.46Å; D251-K253 VanDerWaalsContact CG-NZ 3.27Å; D251-K253 PolarHBondContact O-N 2.92Å; D251-K253 WeakPolarHBondContact OD1-CE 3.33Å; D251-K253 IonicContact OD1-NZ 3.18Å; D251-K253 PolarHBondContact OD1-NZ 3.47Å; D251-K253 WeakPolarHBondContact OD2-CD 3.41Å; D251-K253 VanDerWaalsContact OD2-CE 3.23Å; D251-K253 WeakPolarHBondContact OD2-CE 3.42Å; D251-K253 IonicContact OD2-NZ 2.82Å; D251-K253 PolarHBondContact OD2-NZ 2.87Å
252	N	65.7	Low	74	Confident	138 Å²	138	76 Å²	76	74%	0.738	40%	0.397	S	S	*	.			trans	57.6	5	-173	-60.2	-98.8	0	0	0	115	Y250 V254	Y250-N252 PolarHBondContact O-N 3.01Å; Y250-N252 PolarHBondContact O-ND2 3.2Å; N252-V254 PolarHBondContact O-N 3Å
253	K	54.7	Low	73.9	Confident	161 Å²	161	72.4 Å²	72.4	70%	0.7	37%	0.372	S	S	*	.			trans	-65.5	-19.8	-175.4	-74.7	178.3	-178.1	150	0	113.9	D251	D251-K253 HydrophobicContact CB-CB 4.43Å; D251-K253 HydrophobicContact CB-CD 4.18Å; D251-K253 HydrophobicContact CB-CG 4.09Å; D251-K253 VanDerWaalsContact CG-CD 3.46Å; D251-K253 VanDerWaalsContact CG-NZ 3.27Å; D251-K253 PolarHBondContact O-N 2.92Å; D251-K253 WeakPolarHBondContact OD1-CE 3.33Å; D251-K253 IonicContact OD1-NZ 3.18Å; D251-K253 PolarHBondContact OD1-NZ 3.47Å; D251-K253 WeakPolarHBondContact OD2-CD 3.41Å; D251-K253 VanDerWaalsContact OD2-CE 3.23Å; D251-K253 WeakPolarHBondContact OD2-CE 3.42Å; D251-K253 IonicContact OD2-NZ 2.82Å; D251-K253 PolarHBondContact OD2-NZ 2.87Å
254	V	54.7	Low	73.9	Confident	75 Å²	75	73.7 Å²	73.7	46%	0.455	37%	0.373	S	S	.	.			trans	-117.1	123.2	178.6	-167.9	0	0	0	0	110.8	P248 N252 T256	P248-V254 HydrophobicContact CB-CB 4.41Å; P248-V254 HydrophobicContact CB-CG2 3.91Å; N252-V254 PolarHBondContact O-N 3Å; V254-T256 HydrophobicContact CB-CG2 4.05Å; V254-T256 HydrophobicContact CG1-CG2 3.58Å; V254-T256 PolarHBondContact O-N 3.45Å
255	K	47.9	Very low	74	Confident	199 Å²	199	67.1 Å²	67.1	87%	0.865	34%	0.339	S	S	*	.			trans	-78.2	66.8	166.2	-68.9	178.7	-178.3	171	0	109.7	Q257	K255-Q257 PolarHBondContact O-N 3.48Å
256	T	50.2	Low	74	Confident	57 Å²	57	67.4 Å²	67.4	35%	0.35	34%	0.34	S	S	.	.			trans	-57.8	100.7	-179.7	37.9	0	0	0	0	110.7	D249 V254 G258 I261	D249-T256 PolarHBondContact OD1-OG1 2.99Å; V254-T256 HydrophobicContact CB-CG2 4.05Å; V254-T256 HydrophobicContact CG1-CG2 3.58Å; V254-T256 PolarHBondContact O-N 3.45Å; T256-G258 PolarHBondContact O-N 2.7Å; T256-I261 HydrophobicContact CG2-CD1 3.99Å; T256-I261 HydrophobicContact CG2-CG1 4.27Å
257	Q	47.4	Very low	74.1	Confident	194 Å²	194	66.1 Å²	66.1	91%	0.907	33%	0.331	S	S	*	.			trans	-78.4	50.4	176.8	-67.4	-163.2	3.4	0	0	111.7	K255 E259	K255-Q257 PolarHBondContact O-N 3.48Å; Q257-E259 PolarHBondContact O-N 3.39Å
258	G	55.4	Low	74.3	Confident	30 Å²	30	66.3 Å²	66.3	31%	0.309	33%	0.332	S	S	.	.	S	Bend	trans	69	27.4	176.3	0	0	0	0	0	114.9	T256 Q337	T256-G258 PolarHBondContact O-N 2.7Å; G258-Q337 VanDerWaalsContact O-CG 3.29Å; G258-Q337 WeakPolarHBondContact O-CG 3.17Å; G258-Q337 PolarHBondContact O-NE2 2.97Å
259	E	65.8	Low	74.6	Confident	113 Å²	113	65.9 Å²	65.9	53%	0.528	33%	0.329	S	S	.	.			trans	-73.5	152.6	160.8	-76.4	-170.5	-152.9	0	0	110.6	K233 Q257	K233-E259 IonicContact NZ-OE2 2.75Å; K233-E259 PolarHBondContact NZ-OE2 2.85Å; Q257-E259 PolarHBondContact O-N 3.39Å
260	P	76.8	Confident	75.2	Confident	65 Å²	65	64.8 Å²	64.8	42%	0.422	32%	0.323	S	S	.	.			trans	-66.5	143.2	166.3	30.2	-33.4	0	0	0	110.2	V335 Q337	P260-V335 WeakPolarHBondContact CA-O 3.48Å; P260-Q337 HydrophobicContact CB-CB 4.27Å
261	I	82.9	Confident	75.7	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.067	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.1	179.6	-51.9	173.1	0	0	0	108.3	P248 D249 T256 C263 Y333 H334 V335	P248-I261 HydrophobicContact CG-CG2 4.49Å; D249-I261 VanDerWaalsContact OD1-CD1 3.31Å; D249-I261 WeakPolarHBondContact OD1-CD1 3.44Å; D249-I261 VanDerWaalsContact OD2-CD1 3.32Å; D249-I261 WeakPolarHBondContact OD2-CD1 3.22Å; T256-I261 HydrophobicContact CG2-CD1 3.99Å; T256-I261 HydrophobicContact CG2-CG1 4.27Å; I261-C263 VanDerWaalsContact CG2-SG 3.6Å; I261-Y333 HydrophobicContact CB-CE1 4.45Å; I261-Y333 HydrophobicContact CG2-CD1 4.06Å; I261-Y333 HydrophobicContact CG2-CE1 4Å; I261-H334 CarbonylContact O-C 3.43Å; I261-H334 WeakPolarHBondContact O-CA 3.42Å; I261-V335 HydrophobicContact CB-CB 4.32Å; I261-V335 PolarHBondContact N-O 2.83Å; I261-V335 PolarHBondContact O-N 3.27Å
262	H	88.3	Confident	76.4	Confident	59 Å²	59	60.3 Å²	60.3	27%	0.273	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	111.1	171.2	173.2	76	0	0	0	107.7	C234 E264 Q332 Y333 H334	C234-H262 PolarHBondContact SG-O 3Å; H262-E264 IonicContact CD2-OE1 2.82Å; H262-E264 IonicContact CE1-OE1 2.65Å; H262-E264 PolarHBondContact CE1-OE1 2.81Å; H262-E264 IonicContact NE2-OE1 3.87Å; H262-E264 PolarHBondContact NE2-OE1 2.75Å; H262-Q332 PolarHBondContact CE1-NE2 3.17Å; H262-Q332 PolarHBondContact ND1-NE2 3.04Å; H262-Y333 WeakPolarHBondContact CA-O 3.3Å; H262-H334 AromaticContact ND1-CD2 3.95Å
263	C	91.6	Very high	77.6	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	146.4	178.4	-50.8	0	0	0	0	110.5	C234 I261 W265 Q332 Y333	C234-C263 HydrophobicContact CB-CB 3.88Å; C234-C263 WeakPolarHBondContact CB-SG 3.23Å; C234-C263 CarbonylContact O-C 3.4Å; C234-C263 WeakPolarHBondContact O-CA 3.46Å; C234-C263 WeakPolarHBondContact O-CB 3.29Å; C234-C263 WeakPolarHBondContact SG-CA 3.21Å; C234-C263 WeakPolarHBondContact SG-CB 3.24Å; C234-C263 CovalentContact SG-SG 2.04Å; C234-C263 PolarHBondContact SG-SG 3.44Å; I261-C263 VanDerWaalsContact CG2-SG 3.6Å; C263-W265 HydrophobicContact CB-CE3 4.38Å; C263-W265 HydrophobicContact CB-CH2 3.43Å; C263-W265 VanDerWaalsContact CB-CH2 3.43Å; C263-W265 HydrophobicContact CB-CZ2 4.15Å; C263-W265 HydrophobicContact CB-CZ3 3.57Å; C263-Q332 WeakPolarHBondContact O-CA 3.39Å; C263-Y333 PolarHBondContact N-O 2.83Å; C263-Y333 PolarHBondContact O-N 3.34Å
264	E	93.4	Very high	79.2	Confident	43 Å²	43	50.2 Å²	50.2	20%	0.201	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	127.7	177.8	-71.8	174.8	-130.9	0	0	110.8	A232 C234 G235 Q236 H262 W330 I331	A232-E264 HydrophobicContact CB-CB 3.94Å; A232-E264 HydrophobicContact CB-CG 3.94Å; C234-E264 PolarHBondContact O-N 2.99Å; G235-E264 CarbonylContact C-O 3.54Å; G235-E264 VanDerWaalsContact CA-O 3.25Å; G235-E264 WeakPolarHBondContact CA-O 3.27Å; Q236-E264 PolarHBondContact N-O 3.45Å; H262-E264 IonicContact CD2-OE1 2.82Å; H262-E264 IonicContact CE1-OE1 2.65Å; H262-E264 PolarHBondContact CE1-OE1 2.81Å; H262-E264 IonicContact NE2-OE1 3.87Å; H262-E264 PolarHBondContact NE2-OE1 2.75Å; E264-W330 HydrophobicContact CG-CZ2 3.97Å; E264-W330 PolarHBondContact OE2-NE1 2.88Å; E264-I331 CarbonylContact C-O 3.57Å; E264-I331 WeakPolarHBondContact CA-O 3.4Å
265	W	94.2	Very high	81	Confident	10 Å²	10	46.7 Å²	46.7	4%	0.038	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145	169	-60.8	-101.3	0	0	0	109.9	Q236 F245 C263 I331 F358	Q236-W265 VanDerWaalsContact O-CA 3.3Å; Q236-W265 WeakPolarHBondContact O-CA 3.4Å; F245-W265 HydrophobicContact CD2-CB 4.46Å; F245-W265 AromaticContact CD2-CD1 3.87Å; F245-W265 AromaticContact CD2-CD2 3.94Å; F245-W265 HydrophobicContact CD2-CD2 3.94Å; F245-W265 AromaticContact CD2-CG 3.86Å; F245-W265 HydrophobicContact CD2-CG 3.86Å; F245-W265 AromaticContact CD2-NE1 3.95Å; F245-W265 HydrophobicContact CE2-CD2 4.49Å; F245-W265 HydrophobicContact CE2-CG 4.38Å; C263-W265 HydrophobicContact CB-CE3 4.38Å; C263-W265 HydrophobicContact CB-CH2 3.43Å; C263-W265 VanDerWaalsContact CB-CH2 3.43Å; C263-W265 HydrophobicContact CB-CZ2 4.15Å; C263-W265 HydrophobicContact CB-CZ3 3.57Å; W265-I331 HydrophobicContact CB-CB 4.35Å; W265-I331 HydrophobicContact CE3-CG2 4.42Å; W265-I331 PolarHBondContact N-O 2.67Å; W265-I331 PolarHBondContact O-N 2.82Å; W265-F358 HydrophobicContact CE3-CZ 4.12Å; W265-F358 AromaticContact CH2-CE1 3.64Å; W265-F358 HydrophobicContact CH2-CE1 3.64Å; W265-F358 AromaticContact CH2-CZ 3.6Å; W265-F358 HydrophobicContact CH2-CZ 3.6Å; W265-F358 HydrophobicContact CZ2-CE1 4.43Å; W265-F358 HydrophobicContact CZ2-CZ 4.04Å; W265-F358 AromaticContact CZ3-CE1 3.75Å; W265-F358 HydrophobicContact CZ3-CE1 3.75Å; W265-F358 AromaticContact CZ3-CZ 3.65Å; W265-F358 HydrophobicContact CZ3-CZ 3.65Å
266	R	94.1	Very high	83.3	Confident	14 Å²	14	39.1 Å²	39.1	5%	0.053	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.9	171.8	-70.6	171	-59.9	167.7	9.8	108.9	E69 T72 C73 V74 Q236 T237 F238 V329 W330	E69-R266 PolarHBondContact O-NH2 3.4Å; E69-R266 VanDerWaalsContact O-NH2 3.1Å; T72-R266 PolarHBondContact O-NH2 3.18Å; C73-R266 VanDerWaalsContact C-NH1 3.33Å; C73-R266 PolarHBondContact O-NH1 3.32Å; V74-R266 PolarHBondContact O-NH1 3.18Å; Q236-R266 PolarHBondContact O-N 3.3Å; Q236-R266 VanDerWaalsContact O-N 3.09Å; T237-R266 CarbonylContact C-O 3.44Å; T237-R266 WeakPolarHBondContact CA-O 3.34Å; T237-R266 HydrophobicContact CG2-CB 4.17Å; T237-R266 PolarHBondContact OG1-NH2 3.22Å; F238-R266 PolarHBondContact N-O 3.48Å; R266-V329 CarbonylContact C-O 3.56Å; R266-V329 WeakPolarHBondContact CA-O 3.43Å; R266-W330 HydrophobicContact CG-CB 4.49Å; R266-W330 HydrophobicContact CG-CG 4.43Å
267	I	94.1	Very high	85.4	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.4	174	-59.6	158.1	0	0	0	106.1	F238 F245 I275 L277 R328 V329 I331 F362	F238-I267 HydrophobicContact CB-CG1 4.2Å; F238-I267 HydrophobicContact CD2-CG1 3.98Å; F245-I267 HydrophobicContact CE1-CD1 4.35Å; I267-I275 HydrophobicContact CB-CD1 4.01Å; I267-I275 HydrophobicContact CD1-CG2 4.19Å; I267-I275 HydrophobicContact CG2-CD1 3.64Å; I267-I275 HydrophobicContact CG2-CG1 3.92Å; I267-I275 HydrophobicContact CG2-CG2 4.03Å; I267-I275 WeakPolarHBondContact O-CD1 3.42Å; I267-L277 HydrophobicContact CD1-CD2 3.54Å; I267-R328 VanDerWaalsContact O-CA 3.31Å; I267-R328 WeakPolarHBondContact O-CA 3.05Å; I267-V329 PolarHBondContact N-O 2.9Å; I267-V329 PolarHBondContact O-N 2.63Å; I267-I331 HydrophobicContact CD1-CD1 4.2Å; I267-F362 HydrophobicContact CD1-CB 3.82Å; I267-F362 HydrophobicContact CD1-CD1 3.79Å; I267-F362 HydrophobicContact CD1-CD2 4.2Å; I267-F362 HydrophobicContact CD1-CE1 4.46Å; I267-F362 HydrophobicContact CD1-CG 3.65Å; I267-F362 HydrophobicContact CG1-CD1 4.16Å; I267-F362 HydrophobicContact CG1-CD2 4.46Å; I267-F362 HydrophobicContact CG1-CE1 4.34Å; I267-F362 HydrophobicContact CG1-CG 4.24Å; I267-F362 HydrophobicContact CG2-CD2 3.75Å; I267-F362 HydrophobicContact CG2-CE2 3.75Å; I267-F362 HydrophobicContact CG2-CG 4.33Å; I267-F362 HydrophobicContact CG2-CZ 4.32Å
268	N	91.7	Very high	87.6	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	94.7	-169.4	-73.5	-10.9	0	0	0	109.6	E69 F238 H239 R328	E69-N268 PolarHBondContact OE2-ND2 3.29Å; F238-N268 PolarHBondContact O-N 3.42Å; H239-N268 PolarHBondContact ND1-O 2.86Å; N268-R328 VanDerWaalsContact CG-CZ 3.48Å; N268-R328 PolarHBondContact ND2-NH1 2.98Å; N268-R328 PolarHBondContact ND2-NH2 2.75Å; N268-R328 WeakPolarHBondContact OD1-CD 3.43Å
269	T	90.4	Very high	89.4	Confident	15 Å²	15	28.9 Å²	28.9	9%	0.092	14%	0.144	C	C	.	.			trans	-98.5	175.5	179	-172.9	0	0	0	0	112.4	H273 I275 H327 V364	T269-H273 HydrophobicContact CG2-CB 3.78Å; T269-I275 HydrophobicContact CG2-CD1 4.12Å; T269-I275 HydrophobicContact CG2-CG1 3.93Å; T269-H327 HydrophobicContact CG2-CB 4.04Å; T269-H327 VanDerWaalsContact CG2-O 3.29Å; T269-H327 WeakPolarHBondContact CG2-O 3.4Å; T269-H327 PolarHBondContact N-O 3.32Å; T269-H327 PolarHBondContact O-CD2 3.21Å; T269-V364 HydrophobicContact CG2-CG1 4.17Å; T269-V364 HydrophobicContact CG2-CG2 4.33Å; T269-V364 WeakPolarHBondContact OG1-CG1 3.18Å
270	A	90	Very high	90.6	Very high	3 Å²	3	27.1 Å²	27.1	3%	0.025	14%	0.141	C	C	.	.			trans	-61.5	152.4	172.8	0	0	0	0	0	111.6	H273 H327 E378 N379	A270-H273 WeakPolarHBondContact O-CB 3.24Å; A270-H273 PolarHBondContact O-N 3.23Å; A270-H273 PolarHBondContact O-ND1 2.9Å; A270-H327 WeakPolarHBondContact O-CB 3.32Å; A270-E378 WeakPolarHBondContact CA-OE2 3.26Å; A270-E378 HydrophobicContact CB-CB 3.98Å; A270-N379 VanDerWaalsContact CB-O 3.25Å; A270-N379 WeakPolarHBondContact CB-O 3.46Å
271	R	89.7	Confident	91.1	Very high	55 Å²	55	26.8 Å²	26.8	21%	0.208	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	155.9	178.2	-59.9	177.9	-162.2	-152	5.2	111.4	Y47 P78 H273 V376 E378	Y47-R271 PolarHBondContact OH-NH2 2.79Å; P78-R271 VanDerWaalsContact CG-NH2 3.34Å; R271-H273 PolarHBondContact O-N 2.76Å; R271-H273 PolarHBondContact O-ND1 2.9Å; R271-V376 HydrophobicContact CB-CB 4.41Å; R271-V376 WeakPolarHBondContact CB-O 3.45Å; R271-E378 HydrophobicContact CB-CB 4.41Å; R271-E378 HydrophobicContact CB-CG 3.96Å; R271-E378 VanDerWaalsContact CD-OE1 3.28Å; R271-E378 WeakPolarHBondContact CD-OE1 3.49Å; R271-E378 HydrophobicContact CG-CG 4.3Å; R271-E378 WeakPolarHBondContact CG-OE1 3.38Å; R271-E378 WeakPolarHBondContact CG-OE2 3.28Å; R271-E378 PolarHBondContact N-OE2 3.31Å; R271-E378 IonicContact NE-OE1 3.26Å; R271-E378 PolarHBondContact NE-OE1 3.27Å; R271-E378 VanDerWaalsContact NE-OE1 3.12Å; R271-E378 PolarHBondContact O-N 2.7Å
272	G	85.5	Confident	91.3	Very high	19 Å²	19	26.3 Å²	26.3	20%	0.196	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	2.9	-173.6	0	0	0	0	0	114.9	V376 W394	G272-V376 PolarHBondContact N-O 2.72Å; G272-W394 PolarHBondContact O-NE1 3.12Å
273	H	90.2	Very high	91.1	Very high	5 Å²	5	24 Å²	24	2%	0.023	12%	0.12	C	C	.	.			trans	-105.5	162.6	176.9	-64.6	68.2	0	0	0	112.1	T269 A270 R271 V364 C366 E378 P380	T269-H273 HydrophobicContact CG2-CB 3.78Å; A270-H273 WeakPolarHBondContact O-CB 3.24Å; A270-H273 PolarHBondContact O-N 3.23Å; A270-H273 PolarHBondContact O-ND1 2.9Å; R271-H273 PolarHBondContact O-N 2.76Å; R271-H273 PolarHBondContact O-ND1 2.9Å; H273-V364 HydrophobicContact CB-CG1 4.03Å; H273-C366 VanDerWaalsContact CD2-CA 3.4Å; H273-C366 WeakPolarHBondContact CD2-CA 3.35Å; H273-C366 WeakPolarHBondContact CD2-CB 3.36Å; H273-C366 VanDerWaalsContact NE2-CB 3.32Å; H273-C366 WeakPolarHBondContact NE2-CB 3.46Å; H273-E378 PolarHBondContact CE1-O 2.72Å; H273-E378 VanDerWaalsContact CE1-O 3.25Å; H273-P380 WeakPolarHBondContact NE2-CA 3.39Å
274	R	89.9	Confident	90.4	Very high	82 Å²	82	25 Å²	25	31%	0.309	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	159.9	174.1	-68	179.9	173.7	148.7	4.8	111.2	V364 I365 N369	R274-V364 WeakPolarHBondContact O-CA 3.3Å; R274-I365 PolarHBondContact N-O 2.94Å; R274-I365 PolarHBondContact O-N 2.96Å; R274-N369 PolarHBondContact NH2-O 3.38Å
275	I	92.6	Very high	89.5	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121	178.7	-63.1	154.1	0	0	0	108.3	I267 T269 L277 S324 V329 F362	I267-I275 HydrophobicContact CB-CD1 4.01Å; I267-I275 HydrophobicContact CD1-CG2 4.19Å; I267-I275 HydrophobicContact CG2-CD1 3.64Å; I267-I275 HydrophobicContact CG2-CG1 3.92Å; I267-I275 HydrophobicContact CG2-CG2 4.03Å; I267-I275 WeakPolarHBondContact O-CD1 3.42Å; T269-I275 HydrophobicContact CG2-CD1 4.12Å; T269-I275 HydrophobicContact CG2-CG1 3.93Å; I275-L277 HydrophobicContact CG2-CD2 3.71Å; I275-L277 HydrophobicContact CG2-CG 4.37Å; I275-S324 PolarHBondContact N-OG 2.79Å; I275-S324 PolarHBondContact O-N 2.87Å; I275-S324 PolarHBondContact O-OG 2.86Å; I275-V329 HydrophobicContact CB-CG2 4.17Å; I275-V329 HydrophobicContact CD1-CB 4.19Å; I275-V329 HydrophobicContact CD1-CG2 3.78Å; I275-V329 HydrophobicContact CG2-CG2 4.4Å; I275-F362 HydrophobicContact CG2-CB 4.32Å
276	L	94.4	Very high	88.4	Confident	40 Å²	40	32.1 Å²	32.1	21%	0.209	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.4	169	-175	70.9	0	0	0	108.5	I321 T323 F362 E363 I365	L276-I321 HydrophobicContact CD1-CG2 3.58Å; L276-I321 HydrophobicContact CG-CG2 4.38Å; L276-T323 WeakPolarHBondContact CD1-OG1 3.36Å; L276-F362 CarbonylContact O-C 3.56Å; L276-F362 WeakPolarHBondContact O-CA 3.49Å; L276-E363 HydrophobicContact CB-CB 4.49Å; L276-E363 PolarHBondContact N-O 2.73Å; L276-E363 PolarHBondContact O-N 3.27Å; L276-I365 HydrophobicContact CB-CD1 3.93Å; L276-I365 HydrophobicContact CB-CG1 4.4Å; L276-I365 HydrophobicContact CD2-CD1 4.31Å
277	L	94.4	Very high	87.3	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	139.2	170.5	-51.9	178	0	0	0	109.8	I267 I275 F279 V298 I321 I322 V329 I331 F362	I267-L277 HydrophobicContact CD1-CD2 3.54Å; I275-L277 HydrophobicContact CG2-CD2 3.71Å; I275-L277 HydrophobicContact CG2-CG 4.37Å; L277-F279 HydrophobicContact CB-CD2 4.2Å; L277-F279 HydrophobicContact CB-CE2 3.79Å; L277-F279 HydrophobicContact CD1-CE2 3.64Å; L277-F279 HydrophobicContact CD1-CZ 4.09Å; L277-F279 HydrophobicContact CG-CE2 4.36Å; L277-V298 HydrophobicContact CD1-CG1 3.72Å; L277-I321 WeakPolarHBondContact O-CA 3.29Å; L277-I322 HydrophobicContact CB-CB 4.25Å; L277-I322 HydrophobicContact CD1-CB 4.4Å; L277-I322 PolarHBondContact N-O 3.33Å; L277-I322 PolarHBondContact O-N 2.85Å; L277-V329 HydrophobicContact CD1-CG1 4.21Å; L277-I331 HydrophobicContact CD1-CD1 3.96Å; L277-I331 HydrophobicContact CD2-CD1 4.21Å; L277-F362 HydrophobicContact CD2-CB 3.74Å
278	N	94.6	Very high	86	Confident	62 Å²	62	38.1 Å²	38.1	33%	0.332	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	93.6	174.5	-177.6	-7.5	0	0	0	109.7	T280 A360 G361	N278-T280 VanDerWaalsContact C-N 3.33Å; N278-T280 PolarHBondContact O-N 2.83Å; N278-A360 CarbonylContact O-C 3.21Å; N278-A360 VanDerWaalsContact O-CA 3.27Å; N278-A360 WeakPolarHBondContact O-CA 3.49Å; N278-G361 PolarHBondContact N-O 3.42Å; N278-G361 PolarHBondContact O-N 3.4Å
279	F	92.8	Very high	84.9	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.009	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	82.6	176	-70	-89.4	0	0	0	110.5	F245 L277 Y281 I282 L296 V298 P319 L320 I322 I331 F358 A359 A360	F245-F279 HydrophobicContact CE2-CE1 4.42Å; F245-F279 HydrophobicContact CZ-CE1 4.44Å; F245-F279 HydrophobicContact CZ-CZ 4.41Å; L277-F279 HydrophobicContact CB-CD2 4.2Å; L277-F279 HydrophobicContact CB-CE2 3.79Å; L277-F279 HydrophobicContact CD1-CE2 3.64Å; L277-F279 HydrophobicContact CD1-CZ 4.09Å; L277-F279 HydrophobicContact CG-CE2 4.36Å; F279-Y281 PolarHBondContact O-N 2.85Å; F279-Y281 VanDerWaalsContact O-N 3.16Å; F279-I282 HydrophobicContact CB-CD1 3.91Å; F279-I282 HydrophobicContact CB-CG1 4.13Å; F279-I282 HydrophobicContact CD1-CD1 4.34Å; F279-I282 HydrophobicContact CD1-CG1 4.47Å; F279-I282 HydrophobicContact CG-CD1 4.24Å; F279-L296 HydrophobicContact CD1-CD2 3.8Å; F279-L296 HydrophobicContact CE1-CD1 4.22Å; F279-L296 HydrophobicContact CE1-CD2 3.56Å; F279-L296 HydrophobicContact CE1-CG 4.4Å; F279-L296 HydrophobicContact CZ-CD2 4.16Å; F279-V298 HydrophobicContact CE2-CG2 4.24Å; F279-V298 HydrophobicContact CZ-CG2 4.02Å; F279-P319 WeakPolarHBondContact O-CA 3.31Å; F279-L320 HydrophobicContact CB-CB 4.09Å; F279-L320 WeakPolarHBondContact CB-O 3.46Å; F279-L320 HydrophobicContact CD2-CD2 4.45Å; F279-L320 PolarHBondContact N-O 3.03Å; F279-L320 PolarHBondContact O-N 2.8Å; F279-L320 VanDerWaalsContact O-N 3.14Å; F279-I322 HydrophobicContact CD2-CD1 4.25Å; F279-I322 HydrophobicContact CE2-CD1 3.95Å; F279-I331 HydrophobicContact CZ-CD1 4.34Å; F279-F358 AromaticContact CD1-CD2 3.84Å; F279-F358 HydrophobicContact CD1-CD2 3.84Å; F279-F358 HydrophobicContact CD1-CE2 4.37Å; F279-F358 AromaticContact CE1-CD2 3.83Å; F279-F358 HydrophobicContact CE1-CD2 3.83Å; F279-F358 AromaticContact CE1-CE2 3.94Å; F279-F358 HydrophobicContact CE1-CE2 3.94Å; F279-A359 CarbonylContact C-O 3.43Å; F279-A360 HydrophobicContact CD1-CB 3.52Å; F279-A360 HydrophobicContact CE1-CB 3.74Å; F279-A360 HydrophobicContact CG-CB 4.01Å; F279-A360 HydrophobicContact CZ-CB 4.43Å
280	T	90.9	Very high	84.2	Confident	77 Å²	77	45.3 Å²	45.3	47%	0.472	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	-24.3	177.4	63.6	0	0	0	0	114.5	N278 A359	N278-T280 VanDerWaalsContact C-N 3.33Å; N278-T280 PolarHBondContact O-N 2.83Å; T280-A359 PolarHBondContact N-O 2.93Å; T280-A359 VanDerWaalsContact N-O 3.17Å; T280-A359 PolarHBondContact OG1-O 2.85Å; T280-A359 VanDerWaalsContact OG1-O 3.14Å
281	Y	87.9	Confident	83.3	Confident	58 Å²	58	49 Å²	49	23%	0.227	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	133.3	179.1	-169.5	-96.3	0	0	0	112.8	Y250 F279 S283 R356 F358 A359	Y250-Y281 AromaticContact CD2-CD1 3.77Å; Y250-Y281 HydrophobicContact CD2-CD1 3.77Å; Y250-Y281 HydrophobicContact CD2-CE1 4.29Å; Y250-Y281 AromaticContact CE2-CD1 3.62Å; Y250-Y281 HydrophobicContact CE2-CD1 3.62Å; Y250-Y281 HydrophobicContact CE2-CE1 4.29Å; Y250-Y281 AromaticContact CE2-CG 3.95Å; Y250-Y281 HydrophobicContact CE2-CG 3.95Å; F279-Y281 PolarHBondContact O-N 2.85Å; F279-Y281 VanDerWaalsContact O-N 3.16Å; Y281-S283 WeakPolarHBondContact OH-CB 3.37Å; Y281-R356 HydrophobicContact CE1-CB 3.65Å; Y281-R356 VanDerWaalsContact OH-CD 3.23Å; Y281-R356 WeakPolarHBondContact OH-CD 3.43Å; Y281-F358 CarbonylContact O-C 3.55Å; Y281-F358 WeakPolarHBondContact O-CA 3.46Å; Y281-F358 VanDerWaalsContact O-CB 3.28Å; Y281-F358 WeakPolarHBondContact O-CB 3.3Å; Y281-A359 PolarHBondContact N-O 3.08Å; Y281-A359 VanDerWaalsContact N-O 3.14Å; Y281-A359 PolarHBondContact O-N 3.48Å
282	I	87.2	Confident	82.3	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	124.3	170.6	-55.6	173.6	0	0	0	109.4	F279 M284 L296 K315 Y316 L320 F358	F279-I282 HydrophobicContact CB-CD1 3.91Å; F279-I282 HydrophobicContact CB-CG1 4.13Å; F279-I282 HydrophobicContact CD1-CD1 4.34Å; F279-I282 HydrophobicContact CD1-CG1 4.47Å; F279-I282 HydrophobicContact CG-CD1 4.24Å; I282-M284 HydrophobicContact CG2-CE 4.14Å; I282-L296 HydrophobicContact CD1-CD2 3.95Å; I282-L296 HydrophobicContact CG1-CD2 4.4Å; I282-K315 WeakPolarHBondContact O-CA 3.35Å; I282-Y316 HydrophobicContact CB-CD2 3.75Å; I282-Y316 HydrophobicContact CB-CG 4.41Å; I282-Y316 HydrophobicContact CD1-CD2 3.98Å; I282-Y316 HydrophobicContact CD1-CE2 4.35Å; I282-Y316 HydrophobicContact CD1-CG 4.41Å; I282-Y316 HydrophobicContact CG1-CD2 4.43Å; I282-Y316 HydrophobicContact CG2-CD2 3.79Å; I282-Y316 HydrophobicContact CG2-CE2 4.22Å; I282-Y316 PolarHBondContact O-N 2.77Å; I282-Y316 VanDerWaalsContact O-N 3.1Å; I282-L320 HydrophobicContact CD1-CB 4.44Å; I282-L320 HydrophobicContact CD1-CD2 3.94Å; I282-F358 HydrophobicContact CG1-CB 4.16Å
283	S	82.5	Confident	81.8	Confident	12 Å²	12	51.5 Å²	51.5	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	84.5	177.8	-177.4	0	0	0	0	111.9	Y281 K354 R356 G357	Y281-S283 WeakPolarHBondContact OH-CB 3.37Å; S283-K354 PolarHBondContact OG-O 3.42Å; S283-R356 PolarHBondContact O-N 2.89Å; S283-R356 VanDerWaalsContact O-N 3.11Å; S283-G357 PolarHBondContact N-O 2.85Å; S283-G357 PolarHBondContact O-N 2.89Å; S283-G357 VanDerWaalsContact O-N 3.16Å
284	M	78.7	Confident	81.4	Confident	19 Å²	19	52.4 Å²	52.4	9%	0.094	29%	0.292	C	S	.	.			trans	-110.3	-176	180	-60.9	-172.3	-58.5	0	0	111.6	I282 L296 Y312 G314 Y333	I282-M284 HydrophobicContact CG2-CE 4.14Å; M284-L296 HydrophobicContact CE-CB 3.73Å; M284-L296 HydrophobicContact SD-CB 4.29Å; M284-Y312 WeakPolarHBondContact CE-O 3.48Å; M284-G314 PolarHBondContact N-O 3.39Å; M284-Y333 HydrophobicContact CG-CE2 4.13Å; M284-Y333 HydrophobicContact SD-CD2 3.8Å; M284-Y333 HydrophobicContact SD-CE2 3.41Å; M284-Y333 WeakPolarHBondContact SD-CE2 3.2Å
285	L	72.6	Confident	81.4	Confident	71 Å²	71	49.4 Å²	49.4	37%	0.372	28%	0.281	S	S	.	.			trans	-69.4	148.5	164.7	-78.6	160	0	0	0	109.7	N294 G314	L285-N294 HydrophobicContact CB-CB 4.01Å; L285-G314 PolarHBondContact O-N 3.45Å
286	D	71.4	Confident	81.3	Confident	132 Å²	132	49.4 Å²	49.4	71%	0.706	28%	0.281	S	S	*	.			trans	-96.3	146	-179.4	-162.4	-1.9	0	0	0	109.9
287	S	71.4	Confident	81.3	Confident	30 Å²	30	47.9 Å²	47.9	21%	0.21	27%	0.273	C	S	.	.			trans	-157.1	149.4	177.9	67.5	0	0	0	0	111.3	D289 C290 G292	S287-D289 PolarHBondContact O-N 2.9Å; S287-C290 PolarHBondContact O-N 2.89Å; S287-C290 VanDerWaalsContact O-N 3.07Å; S287-G292 PolarHBondContact OG-N 2.95Å
288	T	66.7	Low	81.3	Confident	111 Å²	111	47.8 Å²	47.8	68%	0.681	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-54.5	123.2	179.1	43.5	0	0	0	0	111.1	C290 S291	T288-C290 PolarHBondContact O-N 2.97Å; T288-S291 WeakPolarHBondContact O-CB 3.36Å; T288-S291 PolarHBondContact O-N 2.86Å; T288-S291 PolarHBondContact O-OG 2.78Å
289	D	68.3	Low	81.3	Confident	154 Å²	154	46.8 Å²	46.8	82%	0.824	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	55.4	20.6	-180	-45.6	-42	0	0	0	114.6	S287 S291	S287-D289 PolarHBondContact O-N 2.9Å; D289-S291 PolarHBondContact O-N 2.8Å
290	C	77.3	Confident	81.3	Confident	15 Å²	15	47.8 Å²	47.8	10%	0.101	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	51.8	24.2	-170	-54.2	0	0	0	0	114.1	S287 T288 R311 C313	S287-C290 PolarHBondContact O-N 2.89Å; S287-C290 VanDerWaalsContact O-N 3.07Å; T288-C290 PolarHBondContact O-N 2.97Å; C290-R311 HydrophobicContact CB-CG 4.05Å; C290-R311 WeakPolarHBondContact O-CD 3.29Å; C290-R311 PolarHBondContact O-NH1 2.8Å; C290-R311 VanDerWaalsContact O-NH1 3.12Å; C290-C313 WeakPolarHBondContact CA-SG 3.18Å; C290-C313 HydrophobicContact CB-CB 3.7Å; C290-C313 WeakPolarHBondContact CB-SG 3.14Å; C290-C313 WeakPolarHBondContact SG-CB 3.46Å; C290-C313 PolarHBondContact SG-N 2.57Å; C290-C313 CovalentContact SG-SG 2.04Å; C290-C313 PolarHBondContact SG-SG 3.33Å
291	S	70.1	Confident	81.3	Confident	80 Å²	80	44.2 Å²	44.2	56%	0.559	25%	0.248	S	C	*	.			trans	-78.1	-20.6	-176.6	61.8	0	0	0	0	113.7	T288 D289	T288-S291 WeakPolarHBondContact O-CB 3.36Å; T288-S291 PolarHBondContact O-N 2.86Å; T288-S291 PolarHBondContact O-OG 2.78Å; D289-S291 PolarHBondContact O-N 2.8Å
292	G	68.2	Low	81.3	Confident	22 Å²	22	42.6 Å²	42.6	23%	0.227	24%	0.244	C	C	.	.	S	Bend	trans	-76.9	176.7	179.1	0	0	0	0	0	113.9	S287 N294 F295	S287-G292 PolarHBondContact OG-N 2.95Å; G292-N294 PolarHBondContact O-N 3.47Å; G292-F295 WeakPolarHBondContact O-CD1 3.4Å
293	D	75	Confident	81.4	Confident	106 Å²	106	45.7 Å²	45.7	57%	0.567	26%	0.257	S	S	*	.	S	Bend	trans	-74.2	16.8	-166	-38	-80.6	0	0	0	116	H334 A336	D293-H334 PolarHBondContact O-ND1 2.77Å; D293-A336 HydrophobicContact CB-CB 3.47Å; D293-A336 VanDerWaalsContact CB-CB 3.47Å; D293-A336 PolarHBondContact O-N 3.39Å
294	N	82.9	Confident	81.7	Confident	24 Å²	24	46.9 Å²	46.9	13%	0.128	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	97.3	-176.9	-62	-96.2	0	0	0	109.5	L285 G292 H334	L285-N294 HydrophobicContact CB-CB 4.01Å; G292-N294 PolarHBondContact O-N 3.47Å; N294-H334 CarbonylContact C-O 3.56Å; N294-H334 VanDerWaalsContact CA-O 3.31Å; N294-H334 WeakPolarHBondContact CA-O 3.4Å
295	F	89.5	Confident	82.2	Confident	18 Å²	18	51.3 Å²	51.3	8%	0.079	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	157.4	-173.1	63.7	-95.1	0	0	0	113.9	G292 E297 R311 Q332 H334	G292-F295 WeakPolarHBondContact O-CD1 3.4Å; F295-E297 HydrophobicContact CD2-CB 3.81Å; F295-E297 HydrophobicContact CE2-CB 3.91Å; F295-R311 HydrophobicContact CB-CG 3.74Å; F295-R311 HydrophobicContact CD2-CG 4.11Å; F295-R311 HydrophobicContact CG-CG 4.16Å; F295-Q332 HydrophobicContact CE2-CG 4.31Å; F295-H334 HydrophobicContact CD1-CB 4.2Å; F295-H334 HydrophobicContact CD2-CB 4.43Å; F295-H334 HydrophobicContact CE1-CB 3.78Å; F295-H334 HydrophobicContact CE2-CB 4.05Å; F295-H334 HydrophobicContact CZ-CB 3.7Å; F295-H334 PolarHBondContact N-O 2.81Å; F295-H334 PolarHBondContact O-N 2.86Å
296	L	91.2	Very high	83	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.7	163.9	171.8	70.1	0	0	0	106.8	F279 I282 M284 R311 Y312 I331 Q332 F358	F279-L296 HydrophobicContact CD1-CD2 3.8Å; F279-L296 HydrophobicContact CE1-CD1 4.22Å; F279-L296 HydrophobicContact CE1-CD2 3.56Å; F279-L296 HydrophobicContact CE1-CG 4.4Å; F279-L296 HydrophobicContact CZ-CD2 4.16Å; I282-L296 HydrophobicContact CD1-CD2 3.95Å; I282-L296 HydrophobicContact CG1-CD2 4.4Å; M284-L296 HydrophobicContact CE-CB 3.73Å; M284-L296 HydrophobicContact SD-CB 4.29Å; L296-R311 CarbonylContact O-C 3.56Å; L296-R311 WeakPolarHBondContact O-CA 3.41Å; L296-Y312 HydrophobicContact CD2-CD2 4.49Å; L296-Y312 PolarHBondContact N-O 3.22Å; L296-Y312 PolarHBondContact O-N 3.12Å; L296-I331 HydrophobicContact CD1-CG2 3.66Å; L296-Q332 CarbonylContact C-O 3.59Å; L296-Q332 WeakPolarHBondContact CA-O 3.49Å; L296-F358 HydrophobicContact CD1-CD1 4.17Å; L296-F358 HydrophobicContact CD1-CE1 4.05Å; L296-F358 HydrophobicContact CD1-CZ 4.34Å; L296-F358 HydrophobicContact CD2-CG 4.46Å
297	E	93.2	Very high	84.1	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.9	-178.1	-174.9	166.4	112.8	0	0	110.2	F295 R299 L308 R311 I331 Q332	F295-E297 HydrophobicContact CD2-CB 3.81Å; F295-E297 HydrophobicContact CE2-CB 3.91Å; E297-R299 HydrophobicContact CG-CG 4.44Å; E297-R299 IonicContact OE1-CZ 2.74Å; E297-R299 IonicContact OE1-NE 3.57Å; E297-R299 PolarHBondContact OE1-NE 2.04Å; E297-R299 IonicContact OE1-NH2 2.57Å; E297-R299 PolarHBondContact OE1-NH2 3.07Å; E297-R299 IonicContact OE2-NH2 3.15Å; E297-L308 HydrophobicContact CG-CD1 3.55Å; E297-R311 HydrophobicContact CB-CG 4.34Å; E297-R311 IonicContact OE2-CZ 3.51Å; E297-R311 IonicContact OE2-NE 3.6Å; E297-R311 PolarHBondContact OE2-NE 3.15Å; E297-R311 IonicContact OE2-NH2 2.66Å; E297-R311 PolarHBondContact OE2-NH2 3.04Å; E297-I331 CarbonylContact O-C 3.57Å; E297-I331 VanDerWaalsContact O-CA 3.31Å; E297-I331 WeakPolarHBondContact O-CA 3.47Å; E297-Q332 HydrophobicContact CB-CB 4.41Å; E297-Q332 PolarHBondContact N-O 3.49Å; E297-Q332 PolarHBondContact O-N 2.86Å
298	V	94.9	Very high	85.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.7	-176.2	-176.5	0	0	0	0	109.1	L277 F279 I309 G310 Y312 I322 V329 I331	L277-V298 HydrophobicContact CD1-CG1 3.72Å; F279-V298 HydrophobicContact CE2-CG2 4.24Å; F279-V298 HydrophobicContact CZ-CG2 4.02Å; V298-I309 HydrophobicContact CG1-CB 4.45Å; V298-I309 HydrophobicContact CG1-CD1 4.08Å; V298-I309 PolarHBondContact O-N 3.05Å; V298-G310 PolarHBondContact N-O 3.49Å; V298-G310 PolarHBondContact O-N 3.3Å; V298-Y312 HydrophobicContact CB-CE2 4.29Å; V298-Y312 HydrophobicContact CG2-CD2 4.32Å; V298-Y312 HydrophobicContact CG2-CE2 3.91Å; V298-I322 HydrophobicContact CB-CD1 4.47Å; V298-I322 HydrophobicContact CG1-CD1 4.36Å; V298-I322 HydrophobicContact CG2-CD1 4.25Å; V298-V329 HydrophobicContact CG1-CG1 3.97Å; V298-I331 HydrophobicContact CG1-CG1 4.43Å; V298-I331 HydrophobicContact CG2-CG2 4.32Å
299	R	95.2	Very high	86.3	Confident	42 Å²	42	46.8 Å²	46.8	16%	0.158	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141.5	-175.3	-64.6	-175.2	173.2	-93.9	-1.5	112.7	E297 G301 A304 S306 P307 L308 V329 W330	E297-R299 HydrophobicContact CG-CG 4.44Å; E297-R299 IonicContact OE1-CZ 2.74Å; E297-R299 IonicContact OE1-NE 3.57Å; E297-R299 PolarHBondContact OE1-NE 2.04Å; E297-R299 IonicContact OE1-NH2 2.57Å; E297-R299 PolarHBondContact OE1-NH2 3.07Å; E297-R299 IonicContact OE2-NH2 3.15Å; R299-G301 VanDerWaalsContact C-N 3.28Å; R299-G301 PolarHBondContact O-N 3.21Å; R299-A304 WeakPolarHBondContact CD-O 3.38Å; R299-A304 PolarHBondContact NE-O 2.99Å; R299-A304 VanDerWaalsContact NE-O 3.15Å; R299-A304 PolarHBondContact NH1-O 2.92Å; R299-S306 WeakPolarHBondContact CD-O 3.31Å; R299-S306 PolarHBondContact NH1-O 3.3Å; R299-P307 CarbonylContact C-O 3.52Å; R299-P307 WeakPolarHBondContact CA-O 3.39Å; R299-P307 WeakPolarHBondContact CB-O 3.46Å; R299-L308 HydrophobicContact CG-CD1 4.29Å; R299-V329 WeakPolarHBondContact O-CA 3.19Å; R299-W330 HydrophobicContact CB-CE3 4.23Å; R299-W330 HydrophobicContact CG-CE3 4.02Å; R299-W330 HydrophobicContact CG-CZ3 4.33Å; R299-W330 PolarHBondContact N-O 2.75Å; R299-W330 PolarHBondContact O-N 3.43Å; R299-W330 VanDerWaalsContact O-N 3.08Å
300	D	92	Very high	87.4	Confident	22 Å²	22	40 Å²	40	12%	0.118	23%	0.227	C	C	.	.	S	Bend	trans	-84.6	65.4	-177.4	-143.6	-14.2	0	0	0	111.1	P307 I309 S324 S325 S326 R328	D300-P307 HydrophobicContact CB-CB 4.35Å; D300-P307 PolarHBondContact N-O 2.55Å; D300-I309 HydrophobicContact CB-CD1 3.68Å; D300-I309 HydrophobicContact CB-CG1 3.72Å; D300-S324 WeakPolarHBondContact OD1-CB 3.35Å; D300-S325 PolarHBondContact OD1-N 3.23Å; D300-S325 WeakPolarHBondContact OD2-CB 3.35Å; D300-S325 PolarHBondContact OD2-N 3.05Å; D300-S325 PolarHBondContact OD2-OG 3.05Å; D300-S326 WeakPolarHBondContact OD1-CA 3.49Å; D300-S326 WeakPolarHBondContact OD1-CB 3Å; D300-S326 PolarHBondContact OD1-N 3.06Å; D300-R328 CarbonylContact C-O 3.47Å
301	G	90.6	Very high	88	Confident	2 Å²	2	43 Å²	43	2%	0.021	24%	0.236	C	C	.	.	S	Bend	trans	166	-171.4	177.2	0	0	0	0	0	113.7	R299 Y303 S306 R328 V329 W330	R299-G301 VanDerWaalsContact C-N 3.28Å; R299-G301 PolarHBondContact O-N 3.21Å; G301-Y303 PolarHBondContact O-N 2.69Å; G301-S306 WeakPolarHBondContact CA-OG 3.35Å; G301-R328 VanDerWaalsContact CA-O 3.26Å; G301-R328 WeakPolarHBondContact CA-O 3.49Å; G301-R328 PolarHBondContact N-O 2.72Å; G301-V329 CarbonylContact O-C 3.55Å; G301-W330 VanDerWaalsContact O-CB 3.31Å; G301-W330 WeakPolarHBondContact O-CB 3.37Å; G301-W330 PolarHBondContact O-N 2.96Å
302	P	89.1	Confident	89	Confident	24 Å²	24	40.8 Å²	40.8	16%	0.156	22%	0.215	C	C	.	.	S	Bend	trans	-75.9	-14.2	-169	20.1	-24.5	0	0	0	116.3	V77 S306	V77-P302 HydrophobicContact CG1-CB 3.85Å; V77-P302 HydrophobicContact CG1-CG 3.48Å; V77-P302 VanDerWaalsContact CG1-CG 3.48Å; P302-S306 WeakPolarHBondContact CD-OG 3.33Å
303	Y	89.3	Confident	89.8	Confident	68 Å²	68	40.2 Å²	40.2	27%	0.267	21%	0.208	S	C	.	.	S	Bend	trans	-158.1	177.2	-166.6	77.3	-65.6	0	0	0	115.6	Y42 V44 G301 K305 S306	Y42-Y303 AromaticContact CD2-CD2 3.88Å; Y42-Y303 HydrophobicContact CD2-CD2 3.88Å; Y42-Y303 AromaticContact CD2-CE2 3.77Å; Y42-Y303 HydrophobicContact CD2-CE2 3.77Å; Y42-Y303 HydrophobicContact CE2-CE2 4.37Å; Y42-Y303 HydrophobicContact CG-CD2 4.03Å; Y42-Y303 HydrophobicContact CG-CE2 4.4Å; V44-Y303 HydrophobicContact CG2-CD1 4.01Å; V44-Y303 HydrophobicContact CG2-CD2 3.74Å; V44-Y303 HydrophobicContact CG2-CE2 4.28Å; V44-Y303 HydrophobicContact CG2-CG 3.57Å; G301-Y303 PolarHBondContact O-N 2.69Å; Y303-K305 VanDerWaalsContact C-N 3.28Å; Y303-K305 HydrophobicContact CD2-CB 4.19Å; Y303-K305 HydrophobicContact CE2-CB 3.52Å; Y303-K305 HydrophobicContact CE2-CD 3.98Å; Y303-K305 HydrophobicContact CE2-CG 3.9Å; Y303-K305 PolarHBondContact O-N 2.86Å; Y303-K305 VanDerWaalsContact O-N 3.11Å; Y303-S306 WeakPolarHBondContact CD1-OG 3.36Å; Y303-S306 PolarHBondContact N-OG 3.25Å; Y303-S306 WeakPolarHBondContact O-CB 3.46Å; Y303-S306 PolarHBondContact O-N 3.32Å; Y303-S306 PolarHBondContact O-OG 2.83Å; Y303-S306 VanDerWaalsContact O-OG 3.14Å
304	A	88.4	Confident	90.2	Very high	36 Å²	36	35.4 Å²	35.4	30%	0.298	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.9	-172	0	0	0	0	0	116.9	R299 W330	R299-A304 WeakPolarHBondContact CD-O 3.38Å; R299-A304 PolarHBondContact NE-O 2.99Å; R299-A304 VanDerWaalsContact NE-O 3.15Å; R299-A304 PolarHBondContact NH1-O 2.92Å; A304-W330 HydrophobicContact CB-CH2 3.65Å; A304-W330 HydrophobicContact CB-CZ2 3.78Å; A304-W330 HydrophobicContact CB-CZ3 4.24Å
305	K	88	Confident	90.2	Very high	112 Å²	112	40.7 Å²	40.7	49%	0.487	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-9	171.9	-67.6	179.1	164.9	168.5	0	113.6	E41 Y42 Y303	E41-K305 IonicContact OE1-NZ 2.87Å; E41-K305 PolarHBondContact OE1-NZ 3.06Å; Y42-K305 HydrophobicContact CD2-CD 4.44Å; Y42-K305 HydrophobicContact CE2-CD 3.68Å; Y42-K305 VanDerWaalsContact CE2-CE 3.44Å; Y42-K305 HydrophobicContact CE2-CG 4Å; Y42-K305 WeakPolarHBondContact OH-CE 3.23Å; Y303-K305 VanDerWaalsContact C-N 3.28Å; Y303-K305 HydrophobicContact CD2-CB 4.19Å; Y303-K305 HydrophobicContact CE2-CB 3.52Å; Y303-K305 HydrophobicContact CE2-CD 3.98Å; Y303-K305 HydrophobicContact CE2-CG 3.9Å; Y303-K305 PolarHBondContact O-N 2.86Å; Y303-K305 VanDerWaalsContact O-N 3.11Å
306	S	91	Very high	89.9	Confident	9 Å²	9	43.8 Å²	43.8	6%	0.063	22%	0.217	C	C	.	.	S	Bend	trans	-60	155.2	179.9	-61.7	0	0	0	0	112.2	R299 G301 P302 Y303 L308	R299-S306 WeakPolarHBondContact CD-O 3.31Å; R299-S306 PolarHBondContact NH1-O 3.3Å; G301-S306 WeakPolarHBondContact CA-OG 3.35Å; P302-S306 WeakPolarHBondContact CD-OG 3.33Å; Y303-S306 WeakPolarHBondContact CD1-OG 3.36Å; Y303-S306 PolarHBondContact N-OG 3.25Å; Y303-S306 WeakPolarHBondContact O-CB 3.46Å; Y303-S306 PolarHBondContact O-N 3.32Å; Y303-S306 PolarHBondContact O-OG 2.83Å; Y303-S306 VanDerWaalsContact O-OG 3.14Å; S306-L308 PolarHBondContact O-N 2.96Å
307	P	93.3	Very high	89.2	Confident	93 Å²	93	50 Å²	50	60%	0.604	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-48.6	132.4	-177.7	-30.2	35.9	0	0	0	113.4	R299 D300 I309	R299-P307 CarbonylContact C-O 3.52Å; R299-P307 WeakPolarHBondContact CA-O 3.39Å; R299-P307 WeakPolarHBondContact CB-O 3.46Å; D300-P307 HydrophobicContact CB-CB 4.35Å; D300-P307 PolarHBondContact N-O 2.55Å; P307-I309 PolarHBondContact O-N 2.95Å
308	L	92.6	Very high	88.8	Confident	92 Å²	92	57.3 Å²	57.3	48%	0.482	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	117.9	179.8	-179.7	65.5	0	0	0	110	E297 R299 S306 G310	E297-L308 HydrophobicContact CG-CD1 3.55Å; R299-L308 HydrophobicContact CG-CD1 4.29Å; S306-L308 PolarHBondContact O-N 2.96Å; L308-G310 WeakPolarHBondContact CD1-O 3.45Å
309	I	92.3	Very high	88.3	Confident	55 Å²	55	60.9 Å²	60.9	28%	0.282	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	-42.8	170.6	-59.1	166.6	0	0	0	109.3	V298 D300 P307 I322	V298-I309 HydrophobicContact CG1-CB 4.45Å; V298-I309 HydrophobicContact CG1-CD1 4.08Å; V298-I309 PolarHBondContact O-N 3.05Å; D300-I309 HydrophobicContact CB-CD1 3.68Å; D300-I309 HydrophobicContact CB-CG1 3.72Å; P307-I309 PolarHBondContact O-N 2.95Å; I309-I322 HydrophobicContact CD1-CG2 4.41Å; I309-I322 HydrophobicContact CG2-CG2 3.55Å
310	G	90.5	Very high	88.1	Confident	12 Å²	12	60.6 Å²	60.6	12%	0.124	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.6	164.3	172.9	0	0	0	0	0	113.7	V298 L308	V298-G310 PolarHBondContact N-O 3.49Å; V298-G310 PolarHBondContact O-N 3.3Å; L308-G310 WeakPolarHBondContact CD1-O 3.45Å
311	R	90.9	Very high	88.1	Confident	79 Å²	79	64.6 Å²	64.6	30%	0.298	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.3	170.1	-172.1	-169.7	-81.9	-155.2	-6.7	108.8	C290 F295 L296 E297	C290-R311 HydrophobicContact CB-CG 4.05Å; C290-R311 WeakPolarHBondContact O-CD 3.29Å; C290-R311 PolarHBondContact O-NH1 2.8Å; C290-R311 VanDerWaalsContact O-NH1 3.12Å; F295-R311 HydrophobicContact CB-CG 3.74Å; F295-R311 HydrophobicContact CD2-CG 4.11Å; F295-R311 HydrophobicContact CG-CG 4.16Å; L296-R311 CarbonylContact O-C 3.56Å; L296-R311 WeakPolarHBondContact O-CA 3.41Å; E297-R311 HydrophobicContact CB-CG 4.34Å; E297-R311 IonicContact OE2-CZ 3.51Å; E297-R311 IonicContact OE2-NE 3.6Å; E297-R311 PolarHBondContact OE2-NE 3.15Å; E297-R311 IonicContact OE2-NH2 2.66Å; E297-R311 PolarHBondContact OE2-NH2 3.04Å
312	Y	90	Very high	88.2	Confident	32 Å²	32	65 Å²	65	13%	0.125	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.5	-167.7	-49.3	-77.3	0	0	0	110.5	M284 L296 V298 L320 I322	M284-Y312 WeakPolarHBondContact CE-O 3.48Å; L296-Y312 HydrophobicContact CD2-CD2 4.49Å; L296-Y312 PolarHBondContact N-O 3.22Å; L296-Y312 PolarHBondContact O-N 3.12Å; V298-Y312 HydrophobicContact CB-CE2 4.29Å; V298-Y312 HydrophobicContact CG2-CD2 4.32Å; V298-Y312 HydrophobicContact CG2-CE2 3.91Å; Y312-L320 HydrophobicContact CD1-CD2 3.6Å; Y312-L320 HydrophobicContact CD2-CD2 4.1Å; Y312-L320 HydrophobicContact CE1-CD1 4.32Å; Y312-L320 HydrophobicContact CE1-CD2 3.58Å; Y312-L320 HydrophobicContact CE2-CD2 4.07Å; Y312-L320 HydrophobicContact CG-CD2 3.87Å; Y312-I322 HydrophobicContact CE2-CD1 3.81Å; Y312-I322 WeakPolarHBondContact OH-CD1 3.33Å
313	C	86.5	Confident	88.2	Confident	11 Å²	11	67.8 Å²	67.8	7%	0.074	35%	0.351	C	S	.	.			trans	-155.1	178.2	-178.9	65.6	0	0	0	0	111.2	C290 Y316	C290-C313 WeakPolarHBondContact CA-SG 3.18Å; C290-C313 HydrophobicContact CB-CB 3.7Å; C290-C313 WeakPolarHBondContact CB-SG 3.14Å; C290-C313 WeakPolarHBondContact SG-CB 3.46Å; C290-C313 PolarHBondContact SG-N 2.57Å; C290-C313 CovalentContact SG-SG 2.04Å; C290-C313 PolarHBondContact SG-SG 3.33Å; C313-Y316 VanDerWaalsContact O-CE2 3.3Å; C313-Y316 WeakPolarHBondContact O-CE2 3.33Å
314	G	83.2	Confident	88.3	Confident	4 Å²	4	64.8 Å²	64.8	4%	0.041	34%	0.34	C	S	.	.	S	Bend	trans	66.3	-138.6	-174.9	0	0	0	0	0	112.4	M284 L285	M284-G314 PolarHBondContact N-O 3.39Å; L285-G314 PolarHBondContact O-N 3.45Å
315	K	83.3	Confident	88.3	Confident	136 Å²	136	67.4 Å²	67.4	59%	0.591	36%	0.357	S	S	*	.	B	Isolated β-bridge	trans	-136	124.6	-173	-174.3	-153.8	166.5	-157.5	0	112.1	I282	I282-K315 WeakPolarHBondContact O-CA 3.35Å
316	Y	83.4	Confident	88.2	Confident	83 Å²	83	63.5 Å²	63.5	33%	0.325	34%	0.344	S	S	.	.			trans	-93.4	153	174.6	-65.9	-101.4	0	0	0	110.6	I282 C313	I282-Y316 HydrophobicContact CB-CD2 3.75Å; I282-Y316 HydrophobicContact CB-CG 4.41Å; I282-Y316 HydrophobicContact CD1-CD2 3.98Å; I282-Y316 HydrophobicContact CD1-CE2 4.35Å; I282-Y316 HydrophobicContact CD1-CG 4.41Å; I282-Y316 HydrophobicContact CG1-CD2 4.43Å; I282-Y316 HydrophobicContact CG2-CD2 3.79Å; I282-Y316 HydrophobicContact CG2-CE2 4.22Å; I282-Y316 PolarHBondContact O-N 2.77Å; I282-Y316 VanDerWaalsContact O-N 3.1Å; C313-Y316 VanDerWaalsContact O-CE2 3.3Å; C313-Y316 WeakPolarHBondContact O-CE2 3.33Å
317	V	76.3	Confident	88.1	Confident	129 Å²	129	64.9 Å²	64.9	78%	0.782	35%	0.349	S	S	*	.	S	Bend	trans	-110.2	-34.7	-179	179.3	0	0	0	0	111.4
318	E	83.8	Confident	88.1	Confident	162 Å²	162	60.7 Å²	60.7	76%	0.757	32%	0.321	S	S	*	.	S	Bend	trans	-105.5	154.3	175.7	-66.2	171.5	-176.9	0	0	109.6	L320	E318-L320 PolarHBondContact O-N 2.88Å
319	P	85.1	Confident	88.2	Confident	76 Å²	76	56.3 Å²	56.3	49%	0.494	30%	0.298	S	S	.	.			trans	-62.2	132.6	176.4	-21.4	33.7	0	0	0	111.7	F279	F279-P319 WeakPolarHBondContact O-CA 3.31Å
320	L	90.7	Very high	88.3	Confident	35 Å²	35	54.2 Å²	54.2	18%	0.183	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	112.3	175.1	166.4	68.5	0	0	0	109.2	F279 I282 Y312 E318 I322	F279-L320 HydrophobicContact CB-CB 4.09Å; F279-L320 WeakPolarHBondContact CB-O 3.46Å; F279-L320 HydrophobicContact CD2-CD2 4.45Å; F279-L320 PolarHBondContact N-O 3.03Å; F279-L320 PolarHBondContact O-N 2.8Å; F279-L320 VanDerWaalsContact O-N 3.14Å; I282-L320 HydrophobicContact CD1-CB 4.44Å; I282-L320 HydrophobicContact CD1-CD2 3.94Å; Y312-L320 HydrophobicContact CD1-CD2 3.6Å; Y312-L320 HydrophobicContact CD2-CD2 4.1Å; Y312-L320 HydrophobicContact CE1-CD1 4.32Å; Y312-L320 HydrophobicContact CE1-CD2 3.58Å; Y312-L320 HydrophobicContact CE2-CD2 4.07Å; Y312-L320 HydrophobicContact CG-CD2 3.87Å; E318-L320 PolarHBondContact O-N 2.88Å; L320-I322 HydrophobicContact CD1-CG1 4.19Å; L320-I322 HydrophobicContact CD2-CD1 4.15Å; L320-I322 HydrophobicContact CG-CD1 4.23Å; L320-I322 HydrophobicContact CG-CG1 4.08Å
321	I	92	Very high	88.5	Confident	106 Å²	106	53.6 Å²	53.6	54%	0.544	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	133.5	177.7	-58	177.3	0	0	0	109.3	L276 L277	L276-I321 HydrophobicContact CD1-CG2 3.58Å; L276-I321 HydrophobicContact CG-CG2 4.38Å; L277-I321 WeakPolarHBondContact O-CA 3.29Å
322	I	91.8	Very high	88.6	Confident	11 Å²	11	51.1 Å²	51.1	6%	0.056	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	130.4	-179.8	-54.5	177.5	0	0	0	108.7	L277 F279 V298 I309 Y312 L320	L277-I322 HydrophobicContact CB-CB 4.25Å; L277-I322 HydrophobicContact CD1-CB 4.4Å; L277-I322 PolarHBondContact N-O 3.33Å; L277-I322 PolarHBondContact O-N 2.85Å; F279-I322 HydrophobicContact CD2-CD1 4.25Å; F279-I322 HydrophobicContact CE2-CD1 3.95Å; V298-I322 HydrophobicContact CB-CD1 4.47Å; V298-I322 HydrophobicContact CG1-CD1 4.36Å; V298-I322 HydrophobicContact CG2-CD1 4.25Å; I309-I322 HydrophobicContact CD1-CG2 4.41Å; I309-I322 HydrophobicContact CG2-CG2 3.55Å; Y312-I322 HydrophobicContact CE2-CD1 3.81Å; Y312-I322 WeakPolarHBondContact OH-CD1 3.33Å; L320-I322 HydrophobicContact CD1-CG1 4.19Å; L320-I322 HydrophobicContact CD2-CD1 4.15Å; L320-I322 HydrophobicContact CG-CD1 4.23Å; L320-I322 HydrophobicContact CG-CG1 4.08Å
323	T	90.5	Very high	88.7	Confident	82 Å²	82	49.8 Å²	49.8	50%	0.503	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.1	172.3	-46.5	0	0	0	0	109.5	L276	L276-T323 WeakPolarHBondContact CD1-OG1 3.36Å
324	S	91.6	Very high	88.7	Confident	5 Å²	5	51.4 Å²	51.4	4%	0.035	27%	0.274	C	S	.	.			trans	-74.9	153.1	175.1	69.8	0	0	0	0	112.3	I275 D300 S326	I275-S324 PolarHBondContact N-OG 2.79Å; I275-S324 PolarHBondContact O-N 2.87Å; I275-S324 PolarHBondContact O-OG 2.86Å; D300-S324 WeakPolarHBondContact OD1-CB 3.35Å; S324-S326 WeakPolarHBondContact CB-O 3.05Å; S324-S326 PolarHBondContact OG-O 3.22Å
325	S	86.9	Confident	88.7	Confident	92 Å²	92	51.5 Å²	51.5	64%	0.643	27%	0.273	S	S	*	.	S	Bend	trans	-87.7	-25	162.9	70.4	0	0	0	0	112	D300	D300-S325 PolarHBondContact OD1-N 3.23Å; D300-S325 WeakPolarHBondContact OD2-CB 3.35Å; D300-S325 PolarHBondContact OD2-N 3.05Å; D300-S325 PolarHBondContact OD2-OG 3.05Å
326	S	86.1	Confident	88.4	Confident	30 Å²	30	46 Å²	46	21%	0.21	25%	0.254	C	S	.	.	S	Bend	trans	-95.2	160.2	179.2	-169.6	0	0	0	0	113.5	D300 S324 R328	D300-S326 WeakPolarHBondContact OD1-CA 3.49Å; D300-S326 WeakPolarHBondContact OD1-CB 3Å; D300-S326 PolarHBondContact OD1-N 3.06Å; S324-S326 WeakPolarHBondContact CB-O 3.05Å; S324-S326 PolarHBondContact OG-O 3.22Å; S326-R328 PolarHBondContact O-N 2.67Å; S326-R328 PolarHBondContact OG-N 3.42Å
327	H	89.4	Confident	87.5	Confident	37 Å²	37	47.9 Å²	47.9	17%	0.171	27%	0.265	C	S	.	.	S	Bend	trans	-79.1	1.7	169.1	70.4	-77.1	0	0	0	113	T269 A270	T269-H327 HydrophobicContact CG2-CB 4.04Å; T269-H327 VanDerWaalsContact CG2-O 3.29Å; T269-H327 WeakPolarHBondContact CG2-O 3.4Å; T269-H327 PolarHBondContact N-O 3.32Å; T269-H327 PolarHBondContact O-CD2 3.21Å; A270-H327 WeakPolarHBondContact O-CB 3.32Å
328	R	92.5	Very high	86.4	Confident	5 Å²	5	44 Å²	44	2%	0.019	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.8	175.3	-64.9	-168.3	166.8	-136.8	-19	111.2	E69 S75 F76 I267 N268 D300 G301 S326	E69-R328 IonicContact OE1-CZ 2.73Å; E69-R328 IonicContact OE1-NH1 3.14Å; E69-R328 PolarHBondContact OE1-NH1 2.79Å; E69-R328 IonicContact OE1-NH2 3.52Å; E69-R328 IonicContact OE2-CZ 3.26Å; E69-R328 IonicContact OE2-NH1 3.57Å; E69-R328 PolarHBondContact OE2-NH1 3.44Å; E69-R328 IonicContact OE2-NH2 3.24Å; E69-R328 PolarHBondContact OE2-NH2 3.47Å; S75-R328 PolarHBondContact OG-NH1 2.84Å; S75-R328 VanDerWaalsContact OG-NH1 3.08Å; F76-R328 PolarHBondContact O-NH1 2.86Å; I267-R328 VanDerWaalsContact O-CA 3.31Å; I267-R328 WeakPolarHBondContact O-CA 3.05Å; N268-R328 VanDerWaalsContact CG-CZ 3.48Å; N268-R328 PolarHBondContact ND2-NH1 2.98Å; N268-R328 PolarHBondContact ND2-NH2 2.75Å; N268-R328 WeakPolarHBondContact OD1-CD 3.43Å; D300-R328 CarbonylContact C-O 3.47Å; G301-R328 VanDerWaalsContact CA-O 3.26Å; G301-R328 WeakPolarHBondContact CA-O 3.49Å; G301-R328 PolarHBondContact N-O 2.72Å; S326-R328 PolarHBondContact O-N 2.67Å; S326-R328 PolarHBondContact OG-N 3.42Å
329	V	94.5	Very high	84.3	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.1	174.4	175.1	0	0	0	0	110.1	R266 I267 I275 L277 V298 R299 G301 I331	R266-V329 CarbonylContact C-O 3.56Å; R266-V329 WeakPolarHBondContact CA-O 3.43Å; I267-V329 PolarHBondContact N-O 2.9Å; I267-V329 PolarHBondContact O-N 2.63Å; I275-V329 HydrophobicContact CB-CG2 4.17Å; I275-V329 HydrophobicContact CD1-CB 4.19Å; I275-V329 HydrophobicContact CD1-CG2 3.78Å; I275-V329 HydrophobicContact CG2-CG2 4.4Å; L277-V329 HydrophobicContact CD1-CG1 4.21Å; V298-V329 HydrophobicContact CG1-CG1 3.97Å; R299-V329 WeakPolarHBondContact O-CA 3.19Å; G301-V329 CarbonylContact O-C 3.55Å; V329-I331 HydrophobicContact CG1-CD1 4.24Å; V329-I331 HydrophobicContact CG1-CG1 3.85Å
330	W	95	Very high	82.4	Confident	10 Å²	10	43.3 Å²	43.3	4%	0.038	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.2	174.6	178.7	95.4	0	0	0	109.8	E264 R266 R299 G301 A304 Q332	E264-W330 HydrophobicContact CG-CZ2 3.97Å; E264-W330 PolarHBondContact OE2-NE1 2.88Å; R266-W330 HydrophobicContact CG-CB 4.49Å; R266-W330 HydrophobicContact CG-CG 4.43Å; R299-W330 HydrophobicContact CB-CE3 4.23Å; R299-W330 HydrophobicContact CG-CE3 4.02Å; R299-W330 HydrophobicContact CG-CZ3 4.33Å; R299-W330 PolarHBondContact N-O 2.75Å; R299-W330 PolarHBondContact O-N 3.43Å; R299-W330 VanDerWaalsContact O-N 3.08Å; G301-W330 VanDerWaalsContact O-CB 3.31Å; G301-W330 WeakPolarHBondContact O-CB 3.37Å; G301-W330 PolarHBondContact O-N 2.96Å; A304-W330 HydrophobicContact CB-CH2 3.65Å; A304-W330 HydrophobicContact CB-CZ2 3.78Å; A304-W330 HydrophobicContact CB-CZ3 4.24Å; W330-Q332 HydrophobicContact CE3-CB 4.44Å; W330-Q332 HydrophobicContact CH2-CB 3.54Å; W330-Q332 HydrophobicContact CH2-CG 4.18Å; W330-Q332 HydrophobicContact CZ2-CB 4.09Å; W330-Q332 HydrophobicContact CZ3-CB 3.72Å
331	I	94.9	Very high	80	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	119.1	-172.6	-53	176.3	0	0	0	109.3	F245 E264 W265 I267 L277 F279 L296 E297 V298 V329	F245-I331 HydrophobicContact CE2-CD1 3.72Å; F245-I331 HydrophobicContact CZ-CD1 3.51Å; E264-I331 CarbonylContact C-O 3.57Å; E264-I331 WeakPolarHBondContact CA-O 3.4Å; W265-I331 HydrophobicContact CB-CB 4.35Å; W265-I331 HydrophobicContact CE3-CG2 4.42Å; W265-I331 PolarHBondContact N-O 2.67Å; W265-I331 PolarHBondContact O-N 2.82Å; I267-I331 HydrophobicContact CD1-CD1 4.2Å; L277-I331 HydrophobicContact CD1-CD1 3.96Å; L277-I331 HydrophobicContact CD2-CD1 4.21Å; F279-I331 HydrophobicContact CZ-CD1 4.34Å; L296-I331 HydrophobicContact CD1-CG2 3.66Å; E297-I331 CarbonylContact O-C 3.57Å; E297-I331 VanDerWaalsContact O-CA 3.31Å; E297-I331 WeakPolarHBondContact O-CA 3.47Å; V298-I331 HydrophobicContact CG1-CG1 4.43Å; V298-I331 HydrophobicContact CG2-CG2 4.32Å; V329-I331 HydrophobicContact CG1-CD1 4.24Å; V329-I331 HydrophobicContact CG1-CG1 3.85Å
332	Q	93.3	Very high	77.4	Confident	27 Å²	27	52.3 Å²	52.3	13%	0.126	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	134.8	175.1	-176.8	-173	6.2	0	0	111	H262 C263 F295 L296 E297 W330	H262-Q332 PolarHBondContact CE1-NE2 3.17Å; H262-Q332 PolarHBondContact ND1-NE2 3.04Å; C263-Q332 WeakPolarHBondContact O-CA 3.39Å; F295-Q332 HydrophobicContact CE2-CG 4.31Å; L296-Q332 CarbonylContact C-O 3.59Å; L296-Q332 WeakPolarHBondContact CA-O 3.49Å; E297-Q332 HydrophobicContact CB-CB 4.41Å; E297-Q332 PolarHBondContact N-O 3.49Å; E297-Q332 PolarHBondContact O-N 2.86Å; W330-Q332 HydrophobicContact CE3-CB 4.44Å; W330-Q332 HydrophobicContact CH2-CB 3.54Å; W330-Q332 HydrophobicContact CH2-CG 4.18Å; W330-Q332 HydrophobicContact CZ2-CB 4.09Å; W330-Q332 HydrophobicContact CZ3-CB 3.72Å
333	Y	91.4	Very high	75.1	Confident	3 Å²	3	54 Å²	54	1%	0.012	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	115.4	165.1	176.4	-97.3	0	0	0	109.2	I261 H262 C263 M284 V335 G357 F358	I261-Y333 HydrophobicContact CB-CE1 4.45Å; I261-Y333 HydrophobicContact CG2-CD1 4.06Å; I261-Y333 HydrophobicContact CG2-CE1 4Å; H262-Y333 WeakPolarHBondContact CA-O 3.3Å; C263-Y333 PolarHBondContact N-O 2.83Å; C263-Y333 PolarHBondContact O-N 3.34Å; M284-Y333 HydrophobicContact CG-CE2 4.13Å; M284-Y333 HydrophobicContact SD-CD2 3.8Å; M284-Y333 HydrophobicContact SD-CE2 3.41Å; M284-Y333 WeakPolarHBondContact SD-CE2 3.2Å; Y333-V335 HydrophobicContact CD1-CG2 4.34Å; Y333-V335 HydrophobicContact CE1-CB 4.38Å; Y333-V335 HydrophobicContact CE1-CG2 3.61Å; Y333-V335 HydrophobicContact CE2-CG2 4.08Å; Y333-V335 VanDerWaalsContact CZ-CG2 3.47Å; Y333-G357 WeakPolarHBondContact OH-CA 3.49Å; Y333-F358 AromaticContact CD2-CD1 3.47Å; Y333-F358 HydrophobicContact CD2-CD1 3.47Å; Y333-F358 VanDerWaalsContact CD2-CD1 3.47Å; Y333-F358 AromaticContact CD2-CE1 3.67Å; Y333-F358 HydrophobicContact CD2-CE1 3.67Å; Y333-F358 AromaticContact CE2-CD1 3.81Å; Y333-F358 HydrophobicContact CE2-CD1 3.81Å; Y333-F358 HydrophobicContact CE2-CE1 4.35Å; Y333-F358 HydrophobicContact CG-CD1 4.2Å; Y333-F358 AromaticContact CG-CE1 3.94Å; Y333-F358 HydrophobicContact CG-CE1 3.94Å
334	H	87.9	Confident	72.8	Confident	45 Å²	45	54.7 Å²	54.7	21%	0.208	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127.6	178.3	-172.1	-87.6	0	0	0	110.5	I261 H262 D293 N294 F295	I261-H334 CarbonylContact O-C 3.43Å; I261-H334 WeakPolarHBondContact O-CA 3.42Å; H262-H334 AromaticContact ND1-CD2 3.95Å; D293-H334 PolarHBondContact O-ND1 2.77Å; N294-H334 CarbonylContact C-O 3.56Å; N294-H334 VanDerWaalsContact CA-O 3.31Å; N294-H334 WeakPolarHBondContact CA-O 3.4Å; F295-H334 HydrophobicContact CD1-CB 4.2Å; F295-H334 HydrophobicContact CD2-CB 4.43Å; F295-H334 HydrophobicContact CE1-CB 3.78Å; F295-H334 HydrophobicContact CE2-CB 4.05Å; F295-H334 HydrophobicContact CZ-CB 3.7Å; F295-H334 PolarHBondContact N-O 2.81Å; F295-H334 PolarHBondContact O-N 2.86Å
335	V	83	Confident	70.9	Confident	6 Å²	6	64.4 Å²	64.4	4%	0.036	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	110.2	175	171.3	0	0	0	0	108.5	P260 I261 Y333	P260-V335 WeakPolarHBondContact CA-O 3.48Å; I261-V335 HydrophobicContact CB-CB 4.32Å; I261-V335 PolarHBondContact N-O 2.83Å; I261-V335 PolarHBondContact O-N 3.27Å; Y333-V335 HydrophobicContact CD1-CG2 4.34Å; Y333-V335 HydrophobicContact CE1-CB 4.38Å; Y333-V335 HydrophobicContact CE1-CG2 3.61Å; Y333-V335 HydrophobicContact CE2-CG2 4.08Å; Y333-V335 VanDerWaalsContact CZ-CG2 3.47Å
336	A	76.1	Confident	69	Low	22 Å²	22	69.9 Å²	69.9	18%	0.182	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-62.1	154.3	177	0	0	0	0	0	113.8	D293 A338 R355	D293-A336 HydrophobicContact CB-CB 3.47Å; D293-A336 VanDerWaalsContact CB-CB 3.47Å; D293-A336 PolarHBondContact O-N 3.39Å; A336-A338 PolarHBondContact O-N 2.75Å; A336-R355 PolarHBondContact O-NH2 2.92Å
337	Q	65.1	Low	67.3	Low	122 Å²	122	72.6 Å²	72.6	57%	0.57	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-54.9	124.2	169.7	178.2	158.1	49.4	0	0	109.7	G258 P260 S339	G258-Q337 VanDerWaalsContact O-CG 3.29Å; G258-Q337 WeakPolarHBondContact O-CG 3.17Å; G258-Q337 PolarHBondContact O-NE2 2.97Å; P260-Q337 HydrophobicContact CB-CB 4.27Å; Q337-S339 PolarHBondContact O-N 3.42Å
338	A	54	Low	65.3	Low	46 Å²	46	73.1 Å²	73.1	38%	0.38	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-69.9	119.4	175.8	0	0	0	0	0	109.4	A336 L340	A336-A338 PolarHBondContact O-N 2.75Å; A338-L340 VanDerWaalsContact C-N 3.27Å; A338-L340 PolarHBondContact O-N 2.89Å
339	S	38.9	Very low	63.1	Low	93 Å²	93	79.8 Å²	79.8	65%	0.65	43%	0.428	S	S	*	.			trans	-64.5	87.7	166.9	43.3	0	0	0	0	109.4	Q337 E341	Q337-S339 PolarHBondContact O-N 3.42Å; S339-E341 PolarHBondContact O-N 3.33Å
340	L	44.4	Very low	60.6	Low	131 Å²	131	87.6 Å²	87.6	69%	0.686	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	21.9	-172.2	-131.7	162.5	0	0	0	113	A338	A338-L340 VanDerWaalsContact C-N 3.27Å; A338-L340 PolarHBondContact O-N 2.89Å
341	E	40.7	Very low	58.3	Low	183 Å²	183	91.6 Å²	91.6	86%	0.855	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-33	-171.4	-54.7	-160	127.6	0	0	112.3	S339	S339-E341 PolarHBondContact O-N 3.33Å
342	D	38.1	Very low	56	Low	147 Å²	147	99.7 Å²	99.7	79%	0.786	52%	0.516	S	S	*	.	S	Bend	trans	-93.6	-12.7	-179.7	-68.8	-58.5	0	0	0	114.9	P344	D342-P344 WeakPolarHBondContact O-CD 3.33Å
343	A	42.6	Very low	53.8	Low	47 Å²	47	106.4 Å²	106.4	39%	0.388	55%	0.545	S	S	.	.	S	Bend	trans	-80.1	116.8	-174.6	0	0	0	0	0	112.5	K345	A343-K345 PolarHBondContact O-N 2.93Å
344	P	42.1	Very low	51.8	Low	96 Å²	96	112.4 Å²	112.4	62%	0.623	57%	0.571	S	S	*	*			trans	-65.6	124.7	-176.8	24.6	-33.4	0	0	0	111.9	D342 K346 N347	D342-P344 WeakPolarHBondContact O-CD 3.33Å; P344-K346 PolarHBondContact O-N 2.77Å; P344-N347 PolarHBondContact O-N 2.83Å
345	K	51.3	Low	50.4	Low	210 Å²	210	114.1 Å²	114.1	91%	0.913	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	-7	-168.7	-67.9	178.7	177.6	174.3	0	117	A343	A343-K345 PolarHBondContact O-N 2.93Å
346	K	48.7	Very low	49.8	Very low	207 Å²	207	121 Å²	121	90%	0.9	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-20.6	172.5	-72.9	-174.6	175.3	179.6	0	114.5	P344	P344-K346 PolarHBondContact O-N 2.77Å
347	N	48.8	Very low	50.1	Low	87 Å²	87	120 Å²	120	47%	0.465	59%	0.592	S	S	.	*	S	Bend	trans	-104.8	-10.3	-176	-84	-17.1	0	0	0	115.4	P344 L349 K350 E351	P344-N347 PolarHBondContact O-N 2.83Å; N347-L349 PolarHBondContact O-N 2.98Å; N347-K350 PolarHBondContact O-N 2.86Å; N347-E351 HydrophobicContact CB-CG 4.4Å; N347-E351 PolarHBondContact O-N 3.31Å
348	A	47.6	Very low	51.3	Low	47 Å²	47	114.1 Å²	114.1	39%	0.388	57%	0.565	S	S	.	*	H	α-helix	trans	-54.1	-30.4	-173.3	0	0	0	0	0	114.8	K352	A348-K352 WeakPolarHBondContact O-CB 3.33Å; A348-K352 WeakPolarHBondContact O-CG 3.41Å; A348-K352 PolarHBondContact O-N 2.87Å
349	L	46.4	Very low	53.1	Low	146 Å²	146	112.3 Å²	112.3	76%	0.764	55%	0.55	S	S	*	.	H	α-helix	trans	-78.6	-24.6	177.4	-161.5	70.4	0	0	0	113.7	N347	N347-L349 PolarHBondContact O-N 2.98Å
350	K	42.7	Very low	55.7	Low	165 Å²	165	108 Å²	108	72%	0.717	52%	0.519	S	S	*	.	H	α-helix	trans	-77.9	-39.7	169.1	-80.3	-175.4	172.1	-178.4	0	110.9	N347 K353	N347-K350 PolarHBondContact O-N 2.86Å; K350-K353 WeakPolarHBondContact O-CB 3.5Å; K350-K353 PolarHBondContact O-N 2.86Å; K350-K353 VanDerWaalsContact O-N 3.12Å
351	E	46.1	Very low	58.2	Low	93 Å²	93	102.6 Å²	102.6	44%	0.435	50%	0.496	S	S	.	.	H	α-helix	trans	-69.6	-38.6	-179.9	-63.8	-99.9	101.1	0	0	111.6	N347 K353 K354	N347-E351 HydrophobicContact CB-CG 4.4Å; N347-E351 PolarHBondContact O-N 3.31Å; E351-K353 PolarHBondContact O-N 2.73Å; E351-K354 WeakPolarHBondContact O-CB 3.37Å; E351-K354 PolarHBondContact O-N 3.06Å; E351-K354 IonicContact OE1-NZ 2.88Å; E351-K354 PolarHBondContact OE1-NZ 2.94Å
352	K	45.9	Very low	60.7	Low	171 Å²	171	94.2 Å²	94.2	74%	0.743	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-15	169.3	-85.3	-167.1	171	-168.8	0	114.6	A348	A348-K352 WeakPolarHBondContact O-CB 3.33Å; A348-K352 WeakPolarHBondContact O-CG 3.41Å; A348-K352 PolarHBondContact O-N 2.87Å
353	K	47	Very low	63.4	Low	168 Å²	168	92.7 Å²	92.7	73%	0.73	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-7.2	172.1	-75.6	-169.5	173	-172.1	0	114.4	K350 E351	K350-K353 WeakPolarHBondContact O-CB 3.5Å; K350-K353 PolarHBondContact O-N 2.86Å; K350-K353 VanDerWaalsContact O-N 3.12Å; E351-K353 PolarHBondContact O-N 2.73Å
354	K	50.5	Low	65.7	Low	129 Å²	129	91.6 Å²	91.6	56%	0.561	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-32.5	175.8	-78	-179.6	173.7	168	0	113.4	S283 E351 R356	S283-K354 PolarHBondContact OG-O 3.42Å; E351-K354 WeakPolarHBondContact O-CB 3.37Å; E351-K354 PolarHBondContact O-N 3.06Å; E351-K354 IonicContact OE1-NZ 2.88Å; E351-K354 PolarHBondContact OE1-NZ 2.94Å; K354-R356 PolarHBondContact O-N 2.03Å
355	R	59.2	Low	68	Low	80 Å²	80	90.4 Å²	90.4	30%	0.302	42%	0.421	S	S	.	.			trans	-75.8	114.8	175.1	-69.1	-174.6	170.7	-153.3	-8.5	109.1	A336	A336-R355 PolarHBondContact O-NH2 2.92Å
356	R	69.3	Low	69.9	Low	150 Å²	150	82.2 Å²	82.2	57%	0.566	39%	0.389	S	S	*	.			trans	-138.1	12.5	173.2	-74.9	-174	158.5	-158	-8.7	113.3	Y250 Y281 S283 K354	Y250-R356 WeakPolarHBondContact CD2-O 3.26Å; Y281-R356 HydrophobicContact CE1-CB 3.65Å; Y281-R356 VanDerWaalsContact OH-CD 3.23Å; Y281-R356 WeakPolarHBondContact OH-CD 3.43Å; S283-R356 PolarHBondContact O-N 2.89Å; S283-R356 VanDerWaalsContact O-N 3.11Å; K354-R356 PolarHBondContact O-N 2.03Å
357	G	83.8	Confident	71.7	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.01	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.3	-141.7	170.2	0	0	0	0	0	114	S247 S283 Y333	S247-G357 VanDerWaalsContact OG-CA 3.25Å; S247-G357 WeakPolarHBondContact OG-CA 3.41Å; S283-G357 PolarHBondContact N-O 2.85Å; S283-G357 PolarHBondContact O-N 2.89Å; S283-G357 VanDerWaalsContact O-N 3.16Å; Y333-G357 WeakPolarHBondContact OH-CA 3.49Å
358	F	90.1	Very high	73.7	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	161.2	172.7	81.6	-87	0	0	0	112.3	F245 S246 S247 Y250 W265 F279 Y281 I282 L296 Y333 A360	F245-F358 AromaticContact CD2-CE2 3.62Å; F245-F358 HydrophobicContact CD2-CE2 3.62Å; F245-F358 AromaticContact CD2-CZ 3.87Å; F245-F358 HydrophobicContact CD2-CZ 3.87Å; F245-F358 AromaticContact CE2-CE2 3.62Å; F245-F358 HydrophobicContact CE2-CE2 3.62Å; F245-F358 AromaticContact CE2-CZ 4Å; F245-F358 HydrophobicContact CE2-CZ 4Å; S246-F358 WeakPolarHBondContact CA-O 3.24Å; S246-F358 VanDerWaalsContact CB-O 3.29Å; S246-F358 WeakPolarHBondContact CB-O 3.06Å; S247-F358 PolarHBondContact N-O 3.36Å; S247-F358 PolarHBondContact OG-N 2.95Å; S247-F358 PolarHBondContact OG-O 2.87Å; Y250-F358 WeakPolarHBondContact CB-O 3.43Å; W265-F358 HydrophobicContact CE3-CZ 4.12Å; W265-F358 AromaticContact CH2-CE1 3.64Å; W265-F358 HydrophobicContact CH2-CE1 3.64Å; W265-F358 AromaticContact CH2-CZ 3.6Å; W265-F358 HydrophobicContact CH2-CZ 3.6Å; W265-F358 HydrophobicContact CZ2-CE1 4.43Å; W265-F358 HydrophobicContact CZ2-CZ 4.04Å; W265-F358 AromaticContact CZ3-CE1 3.75Å; W265-F358 HydrophobicContact CZ3-CE1 3.75Å; W265-F358 AromaticContact CZ3-CZ 3.65Å; W265-F358 HydrophobicContact CZ3-CZ 3.65Å; F279-F358 AromaticContact CD1-CD2 3.84Å; F279-F358 HydrophobicContact CD1-CD2 3.84Å; F279-F358 HydrophobicContact CD1-CE2 4.37Å; F279-F358 AromaticContact CE1-CD2 3.83Å; F279-F358 HydrophobicContact CE1-CD2 3.83Å; F279-F358 AromaticContact CE1-CE2 3.94Å; F279-F358 HydrophobicContact CE1-CE2 3.94Å; Y281-F358 CarbonylContact O-C 3.55Å; Y281-F358 WeakPolarHBondContact O-CA 3.46Å; Y281-F358 VanDerWaalsContact O-CB 3.28Å; Y281-F358 WeakPolarHBondContact O-CB 3.3Å; I282-F358 HydrophobicContact CG1-CB 4.16Å; L296-F358 HydrophobicContact CD1-CD1 4.17Å; L296-F358 HydrophobicContact CD1-CE1 4.05Å; L296-F358 HydrophobicContact CD1-CZ 4.34Å; L296-F358 HydrophobicContact CD2-CG 4.46Å; Y333-F358 AromaticContact CD2-CD1 3.47Å; Y333-F358 HydrophobicContact CD2-CD1 3.47Å; Y333-F358 VanDerWaalsContact CD2-CD1 3.47Å; Y333-F358 AromaticContact CD2-CE1 3.67Å; Y333-F358 HydrophobicContact CD2-CE1 3.67Å; Y333-F358 AromaticContact CE2-CD1 3.81Å; Y333-F358 HydrophobicContact CE2-CD1 3.81Å; Y333-F358 HydrophobicContact CE2-CE1 4.35Å; Y333-F358 HydrophobicContact CG-CD1 4.2Å; Y333-F358 AromaticContact CG-CE1 3.94Å; Y333-F358 HydrophobicContact CG-CE1 3.94Å; F358-A360 HydrophobicContact CD2-CB 4.24Å; F358-A360 HydrophobicContact CE2-CB 4.21Å
359	A	91.6	Very high	75.7	Confident	7 Å²	7	71.8 Å²	71.8	6%	0.058	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	140.5	165.4	0	0	0	0	0	110.6	Y250 F279 T280 Y281	Y250-A359 HydrophobicContact CD1-CB 3.99Å; Y250-A359 HydrophobicContact CD2-CB 3.99Å; Y250-A359 HydrophobicContact CE1-CB 3.71Å; Y250-A359 HydrophobicContact CE2-CB 3.69Å; Y250-A359 HydrophobicContact CG-CB 4.14Å; F279-A359 CarbonylContact C-O 3.43Å; T280-A359 PolarHBondContact N-O 2.93Å; T280-A359 VanDerWaalsContact N-O 3.17Å; T280-A359 PolarHBondContact OG1-O 2.85Å; T280-A359 VanDerWaalsContact OG1-O 3.14Å; Y281-A359 PolarHBondContact N-O 3.08Å; Y281-A359 VanDerWaalsContact N-O 3.14Å; Y281-A359 PolarHBondContact O-N 3.48Å
360	A	93.8	Very high	77.9	Confident	2 Å²	2	66.4 Å²	66.4	2%	0.017	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	149.3	-174.3	0	0	0	0	0	112.3	I244 F245 N278 F279 F358	I244-A360 WeakPolarHBondContact CA-O 3.4Å; F245-A360 HydrophobicContact CD1-CB 4.25Å; F245-A360 HydrophobicContact CE1-CB 3.76Å; F245-A360 HydrophobicContact CE2-CB 4.06Å; F245-A360 HydrophobicContact CZ-CB 3.64Å; F245-A360 PolarHBondContact N-O 3.46Å; F245-A360 PolarHBondContact O-N 2.85Å; F245-A360 VanDerWaalsContact O-O 3.06Å; N278-A360 CarbonylContact O-C 3.21Å; N278-A360 VanDerWaalsContact O-CA 3.27Å; N278-A360 WeakPolarHBondContact O-CA 3.49Å; F279-A360 HydrophobicContact CD1-CB 3.52Å; F279-A360 HydrophobicContact CE1-CB 3.74Å; F279-A360 HydrophobicContact CG-CB 4.01Å; F279-A360 HydrophobicContact CZ-CB 4.43Å; F358-A360 HydrophobicContact CD2-CB 4.24Å; F358-A360 HydrophobicContact CE2-CB 4.21Å
361	G	95	Very high	80.2	Confident	18 Å²	18	63.9 Å²	63.9	19%	0.186	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	161.2	159.4	0	0	0	0	0	110.6	G243 N278	G243-G361 CarbonylContact O-C 3.44Å; G243-G361 VanDerWaalsContact O-CA 3.3Å; G243-G361 WeakPolarHBondContact O-CA 3.38Å; N278-G361 PolarHBondContact N-O 3.42Å; N278-G361 PolarHBondContact O-N 3.4Å
362	F	95	Very high	82.3	Confident	8 Å²	8	61 Å²	61	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.6	162.6	76.5	-88.9	0	0	0	111.3	F238 E240 S242 G243 F245 I267 I275 L276 L277 V364	F238-F362 HydrophobicContact CB-CE1 3.87Å; F238-F362 HydrophobicContact CB-CE2 4.45Å; F238-F362 HydrophobicContact CB-CZ 3.57Å; F238-F362 AromaticContact CD1-CE1 3.56Å; F238-F362 HydrophobicContact CD1-CE1 3.56Å; F238-F362 AromaticContact CD1-CZ 3.76Å; F238-F362 HydrophobicContact CD1-CZ 3.76Å; F238-F362 HydrophobicContact CD2-CD1 4.37Å; F238-F362 AromaticContact CD2-CE1 3.64Å; F238-F362 HydrophobicContact CD2-CE1 3.64Å; F238-F362 HydrophobicContact CD2-CZ 4.26Å; F238-F362 AromaticContact CE1-CE1 3.82Å; F238-F362 HydrophobicContact CE1-CE1 3.82Å; F238-F362 HydrophobicContact CE1-CZ 4.42Å; F238-F362 HydrophobicContact CE2-CD1 4.47Å; F238-F362 AromaticContact CE2-CE1 3.9Å; F238-F362 HydrophobicContact CE2-CE1 3.9Å; F238-F362 AromaticContact CG-CE1 3.43Å; F238-F362 HydrophobicContact CG-CE1 3.43Å; F238-F362 VanDerWaalsContact CG-CE1 3.43Å; F238-F362 AromaticContact CG-CZ 3.64Å; F238-F362 HydrophobicContact CG-CZ 3.64Å; F238-F362 AromaticContact CZ-CE1 3.97Å; F238-F362 HydrophobicContact CZ-CE1 3.97Å; E240-F362 WeakPolarHBondContact O-CE2 3.43Å; S242-F362 VanDerWaalsContact C-CZ 3.46Å; S242-F362 VanDerWaalsContact CA-O 3.26Å; S242-F362 WeakPolarHBondContact CA-O 3.27Å; S242-F362 WeakPolarHBondContact CB-O 3.44Å; G243-F362 PolarHBondContact N-O 2.89Å; G243-F362 WeakPolarHBondContact O-CD1 3.43Å; G243-F362 PolarHBondContact O-N 2.87Å; F245-F362 HydrophobicContact CD1-CD1 4.13Å; F245-F362 HydrophobicContact CE1-CB 4.41Å; F245-F362 HydrophobicContact CE1-CD1 4.04Å; I267-F362 HydrophobicContact CD1-CB 3.82Å; I267-F362 HydrophobicContact CD1-CD1 3.79Å; I267-F362 HydrophobicContact CD1-CD2 4.2Å; I267-F362 HydrophobicContact CD1-CE1 4.46Å; I267-F362 HydrophobicContact CD1-CG 3.65Å; I267-F362 HydrophobicContact CG1-CD1 4.16Å; I267-F362 HydrophobicContact CG1-CD2 4.46Å; I267-F362 HydrophobicContact CG1-CE1 4.34Å; I267-F362 HydrophobicContact CG1-CG 4.24Å; I267-F362 HydrophobicContact CG2-CD2 3.75Å; I267-F362 HydrophobicContact CG2-CE2 3.75Å; I267-F362 HydrophobicContact CG2-CG 4.33Å; I267-F362 HydrophobicContact CG2-CZ 4.32Å; I275-F362 HydrophobicContact CG2-CB 4.32Å; L276-F362 CarbonylContact O-C 3.56Å; L276-F362 WeakPolarHBondContact O-CA 3.49Å; L277-F362 HydrophobicContact CD2-CB 3.74Å; F362-V364 HydrophobicContact CE2-CG2 4.46Å
363	E	93.7	Very high	84.5	Confident	114 Å²	114	56.3 Å²	56.3	53%	0.533	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	133.2	179.1	-177	172.8	-162.1	0	0	108.9	L276	L276-E363 HydrophobicContact CB-CB 4.49Å; L276-E363 PolarHBondContact N-O 2.73Å; L276-E363 PolarHBondContact O-N 3.27Å
364	V	91.5	Very high	86.6	Confident	25 Å²	25	53.4 Å²	53.4	15%	0.152	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	120.8	175.9	171.4	0	0	0	0	108.6	A241 T269 H273 R274 F362	A241-V364 VanDerWaalsContact O-CB 3.29Å; A241-V364 WeakPolarHBondContact O-CB 3.47Å; A241-V364 WeakPolarHBondContact O-CG2 3.37Å; A241-V364 PolarHBondContact O-N 2.84Å; T269-V364 HydrophobicContact CG2-CG1 4.17Å; T269-V364 HydrophobicContact CG2-CG2 4.33Å; T269-V364 WeakPolarHBondContact OG1-CG1 3.18Å; H273-V364 HydrophobicContact CB-CG1 4.03Å; R274-V364 WeakPolarHBondContact O-CA 3.3Å; F362-V364 HydrophobicContact CE2-CG2 4.46Å
365	I	90.1	Very high	88.5	Confident	70 Å²	70	48.2 Å²	48.2	36%	0.359	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.3	175.2	-58.8	177.2	0	0	0	108	R274 L276	R274-I365 PolarHBondContact N-O 2.94Å; R274-I365 PolarHBondContact O-N 2.96Å; L276-I365 HydrophobicContact CB-CD1 3.93Å; L276-I365 HydrophobicContact CB-CG1 4.4Å; L276-I365 HydrophobicContact CD2-CD1 4.31Å
366	C	90.5	Very high	90	Very high	38 Å²	38	45.8 Å²	45.8	26%	0.257	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-79.7	155.7	166.4	68.3	0	0	0	0	111	H273 P380 C392 W394	H273-C366 VanDerWaalsContact CD2-CA 3.4Å; H273-C366 WeakPolarHBondContact CD2-CA 3.35Å; H273-C366 WeakPolarHBondContact CD2-CB 3.36Å; H273-C366 VanDerWaalsContact NE2-CB 3.32Å; H273-C366 WeakPolarHBondContact NE2-CB 3.46Å; C366-P380 HydrophobicContact CB-CG 4.36Å; C366-C392 HydrophobicContact CB-CB 3.69Å; C366-C392 WeakPolarHBondContact CB-SG 3.35Å; C366-C392 VanDerWaalsContact SG-CA 3.51Å; C366-C392 WeakPolarHBondContact SG-CB 3.02Å; C366-C392 CovalentContact SG-SG 2.03Å; C366-C392 PolarHBondContact SG-SG 3.3Å; C366-W394 HydrophobicContact CB-CZ2 4.37Å
367	G	88.1	Confident	91.1	Very high	4 Å²	4	38.6 Å²	38.6	4%	0.041	23%	0.231	C	C	.	.			trans	79.5	-162.8	-179.9	0	0	0	0	0	115.3	V393 W394	G367-V393 CarbonylContact C-O 3.57Å; G367-V393 WeakPolarHBondContact CA-O 3.36Å; G367-W394 VanDerWaalsContact CA-CD1 3.44Å
368	G	89.1	Confident	91.6	Very high	21 Å²	21	38.8 Å²	38.8	22%	0.216	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.5	178.9	-178.4	0	0	0	0	0	114.5	V393 W394 Y395	G368-V393 PolarHBondContact N-O 3.37Å; G368-W394 WeakPolarHBondContact O-CA 3.49Å; G368-Y395 PolarHBondContact O-N 2.79Å
369	N	91.4	Very high	91.6	Very high	98 Å²	98	38.8 Å²	38.8	52%	0.524	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.4	-171.3	-54.7	10.5	0	0	0	111.1	R274 Y395	R274-N369 PolarHBondContact NH2-O 3.38Å; N369-Y395 WeakPolarHBondContact CA-O 3.14Å; N369-Y395 WeakPolarHBondContact OD1-CD2 3.17Å
370	I	91.1	Very high	91.5	Very high	33 Å²	33	39 Å²	39	17%	0.169	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	117.6	177.9	-60.4	176.6	0	0	0	108.4	A372 I377 Y395 I396 T397 F475	I370-A372 HydrophobicContact CG2-CB 4.48Å; I370-I377 HydrophobicContact CD1-CD1 4.07Å; I370-I377 HydrophobicContact CD1-CG1 4.25Å; I370-Y395 PolarHBondContact N-O 3.38Å; I370-I396 CarbonylContact O-C 3.6Å; I370-I396 WeakPolarHBondContact O-CA 3.4Å; I370-T397 PolarHBondContact O-N 2.82Å; I370-F475 HydrophobicContact CG2-CE1 3.98Å; I370-F475 HydrophobicContact CG2-CE2 4.45Å; I370-F475 HydrophobicContact CG2-CZ 3.52Å
371	T	92.6	Very high	91.2	Very high	111 Å²	111	42 Å²	42	68%	0.681	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115	102.9	175.6	-52.7	0	0	0	0	109	T397	T371-T397 WeakPolarHBondContact CA-O 3.2Å
372	A	90	Very high	90.8	Very high	34 Å²	34	41.7 Å²	41.7	28%	0.281	24%	0.242	S	C	.	.	S	Bend	trans	-161.1	154.7	-177	0	0	0	0	0	111.9	I370 N374 T397 F475	I370-A372 HydrophobicContact CG2-CB 4.48Å; A372-N374 VanDerWaalsContact C-N 3.27Å; A372-N374 WeakPolarHBondContact CB-O 3.28Å; A372-N374 PolarHBondContact O-N 2.71Å; A372-T397 PolarHBondContact N-O 2.93Å; A372-T397 VanDerWaalsContact N-O 3.14Å; A372-F475 HydrophobicContact CB-CE2 4.28Å; A372-F475 HydrophobicContact CB-CZ 4.2Å
373	D	91.1	Very high	90.6	Very high	72 Å²	72	41.5 Å²	41.5	39%	0.385	24%	0.241	S	C	.	.	S	Bend	trans	-67.4	-26.4	175.4	-80.5	25.9	0	0	0	113.3	P399 K477	D373-P399 WeakPolarHBondContact OD1-CD 3.39Å; D373-P399 WeakPolarHBondContact OD1-CG 3.31Å; D373-K477 HydrophobicContact CB-CD 3.9Å; D373-K477 HydrophobicContact CB-CG 4.48Å; D373-K477 WeakPolarHBondContact O-CB 3.4Å; D373-K477 WeakPolarHBondContact O-CG 3.26Å; D373-K477 PolarHBondContact O-N 2.87Å; D373-K477 VanDerWaalsContact OD2-CE 3.31Å; D373-K477 WeakPolarHBondContact OD2-CE 3.49Å; D373-K477 IonicContact OD2-NZ 2.87Å; D373-K477 PolarHBondContact OD2-NZ 3.45Å
374	N	91.4	Very high	90.4	Very high	107 Å²	107	39.9 Å²	39.9	57%	0.572	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-160.9	172	172	57.4	48.3	0	0	0	109.8	A372 F475 I476	A372-N374 VanDerWaalsContact C-N 3.27Å; A372-N374 WeakPolarHBondContact CB-O 3.28Å; A372-N374 PolarHBondContact O-N 2.71Å; N374-F475 VanDerWaalsContact C-CZ 3.49Å; N374-F475 CarbonylContact C-O 3.6Å; N374-F475 WeakPolarHBondContact CA-O 3.46Å; N374-F475 WeakPolarHBondContact CB-O 3.37Å; N374-F475 WeakPolarHBondContact O-CZ 3.4Å; N374-I476 HydrophobicContact CB-CG2 4.14Å
375	G	89.6	Confident	90.3	Very high	20 Å²	20	42.9 Å²	42.9	21%	0.206	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175	-175.7	172.9	0	0	0	0	0	111.8	N474 F475	G375-N474 CarbonylContact O-C 3.58Å; G375-N474 VanDerWaalsContact O-CA 3.31Å; G375-N474 WeakPolarHBondContact O-CA 3.4Å; G375-F475 VanDerWaalsContact CA-CE1 3.41Å; G375-F475 PolarHBondContact N-O 2.65Å; G375-F475 PolarHBondContact O-N 2.92Å
376	V	91.1	Very high	90.4	Very high	28 Å²	28	39.7 Å²	39.7	17%	0.17	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.2	-178.3	-168	0	0	0	0	108.5	R271 G272 E378 F473 N474	R271-V376 HydrophobicContact CB-CB 4.41Å; R271-V376 WeakPolarHBondContact CB-O 3.45Å; G272-V376 PolarHBondContact N-O 2.72Å; V376-E378 HydrophobicContact CG1-CG 4.34Å; V376-F473 WeakPolarHBondContact CA-O 3.21Å; V376-F473 WeakPolarHBondContact CG1-O 3.38Å; V376-N474 VanDerWaalsContact CG2-OD1 3.27Å; V376-N474 WeakPolarHBondContact CG2-OD1 3.45Å
377	I	93.4	Very high	90.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.3	171.5	-61.6	173.6	0	0	0	106.9	I370 W394 I396 F471 S472 F473 F475	I370-I377 HydrophobicContact CD1-CD1 4.07Å; I370-I377 HydrophobicContact CD1-CG1 4.25Å; I377-W394 HydrophobicContact CD1-CB 4.02Å; I377-W394 HydrophobicContact CD1-CD2 4.31Å; I377-W394 HydrophobicContact CD1-CG 3.83Å; I377-W394 HydrophobicContact CG2-CD2 3.86Å; I377-W394 HydrophobicContact CG2-CE3 4.26Å; I377-W394 HydrophobicContact CG2-CG 4.4Å; I377-W394 HydrophobicContact CG2-CH2 4.08Å; I377-W394 HydrophobicContact CG2-CZ2 3.67Å; I377-W394 HydrophobicContact CG2-CZ3 4.36Å; I377-I396 HydrophobicContact CD1-CD1 3.93Å; I377-I396 HydrophobicContact CD1-CG1 4.27Å; I377-F471 HydrophobicContact CG2-CE2 4.26Å; I377-S472 WeakPolarHBondContact O-CA 3.31Å; I377-F473 HydrophobicContact CB-CD2 4.38Å; I377-F473 HydrophobicContact CB-CE1 4.16Å; I377-F473 HydrophobicContact CB-CE2 3.8Å; I377-F473 HydrophobicContact CB-CZ 3.66Å; I377-F473 HydrophobicContact CD1-CE2 3.83Å; I377-F473 HydrophobicContact CD1-CZ 3.85Å; I377-F473 HydrophobicContact CG1-CE2 4.16Å; I377-F473 HydrophobicContact CG1-CZ 4.27Å; I377-F473 HydrophobicContact CG2-CE1 4.19Å; I377-F473 HydrophobicContact CG2-CZ 3.92Å; I377-F473 PolarHBondContact N-O 3.39Å; I377-F473 PolarHBondContact O-N 3.03Å; I377-F475 HydrophobicContact CD1-CD1 4.24Å; I377-F475 HydrophobicContact CG1-CD1 4.28Å; I377-F475 HydrophobicContact CG1-CE1 4.42Å
378	E	92.8	Very high	90.4	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.019	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	154.9	177.1	-67.9	169.7	174.4	0	0	107.1	R62 A270 R271 H273 V376 Y382 F471	R62-E378 IonicContact CZ-OE1 2.65Å; R62-E378 IonicContact NE-OE1 3.92Å; R62-E378 IonicContact NH2-OE1 2.71Å; R62-E378 PolarHBondContact NH2-OE1 3.19Å; R62-E378 IonicContact NH2-OE2 3.14Å; R62-E378 PolarHBondContact NH2-OE2 2.63Å; R62-E378 VanDerWaalsContact NH2-OE2 3.07Å; A270-E378 WeakPolarHBondContact CA-OE2 3.26Å; A270-E378 HydrophobicContact CB-CB 3.98Å; R271-E378 HydrophobicContact CB-CB 4.41Å; R271-E378 HydrophobicContact CB-CG 3.96Å; R271-E378 VanDerWaalsContact CD-OE1 3.28Å; R271-E378 WeakPolarHBondContact CD-OE1 3.49Å; R271-E378 HydrophobicContact CG-CG 4.3Å; R271-E378 WeakPolarHBondContact CG-OE1 3.38Å; R271-E378 WeakPolarHBondContact CG-OE2 3.28Å; R271-E378 PolarHBondContact N-OE2 3.31Å; R271-E378 IonicContact NE-OE1 3.26Å; R271-E378 PolarHBondContact NE-OE1 3.27Å; R271-E378 VanDerWaalsContact NE-OE1 3.12Å; R271-E378 PolarHBondContact O-N 2.7Å; H273-E378 PolarHBondContact CE1-O 2.72Å; H273-E378 VanDerWaalsContact CE1-O 3.25Å; V376-E378 HydrophobicContact CG1-CG 4.34Å; E378-Y382 HydrophobicContact CB-CD1 3.74Å; E378-Y382 HydrophobicContact CB-CE1 4.46Å; E378-Y382 HydrophobicContact CB-CG 3.86Å; E378-Y382 VanDerWaalsContact CD-CE1 3.5Å; E378-Y382 HydrophobicContact CG-CD1 3.58Å; E378-Y382 HydrophobicContact CG-CE1 3.84Å; E378-Y382 HydrophobicContact CG-CG 4.17Å; E378-Y382 WeakPolarHBondContact OE2-CD1 3.34Å; E378-F471 WeakPolarHBondContact CA-O 3.26Å
379	N	91.5	Very high	90.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.265	C	S	.	.			trans	-64.9	160.3	173.8	57.3	-84.5	0	0	0	112.5	A270 N381 Y382 A469 G470 F471	A270-N379 VanDerWaalsContact CB-O 3.25Å; A270-N379 WeakPolarHBondContact CB-O 3.46Å; N379-N381 PolarHBondContact O-N 3.47Å; N379-Y382 VanDerWaalsContact O-CB 3.27Å; N379-Y382 WeakPolarHBondContact O-CB 3.41Å; N379-Y382 PolarHBondContact O-N 2.62Å; N379-Y382 WeakPolarHBondContact OD1-CD2 3.12Å; N379-A469 PolarHBondContact OD1-O 2.77Å; N379-G470 WeakPolarHBondContact OD1-CA 3.41Å; N379-F471 HydrophobicContact CB-CD1 3.9Å; N379-F471 HydrophobicContact CB-CE1 3.68Å; N379-F471 HydrophobicContact CB-CE2 4.49Å; N379-F471 HydrophobicContact CB-CG 4.39Å; N379-F471 HydrophobicContact CB-CZ 4.01Å; N379-F471 PolarHBondContact N-O 3.47Å; N379-F471 PolarHBondContact OD1-N 3.49Å; N379-F471 PolarHBondContact OD1-O 3.2Å; N379-F471 VanDerWaalsContact OD1-O 3.04Å
380	P	88.7	Confident	90.5	Very high	12 Å²	12	43 Å²	43	8%	0.078	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	140.6	165.6	-25.1	34.6	0	0	0	110.7	H273 C366 Y382 Y386 C392 F460	H273-P380 WeakPolarHBondContact NE2-CA 3.39Å; C366-P380 HydrophobicContact CB-CG 4.36Å; P380-Y382 PolarHBondContact O-N 2.92Å; P380-Y382 VanDerWaalsContact O-N 3.15Å; P380-Y386 WeakPolarHBondContact O-CA 3.46Å; P380-C392 VanDerWaalsContact CG-SG 3.59Å; P380-F460 HydrophobicContact CG-CD1 4.37Å; P380-F460 HydrophobicContact CG-CE1 4.35Å
381	N	87.1	Confident	90.6	Very high	65 Å²	65	45.8 Å²	45.8	35%	0.348	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	0	-178.8	-160.5	40.5	0	0	0	116.8	N379 Y384 D385	N379-N381 PolarHBondContact O-N 3.47Å; N381-Y384 WeakPolarHBondContact O-CA 3.26Å; N381-Y384 WeakPolarHBondContact O-CB 3.21Å; N381-Y384 WeakPolarHBondContact O-CD2 3.42Å; N381-Y384 PolarHBondContact O-N 3.07Å; N381-D385 WeakPolarHBondContact CB-O 3.38Å; N381-D385 PolarHBondContact ND2-O 3.38Å
382	Y	88.1	Confident	90.6	Very high	12 Å²	12	40.6 Å²	40.6	5%	0.047	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	133.5	174.6	-175.8	-94.3	0	0	0	111.6	A59 E378 N379 P380 M410	A59-Y382 HydrophobicContact CB-CE2 4.35Å; E378-Y382 HydrophobicContact CB-CD1 3.74Å; E378-Y382 HydrophobicContact CB-CE1 4.46Å; E378-Y382 HydrophobicContact CB-CG 3.86Å; E378-Y382 VanDerWaalsContact CD-CE1 3.5Å; E378-Y382 HydrophobicContact CG-CD1 3.58Å; E378-Y382 HydrophobicContact CG-CE1 3.84Å; E378-Y382 HydrophobicContact CG-CG 4.17Å; E378-Y382 WeakPolarHBondContact OE2-CD1 3.34Å; N379-Y382 VanDerWaalsContact O-CB 3.27Å; N379-Y382 WeakPolarHBondContact O-CB 3.41Å; N379-Y382 PolarHBondContact O-N 2.62Å; N379-Y382 WeakPolarHBondContact OD1-CD2 3.12Å; P380-Y382 PolarHBondContact O-N 2.92Å; P380-Y382 VanDerWaalsContact O-N 3.15Å; Y382-M410 HydrophobicContact CE2-SD 3.89Å
383	P	89.9	Confident	90.9	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.026	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	cis	-94.1	25.2	16.6	41.7	-43.1	0	0	0	115.3	A59 R62 R63 N66	A59-P383 HydrophobicContact CB-CB 4.13Å; R62-P383 HydrophobicContact CB-CB 3.64Å; R62-P383 HydrophobicContact CB-CG 3.63Å; R63-P383 HydrophobicContact CB-CG 4.48Å; R63-P383 HydrophobicContact CG-CB 4.07Å; R63-P383 HydrophobicContact CG-CG 3.6Å; N66-P383 WeakPolarHBondContact ND2-CD 3.19Å
384	Y	89.8	Confident	91.1	Very high	80 Å²	80	36.8 Å²	36.8	31%	0.314	20%	0.203	S	C	.	.	S	Bend	trans	-103.1	172.9	169.6	-49.1	-78.8	0	0	0	109.6	R63 N381	R63-Y384 HydrophobicContact CG-CD1 4.14Å; R63-Y384 HydrophobicContact CG-CE1 3.7Å; N381-Y384 WeakPolarHBondContact O-CA 3.26Å; N381-Y384 WeakPolarHBondContact O-CB 3.21Å; N381-Y384 WeakPolarHBondContact O-CD2 3.42Å; N381-Y384 PolarHBondContact O-N 3.07Å
385	D	89.9	Confident	91.2	Very high	87 Å²	87	34.6 Å²	34.6	47%	0.465	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-60.7	144.7	-178.5	-48	-68.9	0	0	0	111.6	N381 E467 K468 A469	N381-D385 WeakPolarHBondContact CB-O 3.38Å; N381-D385 PolarHBondContact ND2-O 3.38Å; D385-E467 HydrophobicContact CB-CB 4.21Å; D385-K468 WeakPolarHBondContact CA-O 3.44Å; D385-K468 WeakPolarHBondContact CB-O 3.48Å; D385-A469 WeakPolarHBondContact OD1-CA 3.37Å; D385-A469 PolarHBondContact OD1-N 2.03Å; D385-A469 VanDerWaalsContact OD1-N 3.1Å
386	Y	91	Very high	91.5	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.016	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-68	158.2	-177	51	-96.6	0	0	0	112.8	P380 L413 E414 D422 F460 V466 E467 K468	P380-Y386 WeakPolarHBondContact O-CA 3.46Å; Y386-L413 HydrophobicContact CD1-CD2 3.99Å; Y386-L413 HydrophobicContact CE1-CD2 3.35Å; Y386-E414 PolarHBondContact OH-N 2.87Å; Y386-D422 WeakPolarHBondContact CE2-OD2 3.35Å; Y386-D422 PolarHBondContact OH-OD2 2.8Å; Y386-F460 HydrophobicContact CD1-CZ 4.27Å; Y386-F460 AromaticContact CD2-CZ 3.77Å; Y386-F460 HydrophobicContact CD2-CZ 3.77Å; Y386-F460 HydrophobicContact CE2-CZ 4.27Å; Y386-F460 HydrophobicContact CG-CE1 4.38Å; Y386-F460 AromaticContact CG-CZ 3.77Å; Y386-F460 HydrophobicContact CG-CZ 3.77Å; Y386-V466 PolarHBondContact OH-O 2.94Å; Y386-E467 WeakPolarHBondContact O-CG 3.4Å; Y386-K468 WeakPolarHBondContact CD1-O 3.49Å; Y386-K468 HydrophobicContact CE1-CB 3.75Å; Y386-K468 WeakPolarHBondContact CE1-O 3.44Å; Y386-K468 PolarHBondContact N-O 3.48Å; Y386-K468 VanDerWaalsContact N-O 3.1Å
387	T	88.9	Confident	91.7	Very high	55 Å²	55	33.4 Å²	33.4	34%	0.337	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-72.7	138.3	175.1	38.4	0	0	0	0	111.8	S390 S462	T387-S390 PolarHBondContact O-OG 3.29Å; T387-S390 PolarHBondContact OG1-OG 3.49Å; T387-S462 PolarHBondContact O-OG 3.17Å
388	P	90.4	Very high	91.8	Very high	47 Å²	47	33.5 Å²	33.5	31%	0.305	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	155.2	170	31.5	-36.2	0	0	0	110.7	S390 D463 E467	P388-S390 VanDerWaalsContact C-N 3.29Å; P388-S390 PolarHBondContact O-N 2.83Å; P388-D463 CarbonylContact C-O 3.59Å; P388-D463 WeakPolarHBondContact CA-O 3.46Å; P388-D463 WeakPolarHBondContact CB-O 2.99Å; P388-E467 HydrophobicContact CB-CG 4.44Å; P388-E467 HydrophobicContact CG-CG 4.5Å; P388-E467 WeakPolarHBondContact CG-OE1 3.36Å
389	N	90.7	Very high	91.9	Very high	117 Å²	117	35.6 Å²	35.6	63%	0.626	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	33.5	-175.1	-50.6	-97.5	0	0	0	113.8	S462 D463	N389-S462 WeakPolarHBondContact CA-O 3.49Å; N389-S462 PolarHBondContact N-OG 3.05Å; N389-D463 PolarHBondContact N-O 3.45Å
390	S	90.7	Very high	91.7	Very high	12 Å²	12	43.2 Å²	43.2	8%	0.084	23%	0.226	C	C	.	.			trans	-78.4	137.7	175.5	-60.8	0	0	0	0	110.8	T387 P388 G461 S462	T387-S390 PolarHBondContact O-OG 3.29Å; T387-S390 PolarHBondContact OG1-OG 3.49Å; P388-S390 VanDerWaalsContact C-N 3.29Å; P388-S390 PolarHBondContact O-N 2.83Å; S390-G461 CarbonylContact O-C 3.56Å; S390-G461 WeakPolarHBondContact O-CA 3.45Å; S390-S462 VanDerWaalsContact CB-OG 3.27Å; S390-S462 WeakPolarHBondContact CB-OG 3.4Å; S390-S462 PolarHBondContact N-OG 2.88Å; S390-S462 PolarHBondContact O-N 2.92Å; S390-S462 PolarHBondContact OG-OG 3.15Å
391	D	93.6	Very high	91.6	Very high	91 Å²	91	50 Å²	50	49%	0.487	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	98.5	167.1	-171	2.8	0	0	0	108.9	R459 F460	D391-R459 VanDerWaalsContact CG-NH2 3.29Å; D391-R459 IonicContact OD1-CZ 3.74Å; D391-R459 IonicContact OD1-NE 3.42Å; D391-R459 PolarHBondContact OD1-NE 3.08Å; D391-R459 IonicContact OD1-NH2 2.61Å; D391-R459 PolarHBondContact OD1-NH2 2.94Å; D391-R459 IonicContact OD2-CZ 3.77Å; D391-R459 IonicContact OD2-NE 3.9Å; D391-R459 IonicContact OD2-NH2 2.96Å; D391-R459 PolarHBondContact OD2-NH2 3.11Å; D391-F460 WeakPolarHBondContact CA-O 3.31Å
392	C	93.9	Very high	91.8	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.014	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	116.8	-168.8	-64.8	0	0	0	0	110.4	C366 P380 W394 R459 F460	C366-C392 HydrophobicContact CB-CB 3.69Å; C366-C392 WeakPolarHBondContact CB-SG 3.35Å; C366-C392 VanDerWaalsContact SG-CA 3.51Å; C366-C392 WeakPolarHBondContact SG-CB 3.02Å; C366-C392 CovalentContact SG-SG 2.03Å; C366-C392 PolarHBondContact SG-SG 3.3Å; P380-C392 VanDerWaalsContact CG-SG 3.59Å; C392-W394 HydrophobicContact CB-CE3 4.47Å; C392-W394 HydrophobicContact CB-CH2 3.47Å; C392-W394 VanDerWaalsContact CB-CH2 3.47Å; C392-W394 HydrophobicContact CB-CZ2 4.05Å; C392-W394 HydrophobicContact CB-CZ3 3.72Å; C392-W394 WeakPolarHBondContact O-CZ3 3.46Å; C392-R459 CarbonylContact O-C 3.57Å; C392-R459 WeakPolarHBondContact O-CA 3.4Å; C392-F460 HydrophobicContact CB-CB 4.35Å; C392-F460 PolarHBondContact N-O 3.35Å; C392-F460 PolarHBondContact O-N 3.14Å
393	V	95	Very high	92	Very high	26 Å²	26	52.1 Å²	52.1	16%	0.158	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	113.2	-174.4	-172.2	0	0	0	0	111.5	G367 G368 Y395 R457 V458 R459	G367-V393 CarbonylContact C-O 3.57Å; G367-V393 WeakPolarHBondContact CA-O 3.36Å; G368-V393 PolarHBondContact N-O 3.37Å; V393-Y395 HydrophobicContact CB-CE2 4.36Å; V393-Y395 HydrophobicContact CG1-CD2 4.48Å; V393-Y395 HydrophobicContact CG1-CE1 4Å; V393-Y395 HydrophobicContact CG1-CE2 3.75Å; V393-Y395 VanDerWaalsContact CG1-CZ 3.47Å; V393-Y395 WeakPolarHBondContact CG1-OH 3.24Å; V393-R457 HydrophobicContact CG1-CG 3.99Å; V393-R457 VanDerWaalsContact CG1-NE 3.34Å; V393-V458 CarbonylContact C-O 3.57Å; V393-V458 WeakPolarHBondContact CA-O 3.49Å; V393-R459 HydrophobicContact CG2-CB 4.31Å; V393-R459 HydrophobicContact CG2-CG 3.97Å
394	W	94.8	Very high	92.2	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.5	174.9	-61.8	-89.6	0	0	0	111.3	G272 C366 G367 G368 I377 C392 R457 V458 F460 F471	G272-W394 PolarHBondContact O-NE1 3.12Å; C366-W394 HydrophobicContact CB-CZ2 4.37Å; G367-W394 VanDerWaalsContact CA-CD1 3.44Å; G368-W394 WeakPolarHBondContact O-CA 3.49Å; I377-W394 HydrophobicContact CD1-CB 4.02Å; I377-W394 HydrophobicContact CD1-CD2 4.31Å; I377-W394 HydrophobicContact CD1-CG 3.83Å; I377-W394 HydrophobicContact CG2-CD2 3.86Å; I377-W394 HydrophobicContact CG2-CE3 4.26Å; I377-W394 HydrophobicContact CG2-CG 4.4Å; I377-W394 HydrophobicContact CG2-CH2 4.08Å; I377-W394 HydrophobicContact CG2-CZ2 3.67Å; I377-W394 HydrophobicContact CG2-CZ3 4.36Å; C392-W394 HydrophobicContact CB-CE3 4.47Å; C392-W394 HydrophobicContact CB-CH2 3.47Å; C392-W394 VanDerWaalsContact CB-CH2 3.47Å; C392-W394 HydrophobicContact CB-CZ2 4.05Å; C392-W394 HydrophobicContact CB-CZ3 3.72Å; C392-W394 WeakPolarHBondContact O-CZ3 3.46Å; W394-R457 WeakPolarHBondContact O-CA 3.25Å; W394-V458 HydrophobicContact CB-CB 4.49Å; W394-V458 HydrophobicContact CE3-CB 4.4Å; W394-V458 HydrophobicContact CE3-CG1 4.48Å; W394-V458 PolarHBondContact N-O 3.43Å; W394-V458 PolarHBondContact O-N 3.29Å; W394-F460 HydrophobicContact CH2-CB 4.2Å; W394-F460 HydrophobicContact CZ3-CB 3.78Å; W394-F471 HydrophobicContact CH2-CZ 4.04Å; W394-F471 HydrophobicContact CZ3-CZ 4.24Å
395	Y	95.1	Very high	92.4	Very high	60 Å²	60	48.1 Å²	48.1	24%	0.235	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	94.3	176.3	-57	-86	0	0	0	109	G368 N369 I370 V393 H430 R457	G368-Y395 PolarHBondContact O-N 2.79Å; N369-Y395 WeakPolarHBondContact CA-O 3.14Å; N369-Y395 WeakPolarHBondContact OD1-CD2 3.17Å; I370-Y395 PolarHBondContact N-O 3.38Å; V393-Y395 HydrophobicContact CB-CE2 4.36Å; V393-Y395 HydrophobicContact CG1-CD2 4.48Å; V393-Y395 HydrophobicContact CG1-CE1 4Å; V393-Y395 HydrophobicContact CG1-CE2 3.75Å; V393-Y395 VanDerWaalsContact CG1-CZ 3.47Å; V393-Y395 WeakPolarHBondContact CG1-OH 3.24Å; Y395-H430 HydrophobicContact CD1-CB 3.96Å; Y395-H430 WeakPolarHBondContact CE1-O 3.19Å; Y395-R457 HydrophobicContact CD1-CB 4.48Å; Y395-R457 HydrophobicContact CD1-CG 4.13Å; Y395-R457 HydrophobicContact CE1-CG 4Å
396	I	95.1	Very high	92.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	135.4	-175.9	-55.5	174.3	0	0	0	109.2	I370 I377 V404 I406 H430 K455 M456 V458 F475	I370-I396 CarbonylContact O-C 3.6Å; I370-I396 WeakPolarHBondContact O-CA 3.4Å; I377-I396 HydrophobicContact CD1-CD1 3.93Å; I377-I396 HydrophobicContact CD1-CG1 4.27Å; I396-V404 HydrophobicContact CG2-CG1 3.89Å; I396-V404 HydrophobicContact CG2-CG2 4.26Å; I396-I406 HydrophobicContact CD1-CD1 4.15Å; I396-H430 PolarHBondContact O-NE2 3.21Å; I396-K455 WeakPolarHBondContact O-CA 3.07Å; I396-M456 PolarHBondContact N-O 3.02Å; I396-M456 PolarHBondContact O-N 3.01Å; I396-M456 VanDerWaalsContact O-N 3.15Å; I396-V458 HydrophobicContact CD1-CG2 3.82Å; I396-F475 HydrophobicContact CD1-CB 4.06Å; I396-F475 HydrophobicContact CD1-CD1 4.17Å; I396-F475 HydrophobicContact CD1-CG 4.09Å; I396-F475 HydrophobicContact CG2-CD2 3.66Å; I396-F475 HydrophobicContact CG2-CE2 3.92Å; I396-F475 HydrophobicContact CG2-CG 4.06Å
397	T	96.2	Very high	92.6	Very high	24 Å²	24	46.4 Å²	46.4	15%	0.147	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	119.3	175.2	-43	0	0	0	0	109.6	I370 T371 A372 H430 N454 K455	I370-T397 PolarHBondContact O-N 2.82Å; T371-T397 WeakPolarHBondContact CA-O 3.2Å; A372-T397 PolarHBondContact N-O 2.93Å; A372-T397 VanDerWaalsContact N-O 3.14Å; T397-H430 PolarHBondContact OG1-CE1 3.14Å; T397-N454 WeakPolarHBondContact CA-O 3.27Å; T397-K455 HydrophobicContact CG2-CG 4.18Å
398	V	94.5	Very high	92.6	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-97.6	167.6	167.8	-62.2	0	0	0	0	109.4	V404 N454 K477	V398-V404 HydrophobicContact CG1-CG2 4.04Å; V398-V404 HydrophobicContact CG2-CG2 3.87Å; V398-N454 HydrophobicContact CG2-CB 3.79Å; V398-N454 PolarHBondContact N-O 3.14Å; V398-N454 PolarHBondContact O-ND2 3.45Å; V398-K477 HydrophobicContact CB-CB 3.93Å; V398-K477 HydrophobicContact CG1-CB 3.85Å; V398-K477 HydrophobicContact CG2-CB 4.47Å
399	P	94.3	Very high	92.4	Very high	49 Å²	49	44 Å²	44	32%	0.318	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-54.7	156.3	175.8	-26.4	35.9	0	0	0	113	D373 Y402 N454	D373-P399 WeakPolarHBondContact OD1-CD 3.39Å; D373-P399 WeakPolarHBondContact OD1-CG 3.31Å; P399-Y402 HydrophobicContact CB-CD2 3.99Å; P399-Y402 HydrophobicContact CB-CE2 4.43Å; P399-Y402 PolarHBondContact O-N 3.2Å; P399-N454 WeakPolarHBondContact O-CB 3.36Å
400	E	87.6	Confident	92.2	Very high	159 Å²	159	38.8 Å²	38.8	74%	0.743	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	153.3	171.9	-61.6	-179.5	165.5	0	0	110.2	Y402	E400-Y402 WeakPolarHBondContact O-CD2 3.06Å; E400-Y402 PolarHBondContact O-N 2.79Å
401	D	87.1	Confident	92.3	Very high	155 Å²	155	38.5 Å²	38.5	83%	0.829	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.7	-1.3	-167.4	-53.7	-37.6	0	0	0	117.1
402	Y	90.9	Very high	92.1	Very high	79 Å²	79	36.5 Å²	36.5	31%	0.31	18%	0.184	S	C	.	.			trans	-109.1	160.1	173.9	-64.7	-98.1	0	0	0	112.8	P399 E400 N454 K477 F479	P399-Y402 HydrophobicContact CB-CD2 3.99Å; P399-Y402 HydrophobicContact CB-CE2 4.43Å; P399-Y402 PolarHBondContact O-N 3.2Å; E400-Y402 WeakPolarHBondContact O-CD2 3.06Å; E400-Y402 PolarHBondContact O-N 2.79Å; Y402-N454 WeakPolarHBondContact O-CA 3.34Å; Y402-N454 WeakPolarHBondContact O-CB 3.16Å; Y402-N454 PolarHBondContact O-N 2.79Å; Y402-K477 HydrophobicContact CD1-CB 4.01Å; Y402-K477 HydrophobicContact CD1-CD 3.72Å; Y402-K477 HydrophobicContact CD1-CG 3.88Å; Y402-K477 HydrophobicContact CE1-CD 3.84Å; Y402-K477 HydrophobicContact CE1-CG 4.3Å; Y402-K477 HydrophobicContact CG-CB 4.22Å; Y402-K477 HydrophobicContact CG-CD 4.14Å; Y402-K477 HydrophobicContact CG-CG 4.46Å; Y402-F479 HydrophobicContact CD1-CB 3.87Å; Y402-F479 HydrophobicContact CE1-CB 3.93Å; Y402-F479 HydrophobicContact CE1-CD2 4.43Å; Y402-F479 HydrophobicContact CE1-CG 4.38Å
403	Q	92.4	Very high	92	Very high	43 Å²	43	36.4 Å²	36.4	20%	0.201	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	157.9	173	-67.3	-178.8	-49.3	0	0	110.8	S451 N452 S453 K477 E478	Q403-S451 PolarHBondContact NE2-O 3.08Å; Q403-N452 PolarHBondContact NE2-O 2.74Å; Q403-S453 WeakPolarHBondContact CA-O 3.33Å; Q403-K477 WeakPolarHBondContact O-CA 3.35Å; Q403-E478 HydrophobicContact CB-CB 4.29Å; Q403-E478 HydrophobicContact CB-CG 4.38Å; Q403-E478 PolarHBondContact N-O 3.29Å; Q403-E478 PolarHBondContact O-N 3.26Å
404	V	93.8	Very high	91.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.4	171.9	-173.5	0	0	0	0	109.8	I396 V398 I406 S451 S453 M456	I396-V404 HydrophobicContact CG2-CG1 3.89Å; I396-V404 HydrophobicContact CG2-CG2 4.26Å; V398-V404 HydrophobicContact CG1-CG2 4.04Å; V398-V404 HydrophobicContact CG2-CG2 3.87Å; V404-I406 HydrophobicContact CG1-CD1 4.26Å; V404-S451 WeakPolarHBondContact O-CB 3.45Å; V404-S451 PolarHBondContact O-N 2.73Å; V404-S453 PolarHBondContact N-O 3.35Å; V404-M456 HydrophobicContact CB-CB 3.96Å; V404-M456 HydrophobicContact CB-CE 4.13Å; V404-M456 HydrophobicContact CG1-CB 3.94Å; V404-M456 HydrophobicContact CG1-CE 4.04Å; V404-M456 HydrophobicContact CG1-SD 4.15Å; V404-M456 HydrophobicContact CG2-CB 4.1Å
405	A	94.1	Very high	91.7	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.6	168.9	0	0	0	0	0	112.2	I449 F475 I476 E478 L497	A405-I449 CarbonylContact C-O 3.52Å; A405-I449 WeakPolarHBondContact CA-O 3.44Å; A405-F475 CarbonylContact O-C 3.11Å; A405-F475 VanDerWaalsContact O-CA 3.28Å; A405-F475 WeakPolarHBondContact O-CA 3.2Å; A405-I476 HydrophobicContact CB-CG1 4Å; A405-I476 PolarHBondContact N-O 3.26Å; A405-I476 PolarHBondContact O-N 2.93Å; A405-E478 HydrophobicContact CB-CB 3.68Å; A405-E478 HydrophobicContact CB-CG 4.08Å; A405-L497 HydrophobicContact CB-CD1 4.38Å; A405-L497 HydrophobicContact CB-CD2 3.9Å
406	I	94.2	Very high	91.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.3	-176.5	-55.7	-59.7	0	0	0	109.6	I396 V404 F408 F426 S448 I449 M456 F473 N474 F475	I396-I406 HydrophobicContact CD1-CD1 4.15Å; V404-I406 HydrophobicContact CG1-CD1 4.26Å; I406-F408 HydrophobicContact CG2-CD2 4.47Å; I406-F408 HydrophobicContact CG2-CE2 4.07Å; I406-F408 HydrophobicContact CG2-CZ 4.2Å; I406-F426 HydrophobicContact CB-CE1 4.4Å; I406-F426 HydrophobicContact CD1-CE1 4.38Å; I406-F426 HydrophobicContact CG1-CD1 4.08Å; I406-F426 HydrophobicContact CG1-CE1 3.9Å; I406-F426 HydrophobicContact CG2-CE1 3.89Å; I406-F426 HydrophobicContact CG2-CZ 4.24Å; I406-S448 CarbonylContact O-C 3.56Å; I406-S448 VanDerWaalsContact O-CA 3.23Å; I406-S448 WeakPolarHBondContact O-CA 3.44Å; I406-S448 VanDerWaalsContact O-CB 3.22Å; I406-S448 WeakPolarHBondContact O-CB 3.28Å; I406-I449 HydrophobicContact CB-CB 4.21Å; I406-I449 PolarHBondContact N-O 3.28Å; I406-I449 PolarHBondContact O-N 3.01Å; I406-I449 VanDerWaalsContact O-N 3.09Å; I406-M456 HydrophobicContact CD1-CE 4.46Å; I406-M456 HydrophobicContact CD1-SD 3.78Å; I406-M456 HydrophobicContact CG1-CE 3.83Å; I406-M456 HydrophobicContact CG1-SD 3.52Å; I406-M456 VanDerWaalsContact CG1-SD 3.52Å; I406-F473 HydrophobicContact CD1-CD2 4.06Å; I406-F473 HydrophobicContact CD1-CE2 3.89Å; I406-F473 HydrophobicContact CG2-CB 3.96Å; I406-F473 HydrophobicContact CG2-CD2 3.62Å; I406-F473 HydrophobicContact CG2-CE2 4.26Å; I406-F473 HydrophobicContact CG2-CG 3.85Å; I406-N474 WeakPolarHBondContact CA-O 3.06Å; I406-F475 HydrophobicContact CD1-CB 3.6Å
407	I	90.7	Very high	91.1	Very high	55 Å²	55	49.7 Å²	49.7	28%	0.282	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	114.6	177.3	-56.4	175.6	0	0	0	108.3	F473 N474 I476 L497	I407-F473 WeakPolarHBondContact O-CA 3.31Å; I407-N474 PolarHBondContact N-O 3.27Å; I407-N474 PolarHBondContact O-N 2.67Å; I407-I476 HydrophobicContact CD1-CD1 3.91Å; I407-L497 HydrophobicContact CD1-CB 4.12Å; I407-L497 HydrophobicContact CG1-CD1 4.29Å
408	F	90.2	Very high	90.7	Very high	11 Å²	11	54.4 Å²	54.4	5%	0.048	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	140.2	179	-63.8	-91.6	0	0	0	111.4	I406 F411 F426 V440 L445 P446 I449 F473	I406-F408 HydrophobicContact CG2-CD2 4.47Å; I406-F408 HydrophobicContact CG2-CE2 4.07Å; I406-F408 HydrophobicContact CG2-CZ 4.2Å; F408-F411 HydrophobicContact CD1-CB 4.49Å; F408-F411 AromaticContact CD1-CD2 3.87Å; F408-F411 HydrophobicContact CD1-CD2 3.87Å; F408-F411 HydrophobicContact CD1-CG 4.49Å; F408-F411 AromaticContact CE1-CD2 3.84Å; F408-F411 HydrophobicContact CE1-CD2 3.84Å; F408-F411 HydrophobicContact CE1-CE2 4.14Å; F408-F426 HydrophobicContact CE1-CE2 4.34Å; F408-F426 AromaticContact CE1-CZ 3.98Å; F408-F426 HydrophobicContact CE1-CZ 3.98Å; F408-F426 AromaticContact CZ-CE2 3.74Å; F408-F426 HydrophobicContact CZ-CE2 3.74Å; F408-F426 AromaticContact CZ-CZ 3.57Å; F408-F426 HydrophobicContact CZ-CZ 3.57Å; F408-V440 HydrophobicContact CZ-CG2 4.35Å; F408-L445 HydrophobicContact CB-CD1 3.61Å; F408-L445 HydrophobicContact CB-CG 3.99Å; F408-P446 HydrophobicContact CD1-CG 4.29Å; F408-P446 HydrophobicContact CD2-CB 3.9Å; F408-P446 HydrophobicContact CD2-CG 4.16Å; F408-P446 WeakPolarHBondContact CD2-O 3.43Å; F408-P446 HydrophobicContact CE1-CG 4.14Å; F408-P446 HydrophobicContact CE2-CB 3.68Å; F408-P446 HydrophobicContact CE2-CG 4.04Å; F408-P446 HydrophobicContact CG-CG 4.3Å; F408-P446 HydrophobicContact CZ-CB 4.08Å; F408-P446 HydrophobicContact CZ-CG 4.02Å; F408-I449 HydrophobicContact CE2-CD1 3.87Å; F408-I449 HydrophobicContact CE2-CG1 4.34Å; F408-I449 HydrophobicContact CZ-CD1 3.94Å; F408-F473 HydrophobicContact CD1-CB 3.92Å; F408-F473 HydrophobicContact CE1-CB 4.34Å; F408-F473 HydrophobicContact CE1-CD1 4.26Å; F408-F473 HydrophobicContact CG-CB 4.32Å
409	S	85.7	Confident	90.5	Very high	40 Å²	40	55 Å²	55	28%	0.28	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-25.5	173.1	-55.5	0	0	0	0	112.1	G55 S472 N474	G55-S409 WeakPolarHBondContact CA-O 3.48Å; G55-S409 PolarHBondContact N-O 3Å; S409-S472 PolarHBondContact N-O 2.92Å; S409-N474 PolarHBondContact OG-ND2 2.86Å
410	M	87.3	Confident	90.3	Very high	7 Å²	7	57 Å²	57	3%	0.034	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	141.5	171.6	-171.2	171.2	-175	0	0	109.2	G55 A59 Y382 A469 F471 S472	G55-M410 VanDerWaalsContact C-SD 3.53Å; G55-M410 VanDerWaalsContact O-SD 3.38Å; A59-M410 HydrophobicContact CB-CE 4.27Å; A59-M410 HydrophobicContact CB-SD 4.01Å; Y382-M410 HydrophobicContact CE2-SD 3.89Å; M410-A469 HydrophobicContact CE-CB 3.55Å; M410-F471 VanDerWaalsContact O-CA 3.29Å; M410-F471 WeakPolarHBondContact O-CA 3.47Å; M410-S472 PolarHBondContact N-O 3.44Å; M410-S472 PolarHBondContact O-N 2.97Å
411	F	91.2	Very high	90.4	Very high	7 Å²	7	54 Å²	54	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	111.9	175.5	-166	-95.9	0	0	0	111.6	F408 L413 V424 V440 G442 S444 L445 P446 G470 F471	F408-F411 HydrophobicContact CD1-CB 4.49Å; F408-F411 AromaticContact CD1-CD2 3.87Å; F408-F411 HydrophobicContact CD1-CD2 3.87Å; F408-F411 HydrophobicContact CD1-CG 4.49Å; F408-F411 AromaticContact CE1-CD2 3.84Å; F408-F411 HydrophobicContact CE1-CD2 3.84Å; F408-F411 HydrophobicContact CE1-CE2 4.14Å; F411-L413 HydrophobicContact CE2-CD1 3.98Å; F411-L413 HydrophobicContact CE2-CG 4.3Å; F411-L413 HydrophobicContact CZ-CD1 3.72Å; F411-L413 HydrophobicContact CZ-CG 4.06Å; F411-V424 HydrophobicContact CE2-CG2 4.41Å; F411-V440 HydrophobicContact CE1-CB 4.4Å; F411-V440 HydrophobicContact CE2-CB 4.44Å; F411-V440 HydrophobicContact CE2-CG2 3.75Å; F411-V440 HydrophobicContact CZ-CB 3.82Å; F411-V440 HydrophobicContact CZ-CG2 3.59Å; F411-G442 WeakPolarHBondContact CD1-O 3.13Å; F411-G442 WeakPolarHBondContact CE1-O 2.96Å; F411-S444 WeakPolarHBondContact CD1-O 3.36Å; F411-L445 HydrophobicContact CB-CD1 4.2Å; F411-P446 HydrophobicContact CB-CG 4.46Å; F411-P446 HydrophobicContact CD1-CG 3.76Å; F411-P446 HydrophobicContact CD2-CG 4.03Å; F411-P446 HydrophobicContact CE1-CG 3.92Å; F411-P446 HydrophobicContact CE2-CG 4.21Å; F411-P446 HydrophobicContact CG-CG 3.81Å; F411-P446 HydrophobicContact CZ-CG 4.16Å; F411-G470 CarbonylContact C-O 3.52Å; F411-G470 WeakPolarHBondContact CA-O 3.34Å; F411-F471 HydrophobicContact CD2-CB 3.84Å; F411-F471 HydrophobicContact CE2-CB 4.39Å
412	Q	90.6	Very high	90.8	Very high	49 Å²	49	46.7 Å²	46.7	23%	0.229	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	102.2	175.2	-68	175.3	13.7	0	0	108.2	D56 G442 Y443 K468 G470	D56-Q412 PolarHBondContact OD1-NE2 2.9Å; Q412-G442 WeakPolarHBondContact CA-O 3.36Å; Q412-Y443 HydrophobicContact CB-CD1 4.45Å; Q412-Y443 HydrophobicContact CG-CD1 4.46Å; Q412-K468 HydrophobicContact CB-CB 4.44Å; Q412-K468 VanDerWaalsContact O-CB 3.3Å; Q412-K468 WeakPolarHBondContact O-CB 3.29Å; Q412-G470 PolarHBondContact N-O 3.44Å; Q412-G470 VanDerWaalsContact O-CA 3.27Å; Q412-G470 WeakPolarHBondContact O-CA 3.14Å; Q412-G470 PolarHBondContact O-N 3.46Å
413	L	92.5	Very high	91	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.215	C	C	.	.			trans	-119.7	175.2	171.5	-63.8	-176	0	0	0	110	Y386 F411 D422 V424 G442 F460 F471	Y386-L413 HydrophobicContact CD1-CD2 3.99Å; Y386-L413 HydrophobicContact CE1-CD2 3.35Å; F411-L413 HydrophobicContact CE2-CD1 3.98Å; F411-L413 HydrophobicContact CE2-CG 4.3Å; F411-L413 HydrophobicContact CZ-CD1 3.72Å; F411-L413 HydrophobicContact CZ-CG 4.06Å; L413-D422 HydrophobicContact CB-CB 4.25Å; L413-V424 HydrophobicContact CD1-CG2 4.13Å; L413-G442 PolarHBondContact N-O 3.36Å; L413-G442 CarbonylContact O-C 3.56Å; L413-G442 WeakPolarHBondContact O-CA 3.28Å; L413-F460 HydrophobicContact CD1-CE2 4.36Å; L413-F460 HydrophobicContact CD2-CE2 3.85Å; L413-F460 HydrophobicContact CD2-CZ 4.47Å; L413-F471 HydrophobicContact CD2-CD1 4.28Å
414	E	92.9	Very high	91.2	Very high	31 Å²	31	42.2 Å²	42.2	15%	0.145	21%	0.206	C	C	.	.			trans	-56.3	145.5	166	-173.1	167.5	-140.1	0	0	111.4	Y386 Y421 D422 C441 G442 V466	Y386-E414 PolarHBondContact OH-N 2.87Å; E414-Y421 HydrophobicContact CG-CD2 4.2Å; E414-Y421 WeakPolarHBondContact OE2-CB 3.43Å; E414-Y421 VanDerWaalsContact OE2-CD2 3.24Å; E414-Y421 WeakPolarHBondContact OE2-CD2 3.27Å; E414-D422 HydrophobicContact CB-CB 4.12Å; E414-C441 WeakPolarHBondContact O-CB 3.31Å; E414-G442 PolarHBondContact O-N 3.2Å; E414-V466 HydrophobicContact CB-CG1 4.29Å; E414-V466 HydrophobicContact CG-CB 4.38Å; E414-V466 HydrophobicContact CG-CG1 4.01Å; E414-V466 WeakPolarHBondContact OE1-CB 3.32Å; E414-V466 WeakPolarHBondContact OE1-CG1 3.38Å; E414-V466 WeakPolarHBondContact OE1-CG2 3.2Å
415	Q	90.1	Very high	91.3	Very high	100 Å²	100	43 Å²	43	47%	0.467	21%	0.209	S	C	.	.			trans	-101.2	120.7	-176.8	-174.2	75	71.7	0	0	110.3	Y443	Q415-Y443 HydrophobicContact CB-CD2 4.17Å; Q415-Y443 HydrophobicContact CB-CE2 3.76Å
416	H	91.2	Very high	91.4	Very high	46 Å²	46	43 Å²	43	21%	0.213	21%	0.209	C	C	.	.			trans	-142.4	154.8	170	-176.2	-83	0	0	0	109.1	D418 C419 I420 Y421 C441	H416-D418 PolarHBondContact ND1-N 3.41Å; H416-C419 PolarHBondContact ND1-N 3.27Å; H416-C419 PolarHBondContact O-N 3.24Å; H416-I420 WeakPolarHBondContact NE2-CD1 3.49Å; H416-Y421 HydrophobicContact CB-CD2 3.95Å; H416-Y421 HydrophobicContact CB-CE2 4.19Å; H416-Y421 AromaticContact CD2-CE2 3.49Å; H416-Y421 VanDerWaalsContact CD2-CE2 3.49Å; H416-Y421 WeakPolarHBondContact CD2-CE2 3.1Å; H416-Y421 AromaticContact CD2-CZ 3.98Å; H416-C441 PolarHBondContact O-SG 2.9Å
417	E	86.2	Confident	91.5	Very high	187 Å²	187	45.3 Å²	45.3	87%	0.874	22%	0.218	S	C	*	.	S	Bend	trans	-63.5	-58.6	-179.5	-61	-174.3	149.9	0	0	111.4	C419	E417-C419 VanDerWaalsContact C-N 3.27Å; E417-C419 PolarHBondContact O-N 2.84Å
418	D	87.8	Confident	91.7	Very high	123 Å²	123	44 Å²	44	66%	0.658	21%	0.211	S	C	*	.	S	Bend	trans	-81.7	9.6	174.4	-61.6	-59.8	0	0	0	114.8	H416 I420	H416-D418 PolarHBondContact ND1-N 3.41Å; D418-I420 HydrophobicContact CB-CG2 3.76Å; D418-I420 PolarHBondContact O-N 3.08Å
419	C	90.4	Very high	91.9	Very high	15 Å²	15	44.3 Å²	44.3	10%	0.101	22%	0.217	C	C	.	.			trans	48.7	47.7	-176	-62.8	0	0	0	0	115.1	H416 E417 R439 C441	H416-C419 PolarHBondContact ND1-N 3.27Å; H416-C419 PolarHBondContact O-N 3.24Å; E417-C419 VanDerWaalsContact C-N 3.27Å; E417-C419 PolarHBondContact O-N 2.84Å; C419-R439 HydrophobicContact CB-CG 4.24Å; C419-R439 VanDerWaalsContact O-CZ 3.3Å; C419-R439 PolarHBondContact O-NE 2.86Å; C419-R439 PolarHBondContact O-NH2 3.4Å; C419-C441 WeakPolarHBondContact CA-SG 3.16Å; C419-C441 HydrophobicContact CB-CB 3.55Å; C419-C441 WeakPolarHBondContact CB-SG 3.41Å; C419-C441 WeakPolarHBondContact SG-CB 3.42Å; C419-C441 PolarHBondContact SG-N 3.46Å; C419-C441 CovalentContact SG-SG 2.03Å; C419-C441 PolarHBondContact SG-SG 3.07Å
420	I	89.7	Confident	92.3	Very high	90 Å²	90	45.1 Å²	45.1	46%	0.462	22%	0.216	S	C	.	.			trans	-80.3	-27.6	-171.9	69.6	179.9	0	0	0	115	H416 D418	H416-I420 WeakPolarHBondContact NE2-CD1 3.49Å; D418-I420 HydrophobicContact CB-CG2 3.76Å; D418-I420 PolarHBondContact O-N 3.08Å
421	Y	90.2	Very high	92.4	Very high	97 Å²	97	47.1 Å²	47.1	38%	0.38	23%	0.233	S	C	.	.	S	Bend	trans	-81.7	-102.1	179.5	-48.8	-56.2	0	0	0	109.7	E414 H416 Y423	E414-Y421 HydrophobicContact CG-CD2 4.2Å; E414-Y421 WeakPolarHBondContact OE2-CB 3.43Å; E414-Y421 VanDerWaalsContact OE2-CD2 3.24Å; E414-Y421 WeakPolarHBondContact OE2-CD2 3.27Å; H416-Y421 HydrophobicContact CB-CD2 3.95Å; H416-Y421 HydrophobicContact CB-CE2 4.19Å; H416-Y421 AromaticContact CD2-CE2 3.49Å; H416-Y421 VanDerWaalsContact CD2-CE2 3.49Å; H416-Y421 WeakPolarHBondContact CD2-CE2 3.1Å; H416-Y421 AromaticContact CD2-CZ 3.98Å; Y421-Y423 WeakPolarHBondContact O-CD1 3.3Å
422	D	94.8	Very high	92	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.261	C	S	.	.	S	Bend	trans	-83.4	134.5	174.5	-60.7	-21.5	0	0	0	112	Y386 L413 E414 C441 G461 S462 D463	Y386-D422 WeakPolarHBondContact CE2-OD2 3.35Å; Y386-D422 PolarHBondContact OH-OD2 2.8Å; L413-D422 HydrophobicContact CB-CB 4.25Å; E414-D422 HydrophobicContact CB-CB 4.12Å; D422-C441 WeakPolarHBondContact O-CB 3.09Å; D422-G461 WeakPolarHBondContact CA-O 3.34Å; D422-S462 WeakPolarHBondContact OD1-CA 3.09Å; D422-S462 WeakPolarHBondContact OD1-CB 3.28Å; D422-D463 PolarHBondContact OD1-N 3.19Å
423	Y	95.4	Very high	91.9	Very high	28 Å²	28	56.7 Å²	56.7	11%	0.11	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	153.6	179	64.7	-81.6	0	0	0	113.2	Y421 E425 R439 V440 R459 F460 G461	Y421-Y423 WeakPolarHBondContact O-CD1 3.3Å; Y423-E425 HydrophobicContact CD2-CB 3.89Å; Y423-E425 HydrophobicContact CE2-CB 3.92Å; Y423-R439 HydrophobicContact CD2-CG 4.04Å; Y423-R439 HydrophobicContact CG-CG 4.29Å; Y423-V440 WeakPolarHBondContact CA-O 3.45Å; Y423-R459 PolarHBondContact OH-NH1 3.41Å; Y423-F460 WeakPolarHBondContact O-CA 3.37Å; Y423-F460 WeakPolarHBondContact O-CD2 3.11Å; Y423-G461 PolarHBondContact N-O 2.52Å; Y423-G461 PolarHBondContact O-N 3.4Å
424	V	95.8	Very high	91.5	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.9	157.7	-172.5	0	0	0	0	109.2	F411 L413 F426 R439 V440 V458 R459 F460 F471	F411-V424 HydrophobicContact CE2-CG2 4.41Å; L413-V424 HydrophobicContact CD1-CG2 4.13Å; V424-F426 HydrophobicContact CB-CE2 3.92Å; V424-F426 HydrophobicContact CB-CZ 4.38Å; V424-F426 HydrophobicContact CG1-CD2 4.07Å; V424-F426 HydrophobicContact CG1-CE1 4.32Å; V424-F426 HydrophobicContact CG1-CE2 3.37Å; V424-F426 HydrophobicContact CG1-CZ 3.51Å; V424-R439 WeakPolarHBondContact O-CA 3.08Å; V424-V440 HydrophobicContact CB-CG2 4.13Å; V424-V440 PolarHBondContact N-O 3.2Å; V424-V440 WeakPolarHBondContact O-CG2 3.03Å; V424-V440 PolarHBondContact O-N 3.15Å; V424-V458 HydrophobicContact CG1-CG1 3.41Å; V424-V458 VanDerWaalsContact CG1-CG1 3.41Å; V424-R459 CarbonylContact C-O 3.54Å; V424-R459 WeakPolarHBondContact CA-O 3.45Å; V424-F460 HydrophobicContact CG2-CB 4.29Å; V424-F460 HydrophobicContact CG2-CD2 3.95Å; V424-F471 HydrophobicContact CG2-CD1 3.74Å; V424-F471 HydrophobicContact CG2-CE1 3.64Å; V424-F471 HydrophobicContact CG2-CG 4.26Å; V424-F471 HydrophobicContact CG2-CZ 4.05Å
425	E	95.7	Very high	91.5	Very high	16 Å²	16	61.9 Å²	61.9	8%	0.075	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132	175.7	-171.8	-175.2	71.6	0	0	110	Y423 R427 V436 A438 V458 R459	Y423-E425 HydrophobicContact CD2-CB 3.89Å; Y423-E425 HydrophobicContact CE2-CB 3.92Å; E425-R427 VanDerWaalsContact CD-NE 3.35Å; E425-R427 HydrophobicContact CG-CG 4.43Å; E425-R427 IonicContact OE1-CZ 2.65Å; E425-R427 IonicContact OE1-NE 3.13Å; E425-R427 PolarHBondContact OE1-NE 3.35Å; E425-R427 IonicContact OE1-NH2 3.42Å; E425-R427 PolarHBondContact OE1-NH2 2.82Å; E425-R427 VanDerWaalsContact OE1-NH2 3.1Å; E425-R427 IonicContact OE2-CZ 2.71Å; E425-R427 IonicContact OE2-NE 2.69Å; E425-R427 IonicContact OE2-NH2 2.68Å; E425-R427 PolarHBondContact OE2-NH2 3.04Å; E425-V436 HydrophobicContact CG-CG1 4.23Å; E425-A438 WeakPolarHBondContact CA-O 3.48Å; E425-V458 CarbonylContact O-C 3.44Å; E425-V458 WeakPolarHBondContact O-CA 3.41Å; E425-R459 PolarHBondContact N-O 3.02Å; E425-R459 PolarHBondContact O-N 3.04Å
426	F	96.2	Very high	91.6	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	126.4	178.7	-62.7	-97.3	0	0	0	108.7	I406 F408 V424 L437 A438 V440 I449 M456 R457 V458 F473	I406-F426 HydrophobicContact CB-CE1 4.4Å; I406-F426 HydrophobicContact CD1-CE1 4.38Å; I406-F426 HydrophobicContact CG1-CD1 4.08Å; I406-F426 HydrophobicContact CG1-CE1 3.9Å; I406-F426 HydrophobicContact CG2-CE1 3.89Å; I406-F426 HydrophobicContact CG2-CZ 4.24Å; F408-F426 HydrophobicContact CE1-CE2 4.34Å; F408-F426 AromaticContact CE1-CZ 3.98Å; F408-F426 HydrophobicContact CE1-CZ 3.98Å; F408-F426 AromaticContact CZ-CE2 3.74Å; F408-F426 HydrophobicContact CZ-CE2 3.74Å; F408-F426 AromaticContact CZ-CZ 3.57Å; F408-F426 HydrophobicContact CZ-CZ 3.57Å; V424-F426 HydrophobicContact CB-CE2 3.92Å; V424-F426 HydrophobicContact CB-CZ 4.38Å; V424-F426 HydrophobicContact CG1-CD2 4.07Å; V424-F426 HydrophobicContact CG1-CE1 4.32Å; V424-F426 HydrophobicContact CG1-CE2 3.37Å; V424-F426 HydrophobicContact CG1-CZ 3.51Å; F426-L437 HydrophobicContact CB-CB 4.32Å; F426-L437 PolarHBondContact O-N 2.85Å; F426-A438 HydrophobicContact CD2-CB 4.44Å; F426-A438 PolarHBondContact N-O 2.9Å; F426-A438 PolarHBondContact O-N 2.92Å; F426-V440 HydrophobicContact CE2-CG2 3.94Å; F426-I449 HydrophobicContact CB-CD1 4.31Å; F426-I449 HydrophobicContact CB-CG2 4.44Å; F426-I449 HydrophobicContact CD1-CD1 4.07Å; F426-I449 HydrophobicContact CD2-CD1 3.39Å; F426-I449 HydrophobicContact CE1-CD1 4.24Å; F426-I449 HydrophobicContact CE2-CD1 3.58Å; F426-I449 HydrophobicContact CG-CD1 3.66Å; F426-I449 HydrophobicContact CZ-CD1 4.02Å; F426-M456 HydrophobicContact CD1-SD 3.81Å; F426-R457 WeakPolarHBondContact CA-O 3.3Å; F426-V458 HydrophobicContact CD1-CB 4.31Å; F426-V458 HydrophobicContact CD1-CG1 3.85Å; F426-V458 HydrophobicContact CD1-CG2 3.64Å; F426-V458 HydrophobicContact CE1-CB 4.34Å; F426-V458 HydrophobicContact CE1-CG1 3.57Å; F426-V458 HydrophobicContact CE1-CG2 3.79Å; F426-V458 HydrophobicContact CG-CG1 4.45Å; F426-V458 HydrophobicContact CZ-CG1 3.98Å; F426-F473 HydrophobicContact CE1-CE1 4.28Å; F426-F473 HydrophobicContact CE1-CE2 4.42Å; F426-F473 HydrophobicContact CE1-CZ 4.12Å; F426-F473 HydrophobicContact CZ-CD1 4.41Å; F426-F473 HydrophobicContact CZ-CE1 4.15Å; F426-F473 HydrophobicContact CZ-CZ 4.45Å
427	R	96.2	Very high	91.7	Very high	49 Å²	49	60.8 Å²	60.8	19%	0.185	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149	179.9	-71.7	178.9	-175.4	-93.1	-7	112.5	E425 G434 D435 V436 M456 R457	E425-R427 VanDerWaalsContact CD-NE 3.35Å; E425-R427 HydrophobicContact CG-CG 4.43Å; E425-R427 IonicContact OE1-CZ 2.65Å; E425-R427 IonicContact OE1-NE 3.13Å; E425-R427 PolarHBondContact OE1-NE 3.35Å; E425-R427 IonicContact OE1-NH2 3.42Å; E425-R427 PolarHBondContact OE1-NH2 2.82Å; E425-R427 VanDerWaalsContact OE1-NH2 3.1Å; E425-R427 IonicContact OE2-CZ 2.71Å; E425-R427 IonicContact OE2-NE 2.69Å; E425-R427 IonicContact OE2-NH2 2.68Å; E425-R427 PolarHBondContact OE2-NH2 3.04Å; R427-G434 WeakPolarHBondContact CD-O 3.24Å; R427-G434 PolarHBondContact NH1-O 3.36Å; R427-D435 CarbonylContact C-O 3.55Å; R427-D435 VanDerWaalsContact CA-O 3.23Å; R427-D435 WeakPolarHBondContact CA-O 3.3Å; R427-V436 HydrophobicContact CG-CG2 4.2Å; R427-V436 VanDerWaalsContact CZ-CG2 3.4Å; R427-M456 WeakPolarHBondContact O-CG 3.35Å; R427-R457 HydrophobicContact CB-CB 4.27Å; R427-R457 PolarHBondContact N-O 2.89Å; R427-R457 PolarHBondContact O-N 2.91Å
428	E	95	Very high	92.1	Very high	28 Å²	28	53 Å²	53	13%	0.131	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	135.4	174.5	-173.5	54.1	-133.3	0	0	111.2	D435 L437 S451 N452 S453	E428-D435 HydrophobicContact CB-CB 4.36Å; E428-D435 PolarHBondContact N-O 3.33Å; E428-L437 HydrophobicContact CB-CD2 4.26Å; E428-L437 HydrophobicContact CB-CG 4.35Å; E428-S451 PolarHBondContact OE1-OG 3.29Å; E428-S451 WeakPolarHBondContact OE2-CA 3.46Å; E428-S451 WeakPolarHBondContact OE2-CB 3.33Å; E428-S451 PolarHBondContact OE2-OG 2.89Å; E428-N452 PolarHBondContact OE2-N 3.4Å; E428-S453 WeakPolarHBondContact OE1-CB 3.35Å; E428-S453 PolarHBondContact OE1-N 3.42Å; E428-S453 PolarHBondContact OE1-OG 2.84Å
429	G	94.1	Very high	92.4	Very high	17 Å²	17	51.7 Å²	51.7	18%	0.175	27%	0.273	C	S	.	.	S	Bend	trans	72.9	-153	-176.9	0	0	0	0	0	113.9	K455 M456 R457	G429-K455 VanDerWaalsContact CA-O 3.31Å; G429-K455 WeakPolarHBondContact CA-O 3.27Å; G429-K455 PolarHBondContact N-O 2.88Å; G429-M456 CarbonylContact O-C 3.6Å; G429-M456 WeakPolarHBondContact O-CA 3.48Å; G429-R457 PolarHBondContact O-N 2.85Å
430	H	94.1	Very high	92.6	Very high	57 Å²	57	52.1 Å²	52.1	26%	0.264	28%	0.275	S	S	.	.	S	Bend	trans	-119	-2.4	178.2	-71.4	169.2	0	0	0	113.8	Y395 I396 T397	Y395-H430 HydrophobicContact CD1-CB 3.96Å; Y395-H430 WeakPolarHBondContact CE1-O 3.19Å; I396-H430 PolarHBondContact O-NE2 3.21Å; T397-H430 PolarHBondContact OG1-CE1 3.14Å
431	A	90.8	Very high	92.8	Very high	48 Å²	48	48.3 Å²	48.3	40%	0.397	26%	0.256	S	S	.	.	S	Bend	trans	-81.5	157.8	-173.4	0	0	0	0	0	112.1	D433 G434	A431-D433 VanDerWaalsContact C-N 3.32Å; A431-D433 WeakPolarHBondContact CB-OD1 3.44Å; A431-G434 PolarHBondContact O-N 3.32Å
432	D	83.2	Confident	92.9	Very high	114 Å²	114	43.7 Å²	43.7	61%	0.61	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-32	176.4	-84.1	-66	0	0	0	112.9	R457	D432-R457 IonicContact OD1-CZ 2.76Å; D432-R457 IonicContact OD1-NH1 2.84Å; D432-R457 PolarHBondContact OD1-NH1 3Å; D432-R457 IonicContact OD1-NH2 3.39Å; D432-R457 PolarHBondContact OD1-NH2 2.97Å
433	D	87.5	Confident	92.5	Very high	144 Å²	144	49.4 Å²	49.4	77%	0.77	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	6.3	179.7	59.4	-26.8	0	0	0	113.9	A431	A431-D433 VanDerWaalsContact C-N 3.32Å; A431-D433 WeakPolarHBondContact CB-OD1 3.44Å
434	G	85.2	Confident	92	Very high	13 Å²	13	52 Å²	52	13%	0.134	28%	0.283	C	S	.	.	S	Bend	trans	-64	145.9	175.9	0	0	0	0	0	113.2	R427 A431	R427-G434 WeakPolarHBondContact CD-O 3.24Å; R427-G434 PolarHBondContact NH1-O 3.36Å; A431-G434 PolarHBondContact O-N 3.32Å
435	D	92.2	Very high	91.6	Very high	127 Å²	127	57 Å²	57	68%	0.679	31%	0.309	S	S	*	.			trans	-54.9	137	-178.4	-67.6	-50.2	0	0	0	112	R427 E428 L437	R427-D435 CarbonylContact C-O 3.55Å; R427-D435 VanDerWaalsContact CA-O 3.23Å; R427-D435 WeakPolarHBondContact CA-O 3.3Å; E428-D435 HydrophobicContact CB-CB 4.36Å; E428-D435 PolarHBondContact N-O 3.33Å; D435-L437 PolarHBondContact O-N 3.46Å
436	V	92.7	Very high	91.3	Very high	71 Å²	71	57.3 Å²	57.3	43%	0.43	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	116	175.9	-179.3	0	0	0	0	109.3	E425 R427	E425-V436 HydrophobicContact CG-CG1 4.23Å; R427-V436 HydrophobicContact CG-CG2 4.2Å; R427-V436 VanDerWaalsContact CZ-CG2 3.4Å
437	L	93.5	Very high	91	Very high	52 Å²	52	64.5 Å²	64.5	27%	0.272	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	-39.6	173.7	-60.7	173.8	0	0	0	110.9	F426 E428 D435 I449 M456	F426-L437 HydrophobicContact CB-CB 4.32Å; F426-L437 PolarHBondContact O-N 2.85Å; E428-L437 HydrophobicContact CB-CD2 4.26Å; E428-L437 HydrophobicContact CB-CG 4.35Å; D435-L437 PolarHBondContact O-N 3.46Å; L437-I449 HydrophobicContact CB-CG2 3.92Å; L437-I449 HydrophobicContact CD1-CG2 4.4Å; L437-M456 HydrophobicContact CD1-CE 3.86Å; L437-M456 HydrophobicContact CD1-CG 4.38Å
438	A	93.3	Very high	90.7	Very high	23 Å²	23	65.1 Å²	65.1	19%	0.19	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	155.3	172.1	0	0	0	0	0	111.5	E425 F426 V440 I449	E425-A438 WeakPolarHBondContact CA-O 3.48Å; F426-A438 HydrophobicContact CD2-CB 4.44Å; F426-A438 PolarHBondContact N-O 2.9Å; F426-A438 PolarHBondContact O-N 2.92Å; A438-V440 HydrophobicContact CB-CG1 4.39Å; A438-I449 HydrophobicContact CB-CD1 3.75Å; A438-I449 HydrophobicContact CB-CG1 4.19Å
439	R	94.6	Very high	90.5	Very high	95 Å²	95	64.5 Å²	64.5	36%	0.358	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128	160.7	-179.6	178.8	177.6	141.1	-5.2	107.2	C419 Y423 V424	C419-R439 HydrophobicContact CB-CG 4.24Å; C419-R439 VanDerWaalsContact O-CZ 3.3Å; C419-R439 PolarHBondContact O-NE 2.86Å; C419-R439 PolarHBondContact O-NH2 3.4Å; Y423-R439 HydrophobicContact CD2-CG 4.04Å; Y423-R439 HydrophobicContact CG-CG 4.29Å; V424-R439 WeakPolarHBondContact O-CA 3.08Å
440	V	94.8	Very high	90.4	Very high	24 Å²	24	66.9 Å²	66.9	15%	0.145	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.8	-170.6	-66.7	0	0	0	0	112	F408 F411 Y423 V424 F426 A438 P446	F408-V440 HydrophobicContact CZ-CG2 4.35Å; F411-V440 HydrophobicContact CE1-CB 4.4Å; F411-V440 HydrophobicContact CE2-CB 4.44Å; F411-V440 HydrophobicContact CE2-CG2 3.75Å; F411-V440 HydrophobicContact CZ-CB 3.82Å; F411-V440 HydrophobicContact CZ-CG2 3.59Å; Y423-V440 WeakPolarHBondContact CA-O 3.45Å; V424-V440 HydrophobicContact CB-CG2 4.13Å; V424-V440 PolarHBondContact N-O 3.2Å; V424-V440 WeakPolarHBondContact O-CG2 3.03Å; V424-V440 PolarHBondContact O-N 3.15Å; F426-V440 HydrophobicContact CE2-CG2 3.94Å; A438-V440 HydrophobicContact CB-CG1 4.39Å; V440-P446 HydrophobicContact CB-CB 4.5Å; V440-P446 HydrophobicContact CB-CG 4.1Å; V440-P446 HydrophobicContact CG1-CB 4Å; V440-P446 HydrophobicContact CG1-CG 4.16Å; V440-P446 HydrophobicContact CG2-CG 4.23Å
441	C	94.1	Very high	90.4	Very high	10 Å²	10	64.2 Å²	64.2	7%	0.068	35%	0.353	C	S	.	.			trans	-155.5	174.7	178.2	67.8	0	0	0	0	110	E414 H416 C419 D422	E414-C441 WeakPolarHBondContact O-CB 3.31Å; H416-C441 PolarHBondContact O-SG 2.9Å; C419-C441 WeakPolarHBondContact CA-SG 3.16Å; C419-C441 HydrophobicContact CB-CB 3.55Å; C419-C441 WeakPolarHBondContact CB-SG 3.41Å; C419-C441 WeakPolarHBondContact SG-CB 3.42Å; C419-C441 PolarHBondContact SG-N 3.46Å; C419-C441 CovalentContact SG-SG 2.03Å; C419-C441 PolarHBondContact SG-SG 3.07Å; D422-C441 WeakPolarHBondContact O-CB 3.09Å
442	G	91.6	Very high	90.4	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.366	C	S	.	.	S	Bend	trans	84.5	-158.9	-179.8	0	0	0	0	0	115.7	F411 Q412 L413 E414	F411-G442 WeakPolarHBondContact CD1-O 3.13Å; F411-G442 WeakPolarHBondContact CE1-O 2.96Å; Q412-G442 WeakPolarHBondContact CA-O 3.36Å; L413-G442 PolarHBondContact N-O 3.36Å; L413-G442 CarbonylContact O-C 3.56Å; L413-G442 WeakPolarHBondContact O-CA 3.28Å; E414-G442 PolarHBondContact O-N 3.2Å
443	Y	87	Confident	90.8	Very high	122 Å²	122	64.3 Å²	64.3	48%	0.478	35%	0.35	S	S	.	.	S	Bend	trans	-108.1	-10.1	-165.3	-52.9	-80.6	0	0	0	115.5	Q412 Q415 K468	Q412-Y443 HydrophobicContact CB-CD1 4.45Å; Q412-Y443 HydrophobicContact CG-CD1 4.46Å; Q415-Y443 HydrophobicContact CB-CD2 4.17Å; Q415-Y443 HydrophobicContact CB-CE2 3.76Å; Y443-K468 HydrophobicContact CE1-CD 4.19Å; Y443-K468 WeakPolarHBondContact OH-CE 3.39Å; Y443-K468 PolarHBondContact OH-NZ 3.49Å; Y443-K468 VanDerWaalsContact OH-NZ 3.12Å
444	S	85.3	Confident	91.1	Very high	83 Å²	83	59 Å²	59	58%	0.58	32%	0.321	S	S	*	.	S	Bend	trans	-82.5	134.6	178.5	49.9	0	0	0	0	110.8	F411 P446	F411-S444 WeakPolarHBondContact CD1-O 3.36Å; S444-P446 WeakPolarHBondContact O-CD 3.34Å
445	L	85.7	Confident	91.6	Very high	105 Å²	105	62.3 Å²	62.3	55%	0.55	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-62.7	117.1	174.7	-166.6	78.8	0	0	0	109.2	F408 F411	F408-L445 HydrophobicContact CB-CD1 3.61Å; F408-L445 HydrophobicContact CB-CG 3.99Å; F411-L445 HydrophobicContact CB-CD1 4.2Å
446	P	89.5	Confident	91.8	Very high	21 Å²	21	56.3 Å²	56.3	14%	0.136	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-70.9	152.9	-174.1	-18.6	31.4	0	0	0	112.7	F408 F411 V440 S444	F408-P446 HydrophobicContact CD1-CG 4.29Å; F408-P446 HydrophobicContact CD2-CB 3.9Å; F408-P446 HydrophobicContact CD2-CG 4.16Å; F408-P446 WeakPolarHBondContact CD2-O 3.43Å; F408-P446 HydrophobicContact CE1-CG 4.14Å; F408-P446 HydrophobicContact CE2-CB 3.68Å; F408-P446 HydrophobicContact CE2-CG 4.04Å; F408-P446 HydrophobicContact CG-CG 4.3Å; F408-P446 HydrophobicContact CZ-CB 4.08Å; F408-P446 HydrophobicContact CZ-CG 4.02Å; F411-P446 HydrophobicContact CB-CG 4.46Å; F411-P446 HydrophobicContact CD1-CG 3.76Å; F411-P446 HydrophobicContact CD2-CG 4.03Å; F411-P446 HydrophobicContact CE1-CG 3.92Å; F411-P446 HydrophobicContact CE2-CG 4.21Å; F411-P446 HydrophobicContact CG-CG 3.81Å; F411-P446 HydrophobicContact CZ-CG 4.16Å; V440-P446 HydrophobicContact CB-CB 4.5Å; V440-P446 HydrophobicContact CB-CG 4.1Å; V440-P446 HydrophobicContact CG1-CB 4Å; V440-P446 HydrophobicContact CG1-CG 4.16Å; V440-P446 HydrophobicContact CG2-CG 4.23Å; S444-P446 WeakPolarHBondContact O-CD 3.34Å
447	N	89.8	Confident	92	Very high	151 Å²	151	53.8 Å²	53.8	81%	0.807	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-56.1	145.9	169.2	-73.4	-33	0	0	0	110.7
448	S	89.9	Confident	92.1	Very high	62 Å²	62	51.3 Å²	51.3	43%	0.434	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-66	135.6	-179	-56.7	0	0	0	0	111.7	I406	I406-S448 CarbonylContact O-C 3.56Å; I406-S448 VanDerWaalsContact O-CA 3.23Å; I406-S448 WeakPolarHBondContact O-CA 3.44Å; I406-S448 VanDerWaalsContact O-CB 3.22Å; I406-S448 WeakPolarHBondContact O-CB 3.28Å
449	I	92.6	Very high	92.2	Very high	15 Å²	15	53.6 Å²	53.6	8%	0.077	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	137.2	-171.2	-56.4	160.5	0	0	0	109.3	A405 I406 F408 F426 L437 A438 M456	A405-I449 CarbonylContact C-O 3.52Å; A405-I449 WeakPolarHBondContact CA-O 3.44Å; I406-I449 HydrophobicContact CB-CB 4.21Å; I406-I449 PolarHBondContact N-O 3.28Å; I406-I449 PolarHBondContact O-N 3.01Å; I406-I449 VanDerWaalsContact O-N 3.09Å; F408-I449 HydrophobicContact CE2-CD1 3.87Å; F408-I449 HydrophobicContact CE2-CG1 4.34Å; F408-I449 HydrophobicContact CZ-CD1 3.94Å; F426-I449 HydrophobicContact CB-CD1 4.31Å; F426-I449 HydrophobicContact CB-CG2 4.44Å; F426-I449 HydrophobicContact CD1-CD1 4.07Å; F426-I449 HydrophobicContact CD2-CD1 3.39Å; F426-I449 HydrophobicContact CE1-CD1 4.24Å; F426-I449 HydrophobicContact CE2-CD1 3.58Å; F426-I449 HydrophobicContact CG-CD1 3.66Å; F426-I449 HydrophobicContact CZ-CD1 4.02Å; L437-I449 HydrophobicContact CB-CG2 3.92Å; L437-I449 HydrophobicContact CD1-CG2 4.4Å; A438-I449 HydrophobicContact CB-CD1 3.75Å; A438-I449 HydrophobicContact CB-CG1 4.19Å; I449-M456 HydrophobicContact CG2-CE 4.28Å
450	K	91.9	Very high	92.2	Very high	67 Å²	67	49.1 Å²	49.1	29%	0.291	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.2	179.2	-177.6	169.2	175	166.6	0	110.7	E478 L497	K450-E478 HydrophobicContact CD-CG 3.81Å; K450-E478 HydrophobicContact CG-CG 4.31Å; K450-E478 VanDerWaalsContact NZ-CG 3.34Å; K450-E478 IonicContact NZ-OE1 2.64Å; K450-E478 PolarHBondContact NZ-OE1 3.16Å; K450-L497 HydrophobicContact CD-CD2 4Å
451	S	93.3	Very high	92.2	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.007	25%	0.253	C	S	.	.			trans	-82.4	153.8	173.5	169.3	0	0	0	0	111	Q403 V404 E428 S453 K455	Q403-S451 PolarHBondContact NE2-O 3.08Å; V404-S451 WeakPolarHBondContact O-CB 3.45Å; V404-S451 PolarHBondContact O-N 2.73Å; E428-S451 PolarHBondContact OE1-OG 3.29Å; E428-S451 WeakPolarHBondContact OE2-CA 3.46Å; E428-S451 WeakPolarHBondContact OE2-CB 3.33Å; E428-S451 PolarHBondContact OE2-OG 2.89Å; S451-S453 PolarHBondContact OG-N 2.62Å; S451-S453 PolarHBondContact OG-O 2.82Å; S451-K455 PolarHBondContact OG-O 2.03Å
452	N	90.3	Very high	92.2	Very high	125 Å²	125	48.5 Å²	48.5	67%	0.668	26%	0.255	S	S	*	.	S	Bend	trans	-80.2	-23.2	173.9	-71.3	-61.1	0	0	0	113.1	Q403 E428	Q403-N452 PolarHBondContact NE2-O 2.74Å; E428-N452 PolarHBondContact OE2-N 3.4Å
453	S	92.2	Very high	92.3	Very high	39 Å²	39	50.9 Å²	50.9	27%	0.273	27%	0.267	S	S	.	.	S	Bend	trans	-119.8	-177.7	-178.7	77.5	0	0	0	0	113.6	Q403 V404 E428 S451 K455	Q403-S453 WeakPolarHBondContact CA-O 3.33Å; V404-S453 PolarHBondContact N-O 3.35Å; E428-S453 WeakPolarHBondContact OE1-CB 3.35Å; E428-S453 PolarHBondContact OE1-N 3.42Å; E428-S453 PolarHBondContact OE1-OG 2.84Å; S451-S453 PolarHBondContact OG-N 2.62Å; S451-S453 PolarHBondContact OG-O 2.82Å; S453-K455 PolarHBondContact O-N 2.96Å; S453-K455 PolarHBondContact OG-N 3.38Å; S453-K455 PolarHBondContact OG-O 3.37Å
454	N	94.3	Very high	92.5	Very high	32 Å²	32	48.3 Å²	48.3	17%	0.171	27%	0.271	C	S	.	.	S	Bend	trans	-78.1	9.7	175.7	79.6	-46.5	0	0	0	114	T397 V398 P399 Y402	T397-N454 WeakPolarHBondContact CA-O 3.27Å; V398-N454 HydrophobicContact CG2-CB 3.79Å; V398-N454 PolarHBondContact N-O 3.14Å; V398-N454 PolarHBondContact O-ND2 3.45Å; P399-N454 WeakPolarHBondContact O-CB 3.36Å; Y402-N454 WeakPolarHBondContact O-CA 3.34Å; Y402-N454 WeakPolarHBondContact O-CB 3.16Å; Y402-N454 PolarHBondContact O-N 2.79Å
455	K	95.8	Very high	92.7	Very high	84 Å²	84	46.9 Å²	46.9	37%	0.365	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	129.7	-174.1	-70.2	173.6	-168.5	172.4	0	111.2	I396 T397 G429 S451 S453	I396-K455 WeakPolarHBondContact O-CA 3.07Å; T397-K455 HydrophobicContact CG2-CG 4.18Å; G429-K455 VanDerWaalsContact CA-O 3.31Å; G429-K455 WeakPolarHBondContact CA-O 3.27Å; G429-K455 PolarHBondContact N-O 2.88Å; S451-K455 PolarHBondContact OG-O 2.03Å; S453-K455 PolarHBondContact O-N 2.96Å; S453-K455 PolarHBondContact OG-N 3.38Å; S453-K455 PolarHBondContact OG-O 3.37Å
456	M	95.8	Very high	92.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	139.5	174.5	-174.8	-171.3	-75.4	0	0	109.4	I396 V404 I406 F426 R427 G429 L437 I449 V458	I396-M456 PolarHBondContact N-O 3.02Å; I396-M456 PolarHBondContact O-N 3.01Å; I396-M456 VanDerWaalsContact O-N 3.15Å; V404-M456 HydrophobicContact CB-CB 3.96Å; V404-M456 HydrophobicContact CB-CE 4.13Å; V404-M456 HydrophobicContact CG1-CB 3.94Å; V404-M456 HydrophobicContact CG1-CE 4.04Å; V404-M456 HydrophobicContact CG1-SD 4.15Å; V404-M456 HydrophobicContact CG2-CB 4.1Å; I406-M456 HydrophobicContact CD1-CE 4.46Å; I406-M456 HydrophobicContact CD1-SD 3.78Å; I406-M456 HydrophobicContact CG1-CE 3.83Å; I406-M456 HydrophobicContact CG1-SD 3.52Å; I406-M456 VanDerWaalsContact CG1-SD 3.52Å; F426-M456 HydrophobicContact CD1-SD 3.81Å; R427-M456 WeakPolarHBondContact O-CG 3.35Å; G429-M456 CarbonylContact O-C 3.6Å; G429-M456 WeakPolarHBondContact O-CA 3.48Å; L437-M456 HydrophobicContact CD1-CE 3.86Å; L437-M456 HydrophobicContact CD1-CG 4.38Å; I449-M456 HydrophobicContact CG2-CE 4.28Å; M456-V458 HydrophobicContact CG-CG2 4.4Å; M456-V458 HydrophobicContact SD-CG2 4.2Å
457	R	96	Very high	92.6	Very high	18 Å²	18	47.8 Å²	47.8	7%	0.068	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.7	170.4	-178.9	-173.2	-174.5	-155.3	12.8	108.5	V393 W394 Y395 F426 R427 G429 D432	V393-R457 HydrophobicContact CG1-CG 3.99Å; V393-R457 VanDerWaalsContact CG1-NE 3.34Å; W394-R457 WeakPolarHBondContact O-CA 3.25Å; Y395-R457 HydrophobicContact CD1-CB 4.48Å; Y395-R457 HydrophobicContact CD1-CG 4.13Å; Y395-R457 HydrophobicContact CE1-CG 4Å; F426-R457 WeakPolarHBondContact CA-O 3.3Å; R427-R457 HydrophobicContact CB-CB 4.27Å; R427-R457 PolarHBondContact N-O 2.89Å; R427-R457 PolarHBondContact O-N 2.91Å; G429-R457 PolarHBondContact O-N 2.85Å; D432-R457 IonicContact OD1-CZ 2.76Å; D432-R457 IonicContact OD1-NH1 2.84Å; D432-R457 PolarHBondContact OD1-NH1 3Å; D432-R457 IonicContact OD1-NH2 3.39Å; D432-R457 PolarHBondContact OD1-NH2 2.97Å
458	V	95.8	Very high	92.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.8	173.2	-168.5	0	0	0	0	108.7	V393 W394 I396 V424 E425 F426 M456 F473	V393-V458 CarbonylContact C-O 3.57Å; V393-V458 WeakPolarHBondContact CA-O 3.49Å; W394-V458 HydrophobicContact CB-CB 4.49Å; W394-V458 HydrophobicContact CE3-CB 4.4Å; W394-V458 HydrophobicContact CE3-CG1 4.48Å; W394-V458 PolarHBondContact N-O 3.43Å; W394-V458 PolarHBondContact O-N 3.29Å; I396-V458 HydrophobicContact CD1-CG2 3.82Å; V424-V458 HydrophobicContact CG1-CG1 3.41Å; V424-V458 VanDerWaalsContact CG1-CG1 3.41Å; E425-V458 CarbonylContact O-C 3.44Å; E425-V458 WeakPolarHBondContact O-CA 3.41Å; F426-V458 HydrophobicContact CD1-CB 4.31Å; F426-V458 HydrophobicContact CD1-CG1 3.85Å; F426-V458 HydrophobicContact CD1-CG2 3.64Å; F426-V458 HydrophobicContact CE1-CB 4.34Å; F426-V458 HydrophobicContact CE1-CG1 3.57Å; F426-V458 HydrophobicContact CE1-CG2 3.79Å; F426-V458 HydrophobicContact CG-CG1 4.45Å; F426-V458 HydrophobicContact CZ-CG1 3.98Å; M456-V458 HydrophobicContact CG-CG2 4.4Å; M456-V458 HydrophobicContact SD-CG2 4.2Å; V458-F473 HydrophobicContact CB-CZ 4.44Å; V458-F473 HydrophobicContact CG1-CE1 4.25Å; V458-F473 HydrophobicContact CG1-CZ 3.9Å; V458-F473 HydrophobicContact CG2-CZ 4.27Å
459	R	95.7	Very high	92.4	Very high	72 Å²	72	41.1 Å²	41.1	27%	0.272	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.8	175.1	179.5	172.6	-170.1	-147.7	6.2	110	D391 C392 V393 Y423 V424 E425	D391-R459 VanDerWaalsContact CG-NH2 3.29Å; D391-R459 IonicContact OD1-CZ 3.74Å; D391-R459 IonicContact OD1-NE 3.42Å; D391-R459 PolarHBondContact OD1-NE 3.08Å; D391-R459 IonicContact OD1-NH2 2.61Å; D391-R459 PolarHBondContact OD1-NH2 2.94Å; D391-R459 IonicContact OD2-CZ 3.77Å; D391-R459 IonicContact OD2-NE 3.9Å; D391-R459 IonicContact OD2-NH2 2.96Å; D391-R459 PolarHBondContact OD2-NH2 3.11Å; C392-R459 CarbonylContact O-C 3.57Å; C392-R459 WeakPolarHBondContact O-CA 3.4Å; V393-R459 HydrophobicContact CG2-CB 4.31Å; V393-R459 HydrophobicContact CG2-CG 3.97Å; Y423-R459 PolarHBondContact OH-NH1 3.41Å; V424-R459 CarbonylContact C-O 3.54Å; V424-R459 WeakPolarHBondContact CA-O 3.45Å; E425-R459 PolarHBondContact N-O 3.02Å; E425-R459 PolarHBondContact O-N 3.04Å
460	F	95.8	Very high	92.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	125.4	164	170.2	-124.5	0	0	0	108.9	P380 Y386 D391 C392 W394 L413 Y423 V424 F471	P380-F460 HydrophobicContact CG-CD1 4.37Å; P380-F460 HydrophobicContact CG-CE1 4.35Å; Y386-F460 HydrophobicContact CD1-CZ 4.27Å; Y386-F460 AromaticContact CD2-CZ 3.77Å; Y386-F460 HydrophobicContact CD2-CZ 3.77Å; Y386-F460 HydrophobicContact CE2-CZ 4.27Å; Y386-F460 HydrophobicContact CG-CE1 4.38Å; Y386-F460 AromaticContact CG-CZ 3.77Å; Y386-F460 HydrophobicContact CG-CZ 3.77Å; D391-F460 WeakPolarHBondContact CA-O 3.31Å; C392-F460 HydrophobicContact CB-CB 4.35Å; C392-F460 PolarHBondContact N-O 3.35Å; C392-F460 PolarHBondContact O-N 3.14Å; W394-F460 HydrophobicContact CH2-CB 4.2Å; W394-F460 HydrophobicContact CZ3-CB 3.78Å; L413-F460 HydrophobicContact CD1-CE2 4.36Å; L413-F460 HydrophobicContact CD2-CE2 3.85Å; L413-F460 HydrophobicContact CD2-CZ 4.47Å; Y423-F460 WeakPolarHBondContact O-CA 3.37Å; Y423-F460 WeakPolarHBondContact O-CD2 3.11Å; V424-F460 HydrophobicContact CG2-CB 4.29Å; V424-F460 HydrophobicContact CG2-CD2 3.95Å; F460-F471 HydrophobicContact CB-CE1 3.95Å; F460-F471 HydrophobicContact CB-CZ 3.88Å; F460-F471 HydrophobicContact CD1-CE1 4.01Å; F460-F471 HydrophobicContact CD1-CZ 4.36Å; F460-F471 HydrophobicContact CD2-CD1 4.4Å; F460-F471 AromaticContact CD2-CE1 3.56Å; F460-F471 HydrophobicContact CD2-CE1 3.56Å; F460-F471 HydrophobicContact CD2-CZ 4.36Å; F460-F471 HydrophobicContact CE1-CE1 4.4Å; F460-F471 AromaticContact CE2-CE1 4Å; F460-F471 HydrophobicContact CE2-CE1 4Å; F460-F471 AromaticContact CG-CE1 3.56Å; F460-F471 HydrophobicContact CG-CE1 3.56Å; F460-F471 AromaticContact CG-CZ 3.96Å; F460-F471 HydrophobicContact CG-CZ 3.96Å; F460-F471 HydrophobicContact CZ-CE1 4.39Å
461	G	94.6	Very high	92.4	Very high	6 Å²	6	37.2 Å²	37.2	6%	0.062	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	138.6	168.2	0	0	0	0	0	110.1	S390 D422 Y423	S390-G461 CarbonylContact O-C 3.56Å; S390-G461 WeakPolarHBondContact O-CA 3.45Å; D422-G461 WeakPolarHBondContact CA-O 3.34Å; Y423-G461 PolarHBondContact N-O 2.52Å; Y423-G461 PolarHBondContact O-N 3.4Å
462	S	94.3	Very high	92.3	Very high	15 Å²	15	37.5 Å²	37.5	11%	0.105	21%	0.209	C	C	.	.			trans	-128	151.8	166	62.5	0	0	0	0	114.1	T387 N389 S390 D422	T387-S462 PolarHBondContact O-OG 3.17Å; N389-S462 WeakPolarHBondContact CA-O 3.49Å; N389-S462 PolarHBondContact N-OG 3.05Å; S390-S462 VanDerWaalsContact CB-OG 3.27Å; S390-S462 WeakPolarHBondContact CB-OG 3.4Å; S390-S462 PolarHBondContact N-OG 2.88Å; S390-S462 PolarHBondContact O-N 2.92Å; S390-S462 PolarHBondContact OG-OG 3.15Å; D422-S462 WeakPolarHBondContact OD1-CA 3.09Å; D422-S462 WeakPolarHBondContact OD1-CB 3.28Å
463	D	93.1	Very high	92.4	Very high	50 Å²	50	31.6 Å²	31.6	27%	0.267	18%	0.177	S	C	.	.			trans	-77.9	179.6	179.4	171.3	-77.6	0	0	0	111.5	P388 N389 D422 S465	P388-D463 CarbonylContact C-O 3.59Å; P388-D463 WeakPolarHBondContact CA-O 3.46Å; P388-D463 WeakPolarHBondContact CB-O 2.99Å; N389-D463 PolarHBondContact N-O 3.45Å; D422-D463 PolarHBondContact OD1-N 3.19Å; D463-S465 PolarHBondContact O-N 2.71Å; D463-S465 WeakPolarHBondContact OD1-CB 3.01Å; D463-S465 PolarHBondContact OD1-N 2.76Å; D463-S465 PolarHBondContact OD1-OG 3.3Å
464	A	91.5	Very high	92.4	Very high	68 Å²	68	32.3 Å²	32.3	56%	0.562	18%	0.178	S	C	*	.	S	Bend	trans	-79.6	8.2	176.5	0	0	0	0	0	114.6
465	S	88.5	Confident	92.4	Very high	53 Å²	53	31 Å²	31	37%	0.371	17%	0.17	S	C	.	.	S	Bend	trans	-152.8	177.2	-172	64.4	0	0	0	0	114	D463 E467	D463-S465 PolarHBondContact O-N 2.71Å; D463-S465 WeakPolarHBondContact OD1-CB 3.01Å; D463-S465 PolarHBondContact OD1-N 2.76Å; D463-S465 PolarHBondContact OD1-OG 3.3Å; S465-E467 PolarHBondContact O-N 2.94Å
466	V	84	Confident	92.3	Very high	56 Å²	56	28.6 Å²	28.6	34%	0.339	16%	0.161	S	C	.	.			trans	55.5	51.1	167.3	-165.8	0	0	0	0	115.3	Y386 E414	Y386-V466 PolarHBondContact OH-O 2.94Å; E414-V466 HydrophobicContact CB-CG1 4.29Å; E414-V466 HydrophobicContact CG-CB 4.38Å; E414-V466 HydrophobicContact CG-CG1 4.01Å; E414-V466 WeakPolarHBondContact OE1-CB 3.32Å; E414-V466 WeakPolarHBondContact OE1-CG1 3.38Å; E414-V466 WeakPolarHBondContact OE1-CG2 3.2Å
467	E	88.4	Confident	92.1	Very high	90 Å²	90	31.8 Å²	31.8	42%	0.421	18%	0.175	S	C	.	.			trans	-59.9	145.4	174.8	-53.4	89.6	156.1	0	0	112.9	D385 Y386 P388 S465	D385-E467 HydrophobicContact CB-CB 4.21Å; Y386-E467 WeakPolarHBondContact O-CG 3.4Å; P388-E467 HydrophobicContact CB-CG 4.44Å; P388-E467 HydrophobicContact CG-CG 4.5Å; P388-E467 WeakPolarHBondContact CG-OE1 3.36Å; S465-E467 PolarHBondContact O-N 2.94Å
468	K	90.1	Very high	91.8	Very high	55 Å²	55	31 Å²	31	24%	0.239	17%	0.172	C	C	.	.			trans	-137.9	174.3	175.6	-52.2	-68.8	169.1	173.2	0	110.6	D385 Y386 Q412 Y443 G470	D385-K468 WeakPolarHBondContact CA-O 3.44Å; D385-K468 WeakPolarHBondContact CB-O 3.48Å; Y386-K468 WeakPolarHBondContact CD1-O 3.49Å; Y386-K468 HydrophobicContact CE1-CB 3.75Å; Y386-K468 WeakPolarHBondContact CE1-O 3.44Å; Y386-K468 PolarHBondContact N-O 3.48Å; Y386-K468 VanDerWaalsContact N-O 3.1Å; Q412-K468 HydrophobicContact CB-CB 4.44Å; Q412-K468 VanDerWaalsContact O-CB 3.3Å; Q412-K468 WeakPolarHBondContact O-CB 3.29Å; Y443-K468 HydrophobicContact CE1-CD 4.19Å; Y443-K468 WeakPolarHBondContact OH-CE 3.39Å; Y443-K468 PolarHBondContact OH-NZ 3.49Å; Y443-K468 VanDerWaalsContact OH-NZ 3.12Å; K468-G470 PolarHBondContact O-N 2.73Å
469	A	87.3	Confident	91.4	Very high	18 Å²	18	34.6 Å²	34.6	15%	0.149	19%	0.188	C	C	.	.			trans	-62.1	-16	-178.2	0	0	0	0	0	114.7	N379 D385 M410	N379-A469 PolarHBondContact OD1-O 2.77Å; D385-A469 WeakPolarHBondContact OD1-CA 3.37Å; D385-A469 PolarHBondContact OD1-N 2.03Å; D385-A469 VanDerWaalsContact OD1-N 3.1Å; M410-A469 HydrophobicContact CE-CB 3.55Å
470	G	90.9	Very high	90.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.1	-141.4	167.3	0	0	0	0	0	114.6	N379 F411 Q412 K468	N379-G470 WeakPolarHBondContact OD1-CA 3.41Å; F411-G470 CarbonylContact C-O 3.52Å; F411-G470 WeakPolarHBondContact CA-O 3.34Å; Q412-G470 PolarHBondContact N-O 3.44Å; Q412-G470 VanDerWaalsContact O-CA 3.27Å; Q412-G470 WeakPolarHBondContact O-CA 3.14Å; Q412-G470 PolarHBondContact O-N 3.46Å; K468-G470 PolarHBondContact O-N 2.73Å
471	F	92.6	Very high	90.3	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	150.4	-172.8	63.5	-92.8	0	0	0	112.7	I377 E378 N379 W394 M410 F411 L413 V424 F460 F473	I377-F471 HydrophobicContact CG2-CE2 4.26Å; E378-F471 WeakPolarHBondContact CA-O 3.26Å; N379-F471 HydrophobicContact CB-CD1 3.9Å; N379-F471 HydrophobicContact CB-CE1 3.68Å; N379-F471 HydrophobicContact CB-CE2 4.49Å; N379-F471 HydrophobicContact CB-CG 4.39Å; N379-F471 HydrophobicContact CB-CZ 4.01Å; N379-F471 PolarHBondContact N-O 3.47Å; N379-F471 PolarHBondContact OD1-N 3.49Å; N379-F471 PolarHBondContact OD1-O 3.2Å; N379-F471 VanDerWaalsContact OD1-O 3.04Å; W394-F471 HydrophobicContact CH2-CZ 4.04Å; W394-F471 HydrophobicContact CZ3-CZ 4.24Å; M410-F471 VanDerWaalsContact O-CA 3.29Å; M410-F471 WeakPolarHBondContact O-CA 3.47Å; F411-F471 HydrophobicContact CD2-CB 3.84Å; F411-F471 HydrophobicContact CE2-CB 4.39Å; L413-F471 HydrophobicContact CD2-CD1 4.28Å; V424-F471 HydrophobicContact CG2-CD1 3.74Å; V424-F471 HydrophobicContact CG2-CE1 3.64Å; V424-F471 HydrophobicContact CG2-CG 4.26Å; V424-F471 HydrophobicContact CG2-CZ 4.05Å; F460-F471 HydrophobicContact CB-CE1 3.95Å; F460-F471 HydrophobicContact CB-CZ 3.88Å; F460-F471 HydrophobicContact CD1-CE1 4.01Å; F460-F471 HydrophobicContact CD1-CZ 4.36Å; F460-F471 HydrophobicContact CD2-CD1 4.4Å; F460-F471 AromaticContact CD2-CE1 3.56Å; F460-F471 HydrophobicContact CD2-CE1 3.56Å; F460-F471 HydrophobicContact CD2-CZ 4.36Å; F460-F471 HydrophobicContact CE1-CE1 4.4Å; F460-F471 AromaticContact CE2-CE1 4Å; F460-F471 HydrophobicContact CE2-CE1 4Å; F460-F471 AromaticContact CG-CE1 3.56Å; F460-F471 HydrophobicContact CG-CE1 3.56Å; F460-F471 AromaticContact CG-CZ 3.96Å; F460-F471 HydrophobicContact CG-CZ 3.96Å; F460-F471 HydrophobicContact CZ-CE1 4.39Å; F471-F473 AromaticContact CD2-CD1 3.67Å; F471-F473 HydrophobicContact CD2-CD1 3.67Å; F471-F473 AromaticContact CD2-CE1 3.79Å; F471-F473 HydrophobicContact CD2-CE1 3.79Å; F471-F473 HydrophobicContact CE2-CD1 4.05Å; F471-F473 AromaticContact CE2-CE1 3.66Å; F471-F473 HydrophobicContact CE2-CE1 3.66Å
472	S	92	Very high	89.9	Confident	7 Å²	7	36.2 Å²	36.2	5%	0.049	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	120.6	168.2	-169.9	0	0	0	0	107.6	I377 S409 M410	I377-S472 WeakPolarHBondContact O-CA 3.31Å; S409-S472 PolarHBondContact N-O 2.92Å; M410-S472 PolarHBondContact N-O 3.44Å; M410-S472 PolarHBondContact O-N 2.97Å
473	F	92.3	Very high	89.4	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	145.1	175.6	66.5	-103.4	0	0	0	111.4	V376 I377 I406 I407 F408 F426 V458 F471	V376-F473 WeakPolarHBondContact CA-O 3.21Å; V376-F473 WeakPolarHBondContact CG1-O 3.38Å; I377-F473 HydrophobicContact CB-CD2 4.38Å; I377-F473 HydrophobicContact CB-CE1 4.16Å; I377-F473 HydrophobicContact CB-CE2 3.8Å; I377-F473 HydrophobicContact CB-CZ 3.66Å; I377-F473 HydrophobicContact CD1-CE2 3.83Å; I377-F473 HydrophobicContact CD1-CZ 3.85Å; I377-F473 HydrophobicContact CG1-CE2 4.16Å; I377-F473 HydrophobicContact CG1-CZ 4.27Å; I377-F473 HydrophobicContact CG2-CE1 4.19Å; I377-F473 HydrophobicContact CG2-CZ 3.92Å; I377-F473 PolarHBondContact N-O 3.39Å; I377-F473 PolarHBondContact O-N 3.03Å; I406-F473 HydrophobicContact CD1-CD2 4.06Å; I406-F473 HydrophobicContact CD1-CE2 3.89Å; I406-F473 HydrophobicContact CG2-CB 3.96Å; I406-F473 HydrophobicContact CG2-CD2 3.62Å; I406-F473 HydrophobicContact CG2-CE2 4.26Å; I406-F473 HydrophobicContact CG2-CG 3.85Å; I407-F473 WeakPolarHBondContact O-CA 3.31Å; F408-F473 HydrophobicContact CD1-CB 3.92Å; F408-F473 HydrophobicContact CE1-CB 4.34Å; F408-F473 HydrophobicContact CE1-CD1 4.26Å; F408-F473 HydrophobicContact CG-CB 4.32Å; F426-F473 HydrophobicContact CE1-CE1 4.28Å; F426-F473 HydrophobicContact CE1-CE2 4.42Å; F426-F473 HydrophobicContact CE1-CZ 4.12Å; F426-F473 HydrophobicContact CZ-CD1 4.41Å; F426-F473 HydrophobicContact CZ-CE1 4.15Å; F426-F473 HydrophobicContact CZ-CZ 4.45Å; V458-F473 HydrophobicContact CB-CZ 4.44Å; V458-F473 HydrophobicContact CG1-CE1 4.25Å; V458-F473 HydrophobicContact CG1-CZ 3.9Å; V458-F473 HydrophobicContact CG2-CZ 4.27Å; F471-F473 AromaticContact CD2-CD1 3.67Å; F471-F473 HydrophobicContact CD2-CD1 3.67Å; F471-F473 AromaticContact CD2-CE1 3.79Å; F471-F473 HydrophobicContact CD2-CE1 3.79Å; F471-F473 HydrophobicContact CE2-CD1 4.05Å; F471-F473 AromaticContact CE2-CE1 3.66Å; F471-F473 HydrophobicContact CE2-CE1 3.66Å
474	N	91.8	Very high	88.8	Confident	54 Å²	54	43 Å²	43	29%	0.289	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.4	170.3	-51.4	-63	0	0	0	108	G375 V376 I406 I407 S409	G375-N474 CarbonylContact O-C 3.58Å; G375-N474 VanDerWaalsContact O-CA 3.31Å; G375-N474 WeakPolarHBondContact O-CA 3.4Å; V376-N474 VanDerWaalsContact CG2-OD1 3.27Å; V376-N474 WeakPolarHBondContact CG2-OD1 3.45Å; I406-N474 WeakPolarHBondContact CA-O 3.06Å; I407-N474 PolarHBondContact N-O 3.27Å; I407-N474 PolarHBondContact O-N 2.67Å; S409-N474 PolarHBondContact OG-ND2 2.86Å
475	F	94.1	Very high	87.9	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	141.2	160.5	72.8	-93.2	0	0	0	108.9	I370 A372 N374 G375 I377 I396 A405 I406	I370-F475 HydrophobicContact CG2-CE1 3.98Å; I370-F475 HydrophobicContact CG2-CE2 4.45Å; I370-F475 HydrophobicContact CG2-CZ 3.52Å; A372-F475 HydrophobicContact CB-CE2 4.28Å; A372-F475 HydrophobicContact CB-CZ 4.2Å; N374-F475 VanDerWaalsContact C-CZ 3.49Å; N374-F475 CarbonylContact C-O 3.6Å; N374-F475 WeakPolarHBondContact CA-O 3.46Å; N374-F475 WeakPolarHBondContact CB-O 3.37Å; N374-F475 WeakPolarHBondContact O-CZ 3.4Å; G375-F475 VanDerWaalsContact CA-CE1 3.41Å; G375-F475 PolarHBondContact N-O 2.65Å; G375-F475 PolarHBondContact O-N 2.92Å; I377-F475 HydrophobicContact CD1-CD1 4.24Å; I377-F475 HydrophobicContact CG1-CD1 4.28Å; I377-F475 HydrophobicContact CG1-CE1 4.42Å; I396-F475 HydrophobicContact CD1-CB 4.06Å; I396-F475 HydrophobicContact CD1-CD1 4.17Å; I396-F475 HydrophobicContact CD1-CG 4.09Å; I396-F475 HydrophobicContact CG2-CD2 3.66Å; I396-F475 HydrophobicContact CG2-CE2 3.92Å; I396-F475 HydrophobicContact CG2-CG 4.06Å; A405-F475 CarbonylContact O-C 3.11Å; A405-F475 VanDerWaalsContact O-CA 3.28Å; A405-F475 WeakPolarHBondContact O-CA 3.2Å; I406-F475 HydrophobicContact CD1-CB 3.6Å
476	I	92.8	Very high	87.3	Confident	34 Å²	34	51.2 Å²	51.2	17%	0.174	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	149.1	175.4	62.7	175.7	0	0	0	109.5	N374 A405 I407 L497	N374-I476 HydrophobicContact CB-CG2 4.14Å; A405-I476 HydrophobicContact CB-CG1 4Å; A405-I476 PolarHBondContact N-O 3.26Å; A405-I476 PolarHBondContact O-N 2.93Å; I407-I476 HydrophobicContact CD1-CD1 3.91Å; I476-L497 HydrophobicContact CD1-CB 4.38Å
477	K	92.4	Very high	87	Confident	67 Å²	67	50.3 Å²	50.3	29%	0.291	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	134.3	157.9	76.5	-179.8	-176.9	180	0	108.4	D373 V398 Y402 Q403	D373-K477 HydrophobicContact CB-CD 3.9Å; D373-K477 HydrophobicContact CB-CG 4.48Å; D373-K477 WeakPolarHBondContact O-CB 3.4Å; D373-K477 WeakPolarHBondContact O-CG 3.26Å; D373-K477 PolarHBondContact O-N 2.87Å; D373-K477 VanDerWaalsContact OD2-CE 3.31Å; D373-K477 WeakPolarHBondContact OD2-CE 3.49Å; D373-K477 IonicContact OD2-NZ 2.87Å; D373-K477 PolarHBondContact OD2-NZ 3.45Å; V398-K477 HydrophobicContact CB-CB 3.93Å; V398-K477 HydrophobicContact CG1-CB 3.85Å; V398-K477 HydrophobicContact CG2-CB 4.47Å; Y402-K477 HydrophobicContact CD1-CB 4.01Å; Y402-K477 HydrophobicContact CD1-CD 3.72Å; Y402-K477 HydrophobicContact CD1-CG 3.88Å; Y402-K477 HydrophobicContact CE1-CD 3.84Å; Y402-K477 HydrophobicContact CE1-CG 4.3Å; Y402-K477 HydrophobicContact CG-CB 4.22Å; Y402-K477 HydrophobicContact CG-CD 4.14Å; Y402-K477 HydrophobicContact CG-CG 4.46Å; Q403-K477 WeakPolarHBondContact O-CA 3.35Å
478	E	89.8	Confident	86.6	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.4	-174.4	165.8	64	-178.4	0	0	107.8	Q403 A405 K450 N495 L497 G498	Q403-E478 HydrophobicContact CB-CB 4.29Å; Q403-E478 HydrophobicContact CB-CG 4.38Å; Q403-E478 PolarHBondContact N-O 3.29Å; Q403-E478 PolarHBondContact O-N 3.26Å; A405-E478 HydrophobicContact CB-CB 3.68Å; A405-E478 HydrophobicContact CB-CG 4.08Å; K450-E478 HydrophobicContact CD-CG 3.81Å; K450-E478 HydrophobicContact CG-CG 4.31Å; K450-E478 VanDerWaalsContact NZ-CG 3.34Å; K450-E478 IonicContact NZ-OE1 2.64Å; K450-E478 PolarHBondContact NZ-OE1 3.16Å; E478-N495 PolarHBondContact OE1-ND2 2.81Å; E478-L497 HydrophobicContact CG-CD2 4.22Å; E478-L497 WeakPolarHBondContact OE2-CA 3.25Å; E478-G498 PolarHBondContact OE2-N 2.82Å
479	F	87.3	Confident	86.3	Confident	76 Å²	76	46.6 Å²	46.6	33%	0.333	26%	0.258	S	S	.	.			trans	-139.3	144.8	-179.7	179.7	-98	0	0	0	108.3	Y402 E481 T484 N495	Y402-F479 HydrophobicContact CD1-CB 3.87Å; Y402-F479 HydrophobicContact CE1-CB 3.93Å; Y402-F479 HydrophobicContact CE1-CD2 4.43Å; Y402-F479 HydrophobicContact CE1-CG 4.38Å; F479-E481 HydrophobicContact CD1-CG 4.05Å; F479-E481 HydrophobicContact CE1-CG 4.44Å; F479-E481 PolarHBondContact O-N 3.47Å; F479-T484 HydrophobicContact CE1-CG2 3.57Å; F479-T484 HydrophobicContact CZ-CG2 3.68Å; F479-N495 PolarHBondContact O-OD1 3.43Å
480	D	83.6	Confident	86.1	Confident	32 Å²	32	52.5 Å²	52.5	17%	0.171	28%	0.276	C	S	.	.			trans	-92.9	88.1	-178.7	-168.6	-35.8	0	0	0	109.8	C482 K483 N495	D480-C482 PolarHBondContact O-N 3.28Å; D480-C482 WeakPolarHBondContact OD1-CB 3.46Å; D480-C482 PolarHBondContact OD1-N 3.46Å; D480-K483 HydrophobicContact CB-CB 4.33Å; D480-K483 HydrophobicContact CB-CD 4.02Å; D480-K483 HydrophobicContact CB-CG 4.02Å; D480-K483 WeakPolarHBondContact O-CB 3.47Å; D480-K483 PolarHBondContact O-N 3.16Å; D480-K483 VanDerWaalsContact O-N 3.1Å; D480-K483 PolarHBondContact OD1-N 2.63Å; D480-K483 IonicContact OD2-NZ 3.2Å; D480-K483 PolarHBondContact OD2-NZ 2.93Å; D480-N495 VanDerWaalsContact CA-OD1 3.27Å; D480-N495 WeakPolarHBondContact CA-OD1 3.19Å
481	E	85.7	Confident	85.8	Confident	46 Å²	46	55 Å²	55	22%	0.215	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-62.4	-27.1	-179	-69.1	92.3	-169.8	0	0	112.3	F479 K483 T484 N495 G499 Y500	F479-E481 HydrophobicContact CD1-CG 4.05Å; F479-E481 HydrophobicContact CE1-CG 4.44Å; F479-E481 PolarHBondContact O-N 3.47Å; E481-K483 VanDerWaalsContact C-N 3.25Å; E481-K483 PolarHBondContact O-N 3Å; E481-T484 WeakPolarHBondContact O-CB 3.45Å; E481-T484 PolarHBondContact O-N 3.12Å; E481-T484 PolarHBondContact O-OG1 3.01Å; E481-N495 PolarHBondContact N-OD1 2.04Å; E481-G499 WeakPolarHBondContact OE2-CA 3.36Å; E481-Y500 HydrophobicContact CB-CD1 3.39Å; E481-Y500 HydrophobicContact CB-CE1 3.93Å; E481-Y500 HydrophobicContact CB-CG 4.06Å; E481-Y500 HydrophobicContact CG-CD1 3.63Å; E481-Y500 HydrophobicContact CG-CE1 3.98Å; E481-Y500 WeakPolarHBondContact OE2-CD1 3.49Å; E481-Y500 PolarHBondContact OE2-N 2.78Å
482	C	85.5	Confident	85.5	Confident	34 Å²	34	59.9 Å²	59.9	23%	0.23	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-70.7	-18	178.1	-61	0	0	0	0	113.3	D480 T484 C493 V494 N495	D480-C482 PolarHBondContact O-N 3.28Å; D480-C482 WeakPolarHBondContact OD1-CB 3.46Å; D480-C482 PolarHBondContact OD1-N 3.46Å; C482-T484 VanDerWaalsContact C-N 3.26Å; C482-C493 WeakPolarHBondContact CA-SG 3.28Å; C482-C493 HydrophobicContact CB-CB 3.69Å; C482-C493 WeakPolarHBondContact CB-SG 3.32Å; C482-C493 WeakPolarHBondContact SG-CB 3.35Å; C482-C493 CovalentContact SG-SG 2.04Å; C482-C493 PolarHBondContact SG-SG 2.76Å; C482-V494 VanDerWaalsContact SG-C 3.52Å; C482-V494 PolarHBondContact SG-N 2.84Å; C482-N495 PolarHBondContact SG-N 2.99Å; C482-N495 VanDerWaalsContact SG-N 3.36Å
483	K	83.5	Confident	85.3	Confident	159 Å²	159	60.7 Å²	60.7	69%	0.691	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-73.1	-15	165.2	-72.9	-176.3	-179.2	88.9	0	113.3	D480 E481	D480-K483 HydrophobicContact CB-CB 4.33Å; D480-K483 HydrophobicContact CB-CD 4.02Å; D480-K483 HydrophobicContact CB-CG 4.02Å; D480-K483 WeakPolarHBondContact O-CB 3.47Å; D480-K483 PolarHBondContact O-N 3.16Å; D480-K483 VanDerWaalsContact O-N 3.1Å; D480-K483 PolarHBondContact OD1-N 2.63Å; D480-K483 IonicContact OD2-NZ 3.2Å; D480-K483 PolarHBondContact OD2-NZ 2.93Å; E481-K483 VanDerWaalsContact C-N 3.25Å; E481-K483 PolarHBondContact O-N 3Å
484	T	80.8	Confident	85	Confident	48 Å²	48	62 Å²	62	29%	0.294	32%	0.323	S	S	.	.	S	Bend	trans	-91.8	142.3	176.2	78.8	0	0	0	0	111	F479 E481 C482 N486 H487	F479-T484 HydrophobicContact CE1-CG2 3.57Å; F479-T484 HydrophobicContact CZ-CG2 3.68Å; E481-T484 WeakPolarHBondContact O-CB 3.45Å; E481-T484 PolarHBondContact O-N 3.12Å; E481-T484 PolarHBondContact O-OG1 3.01Å; C482-T484 VanDerWaalsContact C-N 3.26Å; T484-N486 PolarHBondContact O-N 2.89Å; T484-H487 PolarHBondContact O-CD2 2.94Å
485	T	72.6	Confident	84.5	Confident	148 Å²	148	61.3 Å²	61.3	91%	0.908	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	7.5	178	52.1	0	0	0	0	114.4
486	N	75.4	Confident	83.9	Confident	146 Å²	146	63.4 Å²	63.4	78%	0.781	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.8	7.4	-166.8	-130.5	20	0	0	0	113.9	T484 G488	T484-N486 PolarHBondContact O-N 2.89Å; N486-G488 PolarHBondContact O-N 2.9Å
487	H	77.8	Confident	83.1	Confident	38 Å²	38	64.5 Å²	64.5	18%	0.176	34%	0.338	C	S	.	.	S	Bend	trans	-62.1	-27.9	177.1	63.8	77.6	0	0	0	113	T484 C489 C493 Y500 K515	T484-H487 PolarHBondContact O-CD2 2.94Å; H487-C489 WeakPolarHBondContact ND1-CB 3.29Å; H487-C489 PolarHBondContact ND1-N 2.84Å; H487-C489 PolarHBondContact ND1-SG 3.47Å; H487-C489 VanDerWaalsContact ND1-SG 3.39Å; H487-C489 PolarHBondContact O-N 3.2Å; H487-C493 VanDerWaalsContact CG-SG 3.54Å; H487-Y500 HydrophobicContact CB-CD2 4.13Å; H487-Y500 HydrophobicContact CB-CE2 3.88Å; H487-Y500 WeakPolarHBondContact O-CE2 3.46Å; H487-Y500 PolarHBondContact O-OH 3.03Å; H487-Y500 VanDerWaalsContact O-OH 3.13Å; H487-K515 PolarHBondContact O-NZ 2.67Å
488	G	79.6	Confident	82.2	Confident	52 Å²	52	64 Å²	64	54%	0.536	35%	0.351	S	S	.	.			trans	68	29	172.9	0	0	0	0	0	115.2	N486	N486-G488 PolarHBondContact O-N 2.9Å
489	C	84.8	Confident	81.9	Confident	15 Å²	15	64.6 Å²	64.6	10%	0.101	36%	0.358	C	S	.	.			trans	-80.7	141.8	167.9	-59.4	0	0	0	0	109.3	H487 K492 C493 C502	H487-C489 WeakPolarHBondContact ND1-CB 3.29Å; H487-C489 PolarHBondContact ND1-N 2.84Å; H487-C489 PolarHBondContact ND1-SG 3.47Å; H487-C489 VanDerWaalsContact ND1-SG 3.39Å; H487-C489 PolarHBondContact O-N 3.2Å; C489-K492 WeakPolarHBondContact CB-O 3.4Å; C489-C493 HydrophobicContact CB-CB 4.48Å; C489-C502 WeakPolarHBondContact CA-SG 3.37Å; C489-C502 HydrophobicContact CB-CB 3.54Å; C489-C502 WeakPolarHBondContact CB-SG 3.41Å; C489-C502 WeakPolarHBondContact SG-CA 3.34Å; C489-C502 WeakPolarHBondContact SG-CB 3.18Å; C489-C502 CovalentContact SG-SG 2.03Å; C489-C502 PolarHBondContact SG-SG 2.82Å
490	R	83.9	Confident	81.8	Confident	141 Å²	141	64.5 Å²	64.5	53%	0.532	36%	0.356	S	S	.	.	S	Bend	trans	-69.4	-42.8	-178.6	-175.3	-175.5	155.3	157.9	5.7	113.3	K515 C517	R490-K515 WeakPolarHBondContact CB-O 3.31Å; R490-K515 PolarHBondContact N-O 3Å; R490-C517 PolarHBondContact NH1-O 3.04Å
491	H	83.7	Confident	82	Confident	54 Å²	54	69 Å²	69	25%	0.25	37%	0.37	C	S	.	.	S	Bend	trans	-115	-85	-177.6	-62.2	161.2	0	0	0	111	D505 Y508 C517	H491-D505 IonicContact CG-OD2 3.56Å; H491-D505 IonicContact ND1-OD2 3.95Å; H491-Y508 AromaticContact CE1-CD1 3.79Å; H491-Y508 AromaticContact CE1-CD2 3.71Å; H491-Y508 AromaticContact CE1-CE2 3.95Å; H491-Y508 AromaticContact CE1-CG 3.65Å; H491-C517 WeakPolarHBondContact ND1-CB 3.42Å; H491-C517 PolarHBondContact ND1-SG 2.69Å
492	K	85.5	Confident	82	Confident	101 Å²	101	67.1 Å²	67.1	44%	0.439	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	141.1	-176.6	-175	-176.4	174.2	-154.2	0	111.1	C489 V494 C502 E503	C489-K492 WeakPolarHBondContact CB-O 3.4Å; K492-V494 HydrophobicContact CD-CG2 4.06Å; K492-V494 VanDerWaalsContact CE-CG2 3.45Å; K492-V494 HydrophobicContact CG-CG2 4.13Å; K492-C502 WeakPolarHBondContact O-CA 3.23Å; K492-E503 HydrophobicContact CB-CB 4.07Å; K492-E503 WeakPolarHBondContact CB-O 3.33Å; K492-E503 HydrophobicContact CD-CB 4.04Å; K492-E503 WeakPolarHBondContact CE-OE2 3.22Å; K492-E503 HydrophobicContact CG-CB 4.31Å; K492-E503 PolarHBondContact N-O 2.86Å; K492-E503 IonicContact NZ-OE2 2.73Å; K492-E503 PolarHBondContact NZ-OE2 3.18Å; K492-E503 PolarHBondContact O-N 3.15Å
493	C	88.6	Confident	81.8	Confident	25 Å²	25	67.9 Å²	67.9	17%	0.169	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134.8	165.6	-171	0	0	0	0	108.4	C482 H487 C489	C482-C493 WeakPolarHBondContact CA-SG 3.28Å; C482-C493 HydrophobicContact CB-CB 3.69Å; C482-C493 WeakPolarHBondContact CB-SG 3.32Å; C482-C493 WeakPolarHBondContact SG-CB 3.35Å; C482-C493 CovalentContact SG-SG 2.04Å; C482-C493 PolarHBondContact SG-SG 2.76Å; H487-C493 VanDerWaalsContact CG-SG 3.54Å; C489-C493 HydrophobicContact CB-CB 4.48Å
494	V	85.3	Confident	81.6	Confident	28 Å²	28	61.9 Å²	61.9	17%	0.17	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	118.6	171.6	174.3	0	0	0	0	109.5	C482 K492 R501 E503	C482-V494 VanDerWaalsContact SG-C 3.52Å; C482-V494 PolarHBondContact SG-N 2.84Å; K492-V494 HydrophobicContact CD-CG2 4.06Å; K492-V494 VanDerWaalsContact CE-CG2 3.45Å; K492-V494 HydrophobicContact CG-CG2 4.13Å; V494-R501 HydrophobicContact CB-CG 4.09Å; V494-R501 PolarHBondContact N-O 3.17Å; V494-R501 PolarHBondContact O-N 3.05Å; V494-E503 HydrophobicContact CG2-CB 4.4Å; V494-E503 HydrophobicContact CG2-CG 4.04Å; V494-E503 VanDerWaalsContact CG2-OE2 3.32Å; V494-E503 WeakPolarHBondContact CG2-OE2 2.96Å
495	N	82.7	Confident	81.5	Confident	39 Å²	39	63.3 Å²	63.3	21%	0.209	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	140.1	177.6	-158.2	77.9	0	0	0	110.4	E478 F479 D480 E481 C482	E478-N495 PolarHBondContact OE1-ND2 2.81Å; F479-N495 PolarHBondContact O-OD1 3.43Å; D480-N495 VanDerWaalsContact CA-OD1 3.27Å; D480-N495 WeakPolarHBondContact CA-OD1 3.19Å; E481-N495 PolarHBondContact N-OD1 2.04Å; C482-N495 PolarHBondContact SG-N 2.99Å; C482-N495 VanDerWaalsContact SG-N 3.36Å
496	T	81.3	Confident	81.2	Confident	47 Å²	47	58 Å²	58	29%	0.288	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	170.9	173.9	48.8	0	0	0	0	108.3	G498 G499 R501	T496-G498 PolarHBondContact O-N 2.8Å; T496-G499 CarbonylContact C-O 3.58Å; T496-G499 VanDerWaalsContact C-O 3.22Å; T496-G499 VanDerWaalsContact CA-O 3.28Å; T496-G499 WeakPolarHBondContact CA-O 3.43Å; T496-G499 WeakPolarHBondContact CB-O 3.24Å; T496-G499 PolarHBondContact N-O 3.17Å; T496-G499 PolarHBondContact OG1-O 2.85Å; T496-R501 HydrophobicContact CG2-CG 4.32Å
497	L	76	Confident	80.8	Confident	58 Å²	58	51.8 Å²	51.8	30%	0.304	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	117.9	179.8	-61.9	-179.3	0	0	0	109.9	A405 I407 K450 I476 E478	A405-L497 HydrophobicContact CB-CD1 4.38Å; A405-L497 HydrophobicContact CB-CD2 3.9Å; I407-L497 HydrophobicContact CD1-CB 4.12Å; I407-L497 HydrophobicContact CG1-CD1 4.29Å; K450-L497 HydrophobicContact CD-CD2 4Å; I476-L497 HydrophobicContact CD1-CB 4.38Å; E478-L497 HydrophobicContact CG-CD2 4.22Å; E478-L497 WeakPolarHBondContact OE2-CA 3.25Å
498	G	73.8	Confident	80.6	Confident	55 Å²	55	53.9 Å²	53.9	57%	0.567	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	18.9	-174.9	0	0	0	0	0	115.5	E478 T496	E478-G498 PolarHBondContact OE2-N 2.82Å; T496-G498 PolarHBondContact O-N 2.8Å
499	G	83.2	Confident	80	Confident	15 Å²	15	54.1 Å²	54.1	16%	0.155	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.8	-166.5	174.6	0	0	0	0	0	113.1	E481 T496	E481-G499 WeakPolarHBondContact OE2-CA 3.36Å; T496-G499 CarbonylContact C-O 3.58Å; T496-G499 VanDerWaalsContact C-O 3.22Å; T496-G499 VanDerWaalsContact CA-O 3.28Å; T496-G499 WeakPolarHBondContact CA-O 3.43Å; T496-G499 WeakPolarHBondContact CB-O 3.24Å; T496-G499 PolarHBondContact N-O 3.17Å; T496-G499 PolarHBondContact OG1-O 2.85Å
500	Y	84.9	Confident	79.4	Confident	73 Å²	73	57.1 Å²	57.1	29%	0.286	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	156.2	178.3	63.7	-77.2	0	0	0	112.2	E481 H487 K515	E481-Y500 HydrophobicContact CB-CD1 3.39Å; E481-Y500 HydrophobicContact CB-CE1 3.93Å; E481-Y500 HydrophobicContact CB-CG 4.06Å; E481-Y500 HydrophobicContact CG-CD1 3.63Å; E481-Y500 HydrophobicContact CG-CE1 3.98Å; E481-Y500 WeakPolarHBondContact OE2-CD1 3.49Å; E481-Y500 PolarHBondContact OE2-N 2.78Å; H487-Y500 HydrophobicContact CB-CD2 4.13Å; H487-Y500 HydrophobicContact CB-CE2 3.88Å; H487-Y500 WeakPolarHBondContact O-CE2 3.46Å; H487-Y500 PolarHBondContact O-OH 3.03Å; H487-Y500 VanDerWaalsContact O-OH 3.13Å; Y500-K515 PolarHBondContact OH-NZ 3.38Å
501	R	86.9	Confident	79	Confident	126 Å²	126	53.2 Å²	53.2	48%	0.475	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	155.8	163.9	68.3	175.4	-175.2	-101.9	2.2	110.4	V494 T496 E503	V494-R501 HydrophobicContact CB-CG 4.09Å; V494-R501 PolarHBondContact N-O 3.17Å; V494-R501 PolarHBondContact O-N 3.05Å; T496-R501 HydrophobicContact CG2-CG 4.32Å; R501-E503 IonicContact CZ-OE1 2.69Å; R501-E503 IonicContact NE-OE1 2.71Å; R501-E503 PolarHBondContact NE-OE1 2.8Å; R501-E503 IonicContact NH2-OE1 2.8Å; R501-E503 PolarHBondContact NH2-OE1 2.76Å
502	C	86	Confident	78.6	Confident	7 Å²	7	56.1 Å²	56.1	5%	0.047	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	143.6	168.7	-56.1	0	0	0	0	110.2	C489 K492 L510 G514	C489-C502 WeakPolarHBondContact CA-SG 3.37Å; C489-C502 HydrophobicContact CB-CB 3.54Å; C489-C502 WeakPolarHBondContact CB-SG 3.41Å; C489-C502 WeakPolarHBondContact SG-CA 3.34Å; C489-C502 WeakPolarHBondContact SG-CB 3.18Å; C489-C502 CovalentContact SG-SG 2.03Å; C489-C502 PolarHBondContact SG-SG 2.82Å; K492-C502 WeakPolarHBondContact O-CA 3.23Å; C502-L510 HydrophobicContact CB-CD1 3.98Å; C502-G514 WeakPolarHBondContact CB-O 3.27Å; C502-G514 PolarHBondContact SG-O 3.28Å
503	E	81.9	Confident	78.3	Confident	51 Å²	51	55 Å²	55	24%	0.238	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	154.5	173.1	-76.4	179.7	-171.1	0	0	109.4	K492 V494 R501	K492-E503 HydrophobicContact CB-CB 4.07Å; K492-E503 WeakPolarHBondContact CB-O 3.33Å; K492-E503 HydrophobicContact CD-CB 4.04Å; K492-E503 WeakPolarHBondContact CE-OE2 3.22Å; K492-E503 HydrophobicContact CG-CB 4.31Å; K492-E503 PolarHBondContact N-O 2.86Å; K492-E503 IonicContact NZ-OE2 2.73Å; K492-E503 PolarHBondContact NZ-OE2 3.18Å; K492-E503 PolarHBondContact O-N 3.15Å; V494-E503 HydrophobicContact CG2-CB 4.4Å; V494-E503 HydrophobicContact CG2-CG 4.04Å; V494-E503 VanDerWaalsContact CG2-OE2 3.32Å; V494-E503 WeakPolarHBondContact CG2-OE2 2.96Å; R501-E503 IonicContact CZ-OE1 2.69Å; R501-E503 IonicContact NE-OE1 2.71Å; R501-E503 PolarHBondContact NE-OE1 2.8Å; R501-E503 IonicContact NH2-OE1 2.8Å; R501-E503 PolarHBondContact NH2-OE1 2.76Å
504	C	78.6	Confident	77.8	Confident	32 Å²	32	55.3 Å²	55.3	22%	0.216	31%	0.312	C	S	.	.			trans	-111.8	139.6	-175.9	-63.9	0	0	0	0	111.1	L510 C517	C504-L510 VanDerWaalsContact SG-CD1 3.58Å; C504-C517 VanDerWaalsContact CA-SG 3.51Å; C504-C517 HydrophobicContact CB-CB 3.79Å; C504-C517 WeakPolarHBondContact CB-SG 3.23Å; C504-C517 VanDerWaalsContact SG-CA 3.58Å; C504-C517 WeakPolarHBondContact SG-CB 3.01Å; C504-C517 CovalentContact SG-SG 2.04Å; C504-C517 PolarHBondContact SG-SG 2.77Å
505	D	78.8	Confident	77.7	Confident	79 Å²	79	57.5 Å²	57.5	42%	0.422	32%	0.319	S	S	.	.			trans	-57.6	153.8	174.5	-62.9	-26.4	0	0	0	112.4	H491 G507 Y508	H491-D505 IonicContact CG-OD2 3.56Å; H491-D505 IonicContact ND1-OD2 3.95Å; D505-G507 PolarHBondContact O-N 2.97Å; D505-Y508 HydrophobicContact CB-CD2 4.49Å; D505-Y508 WeakPolarHBondContact O-CB 3.42Å; D505-Y508 PolarHBondContact O-N 2.9Å
506	I	65.9	Low	77.6	Confident	35 Å²	35	57.8 Å²	57.8	18%	0.179	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	120.8	-175.7	-65.5	166.6	0	0	0	110.8	Y524 V548 E550	I506-Y524 HydrophobicContact CB-CE2 3.96Å; I506-Y524 HydrophobicContact CD1-CE1 4.09Å; I506-Y524 HydrophobicContact CG2-CE2 4.49Å; I506-V548 HydrophobicContact CG1-CG1 4.36Å; I506-V548 HydrophobicContact CG2-CG1 4.4Å; I506-V548 WeakPolarHBondContact CG2-O 3.28Å; I506-E550 HydrophobicContact CD1-CB 4Å
507	G	68.1	Low	77.4	Confident	17 Å²	17	55.6 Å²	55.6	18%	0.175	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	107.1	-0.2	-171.3	0	0	0	0	0	114.7	D505 A520	D505-G507 PolarHBondContact O-N 2.97Å; G507-A520 PolarHBondContact O-N 3.39Å
508	Y	73.9	Confident	77.2	Confident	81 Å²	81	57.4 Å²	57.4	32%	0.318	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	148.5	177.9	-66.7	-94.3	0	0	0	112.9	H491 D505 C517 E518 D519	H491-Y508 AromaticContact CE1-CD1 3.79Å; H491-Y508 AromaticContact CE1-CD2 3.71Å; H491-Y508 AromaticContact CE1-CE2 3.95Å; H491-Y508 AromaticContact CE1-CG 3.65Å; D505-Y508 HydrophobicContact CB-CD2 4.49Å; D505-Y508 WeakPolarHBondContact O-CB 3.42Å; D505-Y508 PolarHBondContact O-N 2.9Å; Y508-C517 HydrophobicContact CD1-CB 4.23Å; Y508-C517 HydrophobicContact CG-CB 4.35Å; Y508-E518 CarbonylContact C-O 3.57Å; Y508-E518 WeakPolarHBondContact CA-O 3.47Å; Y508-E518 WeakPolarHBondContact CB-O 3.45Å; Y508-E518 WeakPolarHBondContact CD1-O 3.38Å; Y508-D519 WeakPolarHBondContact CE1-OD1 3.38Å; Y508-D519 PolarHBondContact OH-OD1 3.14Å
509	E	66.1	Low	76.8	Confident	57 Å²	57	61.1 Å²	61.1	27%	0.266	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	151.3	170.3	68.1	-169.6	170.7	0	0	111.3	C517 E518 A520 K545	E509-C517 CarbonylContact O-C 3.22Å; E509-C517 VanDerWaalsContact O-CA 3.31Å; E509-C517 WeakPolarHBondContact O-CA 3.23Å; E509-E518 PolarHBondContact N-O 3.3Å; E509-E518 PolarHBondContact O-N 2.91Å; E509-A520 HydrophobicContact CB-CB 3.77Å; E509-A520 HydrophobicContact CG-CB 3.9Å; E509-K545 IonicContact OE1-NZ 3.3Å; E509-K545 PolarHBondContact OE1-NZ 3.02Å; E509-K545 IonicContact OE2-NZ 2.86Å; E509-K545 PolarHBondContact OE2-NZ 3.37Å
510	L	72.5	Confident	75.9	Confident	78 Å²	78	61.8 Å²	61.8	41%	0.408	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	123.1	-179.6	-169.9	74.2	0	0	0	109.6	C502 C504 S516	C502-L510 HydrophobicContact CB-CD1 3.98Å; C504-L510 VanDerWaalsContact SG-CD1 3.58Å; L510-S516 WeakPolarHBondContact CD1-O 3.17Å
511	H	75	Confident	75.6	Confident	59 Å²	59	59.9 Å²	59.9	27%	0.273	33%	0.326	S	S	.	.			trans	-66.4	162	178.8	177.4	-115.8	0	0	0	111.6	D513 G514 S516 E518	H511-D513 IonicContact CE1-OD2 2.71Å; H511-D513 IonicContact CG-OD1 3.97Å; H511-D513 PolarHBondContact ND1-N 2.82Å; H511-D513 IonicContact ND1-OD1 2.74Å; H511-D513 PolarHBondContact ND1-OD1 2.79Å; H511-D513 IonicContact ND1-OD2 3.79Å; H511-D513 PolarHBondContact ND1-OD2 2.53Å; H511-D513 PolarHBondContact O-N 3.34Å; H511-G514 PolarHBondContact O-N 3.36Å; H511-S516 WeakPolarHBondContact CB-O 2.94Å; H511-S516 PolarHBondContact N-O 2.04Å; H511-E518 HydrophobicContact CB-CG 4.19Å; H511-E518 IonicContact CD2-OE1 3.87Å; H511-E518 IonicContact CD2-OE2 3.42Å; H511-E518 PolarHBondContact CD2-OE2 3.25Å; H511-E518 IonicContact CG-OE2 3.98Å
512	S	75.9	Confident	75.2	Confident	116 Å²	116	55.2 Å²	55.2	81%	0.811	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-8.9	-178.6	67.1	0	0	0	0	115.8
513	D	79.3	Confident	74.9	Confident	76 Å²	76	55.6 Å²	55.6	41%	0.406	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-6.3	171	63.3	17.4	0	0	0	114.1	H511 K515 S516	H511-D513 IonicContact CE1-OD2 2.71Å; H511-D513 IonicContact CG-OD1 3.97Å; H511-D513 PolarHBondContact ND1-N 2.82Å; H511-D513 IonicContact ND1-OD1 2.74Å; H511-D513 PolarHBondContact ND1-OD1 2.79Å; H511-D513 IonicContact ND1-OD2 3.79Å; H511-D513 PolarHBondContact ND1-OD2 2.53Å; H511-D513 PolarHBondContact O-N 3.34Å; D513-K515 PolarHBondContact O-N 3.17Å; D513-K515 PolarHBondContact OD1-N 3.11Å; D513-S516 PolarHBondContact OD1-N 2.86Å; D513-S516 WeakPolarHBondContact OD2-CB 3.21Å; D513-S516 PolarHBondContact OD2-OG 3.37Å
514	G	78.5	Confident	75	Confident	33 Å²	33	58.8 Å²	58.8	34%	0.34	33%	0.332	S	S	.	.	S	Bend	trans	69.9	13.3	-178.2	0	0	0	0	0	114.9	C502 H511	C502-G514 WeakPolarHBondContact CB-O 3.27Å; C502-G514 PolarHBondContact SG-O 3.28Å; H511-G514 PolarHBondContact O-N 3.36Å
515	K	82	Confident	75.2	Confident	73 Å²	73	59 Å²	59	32%	0.317	33%	0.331	S	S	.	.	S	Bend	trans	-138.8	-37	-172.5	-66.3	-164.3	169.2	-139.6	0	115.1	H487 R490 Y500 D513	H487-K515 PolarHBondContact O-NZ 2.67Å; R490-K515 WeakPolarHBondContact CB-O 3.31Å; R490-K515 PolarHBondContact N-O 3Å; Y500-K515 PolarHBondContact OH-NZ 3.38Å; D513-K515 PolarHBondContact O-N 3.17Å; D513-K515 PolarHBondContact OD1-N 3.11Å
516	S	80.9	Confident	74.8	Confident	45 Å²	45	62.9 Å²	62.9	32%	0.315	34%	0.344	S	S	.	.			trans	-85.1	154.9	178.1	-56.6	0	0	0	0	110.5	L510 H511 D513	L510-S516 WeakPolarHBondContact CD1-O 3.17Å; H511-S516 WeakPolarHBondContact CB-O 2.94Å; H511-S516 PolarHBondContact N-O 2.04Å; D513-S516 PolarHBondContact OD1-N 2.86Å; D513-S516 WeakPolarHBondContact OD2-CB 3.21Å; D513-S516 PolarHBondContact OD2-OG 3.37Å
517	C	76.7	Confident	75	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.007	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	135.9	178.4	-61.6	0	0	0	0	109.1	R490 H491 C504 Y508 E509	R490-C517 PolarHBondContact NH1-O 3.04Å; H491-C517 WeakPolarHBondContact ND1-CB 3.42Å; H491-C517 PolarHBondContact ND1-SG 2.69Å; C504-C517 VanDerWaalsContact CA-SG 3.51Å; C504-C517 HydrophobicContact CB-CB 3.79Å; C504-C517 WeakPolarHBondContact CB-SG 3.23Å; C504-C517 VanDerWaalsContact SG-CA 3.58Å; C504-C517 WeakPolarHBondContact SG-CB 3.01Å; C504-C517 CovalentContact SG-SG 2.04Å; C504-C517 PolarHBondContact SG-SG 2.77Å; Y508-C517 HydrophobicContact CD1-CB 4.23Å; Y508-C517 HydrophobicContact CG-CB 4.35Å; E509-C517 CarbonylContact O-C 3.22Å; E509-C517 VanDerWaalsContact O-CA 3.31Å; E509-C517 WeakPolarHBondContact O-CA 3.23Å
518	E	73.1	Confident	75.4	Confident	97 Å²	97	68.5 Å²	68.5	45%	0.453	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	150.2	-177.9	-65	-174.8	134.5	0	0	110.5	Y508 E509 H511 A520	Y508-E518 CarbonylContact C-O 3.57Å; Y508-E518 WeakPolarHBondContact CA-O 3.47Å; Y508-E518 WeakPolarHBondContact CB-O 3.45Å; Y508-E518 WeakPolarHBondContact CD1-O 3.38Å; E509-E518 PolarHBondContact N-O 3.3Å; E509-E518 PolarHBondContact O-N 2.91Å; H511-E518 HydrophobicContact CB-CG 4.19Å; H511-E518 IonicContact CD2-OE1 3.87Å; H511-E518 IonicContact CD2-OE2 3.42Å; H511-E518 PolarHBondContact CD2-OE2 3.25Å; H511-E518 IonicContact CG-OE2 3.98Å; E518-A520 PolarHBondContact O-N 3.07Å
519	D	65.6	Low	75.9	Confident	133 Å²	133	70.4 Å²	70.4	71%	0.711	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.4	126.1	-174.6	-62.6	-64.3	0	0	0	111.1	Y508	Y508-D519 WeakPolarHBondContact CE1-OD1 3.38Å; Y508-D519 PolarHBondContact OH-OD1 3.14Å
520	A	64.4	Low	76.8	Confident	29 Å²	29	69.1 Å²	69.1	24%	0.24	39%	0.392	C	S	.	.			trans	-127	177.1	-172	0	0	0	0	0	113.2	G507 E509 E518	G507-A520 PolarHBondContact O-N 3.39Å; E509-A520 HydrophobicContact CB-CB 3.77Å; E509-A520 HydrophobicContact CG-CB 3.9Å; E518-A520 PolarHBondContact O-N 3.07Å
521	C	77.5	Confident	77.6	Confident	32 Å²	32	69.2 Å²	69.2	22%	0.216	40%	0.399	C	S	.	.	S	Bend	trans	-69.5	132.9	170.2	51.5	0	0	0	0	111.1	P535 C547	C521-P535 HydrophobicContact CB-CG 3.81Å; C521-C547 HydrophobicContact CB-CB 3.72Å; C521-C547 WeakPolarHBondContact CB-SG 3.5Å; C521-C547 VanDerWaalsContact O-CA 3.25Å; C521-C547 WeakPolarHBondContact O-CA 3.3Å; C521-C547 WeakPolarHBondContact O-CB 3.33Å; C521-C547 VanDerWaalsContact SG-CA 3.54Å; C521-C547 WeakPolarHBondContact SG-CB 3.48Å; C521-C547 CovalentContact SG-SG 2.03Å; C521-C547 PolarHBondContact SG-SG 3.23Å
522	G	78.1	Confident	78.3	Confident	28 Å²	28	66.8 Å²	66.8	29%	0.289	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	139.3	-148.6	-179	0	0	0	0	0	113	V548	G522-V548 CarbonylContact C-O 3.54Å; G522-V548 WeakPolarHBondContact CA-O 3.21Å
523	G	81.2	Confident	78.9	Confident	15 Å²	15	64.1 Å²	64.1	16%	0.155	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	117.7	172.3	169.5	0	0	0	0	0	114.8	V548 W549 E550	G523-V548 PolarHBondContact N-O 3.46Å; G523-W549 WeakPolarHBondContact O-CA 3.19Å; G523-E550 PolarHBondContact O-N 3.46Å; G523-E550 VanDerWaalsContact O-N 3.11Å
524	Y	82.3	Confident	79.4	Confident	118 Å²	118	60.6 Å²	60.6	46%	0.463	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	118.3	176.8	-68.6	-83.1	0	0	0	111.5	I506 E550	I506-Y524 HydrophobicContact CB-CE2 3.96Å; I506-Y524 HydrophobicContact CD1-CE1 4.09Å; I506-Y524 HydrophobicContact CG2-CE2 4.49Å; Y524-E550 WeakPolarHBondContact CA-O 3.25Å; Y524-E550 HydrophobicContact CD1-CB 4.26Å; Y524-E550 HydrophobicContact CE1-CB 4.45Å; Y524-E550 WeakPolarHBondContact CE1-OE2 3.41Å
525	L	83.7	Confident	79.7	Confident	36 Å²	36	60.2 Å²	60.2	19%	0.188	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.8	176.9	-63.7	176.3	0	0	0	109.5	L532 W549 E550 I551 K552 Y634	L525-L532 HydrophobicContact CD1-CB 4.27Å; L525-L532 HydrophobicContact CD1-CD2 4.45Å; L525-W549 HydrophobicContact CD1-CB 4.14Å; L525-W549 HydrophobicContact CD1-CG 4.33Å; L525-E550 PolarHBondContact N-O 2.9Å; L525-I551 HydrophobicContact CB-CB 4.45Å; L525-I551 HydrophobicContact CB-CG1 3.88Å; L525-I551 HydrophobicContact CD1-CG1 3.84Å; L525-I551 HydrophobicContact CG-CG1 4.43Å; L525-K552 PolarHBondContact O-N 2.96Å; L525-K552 VanDerWaalsContact O-N 3.16Å; L525-Y634 HydrophobicContact CB-CE1 4.12Å; L525-Y634 HydrophobicContact CD1-CD1 4.4Å; L525-Y634 HydrophobicContact CD1-CE1 3.94Å
526	K	71	Confident	79.8	Confident	161 Å²	161	61.2 Å²	61.2	70%	0.7	35%	0.349	S	S	*	.			trans	-125.9	94	-175.6	-64.9	179	-175.6	173.1	0	110.2
527	G	69.4	Low	79.8	Confident	33 Å²	33	62.1 Å²	62.1	34%	0.34	35%	0.347	S	S	.	.	S	Bend	trans	-170.7	159.8	177	0	0	0	0	0	110.6	N529	G527-N529 PolarHBondContact O-N 3.38Å
528	E	76.9	Confident	80.1	Confident	137 Å²	137	66.6 Å²	66.6	64%	0.64	38%	0.376	S	S	*	.	S	Bend	trans	-70.7	-20.5	173.9	-62.4	-178.4	161.3	0	0	111.8	F635 T636	E528-F635 CarbonylContact O-C 3.55Å; E528-F635 WeakPolarHBondContact O-CA 3.44Å; E528-T636 WeakPolarHBondContact CA-OG1 3.49Å; E528-T636 PolarHBondContact O-N 3.29Å; E528-T636 PolarHBondContact O-OG1 3.4Å
529	N	82.9	Confident	80.4	Confident	122 Å²	122	67.3 Å²	67.3	65%	0.652	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.8	163.3	172.3	57.6	8.1	0	0	0	110.9	G527 Y634 F635	G527-N529 PolarHBondContact O-N 3.38Å; N529-Y634 CarbonylContact C-O 3.48Å; N529-Y634 VanDerWaalsContact CA-O 3.29Å; N529-Y634 WeakPolarHBondContact CA-O 3.28Å; N529-F635 HydrophobicContact CB-CB 4.14Å
530	G	85.8	Confident	81.2	Confident	30 Å²	30	65.1 Å²	65.1	31%	0.309	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175.2	-167.8	174.5	0	0	0	0	0	112.9	V633 Y634	G530-V633 WeakPolarHBondContact O-CA 3.29Å; G530-Y634 VanDerWaalsContact CA-CE1 3.45Å; G530-Y634 PolarHBondContact N-O 3.47Å; G530-Y634 PolarHBondContact O-N 3.21Å
531	S	88.7	Confident	82.3	Confident	80 Å²	80	63.8 Å²	63.8	56%	0.559	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.5	157.4	177.1	55.6	0	0	0	0	111.5	A632	S531-A632 CarbonylContact C-O 3.36Å; S531-A632 VanDerWaalsContact CA-O 3.24Å; S531-A632 WeakPolarHBondContact CA-O 3.28Å; S531-A632 WeakPolarHBondContact CB-O 3.34Å
532	L	89.7	Confident	82.7	Confident	7 Å²	7	64 Å²	64	4%	0.037	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.8	168.1	63.4	154.4	0	0	0	109.7	L525 W549 L561 I617 F630 A632 Y634	L525-L532 HydrophobicContact CD1-CB 4.27Å; L525-L532 HydrophobicContact CD1-CD2 4.45Å; L532-W549 HydrophobicContact CD1-CB 4.44Å; L532-W549 HydrophobicContact CD1-CD2 3.93Å; L532-W549 HydrophobicContact CD1-CE3 4.04Å; L532-W549 HydrophobicContact CD1-CG 4.13Å; L532-L561 HydrophobicContact CD2-CD1 3.89Å; L532-I617 HydrophobicContact CD1-CB 4.49Å; L532-I617 HydrophobicContact CD1-CD1 3.72Å; L532-I617 HydrophobicContact CD1-CG2 4.11Å; L532-I617 HydrophobicContact CD2-CD1 4.19Å; L532-F630 HydrophobicContact CD1-CE2 4.02Å; L532-F630 HydrophobicContact CG-CE2 4.29Å; L532-A632 HydrophobicContact CD2-CB 4.06Å; L532-A632 HydrophobicContact CG-CB 4.27Å; L532-A632 PolarHBondContact N-O 3.05Å; L532-A632 PolarHBondContact O-N 3.29Å; L532-Y634 HydrophobicContact CD2-CD1 4.31Å
533	T	90.1	Very high	82.9	Confident	61 Å²	61	65.2 Å²	65.2	37%	0.374	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	155.1	178.8	59.2	0	0	0	0	109.5	F537 W549 F630 A631	T533-F537 HydrophobicContact CG2-CB 4.47Å; T533-F537 HydrophobicContact CG2-CD1 3.86Å; T533-F537 HydrophobicContact CG2-CG 4.27Å; T533-W549 WeakPolarHBondContact O-CZ2 3.43Å; T533-F630 VanDerWaalsContact CA-O 3.31Å; T533-F630 WeakPolarHBondContact CA-O 3.32Å; T533-A631 HydrophobicContact CG2-CB 4.03Å
534	S	89.7	Confident	82.9	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.014	39%	0.387	C	S	.	.			trans	-57.8	156.6	165	53.9	0	0	0	0	110.9	F537 G629 F630	S534-F537 WeakPolarHBondContact O-CB 3.46Å; S534-F537 PolarHBondContact O-N 2.62Å; S534-G629 WeakPolarHBondContact OG-CA 3.39Å; S534-F630 PolarHBondContact N-O 3.42Å; S534-F630 PolarHBondContact OG-N 2.97Å; S534-F630 VanDerWaalsContact OG-N 3.09Å; S534-F630 PolarHBondContact OG-O 2.78Å
535	P	84.9	Confident	82.8	Confident	24 Å²	24	69.2 Å²	69.2	16%	0.156	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	147.9	169.5	-23.4	34.1	0	0	0	111.2	C521 F537 P542 C547	C521-P535 HydrophobicContact CB-CG 3.81Å; P535-F537 PolarHBondContact O-N 3.28Å; P535-P542 HydrophobicContact CB-CG 4.42Å; P535-C547 WeakPolarHBondContact CG-SG 3.33Å
536	N	82.3	Confident	83	Confident	95 Å²	95	74 Å²	74	51%	0.508	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	-8.1	-178.9	-55.5	-17.2	0	0	0	117.7	N539 L540	N536-N539 CarbonylContact C-O 3.53Å; N536-N539 HydrophobicContact CB-CB 4.26Å; N536-N539 WeakPolarHBondContact O-CA 3.42Å; N536-N539 VanDerWaalsContact O-CB 3.29Å; N536-N539 WeakPolarHBondContact O-CB 3.34Å; N536-N539 PolarHBondContact O-N 2.71Å; N536-N539 PolarHBondContact O-ND2 2.03Å; N536-L540 VanDerWaalsContact CB-O 3.24Å; N536-L540 WeakPolarHBondContact CB-O 2.96Å; N536-L540 PolarHBondContact ND2-O 3.37Å
537	F	82.5	Confident	83.8	Confident	64 Å²	64	66.4 Å²	66.4	28%	0.281	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	132.5	-176.7	-176.3	-91.5	0	0	0	112.7	T533 S534 P535 H565 S628 A631	T533-F537 HydrophobicContact CG2-CB 4.47Å; T533-F537 HydrophobicContact CG2-CD1 3.86Å; T533-F537 HydrophobicContact CG2-CG 4.27Å; S534-F537 WeakPolarHBondContact O-CB 3.46Å; S534-F537 PolarHBondContact O-N 2.62Å; P535-F537 PolarHBondContact O-N 3.28Å; F537-H565 HydrophobicContact CE2-CB 4.2Å; F537-H565 AromaticContact CE2-CD2 3.62Å; F537-H565 AromaticContact CE2-CG 3.92Å; F537-H565 HydrophobicContact CZ-CB 4.18Å; F537-S628 WeakPolarHBondContact CD2-O 3.31Å; F537-A631 HydrophobicContact CD1-CB 4.38Å; F537-A631 HydrophobicContact CE1-CB 3.84Å; F537-A631 HydrophobicContact CE2-CB 4.17Å; F537-A631 HydrophobicContact CZ-CB 3.73Å
538	P	82	Confident	84.7	Confident	94 Å²	94	65.6 Å²	65.6	61%	0.61	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.5	10.9	8.6	36.8	-38.4	0	0	0	115.2
539	N	79.1	Confident	85.3	Confident	112 Å²	112	60 Å²	60	60%	0.599	32%	0.32	S	S	*	.	S	Bend	trans	-84	168.2	173.8	-43.6	-88.9	0	0	0	110.7	N536 Y541	N536-N539 CarbonylContact C-O 3.53Å; N536-N539 HydrophobicContact CB-CB 4.26Å; N536-N539 WeakPolarHBondContact O-CA 3.42Å; N536-N539 VanDerWaalsContact O-CB 3.29Å; N536-N539 WeakPolarHBondContact O-CB 3.34Å; N536-N539 PolarHBondContact O-N 2.71Å; N536-N539 PolarHBondContact O-ND2 2.03Å; N539-Y541 PolarHBondContact O-N 3.06Å
540	L	83.9	Confident	85.5	Confident	87 Å²	87	55 Å²	55	46%	0.455	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-55.9	131.7	179.6	-59.4	-179.5	0	0	0	112.8	N536 Q626 K627	N536-L540 VanDerWaalsContact CB-O 3.24Å; N536-L540 WeakPolarHBondContact CB-O 2.96Å; N536-L540 PolarHBondContact ND2-O 3.37Å; L540-Q626 HydrophobicContact CB-CB 3.89Å; L540-Q626 HydrophobicContact CD1-CB 4.23Å; L540-Q626 HydrophobicContact CD2-CB 4.32Å; L540-Q626 HydrophobicContact CG-CB 4.36Å; L540-K627 WeakPolarHBondContact CA-O 3.38Å; L540-K627 VanDerWaalsContact CD2-C 3.49Å; L540-K627 WeakPolarHBondContact CD2-O 3.27Å
541	Y	87.7	Confident	85.7	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-72.8	155.8	175.4	52.8	-103.8	0	0	0	111.9	N539 L568 E569 D578 F619 T621 Q626 K627	N539-Y541 PolarHBondContact O-N 3.06Å; Y541-L568 HydrophobicContact CD1-CD2 4.37Å; Y541-L568 HydrophobicContact CE1-CD2 3.67Å; Y541-E569 PolarHBondContact OH-N 3.3Å; Y541-D578 WeakPolarHBondContact CE2-OD2 3.5Å; Y541-D578 PolarHBondContact OH-OD2 3.3Å; Y541-F619 HydrophobicContact CD1-CZ 4.01Å; Y541-F619 HydrophobicContact CD2-CZ 4.06Å; Y541-F619 HydrophobicContact CE1-CZ 4.29Å; Y541-F619 HydrophobicContact CE2-CZ 4.35Å; Y541-F619 HydrophobicContact CG-CE1 4.32Å; Y541-F619 AromaticContact CG-CZ 3.88Å; Y541-F619 HydrophobicContact CG-CZ 3.88Å; Y541-T621 HydrophobicContact CD2-CG2 3.59Å; Y541-T621 HydrophobicContact CE2-CG2 3.65Å; Y541-T621 HydrophobicContact CG-CG2 4.45Å; Y541-Q626 HydrophobicContact CE2-CB 4.49Å; Y541-Q626 WeakPolarHBondContact O-CG 3.01Å; Y541-Q626 PolarHBondContact O-NE2 3.08Å; Y541-K627 WeakPolarHBondContact CD1-O 3.38Å; Y541-K627 HydrophobicContact CE1-CB 3.86Å; Y541-K627 WeakPolarHBondContact CE1-O 3.43Å; Y541-K627 VanDerWaalsContact CZ-N 3.29Å; Y541-K627 PolarHBondContact OH-N 3.46Å
542	P	84.4	Confident	85.6	Confident	37 Å²	37	54.6 Å²	54.6	24%	0.24	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-77.3	153.2	177.2	-9.9	25.9	0	0	0	113.7	P535 K545 T621	P535-P542 HydrophobicContact CB-CG 4.42Å; P542-K545 HydrophobicContact CB-CG 3.96Å; P542-K545 HydrophobicContact CG-CG 4.3Å; P542-T621 PolarHBondContact O-OG1 3.08Å
543	N	81.9	Confident	85.3	Confident	53 Å²	53	54.9 Å²	54.9	28%	0.283	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	156.1	173.1	-57.8	21.9	0	0	0	110.7	K545 D622 S623 S624 Q626	N543-K545 VanDerWaalsContact C-N 3.26Å; N543-K545 PolarHBondContact O-N 2.87Å; N543-D622 CarbonylContact C-O 3.53Å; N543-D622 WeakPolarHBondContact CA-O 3.43Å; N543-D622 WeakPolarHBondContact CB-O 3.33Å; N543-S623 PolarHBondContact ND2-O 3.21Å; N543-S624 WeakPolarHBondContact ND2-CA 3.27Å; N543-S624 PolarHBondContact ND2-N 2.96Å; N543-S624 PolarHBondContact ND2-O 3.34Å; N543-S624 PolarHBondContact OD1-O 3.4Å; N543-Q626 WeakPolarHBondContact OD1-CG 3.24Å; N543-Q626 PolarHBondContact OD1-NE2 3.47Å
544	K	81.2	Confident	84.8	Confident	162 Å²	162	58.1 Å²	58.1	70%	0.704	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	39.4	176.7	-56.2	-172.2	176.7	-174.9	0	113.4	T621 D622	K544-T621 WeakPolarHBondContact CA-O 3.49Å; K544-T621 PolarHBondContact N-O 2.88Å; K544-T621 PolarHBondContact N-OG1 2.95Å; K544-D622 PolarHBondContact N-O 3.47Å
545	K	81.6	Confident	84.1	Confident	55 Å²	55	62.7 Å²	62.7	24%	0.239	32%	0.319	C	S	.	.			trans	-108.8	140	176.6	-78	-71.3	165.7	-173.5	0	111.3	E509 P542 N543 V620 T621	E509-K545 IonicContact OE1-NZ 3.3Å; E509-K545 PolarHBondContact OE1-NZ 3.02Å; E509-K545 IonicContact OE2-NZ 2.86Å; E509-K545 PolarHBondContact OE2-NZ 3.37Å; P542-K545 HydrophobicContact CB-CG 3.96Å; P542-K545 HydrophobicContact CG-CG 4.3Å; N543-K545 VanDerWaalsContact C-N 3.26Å; N543-K545 PolarHBondContact O-N 2.87Å; K545-V620 CarbonylContact O-C 3.58Å; K545-V620 WeakPolarHBondContact O-CA 3.05Å; K545-T621 PolarHBondContact N-OG1 2.92Å; K545-T621 PolarHBondContact O-N 2.77Å; K545-T621 PolarHBondContact O-OG1 2.85Å
546	R	87.1	Confident	83.5	Confident	138 Å²	138	65.6 Å²	65.6	52%	0.521	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	105.5	172.7	-179.4	170.1	-176.2	-95.1	-2	108.7	V548 E618 F619 V620	R546-V548 HydrophobicContact CG-CG2 4.46Å; R546-E618 IonicContact CZ-OE1 2.85Å; R546-E618 IonicContact NE-OE1 2.65Å; R546-E618 PolarHBondContact NE-OE1 3.49Å; R546-E618 IonicContact NH2-OE1 2.69Å; R546-E618 PolarHBondContact NH2-OE1 3.12Å; R546-E618 IonicContact NH2-OE2 3.25Å; R546-E618 PolarHBondContact NH2-OE2 3.24Å; R546-E618 VanDerWaalsContact NH2-OE2 3.13Å; R546-F619 CarbonylContact C-O 3.58Å; R546-F619 VanDerWaalsContact CA-O 3.31Å; R546-F619 WeakPolarHBondContact CA-O 3.1Å; R546-V620 HydrophobicContact CG-CG2 4.3Å
547	C	87.3	Confident	83.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.6	178.6	-47.3	0	0	0	0	109.8	C521 P535 W549 E618 F619	C521-C547 HydrophobicContact CB-CB 3.72Å; C521-C547 WeakPolarHBondContact CB-SG 3.5Å; C521-C547 VanDerWaalsContact O-CA 3.25Å; C521-C547 WeakPolarHBondContact O-CA 3.3Å; C521-C547 WeakPolarHBondContact O-CB 3.33Å; C521-C547 VanDerWaalsContact SG-CA 3.54Å; C521-C547 WeakPolarHBondContact SG-CB 3.48Å; C521-C547 CovalentContact SG-SG 2.03Å; C521-C547 PolarHBondContact SG-SG 3.23Å; P535-C547 WeakPolarHBondContact CG-SG 3.33Å; C547-W549 HydrophobicContact CB-CE3 4.31Å; C547-W549 HydrophobicContact CB-CH2 3.36Å; C547-W549 HydrophobicContact CB-CZ2 4.01Å; C547-W549 HydrophobicContact CB-CZ3 3.53Å; C547-E618 WeakPolarHBondContact O-CA 3.48Å; C547-F619 HydrophobicContact CB-CB 4.31Å; C547-F619 HydrophobicContact CB-CD1 4.39Å; C547-F619 PolarHBondContact N-O 2.91Å; C547-F619 PolarHBondContact O-N 2.65Å
548	V	88.6	Confident	83.1	Confident	17 Å²	17	62.3 Å²	62.3	10%	0.103	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.5	178.3	-175.5	0	0	0	0	110.1	I506 G522 G523 R546 R616 I617 E618	I506-V548 HydrophobicContact CG1-CG1 4.36Å; I506-V548 HydrophobicContact CG2-CG1 4.4Å; I506-V548 WeakPolarHBondContact CG2-O 3.28Å; G522-V548 CarbonylContact C-O 3.54Å; G522-V548 WeakPolarHBondContact CA-O 3.21Å; G523-V548 PolarHBondContact N-O 3.46Å; R546-V548 HydrophobicContact CG-CG2 4.46Å; V548-R616 HydrophobicContact CG1-CG 4.17Å; V548-I617 WeakPolarHBondContact CA-O 3.44Å; V548-E618 HydrophobicContact CG2-CB 4.46Å; V548-E618 HydrophobicContact CG2-CG 4.27Å
549	W	89.4	Confident	83.2	Confident	19 Å²	19	57.9 Å²	57.9	7%	0.072	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	144.6	170.6	-59.5	-93.6	0	0	0	110.1	G523 L525 L532 T533 C547 I617 F619 F630	G523-W549 WeakPolarHBondContact O-CA 3.19Å; L525-W549 HydrophobicContact CD1-CB 4.14Å; L525-W549 HydrophobicContact CD1-CG 4.33Å; L532-W549 HydrophobicContact CD1-CB 4.44Å; L532-W549 HydrophobicContact CD1-CD2 3.93Å; L532-W549 HydrophobicContact CD1-CE3 4.04Å; L532-W549 HydrophobicContact CD1-CG 4.13Å; T533-W549 WeakPolarHBondContact O-CZ2 3.43Å; C547-W549 HydrophobicContact CB-CE3 4.31Å; C547-W549 HydrophobicContact CB-CH2 3.36Å; C547-W549 HydrophobicContact CB-CZ2 4.01Å; C547-W549 HydrophobicContact CB-CZ3 3.53Å; W549-I617 HydrophobicContact CB-CB 4.45Å; W549-I617 HydrophobicContact CE3-CG2 4.32Å; W549-I617 PolarHBondContact N-O 2.96Å; W549-I617 PolarHBondContact O-N 2.94Å; W549-F619 HydrophobicContact CH2-CB 4.38Å; W549-F619 HydrophobicContact CZ3-CB 3.82Å; W549-F630 HydrophobicContact CH2-CE1 4.47Å; W549-F630 AromaticContact CH2-CZ 3.72Å; W549-F630 HydrophobicContact CH2-CZ 3.72Å; W549-F630 AromaticContact CZ3-CZ 3.76Å; W549-F630 HydrophobicContact CZ3-CZ 3.76Å
550	E	88.7	Confident	83.4	Confident	17 Å²	17	52.5 Å²	52.5	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	113.5	172.8	-163.9	168.8	-95.9	0	0	109.9	I506 G523 Y524 L525 L615 R616	I506-E550 HydrophobicContact CD1-CB 4Å; G523-E550 PolarHBondContact O-N 3.46Å; G523-E550 VanDerWaalsContact O-N 3.11Å; Y524-E550 WeakPolarHBondContact CA-O 3.25Å; Y524-E550 HydrophobicContact CD1-CB 4.26Å; Y524-E550 HydrophobicContact CE1-CB 4.45Å; Y524-E550 WeakPolarHBondContact CE1-OE2 3.41Å; L525-E550 PolarHBondContact N-O 2.9Å; E550-L615 WeakPolarHBondContact CA-O 3.35Å; E550-R616 IonicContact OE1-CZ 3.77Å; E550-R616 IonicContact OE1-NE 3.68Å; E550-R616 PolarHBondContact OE1-NE 2.97Å; E550-R616 IonicContact OE1-NH2 2.94Å; E550-R616 PolarHBondContact OE1-NH2 3.07Å
551	I	88.6	Confident	83.5	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	123.4	178.4	-57.8	160.4	0	0	0	107.4	L525 I559 H614 L615 I617 Y634	L525-I551 HydrophobicContact CB-CB 4.45Å; L525-I551 HydrophobicContact CB-CG1 3.88Å; L525-I551 HydrophobicContact CD1-CG1 3.84Å; L525-I551 HydrophobicContact CG-CG1 4.43Å; I551-I559 HydrophobicContact CB-CD1 4.03Å; I551-I559 HydrophobicContact CB-CG2 4.44Å; I551-I559 HydrophobicContact CD1-CG2 4.14Å; I551-I559 HydrophobicContact CG2-CD1 3.72Å; I551-I559 HydrophobicContact CG2-CG1 4.04Å; I551-I559 HydrophobicContact CG2-CG2 3.92Å; I551-I559 WeakPolarHBondContact O-CD1 3.27Å; I551-H614 WeakPolarHBondContact O-CA 3.16Å; I551-L615 HydrophobicContact CB-CB 4.48Å; I551-L615 HydrophobicContact CD1-CD2 4.42Å; I551-L615 PolarHBondContact N-O 2.84Å; I551-L615 PolarHBondContact O-N 2.97Å; I551-I617 HydrophobicContact CD1-CD1 3.82Å; I551-Y634 HydrophobicContact CD1-CD1 3.97Å; I551-Y634 HydrophobicContact CD1-CD2 4.11Å; I551-Y634 HydrophobicContact CD1-CG 3.71Å; I551-Y634 HydrophobicContact CG1-CD1 4.37Å; I551-Y634 HydrophobicContact CG1-CD2 4.41Å; I551-Y634 HydrophobicContact CG1-CG 4.33Å; I551-Y634 HydrophobicContact CG2-CD2 3.69Å; I551-Y634 HydrophobicContact CG2-CE2 3.62Å; I551-Y634 HydrophobicContact CG2-CG 4.4Å
552	K	87.1	Confident	83.4	Confident	100 Å²	100	50.5 Å²	50.5	44%	0.435	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	100.8	-178.9	178.7	145.1	-177	146	0	110.8	L525 H614	L525-K552 PolarHBondContact O-N 2.96Å; L525-K552 VanDerWaalsContact O-N 3.16Å; K552-H614 WeakPolarHBondContact CD-NE2 3.47Å; K552-H614 WeakPolarHBondContact CE-NE2 3.33Å; K552-H614 PolarHBondContact NZ-CE1 2.63Å; K552-H614 PolarHBondContact NZ-NE2 2.88Å
553	A	82.4	Confident	83.5	Confident	13 Å²	13	48.9 Å²	48.9	11%	0.107	23%	0.23	C	C	.	.			trans	-80.8	176.8	172.9	0	0	0	0	0	111.4	I559 S613 T636	A553-I559 HydrophobicContact CB-CD1 4.16Å; A553-I559 HydrophobicContact CB-CG1 3.81Å; A553-S613 WeakPolarHBondContact CB-O 3.3Å; A553-S613 PolarHBondContact N-O 2.98Å; A553-T636 HydrophobicContact CB-CG2 3.68Å
554	H	80.9	Confident	83.7	Confident	130 Å²	130	50 Å²	50	60%	0.602	24%	0.239	S	C	*	.			trans	-76.8	151.9	169.7	-159.3	80.5	0	0	0	109.9	Q556 Y557 S613	H554-Q556 PolarHBondContact O-N 3.42Å; H554-Y557 HydrophobicContact CB-CD2 3.75Å; H554-Y557 HydrophobicContact CB-CE2 3.99Å; H554-Y557 WeakPolarHBondContact O-CB 3.18Å; H554-Y557 PolarHBondContact O-N 3.34Å; H554-S613 WeakPolarHBondContact O-CB 3.3Å
555	S	74.7	Confident	84	Confident	98 Å²	98	45.6 Å²	45.6	69%	0.685	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	4	-170.3	57.2	0	0	0	0	116.6
556	Q	71.9	Confident	84.4	Confident	85 Å²	85	43.7 Å²	43.7	40%	0.397	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	10.5	172.7	-62.5	-172	-5.9	0	0	112.7	H554 L638 A639	H554-Q556 PolarHBondContact O-N 3.42Å; Q556-L638 HydrophobicContact CB-CD2 3.92Å; Q556-L638 CarbonylContact O-C 3.5Å; Q556-L638 WeakPolarHBondContact O-CA 2.98Å; Q556-A639 PolarHBondContact O-N 2.76Å
557	Y	77.3	Confident	84.4	Confident	57 Å²	57	37.9 Å²	37.9	22%	0.224	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	140.4	-173.8	-68.4	-121.2	0	0	0	111.1	H554 S613 V637 L638	H554-Y557 HydrophobicContact CB-CD2 3.75Å; H554-Y557 HydrophobicContact CB-CE2 3.99Å; H554-Y557 WeakPolarHBondContact O-CB 3.18Å; H554-Y557 PolarHBondContact O-N 3.34Å; Y557-S613 WeakPolarHBondContact O-CA 3.02Å; Y557-S613 VanDerWaalsContact O-CB 3.3Å; Y557-S613 WeakPolarHBondContact O-CB 3.39Å; Y557-V637 CarbonylContact C-O 3.58Å; Y557-V637 WeakPolarHBondContact CA-O 3.48Å; Y557-V637 WeakPolarHBondContact CB-O 3.49Å; Y557-L638 HydrophobicContact CD1-CG 4.27Å; Y557-L638 HydrophobicContact CD2-CD2 3.7Å; Y557-L638 HydrophobicContact CD2-CG 4.18Å; Y557-L638 HydrophobicContact CE1-CD2 4.38Å; Y557-L638 HydrophobicContact CE1-CG 3.86Å; Y557-L638 HydrophobicContact CE2-CD2 3.33Å; Y557-L638 HydrophobicContact CE2-CG 3.75Å; Y557-L638 HydrophobicContact CG-CD2 4.35Å; Y557-L638 HydrophobicContact CG-CG 4.42Å
558	R	78.8	Confident	84.4	Confident	33 Å²	33	38.1 Å²	38.1	13%	0.125	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	154.2	164	-72.4	178.1	176.5	178.4	-6.5	109.6	S610 T636 V637 A639 D644 E647	R558-S610 WeakPolarHBondContact CD-O 3.39Å; R558-S610 WeakPolarHBondContact CG-O 3.32Å; R558-T636 WeakPolarHBondContact O-CA 3.37Å; R558-V637 PolarHBondContact N-O 3.04Å; R558-V637 PolarHBondContact O-N 3.46Å; R558-A639 HydrophobicContact CG-CB 4.18Å; R558-D644 IonicContact CZ-OD2 3.35Å; R558-D644 VanDerWaalsContact CZ-OD2 3.25Å; R558-D644 IonicContact NH1-OD2 3.72Å; R558-D644 PolarHBondContact NH1-OD2 3.31Å; R558-D644 IonicContact NH2-OD2 3.99Å; R558-D644 PolarHBondContact NH2-OD2 2.97Å; R558-E647 IonicContact NH2-OE1 2.76Å; R558-E647 PolarHBondContact NH2-OE1 2.88Å
559	I	84.6	Confident	84.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	124.4	-180	-59.5	155.3	0	0	0	108.2	I551 A553 S610 S613 L615 Y634 T636	I551-I559 HydrophobicContact CB-CD1 4.03Å; I551-I559 HydrophobicContact CB-CG2 4.44Å; I551-I559 HydrophobicContact CD1-CG2 4.14Å; I551-I559 HydrophobicContact CG2-CD1 3.72Å; I551-I559 HydrophobicContact CG2-CG1 4.04Å; I551-I559 HydrophobicContact CG2-CG2 3.92Å; I551-I559 WeakPolarHBondContact O-CD1 3.27Å; A553-I559 HydrophobicContact CB-CD1 4.16Å; A553-I559 HydrophobicContact CB-CG1 3.81Å; I559-S610 WeakPolarHBondContact CB-OG 3.45Å; I559-S610 PolarHBondContact N-OG 3.29Å; I559-S610 WeakPolarHBondContact O-CB 3.04Å; I559-S610 PolarHBondContact O-N 2.9Å; I559-S610 PolarHBondContact O-OG 3.03Å; I559-S613 WeakPolarHBondContact CD1-O 3.18Å; I559-L615 HydrophobicContact CB-CB 4.41Å; I559-L615 HydrophobicContact CD1-CB 3.74Å; I559-L615 HydrophobicContact CG2-CB 4.36Å; I559-L615 HydrophobicContact CG2-CD2 3.99Å; I559-Y634 HydrophobicContact CG2-CD2 4.45Å; I559-T636 HydrophobicContact CG1-CG2 4.22Å
560	F	83.6	Confident	83.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	136.1	169.3	-68.8	-94.2	0	0	0	109.3	L607 L608 T609 Y634 F635 V637 I661	F560-L607 HydrophobicContact CB-CD1 4.25Å; F560-L607 HydrophobicContact CD1-CD1 4.33Å; F560-L607 HydrophobicContact CD1-CD2 4.3Å; F560-L607 HydrophobicContact CD1-CG 4.37Å; F560-L608 CarbonylContact C-O 3.54Å; F560-L608 WeakPolarHBondContact CA-O 3.32Å; F560-T609 HydrophobicContact CD1-CG2 4.07Å; F560-T609 WeakPolarHBondContact CD1-OG1 3.49Å; F560-T609 HydrophobicContact CE1-CG2 3.56Å; F560-T609 WeakPolarHBondContact CE1-OG1 3.44Å; F560-T609 HydrophobicContact CE2-CG2 4.3Å; F560-T609 HydrophobicContact CZ-CG2 3.68Å; F560-Y634 CarbonylContact O-C 3.56Å; F560-Y634 WeakPolarHBondContact O-CA 3.25Å; F560-Y634 WeakPolarHBondContact O-CB 3.48Å; F560-F635 HydrophobicContact CB-CD1 4.27Å; F560-F635 HydrophobicContact CB-CD2 4.05Å; F560-F635 HydrophobicContact CB-CE1 3.81Å; F560-F635 HydrophobicContact CB-CE2 3.56Å; F560-F635 HydrophobicContact CB-CG 4.38Å; F560-F635 HydrophobicContact CB-CZ 3.43Å; F560-F635 VanDerWaalsContact CB-CZ 3.43Å; F560-F635 HydrophobicContact CD2-CD2 4.31Å; F560-F635 AromaticContact CD2-CE2 3.83Å; F560-F635 HydrophobicContact CD2-CE2 3.83Å; F560-F635 HydrophobicContact CD2-CZ 4.45Å; F560-F635 HydrophobicContact CG-CD2 4.47Å; F560-F635 AromaticContact CG-CE2 3.77Å; F560-F635 HydrophobicContact CG-CE2 3.77Å; F560-F635 AromaticContact CG-CZ 3.92Å; F560-F635 HydrophobicContact CG-CZ 3.92Å; F560-F635 PolarHBondContact N-O 3.39Å; F560-F635 PolarHBondContact O-N 3.41Å; F560-V637 HydrophobicContact CD2-CB 4.35Å; F560-V637 HydrophobicContact CD2-CG2 3.84Å; F560-V637 HydrophobicContact CE2-CB 3.96Å; F560-V637 HydrophobicContact CE2-CG2 3.81Å; F560-I661 HydrophobicContact CD1-CD1 3.91Å; F560-I661 HydrophobicContact CD1-CG1 4.02Å; F560-I661 HydrophobicContact CD2-CD1 4.36Å; F560-I661 HydrophobicContact CD2-CG1 4.29Å; F560-I661 HydrophobicContact CE1-CD1 3.92Å; F560-I661 HydrophobicContact CE1-CG1 3.5Å; F560-I661 HydrophobicContact CE2-CD1 4.39Å; F560-I661 HydrophobicContact CE2-CG1 3.83Å; F560-I661 HydrophobicContact CG-CD1 4.13Å; F560-I661 HydrophobicContact CG-CG1 4.38Å; F560-I661 HydrophobicContact CZ-CD1 4.17Å; F560-I661 HydrophobicContact CZ-CG1 3.4Å; F560-I661 VanDerWaalsContact CZ-CG1 3.4Å
561	L	86.6	Confident	82.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.6	178.9	176.7	67.6	0	0	0	108.9	L532 F563 V582 L607 L608 L615 I617 A632	L532-L561 HydrophobicContact CD2-CD1 3.89Å; L561-F563 HydrophobicContact CD2-CE2 3.68Å; L561-F563 HydrophobicContact CD2-CZ 3.94Å; L561-F563 HydrophobicContact CG-CD2 4.48Å; L561-F563 HydrophobicContact CG-CE2 3.94Å; L561-F563 HydrophobicContact CG-CZ 4.42Å; L561-V582 HydrophobicContact CD2-CG1 4.13Å; L561-V582 HydrophobicContact CD2-CG2 4.24Å; L561-L607 CarbonylContact O-C 3.53Å; L561-L607 WeakPolarHBondContact O-CA 3.03Å; L561-L608 HydrophobicContact CB-CB 4.47Å; L561-L608 PolarHBondContact N-O 3.26Å; L561-L608 PolarHBondContact O-N 2.88Å; L561-L615 HydrophobicContact CB-CD2 4.06Å; L561-L615 HydrophobicContact CD2-CD2 4.16Å; L561-I617 HydrophobicContact CD1-CD1 3.96Å; L561-I617 HydrophobicContact CD2-CD1 3.67Å; L561-I617 HydrophobicContact CD2-CG1 4.27Å; L561-I617 HydrophobicContact CG-CD1 4.46Å; L561-A632 HydrophobicContact CD1-CB 3.77Å
562	N	85.3	Confident	80.9	Confident	45 Å²	45	44 Å²	44	24%	0.241	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	120.2	-178.4	-179.7	8.7	0	0	0	110.5	F606 L607 A632 V633	N562-F606 WeakPolarHBondContact CA-O 3.16Å; N562-L607 HydrophobicContact CB-CD1 3.89Å; N562-A632 CarbonylContact O-C 3.54Å; N562-A632 VanDerWaalsContact O-CA 3.23Å; N562-A632 WeakPolarHBondContact O-CA 3.38Å; N562-V633 HydrophobicContact CB-CG2 4.01Å; N562-V633 PolarHBondContact N-O 3.22Å; N562-V633 PolarHBondContact O-N 2.03Å
563	F	86.6	Confident	79.5	Confident	3 Å²	3	42 Å²	42	1%	0.013	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	114.4	177.1	-70.9	-93.8	0	0	0	111.1	L561 F566 I580 F606 F630 A632	L561-F563 HydrophobicContact CD2-CE2 3.68Å; L561-F563 HydrophobicContact CD2-CZ 3.94Å; L561-F563 HydrophobicContact CG-CD2 4.48Å; L561-F563 HydrophobicContact CG-CE2 3.94Å; L561-F563 HydrophobicContact CG-CZ 4.42Å; F563-F566 HydrophobicContact CB-CD2 4.37Å; F563-F566 AromaticContact CD1-CD2 3.62Å; F563-F566 HydrophobicContact CD1-CD2 3.62Å; F563-F566 HydrophobicContact CD1-CE2 4.09Å; F563-F566 HydrophobicContact CE1-CD2 4.05Å; F563-F566 HydrophobicContact CE1-CE2 4.05Å; F563-F566 HydrophobicContact CG-CD2 4.03Å; F563-I580 HydrophobicContact CE1-CD1 3.97Å; F563-I580 HydrophobicContact CE1-CG2 4.47Å; F563-I580 HydrophobicContact CZ-CD1 4.1Å; F563-I580 HydrophobicContact CZ-CG2 4.43Å; F563-F606 AromaticContact CD2-CD1 3.97Å; F563-F606 HydrophobicContact CD2-CD1 3.97Å; F563-F606 HydrophobicContact CE2-CD1 4.32Å; F563-F606 PolarHBondContact N-O 2.78Å; F563-F606 VanDerWaalsContact N-O 3.16Å; F563-F630 HydrophobicContact CD1-CB 4.37Å; F563-F630 HydrophobicContact CD1-CD2 4.37Å; F563-F630 HydrophobicContact CE1-CD2 4.01Å; F563-F630 HydrophobicContact CE1-CG 4.38Å; F563-A632 HydrophobicContact CD1-CB 3.8Å; F563-A632 HydrophobicContact CE1-CB 4.01Å; F563-A632 HydrophobicContact CG-CB 4.16Å
564	T	86.1	Confident	78.5	Confident	77 Å²	77	44.3 Å²	44.3	47%	0.472	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	-19.9	178.3	56.4	0	0	0	0	112.8	A631 V633	T564-A631 PolarHBondContact N-O 2.88Å; T564-A631 PolarHBondContact OG1-O 2.9Å; T564-V633 HydrophobicContact CG2-CG1 4.44Å; T564-V633 HydrophobicContact CG2-CG2 4.25Å
565	H	87.8	Confident	78	Confident	69 Å²	69	38.6 Å²	38.6	32%	0.319	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	139.1	170.4	-176.4	92.6	0	0	0	110	F537 S628 G629 F630 A631	F537-H565 HydrophobicContact CE2-CB 4.2Å; F537-H565 AromaticContact CE2-CD2 3.62Å; F537-H565 AromaticContact CE2-CG 3.92Å; F537-H565 HydrophobicContact CZ-CB 4.18Å; H565-S628 PolarHBondContact NE2-OG 3.31Å; H565-G629 PolarHBondContact CD2-O 3.1Å; H565-F630 VanDerWaalsContact O-CA 3.25Å; H565-F630 WeakPolarHBondContact O-CA 3.04Å; H565-F630 WeakPolarHBondContact O-CB 3.08Å; H565-A631 HydrophobicContact CB-CB 4.11Å; H565-A631 PolarHBondContact N-O 2.77Å; H565-A631 VanDerWaalsContact N-O 3.16Å; H565-A631 PolarHBondContact O-N 2.95Å
566	F	88.9	Confident	77.9	Confident	16 Å²	16	39.4 Å²	39.4	7%	0.07	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	107.8	180	-158.7	-66.9	0	0	0	111.6	F563 L568 I580 F598 G600 I602	F563-F566 HydrophobicContact CB-CD2 4.37Å; F563-F566 AromaticContact CD1-CD2 3.62Å; F563-F566 HydrophobicContact CD1-CD2 3.62Å; F563-F566 HydrophobicContact CD1-CE2 4.09Å; F563-F566 HydrophobicContact CE1-CD2 4.05Å; F563-F566 HydrophobicContact CE1-CE2 4.05Å; F563-F566 HydrophobicContact CG-CD2 4.03Å; F566-L568 HydrophobicContact CD1-CG 4.44Å; F566-L568 HydrophobicContact CE1-CB 4.24Å; F566-L568 HydrophobicContact CE1-CD1 3.92Å; F566-L568 HydrophobicContact CE1-CG 3.85Å; F566-L568 HydrophobicContact CZ-CD1 3.79Å; F566-L568 HydrophobicContact CZ-CG 4.2Å; F566-I580 HydrophobicContact CE2-CG2 3.57Å; F566-I580 HydrophobicContact CZ-CG2 3.68Å; F566-F598 HydrophobicContact CE2-CB 4Å; F566-F598 HydrophobicContact CZ-CB 3.63Å; F566-G600 WeakPolarHBondContact CD1-O 3.32Å; F566-I602 HydrophobicContact CB-CB 4.19Å; F566-I602 HydrophobicContact CD1-CB 4.04Å; F566-I602 HydrophobicContact CD1-CD1 4.08Å; F566-I602 HydrophobicContact CD1-CG1 3.84Å; F566-I602 HydrophobicContact CD2-CB 4.46Å; F566-I602 HydrophobicContact CD2-CD1 4.21Å; F566-I602 HydrophobicContact CE1-CD1 3.8Å; F566-I602 HydrophobicContact CE1-CG1 3.96Å; F566-I602 HydrophobicContact CE2-CD1 3.93Å; F566-I602 HydrophobicContact CG-CB 3.97Å; F566-I602 HydrophobicContact CG-CD1 4.3Å; F566-I602 HydrophobicContact CG-CG1 4.2Å; F566-I602 HydrophobicContact CZ-CD1 3.73Å; F566-I602 HydrophobicContact CZ-CG1 4.38Å
567	D	87.8	Confident	78.1	Confident	16 Å²	16	36.5 Å²	36.5	9%	0.086	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	88.2	179.1	174.1	72.4	0	0	0	108	R601 K627 S628 G629	D567-R601 IonicContact OD1-CZ 3.42Å; D567-R601 VanDerWaalsContact OD1-CZ 3.26Å; D567-R601 IonicContact OD1-NE 3.89Å; D567-R601 PolarHBondContact OD1-NE 2.59Å; D567-R601 IonicContact OD1-NH2 2.72Å; D567-R601 PolarHBondContact OD1-NH2 3.37Å; D567-K627 WeakPolarHBondContact O-CB 3.39Å; D567-S628 WeakPolarHBondContact CB-OG 3.17Å; D567-S628 VanDerWaalsContact CG-OG 3.32Å; D567-S628 WeakPolarHBondContact OD2-CB 3.23Å; D567-S628 PolarHBondContact OD2-N 2.9Å; D567-S628 PolarHBondContact OD2-OG 2.81Å; D567-G629 CarbonylContact C-O 3.45Å; D567-G629 PolarHBondContact N-O 2.91Å; D567-G629 WeakPolarHBondContact O-CA 3.21Å; D567-G629 PolarHBondContact O-N 2.84Å
568	L	87.8	Confident	78.6	Confident	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.181	C	C	.	.			trans	-108.4	168.2	174	-61.4	-172.8	0	0	0	110.1	Y541 F566 I580 G600 F619 K627 F630	Y541-L568 HydrophobicContact CD1-CD2 4.37Å; Y541-L568 HydrophobicContact CE1-CD2 3.67Å; F566-L568 HydrophobicContact CD1-CG 4.44Å; F566-L568 HydrophobicContact CE1-CB 4.24Å; F566-L568 HydrophobicContact CE1-CD1 3.92Å; F566-L568 HydrophobicContact CE1-CG 3.85Å; F566-L568 HydrophobicContact CZ-CD1 3.79Å; F566-L568 HydrophobicContact CZ-CG 4.2Å; L568-I580 HydrophobicContact CD1-CB 4.38Å; L568-I580 HydrophobicContact CD1-CG2 4.32Å; L568-G600 PolarHBondContact N-O 3.27Å; L568-G600 CarbonylContact O-C 3.28Å; L568-G600 VanDerWaalsContact O-CA 3.28Å; L568-G600 WeakPolarHBondContact O-CA 3.47Å; L568-F619 HydrophobicContact CD1-CD2 4.29Å; L568-F619 HydrophobicContact CD1-CE2 3.94Å; L568-F619 HydrophobicContact CD2-CE2 3.57Å; L568-F619 HydrophobicContact CD2-CZ 4.05Å; L568-F619 HydrophobicContact CG-CE2 4.41Å; L568-K627 VanDerWaalsContact C-CG 3.44Å; L568-F630 HydrophobicContact CD2-CD1 4.44Å
569	E	83.3	Confident	79.1	Confident	7 Å²	7	34.6 Å²	34.6	3%	0.033	18%	0.184	C	C	.	.	S	Bend	trans	-62.5	157	162.7	-177.4	163.7	-130.9	0	0	110.5	Y541 Y577 D578 C599 G600 V625 K627 K924	Y541-E569 PolarHBondContact OH-N 3.3Å; E569-Y577 WeakPolarHBondContact OE2-CB 3.34Å; E569-D578 HydrophobicContact CB-CB 4.03Å; E569-C599 WeakPolarHBondContact O-CB 3.2Å; E569-G600 PolarHBondContact O-N 2.85Å; E569-V625 VanDerWaalsContact OE1-CB 3.29Å; E569-V625 WeakPolarHBondContact OE1-CB 3.33Å; E569-V625 VanDerWaalsContact OE1-CG2 3.3Å; E569-V625 WeakPolarHBondContact OE1-CG2 3.35Å; E569-K627 HydrophobicContact CB-CG 4.5Å; E569-K924 VanDerWaalsContact CD-NZ 3.32Å; E569-K924 WeakPolarHBondContact OE1-CE 3.2Å; E569-K924 IonicContact OE1-NZ 3.22Å; E569-K924 PolarHBondContact OE1-NZ 2.74Å; E569-K924 WeakPolarHBondContact OE2-CE 3.34Å; E569-K924 IonicContact OE2-NZ 2.71Å; E569-K924 PolarHBondContact OE2-NZ 3.03Å
570	G	71.9	Confident	79.4	Confident	19 Å²	19	34.6 Å²	34.6	20%	0.196	18%	0.184	C	C	.	.	S	Bend	trans	114.2	173.7	166.4	0	0	0	0	0	114.2	G600 G837	G570-G600 WeakPolarHBondContact O-CA 3.31Å; G570-G837 WeakPolarHBondContact CA-O 3.33Å
571	V	64.8	Low	79.7	Confident	49 Å²	49	37.9 Å²	37.9	30%	0.297	20%	0.199	S	C	.	.	B	Isolated β-bridge	trans	-123.2	136.5	172.9	178.1	0	0	0	0	107.6	T573 N574 C599 Y836 G837	V571-T573 PolarHBondContact O-N 3.37Å; V571-N574 CarbonylContact O-C 3.6Å; V571-N574 PolarHBondContact O-N 3.02Å; V571-N574 VanDerWaalsContact O-N 3.09Å; V571-N574 VanDerWaalsContact O-O 3.05Å; V571-C599 PolarHBondContact O-SG 3.34Å; V571-C599 VanDerWaalsContact O-SG 3.39Å; V571-Y836 WeakPolarHBondContact CG2-O 3.29Å; V571-G837 PolarHBondContact N-O 2.98Å
572	L	61.7	Low	79.9	Confident	104 Å²	104	37.9 Å²	37.9	55%	0.545	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-10.7	-171.6	-81.1	161.9	0	0	0	115.9	I602	L572-I602 HydrophobicContact CD1-CG1 4.37Å; L572-I602 HydrophobicContact CD2-CD1 3.95Å; L572-I602 HydrophobicContact CD2-CG1 3.95Å
573	T	56.7	Low	80.2	Confident	57 Å²	57	36.3 Å²	36.3	35%	0.35	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-30.1	176.4	47.3	0	0	0	0	113.5	V571 N709	V571-T573 PolarHBondContact O-N 3.37Å; T573-N709 WeakPolarHBondContact CG2-O 3.49Å
574	N	60.4	Low	80.3	Confident	61 Å²	61	36.2 Å²	36.2	33%	0.326	19%	0.19	S	C	.	.	B	Isolated β-bridge	trans	-161.5	128.5	173.5	-150.9	32.3	0	0	0	109.8	V571 E576 M835 G838	V571-N574 CarbonylContact O-C 3.6Å; V571-N574 PolarHBondContact O-N 3.02Å; V571-N574 VanDerWaalsContact O-N 3.09Å; V571-N574 VanDerWaalsContact O-O 3.05Å; N574-E576 PolarHBondContact ND2-OE1 2.97Å; N574-M835 HydrophobicContact CB-CE 3.61Å; N574-G838 PolarHBondContact ND2-O 3.36Å; N574-G838 WeakPolarHBondContact O-CA 3.43Å
575	C	70.8	Confident	80.4	Confident	11 Å²	11	32.6 Å²	32.6	7%	0.074	17%	0.168	C	C	.	.			trans	-109.7	60.8	-168.1	-66.4	0	0	0	0	112.5	Y579 Q597 C599	C575-Y579 WeakPolarHBondContact O-CD1 3.06Å; C575-Q597 HydrophobicContact CB-CG 4.02Å; C575-Q597 PolarHBondContact O-NE2 2.86Å; C575-C599 WeakPolarHBondContact CA-SG 3.32Å; C575-C599 HydrophobicContact CB-CB 3.55Å; C575-C599 WeakPolarHBondContact CB-SG 3.3Å; C575-C599 WeakPolarHBondContact SG-CB 3.43Å; C575-C599 PolarHBondContact SG-N 2.88Å; C575-C599 VanDerWaalsContact SG-N 3.42Å; C575-C599 CovalentContact SG-SG 2.04Å; C575-C599 PolarHBondContact SG-SG 3.04Å
576	E	72.2	Confident	80	Confident	115 Å²	115	31.8 Å²	31.8	54%	0.537	17%	0.166	S	C	.	.			trans	-85.1	-23.8	-172.9	-69.3	-171.2	-178.5	0	0	115.3	N574 G838	N574-E576 PolarHBondContact ND2-OE1 2.97Å; E576-G838 VanDerWaalsContact CG-O 3.3Å; E576-G838 WeakPolarHBondContact CG-O 3.04Å
577	Y	77.2	Confident	79.2	Confident	23 Å²	23	33.8 Å²	33.8	9%	0.09	19%	0.191	C	C	.	.	S	Bend	trans	-85.8	-109.8	177.2	-59	-62.6	0	0	0	111.3	E569 Y579 D622 G837 S839 N840 K924	E569-Y577 WeakPolarHBondContact OE2-CB 3.34Å; Y577-Y579 WeakPolarHBondContact O-CD1 3.45Å; Y577-D622 WeakPolarHBondContact CD1-OD2 3.21Å; Y577-G837 WeakPolarHBondContact CD2-O 3.37Å; Y577-S839 VanDerWaalsContact OH-C 3.27Å; Y577-S839 PolarHBondContact OH-O 2.64Å; Y577-N840 PolarHBondContact OH-OD1 3.43Å; Y577-K924 HydrophobicContact CD1-CD 4.41Å; Y577-K924 HydrophobicContact CE1-CD 3.88Å; Y577-K924 HydrophobicContact CE1-CG 4.31Å; Y577-K924 HydrophobicContact CE2-CD 4.34Å; Y577-K924 HydrophobicContact CE2-CG 4.27Å
578	D	87.5	Confident	78.5	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.011	23%	0.228	C	C	.	.	S	Bend	trans	-82.7	132	174.7	-60.5	-23.8	0	0	0	110.9	Y541 E569 C599 V620 T621 D622	Y541-D578 WeakPolarHBondContact CE2-OD2 3.5Å; Y541-D578 PolarHBondContact OH-OD2 3.3Å; E569-D578 HydrophobicContact CB-CB 4.03Å; D578-C599 VanDerWaalsContact O-CB 3.31Å; D578-C599 WeakPolarHBondContact O-CB 3.49Å; D578-V620 WeakPolarHBondContact CA-O 3.36Å; D578-T621 HydrophobicContact CB-CG2 4.5Å; D578-T621 WeakPolarHBondContact OD1-CA 3.34Å; D578-T621 VanDerWaalsContact OD1-CB 3.28Å; D578-T621 WeakPolarHBondContact OD1-CB 3.45Å; D578-D622 PolarHBondContact OD1-N 2.68Å
579	Y	89.4	Confident	77.7	Confident	48 Å²	48	41.7 Å²	41.7	19%	0.188	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	158	179.2	62.6	-96.4	0	0	0	113.6	C575 Y577 K581 Q597 F598 F619 V620	C575-Y579 WeakPolarHBondContact O-CD1 3.06Å; Y577-Y579 WeakPolarHBondContact O-CD1 3.45Å; Y579-K581 HydrophobicContact CD2-CB 4.24Å; Y579-K581 HydrophobicContact CE2-CB 4.3Å; Y579-Q597 HydrophobicContact CD2-CG 3.56Å; Y579-Q597 HydrophobicContact CE2-CG 4.27Å; Y579-Q597 HydrophobicContact CG-CG 3.74Å; Y579-F598 WeakPolarHBondContact CA-O 3.36Å; Y579-F619 WeakPolarHBondContact O-CA 3.36Å; Y579-F619 WeakPolarHBondContact O-CD2 3.42Å; Y579-V620 HydrophobicContact CD1-CB 4.45Å; Y579-V620 HydrophobicContact CD2-CB 4.43Å; Y579-V620 HydrophobicContact CD2-CG2 4.46Å; Y579-V620 HydrophobicContact CE1-CB 3.99Å; Y579-V620 HydrophobicContact CE1-CG1 4.3Å; Y579-V620 HydrophobicContact CE1-CG2 4.47Å; Y579-V620 HydrophobicContact CE2-CB 3.97Å; Y579-V620 HydrophobicContact CE2-CG2 3.7Å; Y579-V620 PolarHBondContact N-O 3.25Å; Y579-V620 PolarHBondContact O-N 3.28Å
580	I	90.9	Very high	77.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.4	164.1	-162.3	175.6	0	0	0	110.2	F563 F566 L568 F598 I617 E618 F619 F630	F563-I580 HydrophobicContact CE1-CD1 3.97Å; F563-I580 HydrophobicContact CE1-CG2 4.47Å; F563-I580 HydrophobicContact CZ-CD1 4.1Å; F563-I580 HydrophobicContact CZ-CG2 4.43Å; F566-I580 HydrophobicContact CE2-CG2 3.57Å; F566-I580 HydrophobicContact CZ-CG2 3.68Å; L568-I580 HydrophobicContact CD1-CB 4.38Å; L568-I580 HydrophobicContact CD1-CG2 4.32Å; I580-F598 HydrophobicContact CG2-CB 3.9Å; I580-F598 PolarHBondContact N-O 2.84Å; I580-F598 PolarHBondContact O-N 2.66Å; I580-I617 HydrophobicContact CD1-CG2 3.47Å; I580-I617 VanDerWaalsContact CD1-CG2 3.47Å; I580-I617 HydrophobicContact CG1-CG2 3.71Å; I580-E618 CarbonylContact C-O 3.57Å; I580-E618 VanDerWaalsContact CA-O 3.29Å; I580-E618 WeakPolarHBondContact CA-O 2.99Å; I580-F619 HydrophobicContact CB-CD2 4.37Å; I580-F619 HydrophobicContact CG1-CB 4.23Å; I580-F630 HydrophobicContact CD1-CD1 4.07Å; I580-F630 HydrophobicContact CD1-CD2 4.17Å; I580-F630 HydrophobicContact CD1-CE1 3.68Å; I580-F630 HydrophobicContact CD1-CE2 3.78Å; I580-F630 HydrophobicContact CD1-CG 4.32Å; I580-F630 HydrophobicContact CD1-CZ 3.53Å
581	K	89.8	Confident	77.9	Confident	69 Å²	69	50.9 Å²	50.9	30%	0.3	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.6	-179.3	-175.1	172.8	-175.5	166.3	0	109.4	Y579 Q597 E618	Y579-K581 HydrophobicContact CD2-CB 4.24Å; Y579-K581 HydrophobicContact CE2-CB 4.3Å; K581-Q597 HydrophobicContact CB-CG 4.48Å; K581-E618 PolarHBondContact N-O 3.43Å; K581-E618 PolarHBondContact O-N 2.83Å
582	V	90.6	Very high	78.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.3	-176.4	-174.9	0	0	0	0	110	L561 H595 G596 F598 L608 L615 I617	L561-V582 HydrophobicContact CD2-CG1 4.13Å; L561-V582 HydrophobicContact CD2-CG2 4.24Å; V582-H595 PolarHBondContact O-N 3.32Å; V582-G596 PolarHBondContact N-O 2.81Å; V582-G596 VanDerWaalsContact N-O 3.08Å; V582-F598 HydrophobicContact CB-CE2 4.28Å; V582-F598 HydrophobicContact CG2-CD2 4.23Å; V582-F598 HydrophobicContact CG2-CE2 4.15Å; V582-L608 HydrophobicContact CB-CD1 3.82Å; V582-L608 HydrophobicContact CG1-CD1 3.56Å; V582-L608 HydrophobicContact CG1-CD2 3.72Å; V582-L608 HydrophobicContact CG1-CG 4.33Å; V582-L608 HydrophobicContact CG2-CD1 4.26Å; V582-L615 HydrophobicContact CG1-CD1 3.78Å; V582-L615 HydrophobicContact CG1-CD2 4.32Å; V582-L615 HydrophobicContact CG1-CG 4.2Å; V582-I617 HydrophobicContact CG2-CG2 4.5Å
583	T	91.2	Very high	79.5	Confident	13 Å²	13	50.5 Å²	50.5	8%	0.08	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	124.5	-168.5	-52.6	0	0	0	0	110.9	V585 V591 K593 V594 R616	T583-V585 HydrophobicContact CG2-CG2 4.38Å; T583-V591 HydrophobicContact CG2-CB 4.31Å; T583-V591 HydrophobicContact CG2-CG1 3.65Å; T583-V591 HydrophobicContact CG2-CG2 4.02Å; T583-K593 CarbonylContact C-O 3.57Å; T583-K593 WeakPolarHBondContact CA-O 3.46Å; T583-K593 WeakPolarHBondContact CG2-O 3.47Å; T583-V594 HydrophobicContact CG2-CG2 4.22Å; T583-R616 PolarHBondContact N-O 3.12Å; T583-R616 PolarHBondContact O-N 3.35Å
584	S	89.2	Confident	80.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	132.7	166	-92.2	0	0	0	0	109.8	A592 K593 H595 S610 E611	S584-A592 PolarHBondContact O-N 3.02Å; S584-K593 PolarHBondContact N-O 3.35Å; S584-K593 PolarHBondContact O-N 3.01Å; S584-H595 WeakPolarHBondContact CB-NE2 3.29Å; S584-H595 PolarHBondContact OG-NE2 2.65Å; S584-S610 WeakPolarHBondContact OG-CA 3.03Å; S584-S610 WeakPolarHBondContact OG-CB 3.43Å; S584-E611 PolarHBondContact OG-N 2.95Å; S584-E611 VanDerWaalsContact OG-N 3.12Å
585	V	87.6	Confident	81.7	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.3	-173.3	179.3	0	0	0	0	109.3	T583 G589 E590 T612 H614 R616	T583-V585 HydrophobicContact CG2-CG2 4.38Å; V585-G589 VanDerWaalsContact CG1-C 3.41Å; V585-G589 WeakPolarHBondContact CG1-O 3.41Å; V585-E590 CarbonylContact C-O 3.59Å; V585-E590 VanDerWaalsContact CA-O 3.3Å; V585-E590 WeakPolarHBondContact CA-O 3.32Å; V585-E590 WeakPolarHBondContact CG1-O 3.44Å; V585-T612 PolarHBondContact N-OG1 2.86Å; V585-T612 WeakPolarHBondContact O-CB 3.33Å; V585-T612 PolarHBondContact O-OG1 2.92Å; V585-H614 HydrophobicContact CB-CB 4.27Å; V585-H614 PolarHBondContact N-O 2.72Å; V585-H614 VanDerWaalsContact N-O 3.13Å; V585-R616 HydrophobicContact CG2-CB 3.58Å
586	D	80.7	Confident	82	Confident	53 Å²	53	50.9 Å²	50.9	28%	0.283	29%	0.288	S	S	.	.			trans	-81.2	-167.6	-179.8	81.4	-5.9	0	0	0	113.6	D588 G589 E590 H614	D586-D588 VanDerWaalsContact C-N 3.34Å; D586-D588 PolarHBondContact O-N 3.24Å; D586-D588 PolarHBondContact OD1-N 3.42Å; D586-G589 PolarHBondContact OD1-N 2.76Å; D586-E590 PolarHBondContact N-O 2.88Å; D586-E590 PolarHBondContact OD1-N 2.9Å; D586-H614 PolarHBondContact O-CE1 2.83Å; D586-H614 VanDerWaalsContact O-CE1 3.32Å; D586-H614 PolarHBondContact O-ND1 3.23Å
587	G	71.7	Confident	82.6	Confident	58 Å²	58	49 Å²	49	60%	0.598	28%	0.28	S	S	*	.	S	Bend	trans	-64.3	-33.7	-179.8	0	0	0	0	0	114.8
588	D	73.2	Confident	83.1	Confident	159 Å²	159	49.1 Å²	49.1	85%	0.85	28%	0.28	S	S	*	.	S	Bend	trans	-101	-17.1	-168.2	-65.8	-46.1	0	0	0	112.6	D586	D586-D588 VanDerWaalsContact C-N 3.34Å; D586-D588 PolarHBondContact O-N 3.24Å; D586-D588 PolarHBondContact OD1-N 3.42Å
589	G	71.8	Confident	83	Confident	27 Å²	27	49 Å²	49	28%	0.278	28%	0.28	S	S	.	.	S	Bend	trans	123.6	0.7	171.3	0	0	0	0	0	114.7	V585 D586 R616	V585-G589 VanDerWaalsContact CG1-C 3.41Å; V585-G589 WeakPolarHBondContact CG1-O 3.41Å; D586-G589 PolarHBondContact OD1-N 2.76Å; G589-R616 PolarHBondContact O-NH1 3.33Å; G589-R616 PolarHBondContact O-NH2 2.84Å
590	E	76.9	Confident	82.5	Confident	135 Å²	135	47 Å²	47	63%	0.631	27%	0.273	S	S	*	.			trans	-81.6	158.2	-176.2	-68.9	-58.4	152.5	0	0	112.8	V585 D586 A592	V585-E590 CarbonylContact C-O 3.59Å; V585-E590 VanDerWaalsContact CA-O 3.3Å; V585-E590 WeakPolarHBondContact CA-O 3.32Å; V585-E590 WeakPolarHBondContact CG1-O 3.44Å; D586-E590 PolarHBondContact N-O 2.88Å; D586-E590 PolarHBondContact OD1-N 2.9Å; E590-A592 PolarHBondContact O-N 2.83Å
591	V	81.3	Confident	82	Confident	84 Å²	84	56 Å²	56	51%	0.509	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	107.3	-176.5	175.6	0	0	0	0	110.3	T583 V594	T583-V591 HydrophobicContact CG2-CB 4.31Å; T583-V591 HydrophobicContact CG2-CG1 3.65Å; T583-V591 HydrophobicContact CG2-CG2 4.02Å; V591-V594 HydrophobicContact CG1-CG2 3.95Å
592	A	79.5	Confident	81	Confident	53 Å²	53	53.9 Å²	53.9	44%	0.438	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-45.5	171.5	0	0	0	0	0	111.2	S584 E590 T612	S584-A592 PolarHBondContact O-N 3.02Å; E590-A592 PolarHBondContact O-N 2.83Å; A592-T612 HydrophobicContact CB-CG2 3.69Å
593	K	80.9	Confident	79.3	Confident	91 Å²	91	57.7 Å²	57.7	40%	0.396	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	136.1	176.6	-177.3	172.7	-175.5	-179.7	0	112.5	T583 S584 E611	T583-K593 CarbonylContact C-O 3.57Å; T583-K593 WeakPolarHBondContact CA-O 3.46Å; T583-K593 WeakPolarHBondContact CG2-O 3.47Å; S584-K593 PolarHBondContact N-O 3.35Å; S584-K593 PolarHBondContact O-N 3.01Å; K593-E611 WeakPolarHBondContact CB-OE2 3.48Å; K593-E611 HydrophobicContact CD-CG 4.31Å; K593-E611 WeakPolarHBondContact CD-OE1 3.44Å; K593-E611 WeakPolarHBondContact CD-OE2 3.47Å; K593-E611 WeakPolarHBondContact CE-OE1 3.28Å; K593-E611 IonicContact NZ-OE1 3Å; K593-E611 PolarHBondContact NZ-OE1 3.09Å
594	V	83.7	Confident	77.2	Confident	70 Å²	70	61.4 Å²	61.4	42%	0.424	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.2	163.8	-177.4	0	0	0	0	107.9	T583 V591	T583-V594 HydrophobicContact CG2-CG2 4.22Å; V591-V594 HydrophobicContact CG1-CG2 3.95Å
595	H	80.4	Confident	75.4	Confident	47 Å²	47	69.2 Å²	69.2	22%	0.218	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-23.3	179.4	-67.9	-84.4	0	0	0	112.8	V582 S584 L608 T609	V582-H595 PolarHBondContact O-N 3.32Å; S584-H595 WeakPolarHBondContact CB-NE2 3.29Å; S584-H595 PolarHBondContact OG-NE2 2.65Å; H595-L608 HydrophobicContact CB-CD1 3.6Å; H595-L608 HydrophobicContact CB-CD2 4.35Å; H595-L608 HydrophobicContact CB-CG 4.12Å; H595-T609 PolarHBondContact CE1-O 3.47Å
596	G	77.2	Confident	74.3	Confident	21 Å²	21	72.4 Å²	72.4	22%	0.216	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.8	171.6	175.3	0	0	0	0	0	112.9	V582	V582-G596 PolarHBondContact N-O 2.81Å; V582-G596 VanDerWaalsContact N-O 3.08Å
597	Q	84.9	Confident	73.8	Confident	76 Å²	76	73.5 Å²	73.5	36%	0.355	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.6	168.6	-173.1	165.4	-45.6	0	0	106.6	C575 Y579 K581	C575-Q597 HydrophobicContact CB-CG 4.02Å; C575-Q597 PolarHBondContact O-NE2 2.86Å; Y579-Q597 HydrophobicContact CD2-CG 3.56Å; Y579-Q597 HydrophobicContact CE2-CG 4.27Å; Y579-Q597 HydrophobicContact CG-CG 3.74Å; K581-Q597 HydrophobicContact CB-CG 4.48Å
598	F	86.6	Confident	74	Confident	24 Å²	24	71.1 Å²	71.1	11%	0.105	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	134.6	-162.2	-59.1	-76.6	0	0	0	110.1	F566 Y579 I580 V582 I602 F606 L608	F566-F598 HydrophobicContact CE2-CB 4Å; F566-F598 HydrophobicContact CZ-CB 3.63Å; Y579-F598 WeakPolarHBondContact CA-O 3.36Å; I580-F598 HydrophobicContact CG2-CB 3.9Å; I580-F598 PolarHBondContact N-O 2.84Å; I580-F598 PolarHBondContact O-N 2.66Å; V582-F598 HydrophobicContact CB-CE2 4.28Å; V582-F598 HydrophobicContact CG2-CD2 4.23Å; V582-F598 HydrophobicContact CG2-CE2 4.15Å; F598-I602 HydrophobicContact CB-CD1 3.74Å; F598-I602 HydrophobicContact CD1-CD1 3.82Å; F598-I602 HydrophobicContact CG-CD1 4.16Å; F598-F606 HydrophobicContact CD1-CE1 4.45Å; F598-F606 HydrophobicContact CD1-CZ 4.49Å; F598-F606 AromaticContact CE1-CE1 3.79Å; F598-F606 HydrophobicContact CE1-CE1 3.79Å; F598-F606 HydrophobicContact CE1-CE2 4.3Å; F598-F606 AromaticContact CE1-CZ 3.53Å; F598-F606 HydrophobicContact CE1-CZ 3.53Å; F598-F606 HydrophobicContact CE2-CE1 4.18Å; F598-F606 HydrophobicContact CE2-CZ 4.49Å; F598-F606 AromaticContact CZ-CE1 3.64Å; F598-F606 HydrophobicContact CZ-CE1 3.64Å; F598-F606 AromaticContact CZ-CZ 3.53Å; F598-F606 HydrophobicContact CZ-CZ 3.53Å; F598-L608 HydrophobicContact CE2-CD1 4.24Å; F598-L608 HydrophobicContact CZ-CD1 4.43Å
599	C	85.9	Confident	74.3	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.354	C	S	.	.			trans	-152	176.8	-175.1	63.7	0	0	0	0	110.9	E569 V571 C575 D578	E569-C599 WeakPolarHBondContact O-CB 3.2Å; V571-C599 PolarHBondContact O-SG 3.34Å; V571-C599 VanDerWaalsContact O-SG 3.39Å; C575-C599 WeakPolarHBondContact CA-SG 3.32Å; C575-C599 HydrophobicContact CB-CB 3.55Å; C575-C599 WeakPolarHBondContact CB-SG 3.3Å; C575-C599 WeakPolarHBondContact SG-CB 3.43Å; C575-C599 PolarHBondContact SG-N 2.88Å; C575-C599 VanDerWaalsContact SG-N 3.42Å; C575-C599 CovalentContact SG-SG 2.04Å; C575-C599 PolarHBondContact SG-SG 3.04Å; D578-C599 VanDerWaalsContact O-CB 3.31Å; D578-C599 WeakPolarHBondContact O-CB 3.49Å
600	G	79.4	Confident	74.9	Confident	5 Å²	5	63.9 Å²	63.9	5%	0.052	34%	0.341	C	S	.	.	S	Bend	trans	65.5	-137.3	-179.1	0	0	0	0	0	113.5	F566 L568 E569 G570	F566-G600 WeakPolarHBondContact CD1-O 3.32Å; L568-G600 PolarHBondContact N-O 3.27Å; L568-G600 CarbonylContact O-C 3.28Å; L568-G600 VanDerWaalsContact O-CA 3.28Å; L568-G600 WeakPolarHBondContact O-CA 3.47Å; E569-G600 PolarHBondContact O-N 2.85Å; G570-G600 WeakPolarHBondContact O-CA 3.31Å
601	R	79.3	Confident	75	Confident	190 Å²	190	62 Å²	62	72%	0.717	33%	0.332	S	S	*	.	B	Isolated β-bridge	trans	-115.5	120	178.4	-72.1	179.5	173.8	168.3	0	110.7	D567	D567-R601 IonicContact OD1-CZ 3.42Å; D567-R601 VanDerWaalsContact OD1-CZ 3.26Å; D567-R601 IonicContact OD1-NE 3.89Å; D567-R601 PolarHBondContact OD1-NE 2.59Å; D567-R601 IonicContact OD1-NH2 2.72Å; D567-R601 PolarHBondContact OD1-NH2 3.37Å
602	I	68.5	Low	75.1	Confident	25 Å²	25	59.7 Å²	59.7	13%	0.128	32%	0.318	C	S	.	.			trans	-108.5	145.5	179.1	-61.1	-176.9	0	0	0	109.2	F566 L572 F598 F606	F566-I602 HydrophobicContact CB-CB 4.19Å; F566-I602 HydrophobicContact CD1-CB 4.04Å; F566-I602 HydrophobicContact CD1-CD1 4.08Å; F566-I602 HydrophobicContact CD1-CG1 3.84Å; F566-I602 HydrophobicContact CD2-CB 4.46Å; F566-I602 HydrophobicContact CD2-CD1 4.21Å; F566-I602 HydrophobicContact CE1-CD1 3.8Å; F566-I602 HydrophobicContact CE1-CG1 3.96Å; F566-I602 HydrophobicContact CE2-CD1 3.93Å; F566-I602 HydrophobicContact CG-CB 3.97Å; F566-I602 HydrophobicContact CG-CD1 4.3Å; F566-I602 HydrophobicContact CG-CG1 4.2Å; F566-I602 HydrophobicContact CZ-CD1 3.73Å; F566-I602 HydrophobicContact CZ-CG1 4.38Å; L572-I602 HydrophobicContact CD1-CG1 4.37Å; L572-I602 HydrophobicContact CD2-CD1 3.95Å; L572-I602 HydrophobicContact CD2-CG1 3.95Å; F598-I602 HydrophobicContact CB-CD1 3.74Å; F598-I602 HydrophobicContact CD1-CD1 3.82Å; F598-I602 HydrophobicContact CG-CD1 4.16Å; I602-F606 HydrophobicContact CG2-CB 3.98Å; I602-F606 HydrophobicContact CG2-CG 4.37Å
603	A	55.7	Low	75.3	Confident	79 Å²	79	58.3 Å²	58.3	65%	0.653	31%	0.305	S	S	*	.			trans	-58.2	134.2	178.2	0	0	0	0	0	111.2	Q605	A603-Q605 PolarHBondContact O-N 2.82Å
604	P	46.4	Very low	75.7	Confident	92 Å²	92	54.7 Å²	54.7	60%	0.597	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	69.8	-173.8	31.6	-36.6	0	0	0	112.3
605	Q	52.5	Low	76	Confident	164 Å²	164	51.3 Å²	51.3	77%	0.766	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-167.9	17.7	168.7	-113.2	143.7	109.9	0	0	113	A603 L607	A603-Q605 PolarHBondContact O-N 2.82Å; Q605-L607 PolarHBondContact O-N 3.42Å
606	F	63.8	Low	76.5	Confident	68 Å²	68	51.9 Å²	51.9	30%	0.298	27%	0.269	S	S	.	.			trans	-68.8	104.1	-177.8	-172.7	-104.9	0	0	0	111.1	N562 F563 F598 I602 L608	N562-F606 WeakPolarHBondContact CA-O 3.16Å; F563-F606 AromaticContact CD2-CD1 3.97Å; F563-F606 HydrophobicContact CD2-CD1 3.97Å; F563-F606 HydrophobicContact CE2-CD1 4.32Å; F563-F606 PolarHBondContact N-O 2.78Å; F563-F606 VanDerWaalsContact N-O 3.16Å; F598-F606 HydrophobicContact CD1-CE1 4.45Å; F598-F606 HydrophobicContact CD1-CZ 4.49Å; F598-F606 AromaticContact CE1-CE1 3.79Å; F598-F606 HydrophobicContact CE1-CE1 3.79Å; F598-F606 HydrophobicContact CE1-CE2 4.3Å; F598-F606 AromaticContact CE1-CZ 3.53Å; F598-F606 HydrophobicContact CE1-CZ 3.53Å; F598-F606 HydrophobicContact CE2-CE1 4.18Å; F598-F606 HydrophobicContact CE2-CZ 4.49Å; F598-F606 AromaticContact CZ-CE1 3.64Å; F598-F606 HydrophobicContact CZ-CE1 3.64Å; F598-F606 AromaticContact CZ-CZ 3.53Å; F598-F606 HydrophobicContact CZ-CZ 3.53Å; I602-F606 HydrophobicContact CG2-CB 3.98Å; I602-F606 HydrophobicContact CG2-CG 4.37Å; F606-L608 HydrophobicContact CE1-CB 4.1Å; F606-L608 HydrophobicContact CE1-CD1 3.95Å; F606-L608 HydrophobicContact CZ-CD1 4.46Å
607	L	69.5	Low	77.1	Confident	75 Å²	75	50.9 Å²	50.9	39%	0.393	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.4	176.2	-174.3	71.4	0	0	0	109.9	F560 L561 N562 Q605	F560-L607 HydrophobicContact CB-CD1 4.25Å; F560-L607 HydrophobicContact CD1-CD1 4.33Å; F560-L607 HydrophobicContact CD1-CD2 4.3Å; F560-L607 HydrophobicContact CD1-CG 4.37Å; L561-L607 CarbonylContact O-C 3.53Å; L561-L607 WeakPolarHBondContact O-CA 3.03Å; N562-L607 HydrophobicContact CB-CD1 3.89Å; Q605-L607 PolarHBondContact O-N 3.42Å
608	L	76.6	Confident	77.4	Confident	8 Å²	8	49.1 Å²	49.1	4%	0.042	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	130.3	-179	-178.5	159.9	0	0	0	109.4	F560 L561 V582 H595 F598 F606 L615	F560-L608 CarbonylContact C-O 3.54Å; F560-L608 WeakPolarHBondContact CA-O 3.32Å; L561-L608 HydrophobicContact CB-CB 4.47Å; L561-L608 PolarHBondContact N-O 3.26Å; L561-L608 PolarHBondContact O-N 2.88Å; V582-L608 HydrophobicContact CB-CD1 3.82Å; V582-L608 HydrophobicContact CG1-CD1 3.56Å; V582-L608 HydrophobicContact CG1-CD2 3.72Å; V582-L608 HydrophobicContact CG1-CG 4.33Å; V582-L608 HydrophobicContact CG2-CD1 4.26Å; H595-L608 HydrophobicContact CB-CD1 3.6Å; H595-L608 HydrophobicContact CB-CD2 4.35Å; H595-L608 HydrophobicContact CB-CG 4.12Å; F598-L608 HydrophobicContact CE2-CD1 4.24Å; F598-L608 HydrophobicContact CZ-CD1 4.43Å; F606-L608 HydrophobicContact CE1-CB 4.1Å; F606-L608 HydrophobicContact CE1-CD1 3.95Å; F606-L608 HydrophobicContact CZ-CD1 4.46Å; L608-L615 HydrophobicContact CD2-CD1 4.18Å; L608-L615 HydrophobicContact CD2-CD2 4.28Å
609	T	79.9	Confident	77.6	Confident	35 Å²	35	48 Å²	48	22%	0.215	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.8	-178.3	-49.8	0	0	0	0	110.1	F560 H595	F560-T609 HydrophobicContact CD1-CG2 4.07Å; F560-T609 WeakPolarHBondContact CD1-OG1 3.49Å; F560-T609 HydrophobicContact CE1-CG2 3.56Å; F560-T609 WeakPolarHBondContact CE1-OG1 3.44Å; F560-T609 HydrophobicContact CE2-CG2 4.3Å; F560-T609 HydrophobicContact CZ-CG2 3.68Å; H595-T609 PolarHBondContact CE1-O 3.47Å
610	S	83.9	Confident	77.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.254	C	S	.	.			trans	-75.2	138.4	174	79.4	0	0	0	0	111.2	R558 I559 S584 T612	R558-S610 WeakPolarHBondContact CD-O 3.39Å; R558-S610 WeakPolarHBondContact CG-O 3.32Å; I559-S610 WeakPolarHBondContact CB-OG 3.45Å; I559-S610 PolarHBondContact N-OG 3.29Å; I559-S610 WeakPolarHBondContact O-CB 3.04Å; I559-S610 PolarHBondContact O-N 2.9Å; I559-S610 PolarHBondContact O-OG 3.03Å; S584-S610 WeakPolarHBondContact OG-CA 3.03Å; S584-S610 WeakPolarHBondContact OG-CB 3.43Å; S610-T612 WeakPolarHBondContact CB-O 3.32Å; S610-T612 PolarHBondContact OG-O 2.91Å
611	E	79.3	Confident	78.3	Confident	96 Å²	96	49.5 Å²	49.5	45%	0.449	25%	0.254	S	S	.	.	S	Bend	trans	-76.9	-36.9	174.4	-66.9	-179.5	161.2	0	0	111.1	S584 K593	S584-E611 PolarHBondContact OG-N 2.95Å; S584-E611 VanDerWaalsContact OG-N 3.12Å; K593-E611 WeakPolarHBondContact CB-OE2 3.48Å; K593-E611 HydrophobicContact CD-CG 4.31Å; K593-E611 WeakPolarHBondContact CD-OE1 3.44Å; K593-E611 WeakPolarHBondContact CD-OE2 3.47Å; K593-E611 WeakPolarHBondContact CE-OE1 3.28Å; K593-E611 IonicContact NZ-OE1 3Å; K593-E611 PolarHBondContact NZ-OE1 3.09Å
612	T	82.8	Confident	78.5	Confident	34 Å²	34	42 Å²	42	21%	0.209	23%	0.228	C	C	.	.	S	Bend	trans	-102	165.2	178	58.7	0	0	0	0	111.9	V585 A592 S610 H614	V585-T612 PolarHBondContact N-OG1 2.86Å; V585-T612 WeakPolarHBondContact O-CB 3.33Å; V585-T612 PolarHBondContact O-OG1 2.92Å; A592-T612 HydrophobicContact CB-CG2 3.69Å; S610-T612 WeakPolarHBondContact CB-O 3.32Å; S610-T612 PolarHBondContact OG-O 2.91Å; T612-H614 PolarHBondContact O-N 3.32Å; T612-H614 PolarHBondContact OG1-O 3Å
613	S	85.2	Confident	79.1	Confident	25 Å²	25	44.6 Å²	44.6	18%	0.175	25%	0.249	C	C	.	.	S	Bend	trans	-74.2	3.9	175.5	59.6	0	0	0	0	115.2	A553 H554 Y557 I559	A553-S613 WeakPolarHBondContact CB-O 3.3Å; A553-S613 PolarHBondContact N-O 2.98Å; H554-S613 WeakPolarHBondContact O-CB 3.3Å; Y557-S613 WeakPolarHBondContact O-CA 3.02Å; Y557-S613 VanDerWaalsContact O-CB 3.3Å; Y557-S613 WeakPolarHBondContact O-CB 3.39Å; I559-S613 WeakPolarHBondContact CD1-O 3.18Å
614	H	88.8	Confident	80	Confident	14 Å²	14	42.4 Å²	42.4	7%	0.065	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.2	172.4	-50.1	153.1	0	0	0	110.8	I551 K552 V585 D586 T612	I551-H614 WeakPolarHBondContact O-CA 3.16Å; K552-H614 WeakPolarHBondContact CD-NE2 3.47Å; K552-H614 WeakPolarHBondContact CE-NE2 3.33Å; K552-H614 PolarHBondContact NZ-CE1 2.63Å; K552-H614 PolarHBondContact NZ-NE2 2.88Å; V585-H614 HydrophobicContact CB-CB 4.27Å; V585-H614 PolarHBondContact N-O 2.72Å; V585-H614 VanDerWaalsContact N-O 3.13Å; D586-H614 PolarHBondContact O-CE1 2.83Å; D586-H614 VanDerWaalsContact O-CE1 3.32Å; D586-H614 PolarHBondContact O-ND1 3.23Å; T612-H614 PolarHBondContact O-N 3.32Å; T612-H614 PolarHBondContact OG1-O 3Å
615	L	89.7	Confident	81.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	121	177.3	-171.4	69.1	0	0	0	110.1	E550 I551 I559 L561 V582 L608 I617	E550-L615 WeakPolarHBondContact CA-O 3.35Å; I551-L615 HydrophobicContact CB-CB 4.48Å; I551-L615 HydrophobicContact CD1-CD2 4.42Å; I551-L615 PolarHBondContact N-O 2.84Å; I551-L615 PolarHBondContact O-N 2.97Å; I559-L615 HydrophobicContact CB-CB 4.41Å; I559-L615 HydrophobicContact CD1-CB 3.74Å; I559-L615 HydrophobicContact CG2-CB 4.36Å; I559-L615 HydrophobicContact CG2-CD2 3.99Å; L561-L615 HydrophobicContact CB-CD2 4.06Å; L561-L615 HydrophobicContact CD2-CD2 4.16Å; V582-L615 HydrophobicContact CG1-CD1 3.78Å; V582-L615 HydrophobicContact CG1-CD2 4.32Å; V582-L615 HydrophobicContact CG1-CG 4.2Å; L608-L615 HydrophobicContact CD2-CD1 4.18Å; L608-L615 HydrophobicContact CD2-CD2 4.28Å; L615-I617 HydrophobicContact CG-CG1 4.46Å
616	R	90.4	Very high	82.7	Confident	59 Å²	59	35.3 Å²	35.3	22%	0.223	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.8	177.4	-174.3	178.7	-66.1	151.9	2.2	109.7	V548 E550 T583 V585 G589	V548-R616 HydrophobicContact CG1-CG 4.17Å; E550-R616 IonicContact OE1-CZ 3.77Å; E550-R616 IonicContact OE1-NE 3.68Å; E550-R616 PolarHBondContact OE1-NE 2.97Å; E550-R616 IonicContact OE1-NH2 2.94Å; E550-R616 PolarHBondContact OE1-NH2 3.07Å; T583-R616 PolarHBondContact N-O 3.12Å; T583-R616 PolarHBondContact O-N 3.35Å; V585-R616 HydrophobicContact CG2-CB 3.58Å; G589-R616 PolarHBondContact O-NH1 3.33Å; G589-R616 PolarHBondContact O-NH2 2.84Å
617	I	91	Very high	83.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	118.9	-177.3	-54.8	173.2	0	0	0	107.3	L532 V548 W549 I551 L561 I580 V582 L615	L532-I617 HydrophobicContact CD1-CB 4.49Å; L532-I617 HydrophobicContact CD1-CD1 3.72Å; L532-I617 HydrophobicContact CD1-CG2 4.11Å; L532-I617 HydrophobicContact CD2-CD1 4.19Å; V548-I617 WeakPolarHBondContact CA-O 3.44Å; W549-I617 HydrophobicContact CB-CB 4.45Å; W549-I617 HydrophobicContact CE3-CG2 4.32Å; W549-I617 PolarHBondContact N-O 2.96Å; W549-I617 PolarHBondContact O-N 2.94Å; I551-I617 HydrophobicContact CD1-CD1 3.82Å; L561-I617 HydrophobicContact CD1-CD1 3.96Å; L561-I617 HydrophobicContact CD2-CD1 3.67Å; L561-I617 HydrophobicContact CD2-CG1 4.27Å; L561-I617 HydrophobicContact CG-CD1 4.46Å; I580-I617 HydrophobicContact CD1-CG2 3.47Å; I580-I617 VanDerWaalsContact CD1-CG2 3.47Å; I580-I617 HydrophobicContact CG1-CG2 3.71Å; V582-I617 HydrophobicContact CG2-CG2 4.5Å; L615-I617 HydrophobicContact CG-CG1 4.46Å
618	E	90.6	Very high	84.6	Confident	38 Å²	38	33 Å²	33	18%	0.178	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.3	-176.5	172.7	169	180	0	0	109.8	R546 C547 V548 I580 K581 V620	R546-E618 IonicContact CZ-OE1 2.85Å; R546-E618 IonicContact NE-OE1 2.65Å; R546-E618 PolarHBondContact NE-OE1 3.49Å; R546-E618 IonicContact NH2-OE1 2.69Å; R546-E618 PolarHBondContact NH2-OE1 3.12Å; R546-E618 IonicContact NH2-OE2 3.25Å; R546-E618 PolarHBondContact NH2-OE2 3.24Å; R546-E618 VanDerWaalsContact NH2-OE2 3.13Å; C547-E618 WeakPolarHBondContact O-CA 3.48Å; V548-E618 HydrophobicContact CG2-CB 4.46Å; V548-E618 HydrophobicContact CG2-CG 4.27Å; I580-E618 CarbonylContact C-O 3.57Å; I580-E618 VanDerWaalsContact CA-O 3.29Å; I580-E618 WeakPolarHBondContact CA-O 2.99Å; K581-E618 PolarHBondContact N-O 3.43Å; K581-E618 PolarHBondContact O-N 2.83Å; E618-V620 HydrophobicContact CG-CG2 3.93Å
619	F	91.5	Very high	85.2	Confident	1 Å²	1	32.6 Å²	32.6	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.6	175.5	173.7	-124.4	0	0	0	109.3	Y541 R546 C547 W549 L568 Y579 I580 T621 F630	Y541-F619 HydrophobicContact CD1-CZ 4.01Å; Y541-F619 HydrophobicContact CD2-CZ 4.06Å; Y541-F619 HydrophobicContact CE1-CZ 4.29Å; Y541-F619 HydrophobicContact CE2-CZ 4.35Å; Y541-F619 HydrophobicContact CG-CE1 4.32Å; Y541-F619 AromaticContact CG-CZ 3.88Å; Y541-F619 HydrophobicContact CG-CZ 3.88Å; R546-F619 CarbonylContact C-O 3.58Å; R546-F619 VanDerWaalsContact CA-O 3.31Å; R546-F619 WeakPolarHBondContact CA-O 3.1Å; C547-F619 HydrophobicContact CB-CB 4.31Å; C547-F619 HydrophobicContact CB-CD1 4.39Å; C547-F619 PolarHBondContact N-O 2.91Å; C547-F619 PolarHBondContact O-N 2.65Å; W549-F619 HydrophobicContact CH2-CB 4.38Å; W549-F619 HydrophobicContact CZ3-CB 3.82Å; L568-F619 HydrophobicContact CD1-CD2 4.29Å; L568-F619 HydrophobicContact CD1-CE2 3.94Å; L568-F619 HydrophobicContact CD2-CE2 3.57Å; L568-F619 HydrophobicContact CD2-CZ 4.05Å; L568-F619 HydrophobicContact CG-CE2 4.41Å; Y579-F619 WeakPolarHBondContact O-CA 3.36Å; Y579-F619 WeakPolarHBondContact O-CD2 3.42Å; I580-F619 HydrophobicContact CB-CD2 4.37Å; I580-F619 HydrophobicContact CG1-CB 4.23Å; F619-T621 HydrophobicContact CD1-CG2 4.41Å; F619-T621 HydrophobicContact CE1-CG2 3.58Å; F619-T621 HydrophobicContact CE2-CG2 3.76Å; F619-T621 HydrophobicContact CZ-CG2 3.2Å; F619-F630 HydrophobicContact CB-CE1 4.03Å; F619-F630 HydrophobicContact CB-CZ 4.44Å; F619-F630 HydrophobicContact CD1-CE1 4.03Å; F619-F630 HydrophobicContact CD2-CD1 4.35Å; F619-F630 AromaticContact CD2-CE1 3.87Å; F619-F630 HydrophobicContact CD2-CE1 3.87Å; F619-F630 HydrophobicContact CE1-CE1 4.46Å; F619-F630 HydrophobicContact CE2-CD1 4.49Å; F619-F630 HydrophobicContact CE2-CE1 4.33Å; F619-F630 AromaticContact CG-CE1 3.71Å; F619-F630 HydrophobicContact CG-CE1 3.71Å
620	V	90	Very high	85.7	Confident	28 Å²	28	30.9 Å²	30.9	17%	0.17	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.4	-178.1	-173.7	0	0	0	0	109	K545 R546 D578 Y579 E618	K545-V620 CarbonylContact O-C 3.58Å; K545-V620 WeakPolarHBondContact O-CA 3.05Å; R546-V620 HydrophobicContact CG-CG2 4.3Å; D578-V620 WeakPolarHBondContact CA-O 3.36Å; Y579-V620 HydrophobicContact CD1-CB 4.45Å; Y579-V620 HydrophobicContact CD2-CB 4.43Å; Y579-V620 HydrophobicContact CD2-CG2 4.46Å; Y579-V620 HydrophobicContact CE1-CB 3.99Å; Y579-V620 HydrophobicContact CE1-CG1 4.3Å; Y579-V620 HydrophobicContact CE1-CG2 4.47Å; Y579-V620 HydrophobicContact CE2-CB 3.97Å; Y579-V620 HydrophobicContact CE2-CG2 3.7Å; Y579-V620 PolarHBondContact N-O 3.25Å; Y579-V620 PolarHBondContact O-N 3.28Å; E618-V620 HydrophobicContact CG-CG2 3.93Å
621	T	88.3	Confident	86	Confident	9 Å²	9	31.4 Å²	31.4	6%	0.055	17%	0.171	C	C	.	.			trans	-125.8	145.8	175.4	65.7	0	0	0	0	113.5	Y541 P542 K544 K545 D578 F619	Y541-T621 HydrophobicContact CD2-CG2 3.59Å; Y541-T621 HydrophobicContact CE2-CG2 3.65Å; Y541-T621 HydrophobicContact CG-CG2 4.45Å; P542-T621 PolarHBondContact O-OG1 3.08Å; K544-T621 WeakPolarHBondContact CA-O 3.49Å; K544-T621 PolarHBondContact N-O 2.88Å; K544-T621 PolarHBondContact N-OG1 2.95Å; K545-T621 PolarHBondContact N-OG1 2.92Å; K545-T621 PolarHBondContact O-N 2.77Å; K545-T621 PolarHBondContact O-OG1 2.85Å; D578-T621 HydrophobicContact CB-CG2 4.5Å; D578-T621 WeakPolarHBondContact OD1-CA 3.34Å; D578-T621 VanDerWaalsContact OD1-CB 3.28Å; D578-T621 WeakPolarHBondContact OD1-CB 3.45Å; F619-T621 HydrophobicContact CD1-CG2 4.41Å; F619-T621 HydrophobicContact CE1-CG2 3.58Å; F619-T621 HydrophobicContact CE2-CG2 3.76Å; F619-T621 HydrophobicContact CZ-CG2 3.2Å
622	D	84.4	Confident	86.5	Confident	31 Å²	31	26.9 Å²	26.9	17%	0.166	15%	0.15	C	C	.	.			trans	-84.2	-166.8	-176.7	97.4	-15.8	0	0	0	112.6	N543 K544 Y577 D578 S624 K924	N543-D622 CarbonylContact C-O 3.53Å; N543-D622 WeakPolarHBondContact CA-O 3.43Å; N543-D622 WeakPolarHBondContact CB-O 3.33Å; K544-D622 PolarHBondContact N-O 3.47Å; Y577-D622 WeakPolarHBondContact CD1-OD2 3.21Å; D578-D622 PolarHBondContact OD1-N 2.68Å; D622-S624 VanDerWaalsContact C-N 3.3Å; D622-S624 VanDerWaalsContact CG-OG 3.22Å; D622-S624 PolarHBondContact O-N 3.46Å; D622-S624 WeakPolarHBondContact OD1-CA 3.33Å; D622-S624 WeakPolarHBondContact OD1-CB 3.28Å; D622-S624 PolarHBondContact OD1-N 2.78Å; D622-S624 PolarHBondContact OD1-OG 3.4Å; D622-S624 PolarHBondContact OD2-OG 2.78Å; D622-K924 IonicContact OD1-NZ 2.67Å; D622-K924 IonicContact OD2-NZ 3.88Å; D622-K924 PolarHBondContact OD2-NZ 3.32Å
623	S	80.6	Confident	86.8	Confident	81 Å²	81	27.9 Å²	27.9	57%	0.566	16%	0.156	S	C	*	.	S	Bend	trans	-75	-4.3	178	36.1	0	0	0	0	116.3	N543	N543-S623 PolarHBondContact ND2-O 3.21Å
624	S	75.5	Confident	87	Confident	33 Å²	33	27.3 Å²	27.3	23%	0.231	15%	0.15	C	C	.	.	S	Bend	trans	-133.4	-110.4	-154.1	70.3	0	0	0	0	115.9	N543 D622 Q626 K924	N543-S624 WeakPolarHBondContact ND2-CA 3.27Å; N543-S624 PolarHBondContact ND2-N 2.96Å; N543-S624 PolarHBondContact ND2-O 3.34Å; N543-S624 PolarHBondContact OD1-O 3.4Å; D622-S624 VanDerWaalsContact C-N 3.3Å; D622-S624 VanDerWaalsContact CG-OG 3.22Å; D622-S624 PolarHBondContact O-N 3.46Å; D622-S624 WeakPolarHBondContact OD1-CA 3.33Å; D622-S624 WeakPolarHBondContact OD1-CB 3.28Å; D622-S624 PolarHBondContact OD1-N 2.78Å; D622-S624 PolarHBondContact OD1-OG 3.4Å; D622-S624 PolarHBondContact OD2-OG 2.78Å; S624-Q626 PolarHBondContact O-N 3.28Å; S624-K924 PolarHBondContact OG-NZ 3.16Å
625	V	72.9	Confident	86.9	Confident	30 Å²	30	29.7 Å²	29.7	18%	0.182	16%	0.161	C	C	.	.			trans	-76.1	107.5	-155.5	178.5	0	0	0	0	112.9	E569 K627	E569-V625 VanDerWaalsContact OE1-CB 3.29Å; E569-V625 WeakPolarHBondContact OE1-CB 3.33Å; E569-V625 VanDerWaalsContact OE1-CG2 3.3Å; E569-V625 WeakPolarHBondContact OE1-CG2 3.35Å; V625-K627 HydrophobicContact CG1-CD 4.29Å
626	Q	81.5	Confident	86.5	Confident	76 Å²	76	30.7 Å²	30.7	36%	0.355	17%	0.167	S	C	.	.			trans	-77	139.9	174.5	-53.4	176	-9.2	0	0	112.2	L540 Y541 N543 S624	L540-Q626 HydrophobicContact CB-CB 3.89Å; L540-Q626 HydrophobicContact CD1-CB 4.23Å; L540-Q626 HydrophobicContact CD2-CB 4.32Å; L540-Q626 HydrophobicContact CG-CB 4.36Å; Y541-Q626 HydrophobicContact CE2-CB 4.49Å; Y541-Q626 WeakPolarHBondContact O-CG 3.01Å; Y541-Q626 PolarHBondContact O-NE2 3.08Å; N543-Q626 WeakPolarHBondContact OD1-CG 3.24Å; N543-Q626 PolarHBondContact OD1-NE2 3.47Å; S624-Q626 PolarHBondContact O-N 3.28Å
627	K	85.9	Confident	85.5	Confident	66 Å²	66	29.2 Å²	29.2	29%	0.287	16%	0.164	S	C	.	.			trans	-121.4	-179.4	169.6	-58.2	-59	-174.4	-164.8	0	111	L540 Y541 D567 L568 E569 V625 G629	L540-K627 WeakPolarHBondContact CA-O 3.38Å; L540-K627 VanDerWaalsContact CD2-C 3.49Å; L540-K627 WeakPolarHBondContact CD2-O 3.27Å; Y541-K627 WeakPolarHBondContact CD1-O 3.38Å; Y541-K627 HydrophobicContact CE1-CB 3.86Å; Y541-K627 WeakPolarHBondContact CE1-O 3.43Å; Y541-K627 VanDerWaalsContact CZ-N 3.29Å; Y541-K627 PolarHBondContact OH-N 3.46Å; D567-K627 WeakPolarHBondContact O-CB 3.39Å; L568-K627 VanDerWaalsContact C-CG 3.44Å; E569-K627 HydrophobicContact CB-CG 4.5Å; V625-K627 HydrophobicContact CG1-CD 4.29Å; K627-G629 PolarHBondContact O-N 3.5Å
628	S	88.2	Confident	84.4	Confident	28 Å²	28	31.3 Å²	31.3	20%	0.196	18%	0.175	C	C	.	.			trans	-72.7	-11.3	-176.2	63	0	0	0	0	114.3	F537 H565 D567	F537-S628 WeakPolarHBondContact CD2-O 3.31Å; H565-S628 PolarHBondContact NE2-OG 3.31Å; D567-S628 WeakPolarHBondContact CB-OG 3.17Å; D567-S628 VanDerWaalsContact CG-OG 3.32Å; D567-S628 WeakPolarHBondContact OD2-CB 3.23Å; D567-S628 PolarHBondContact OD2-N 2.9Å; D567-S628 PolarHBondContact OD2-OG 2.81Å
629	G	88.4	Confident	82.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.2	-144.8	169.4	0	0	0	0	0	113.5	S534 H565 D567 K627	S534-G629 WeakPolarHBondContact OG-CA 3.39Å; H565-G629 PolarHBondContact CD2-O 3.1Å; D567-G629 CarbonylContact C-O 3.45Å; D567-G629 PolarHBondContact N-O 2.91Å; D567-G629 WeakPolarHBondContact O-CA 3.21Å; D567-G629 PolarHBondContact O-N 2.84Å; K627-G629 PolarHBondContact O-N 3.5Å
630	F	90.6	Very high	81.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	154.8	-179.5	70.8	-92.2	0	0	0	112.5	L532 T533 S534 W549 F563 H565 L568 I580 F619	L532-F630 HydrophobicContact CD1-CE2 4.02Å; L532-F630 HydrophobicContact CG-CE2 4.29Å; T533-F630 VanDerWaalsContact CA-O 3.31Å; T533-F630 WeakPolarHBondContact CA-O 3.32Å; S534-F630 PolarHBondContact N-O 3.42Å; S534-F630 PolarHBondContact OG-N 2.97Å; S534-F630 VanDerWaalsContact OG-N 3.09Å; S534-F630 PolarHBondContact OG-O 2.78Å; W549-F630 HydrophobicContact CH2-CE1 4.47Å; W549-F630 AromaticContact CH2-CZ 3.72Å; W549-F630 HydrophobicContact CH2-CZ 3.72Å; W549-F630 AromaticContact CZ3-CZ 3.76Å; W549-F630 HydrophobicContact CZ3-CZ 3.76Å; F563-F630 HydrophobicContact CD1-CB 4.37Å; F563-F630 HydrophobicContact CD1-CD2 4.37Å; F563-F630 HydrophobicContact CE1-CD2 4.01Å; F563-F630 HydrophobicContact CE1-CG 4.38Å; H565-F630 VanDerWaalsContact O-CA 3.25Å; H565-F630 WeakPolarHBondContact O-CA 3.04Å; H565-F630 WeakPolarHBondContact O-CB 3.08Å; L568-F630 HydrophobicContact CD2-CD1 4.44Å; I580-F630 HydrophobicContact CD1-CD1 4.07Å; I580-F630 HydrophobicContact CD1-CD2 4.17Å; I580-F630 HydrophobicContact CD1-CE1 3.68Å; I580-F630 HydrophobicContact CD1-CE2 3.78Å; I580-F630 HydrophobicContact CD1-CG 4.32Å; I580-F630 HydrophobicContact CD1-CZ 3.53Å; F619-F630 HydrophobicContact CB-CE1 4.03Å; F619-F630 HydrophobicContact CB-CZ 4.44Å; F619-F630 HydrophobicContact CD1-CE1 4.03Å; F619-F630 HydrophobicContact CD2-CD1 4.35Å; F619-F630 AromaticContact CD2-CE1 3.87Å; F619-F630 HydrophobicContact CD2-CE1 3.87Å; F619-F630 HydrophobicContact CE1-CE1 4.46Å; F619-F630 HydrophobicContact CE2-CD1 4.49Å; F619-F630 HydrophobicContact CE2-CE1 4.33Å; F619-F630 AromaticContact CG-CE1 3.71Å; F619-F630 HydrophobicContact CG-CE1 3.71Å
631	A	90.1	Very high	80	Confident	10 Å²	10	45.9 Å²	45.9	8%	0.083	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.9	165.2	0	0	0	0	0	109	T533 F537 T564 H565	T533-A631 HydrophobicContact CG2-CB 4.03Å; F537-A631 HydrophobicContact CD1-CB 4.38Å; F537-A631 HydrophobicContact CE1-CB 3.84Å; F537-A631 HydrophobicContact CE2-CB 4.17Å; F537-A631 HydrophobicContact CZ-CB 3.73Å; T564-A631 PolarHBondContact N-O 2.88Å; T564-A631 PolarHBondContact OG1-O 2.9Å; H565-A631 HydrophobicContact CB-CB 4.11Å; H565-A631 PolarHBondContact N-O 2.77Å; H565-A631 VanDerWaalsContact N-O 3.16Å; H565-A631 PolarHBondContact O-N 2.95Å
632	A	89.9	Confident	78.7	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.008	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	147.2	177.9	0	0	0	0	0	111.3	S531 L532 L561 N562 F563	S531-A632 CarbonylContact C-O 3.36Å; S531-A632 VanDerWaalsContact CA-O 3.24Å; S531-A632 WeakPolarHBondContact CA-O 3.28Å; S531-A632 WeakPolarHBondContact CB-O 3.34Å; L532-A632 HydrophobicContact CD2-CB 4.06Å; L532-A632 HydrophobicContact CG-CB 4.27Å; L532-A632 PolarHBondContact N-O 3.05Å; L532-A632 PolarHBondContact O-N 3.29Å; L561-A632 HydrophobicContact CD1-CB 3.77Å; N562-A632 CarbonylContact O-C 3.54Å; N562-A632 VanDerWaalsContact O-CA 3.23Å; N562-A632 WeakPolarHBondContact O-CA 3.38Å; F563-A632 HydrophobicContact CD1-CB 3.8Å; F563-A632 HydrophobicContact CE1-CB 4.01Å; F563-A632 HydrophobicContact CG-CB 4.16Å
633	V	90.4	Very high	77.8	Confident	56 Å²	56	51.3 Å²	51.3	34%	0.339	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	142.6	170.3	-62.3	0	0	0	0	109.2	G530 N562 T564	G530-V633 WeakPolarHBondContact O-CA 3.29Å; N562-V633 HydrophobicContact CB-CG2 4.01Å; N562-V633 PolarHBondContact N-O 3.22Å; N562-V633 PolarHBondContact O-N 2.03Å; T564-V633 HydrophobicContact CG2-CG1 4.44Å; T564-V633 HydrophobicContact CG2-CG2 4.25Å
634	Y	89.4	Confident	77.2	Confident	12 Å²	12	49 Å²	49	5%	0.047	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153.4	175.6	79.6	-91.1	0	0	0	111.1	L525 N529 G530 L532 I551 I559 F560	L525-Y634 HydrophobicContact CB-CE1 4.12Å; L525-Y634 HydrophobicContact CD1-CD1 4.4Å; L525-Y634 HydrophobicContact CD1-CE1 3.94Å; N529-Y634 CarbonylContact C-O 3.48Å; N529-Y634 VanDerWaalsContact CA-O 3.29Å; N529-Y634 WeakPolarHBondContact CA-O 3.28Å; G530-Y634 VanDerWaalsContact CA-CE1 3.45Å; G530-Y634 PolarHBondContact N-O 3.47Å; G530-Y634 PolarHBondContact O-N 3.21Å; L532-Y634 HydrophobicContact CD2-CD1 4.31Å; I551-Y634 HydrophobicContact CD1-CD1 3.97Å; I551-Y634 HydrophobicContact CD1-CD2 4.11Å; I551-Y634 HydrophobicContact CD1-CG 3.71Å; I551-Y634 HydrophobicContact CG1-CD1 4.37Å; I551-Y634 HydrophobicContact CG1-CD2 4.41Å; I551-Y634 HydrophobicContact CG1-CG 4.33Å; I551-Y634 HydrophobicContact CG2-CD2 3.69Å; I551-Y634 HydrophobicContact CG2-CE2 3.62Å; I551-Y634 HydrophobicContact CG2-CG 4.4Å; I559-Y634 HydrophobicContact CG2-CD2 4.45Å; F560-Y634 CarbonylContact O-C 3.56Å; F560-Y634 WeakPolarHBondContact O-CA 3.25Å; F560-Y634 WeakPolarHBondContact O-CB 3.48Å
635	F	85.9	Confident	77.4	Confident	65 Å²	65	49.6 Å²	49.6	29%	0.285	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	153.1	173.6	57.6	-86.4	0	0	0	111.3	E528 N529 F560 V637 I661	E528-F635 CarbonylContact O-C 3.55Å; E528-F635 WeakPolarHBondContact O-CA 3.44Å; N529-F635 HydrophobicContact CB-CB 4.14Å; F560-F635 HydrophobicContact CB-CD1 4.27Å; F560-F635 HydrophobicContact CB-CD2 4.05Å; F560-F635 HydrophobicContact CB-CE1 3.81Å; F560-F635 HydrophobicContact CB-CE2 3.56Å; F560-F635 HydrophobicContact CB-CG 4.38Å; F560-F635 HydrophobicContact CB-CZ 3.43Å; F560-F635 VanDerWaalsContact CB-CZ 3.43Å; F560-F635 HydrophobicContact CD2-CD2 4.31Å; F560-F635 AromaticContact CD2-CE2 3.83Å; F560-F635 HydrophobicContact CD2-CE2 3.83Å; F560-F635 HydrophobicContact CD2-CZ 4.45Å; F560-F635 HydrophobicContact CG-CD2 4.47Å; F560-F635 AromaticContact CG-CE2 3.77Å; F560-F635 HydrophobicContact CG-CE2 3.77Å; F560-F635 AromaticContact CG-CZ 3.92Å; F560-F635 HydrophobicContact CG-CZ 3.92Å; F560-F635 PolarHBondContact N-O 3.39Å; F560-F635 PolarHBondContact O-N 3.41Å; F635-V637 HydrophobicContact CD2-CG2 3.86Å; F635-V637 HydrophobicContact CE2-CG2 3.93Å; F635-I661 HydrophobicContact CE2-CD1 3.49Å; F635-I661 VanDerWaalsContact CE2-CD1 3.49Å; F635-I661 HydrophobicContact CZ-CD1 3.53Å
636	T	81	Confident	77.8	Confident	20 Å²	20	49.3 Å²	49.3	12%	0.123	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131	-176.3	68.4	0	0	0	0	110.6	E528 A553 R558 I559	E528-T636 WeakPolarHBondContact CA-OG1 3.49Å; E528-T636 PolarHBondContact O-N 3.29Å; E528-T636 PolarHBondContact O-OG1 3.4Å; A553-T636 HydrophobicContact CB-CG2 3.68Å; R558-T636 WeakPolarHBondContact O-CA 3.37Å; I559-T636 HydrophobicContact CG1-CG2 4.22Å
637	V	69.9	Low	77.5	Confident	28 Å²	28	52.7 Å²	52.7	17%	0.17	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	139	176.6	-174	0	0	0	0	109.2	Y557 R558 F560 F635 A639 D642	Y557-V637 CarbonylContact C-O 3.58Å; Y557-V637 WeakPolarHBondContact CA-O 3.48Å; Y557-V637 WeakPolarHBondContact CB-O 3.49Å; R558-V637 PolarHBondContact N-O 3.04Å; R558-V637 PolarHBondContact O-N 3.46Å; F560-V637 HydrophobicContact CD2-CB 4.35Å; F560-V637 HydrophobicContact CD2-CG2 3.84Å; F560-V637 HydrophobicContact CE2-CB 3.96Å; F560-V637 HydrophobicContact CE2-CG2 3.81Å; F635-V637 HydrophobicContact CD2-CG2 3.86Å; F635-V637 HydrophobicContact CE2-CG2 3.93Å; V637-A639 PolarHBondContact O-N 2.91Å; V637-D642 HydrophobicContact CG1-CB 4.15Å
638	L	67.7	Low	76.9	Confident	45 Å²	45	53.3 Å²	53.3	24%	0.236	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	121.7	171.3	-86	164	0	0	0	110.1	Q556 Y557 R640 L641 D642	Q556-L638 HydrophobicContact CB-CD2 3.92Å; Q556-L638 CarbonylContact O-C 3.5Å; Q556-L638 WeakPolarHBondContact O-CA 2.98Å; Y557-L638 HydrophobicContact CD1-CG 4.27Å; Y557-L638 HydrophobicContact CD2-CD2 3.7Å; Y557-L638 HydrophobicContact CD2-CG 4.18Å; Y557-L638 HydrophobicContact CE1-CD2 4.38Å; Y557-L638 HydrophobicContact CE1-CG 3.86Å; Y557-L638 HydrophobicContact CE2-CD2 3.33Å; Y557-L638 HydrophobicContact CE2-CG 3.75Å; Y557-L638 HydrophobicContact CG-CD2 4.35Å; Y557-L638 HydrophobicContact CG-CG 4.42Å; L638-R640 PolarHBondContact O-N 3.46Å; L638-L641 HydrophobicContact CB-CB 4.16Å; L638-L641 HydrophobicContact CB-CD1 4.04Å; L638-L641 HydrophobicContact CB-CG 3.86Å; L638-L641 HydrophobicContact CD1-CD1 3.84Å; L638-L641 HydrophobicContact CD1-CG 4.09Å; L638-L641 PolarHBondContact O-N 2.74Å; L638-D642 PolarHBondContact O-N 3.16Å
639	A	58.3	Low	76.5	Confident	44 Å²	44	58.9 Å²	58.9	36%	0.364	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	22.5	171.9	0	0	0	0	0	113.4	Q556 R558 V637 D642	Q556-A639 PolarHBondContact O-N 2.76Å; R558-A639 HydrophobicContact CG-CB 4.18Å; V637-A639 PolarHBondContact O-N 2.91Å; A639-D642 CarbonylContact C-O 3.49Å; A639-D642 VanDerWaalsContact C-O 3.28Å
640	R	59.6	Low	76.2	Confident	193 Å²	193	61.6 Å²	61.6	73%	0.728	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	-13.4	171.8	-69.5	-177.2	171.5	-172.5	-3.2	112.4	L638	L638-R640 PolarHBondContact O-N 3.46Å
641	L	62.4	Low	75.5	Confident	136 Å²	136	62.2 Å²	62.2	71%	0.712	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-37.7	168	-65.9	-178.9	0	0	0	109.9	L638	L638-L641 HydrophobicContact CB-CB 4.16Å; L638-L641 HydrophobicContact CB-CD1 4.04Å; L638-L641 HydrophobicContact CB-CG 3.86Å; L638-L641 HydrophobicContact CD1-CD1 3.84Å; L638-L641 HydrophobicContact CD1-CG 4.09Å; L638-L641 PolarHBondContact O-N 2.74Å
642	D	60.5	Low	75.1	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.021	33%	0.328	C	S	.	.	S	Bend	trans	-89.8	110.2	163.3	-160.6	43.9	0	0	0	108	V637 L638 A639 N659 I661 G662	V637-D642 HydrophobicContact CG1-CB 4.15Å; L638-D642 PolarHBondContact O-N 3.16Å; A639-D642 CarbonylContact C-O 3.49Å; A639-D642 VanDerWaalsContact C-O 3.28Å; D642-N659 PolarHBondContact OD2-ND2 2.78Å; D642-I661 WeakPolarHBondContact OD1-CA 3.37Å; D642-G662 PolarHBondContact OD1-N 3.47Å
643	R	65.6	Low	74.9	Confident	150 Å²	150	63.8 Å²	63.8	57%	0.566	33%	0.33	S	S	*	.			trans	-91.8	123.7	174	174.2	-172.4	177	-169.1	-4.5	106.7	E645 N659	R643-E645 PolarHBondContact O-N 3.27Å; R643-N659 PolarHBondContact O-OD1 2.65Å
644	D	67.1	Low	74.6	Confident	31 Å²	31	66.2 Å²	66.2	17%	0.166	34%	0.338	C	S	.	.			trans	-66.9	102.7	170.4	-155.2	-50.5	0	0	0	109.6	R558 C646 E647 N659	R558-D644 IonicContact CZ-OD2 3.35Å; R558-D644 VanDerWaalsContact CZ-OD2 3.25Å; R558-D644 IonicContact NH1-OD2 3.72Å; R558-D644 PolarHBondContact NH1-OD2 3.31Å; R558-D644 IonicContact NH2-OD2 3.99Å; R558-D644 PolarHBondContact NH2-OD2 2.97Å; D644-C646 VanDerWaalsContact C-N 3.33Å; D644-C646 WeakPolarHBondContact OD1-CA 3.28Å; D644-C646 VanDerWaalsContact OD1-CB 3.27Å; D644-C646 WeakPolarHBondContact OD1-CB 3.16Å; D644-C646 PolarHBondContact OD1-N 3.34Å; D644-E647 HydrophobicContact CB-CB 4.16Å; D644-E647 HydrophobicContact CB-CG 3.91Å; D644-E647 PolarHBondContact OD1-N 2.81Å; D644-N659 WeakPolarHBondContact CA-OD1 3.29Å
645	E	79.2	Confident	74.3	Confident	46 Å²	46	67.3 Å²	67.3	22%	0.215	34%	0.344	C	S	.	.	S	Bend	trans	-75.1	-27	175.1	-87	100.7	-147.7	0	0	111.3	R643 E647 V648 G651 Y664	R643-E645 PolarHBondContact O-N 3.27Å; E645-E647 PolarHBondContact O-N 2.71Å; E645-V648 PolarHBondContact O-N 3.36Å; E645-V648 VanDerWaalsContact O-O 3.07Å; E645-G651 WeakPolarHBondContact O-CA 3.47Å; E645-G651 PolarHBondContact O-N 2.91Å; E645-G651 VanDerWaalsContact O-N 3.1Å; E645-Y664 HydrophobicContact CB-CD1 3.25Å; E645-Y664 HydrophobicContact CB-CE1 3.7Å; E645-Y664 HydrophobicContact CB-CG 3.92Å; E645-Y664 HydrophobicContact CG-CD1 3.61Å; E645-Y664 HydrophobicContact CG-CE1 3.7Å; E645-Y664 WeakPolarHBondContact OE2-CD1 3.17Å
646	C	82	Confident	74.1	Confident	25 Å²	25	67.1 Å²	67.1	17%	0.169	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-30.8	179.6	-56.2	0	0	0	0	112.8	D644 V648 N650 C657 N659	D644-C646 VanDerWaalsContact C-N 3.33Å; D644-C646 WeakPolarHBondContact OD1-CA 3.28Å; D644-C646 VanDerWaalsContact OD1-CB 3.27Å; D644-C646 WeakPolarHBondContact OD1-CB 3.16Å; D644-C646 PolarHBondContact OD1-N 3.34Å; C646-V648 PolarHBondContact O-N 2.88Å; C646-V648 VanDerWaalsContact O-N 3.12Å; C646-N650 WeakPolarHBondContact O-CA 3.41Å; C646-C657 WeakPolarHBondContact CA-SG 3.37Å; C646-C657 HydrophobicContact CB-CB 3.57Å; C646-C657 WeakPolarHBondContact CB-SG 3.44Å; C646-C657 WeakPolarHBondContact SG-CB 3.39Å; C646-C657 CovalentContact SG-SG 2.03Å; C646-C657 PolarHBondContact SG-SG 3.46Å; C646-N659 PolarHBondContact SG-N 3.03Å; C646-N659 VanDerWaalsContact SG-N 3.39Å
647	E	76.3	Confident	74.1	Confident	146 Å²	146	67.1 Å²	67.1	68%	0.682	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-14.1	172.5	-78	-177.8	-151.4	0	0	113.9	R558 D644 E645	R558-E647 IonicContact NH2-OE1 2.76Å; R558-E647 PolarHBondContact NH2-OE1 2.88Å; D644-E647 HydrophobicContact CB-CB 4.16Å; D644-E647 HydrophobicContact CB-CG 3.91Å; D644-E647 PolarHBondContact OD1-N 2.81Å; E645-E647 PolarHBondContact O-N 2.71Å
648	V	72.8	Confident	74.3	Confident	79 Å²	79	70.2 Å²	70.2	48%	0.479	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122	110.4	179.4	-176	0	0	0	0	110.6	E645 C646 N650 G651	E645-V648 PolarHBondContact O-N 3.36Å; E645-V648 VanDerWaalsContact O-O 3.07Å; C646-V648 PolarHBondContact O-N 2.88Å; C646-V648 VanDerWaalsContact O-N 3.12Å; V648-N650 PolarHBondContact O-N 2.94Å; V648-G651 PolarHBondContact O-N 3.35Å
649	D	78.4	Confident	74.3	Confident	146 Å²	146	69.2 Å²	69.2	78%	0.781	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	56.8	32.4	176.6	-151.6	33.8	0	0	0	113	G651 G652	D649-G651 PolarHBondContact O-N 3.34Å; D649-G652 WeakPolarHBondContact O-CA 3.18Å; D649-G652 PolarHBondContact O-N 2.91Å
650	N	83	Confident	74.7	Confident	57 Å²	57	70.7 Å²	70.7	31%	0.305	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	55.3	30	-173.8	-160.6	35.2	0	0	0	113.2	C646 V648 G652 C653 Q655 C657	C646-N650 WeakPolarHBondContact O-CA 3.41Å; V648-N650 PolarHBondContact O-N 2.94Å; N650-G652 PolarHBondContact O-N 3Å; N650-G652 VanDerWaalsContact O-N 3.14Å; N650-C653 PolarHBondContact ND2-O 2.84Å; N650-C653 WeakPolarHBondContact O-CB 3.36Å; N650-C653 PolarHBondContact O-N 3.13Å; N650-C653 PolarHBondContact O-SG 2.81Å; N650-Q655 PolarHBondContact ND2-O 2.94Å; N650-C657 VanDerWaalsContact O-CB 3.27Å; N650-C657 WeakPolarHBondContact O-CB 3.41Å; N650-C657 PolarHBondContact O-SG 2.99Å; N650-C657 WeakPolarHBondContact OD1-CB 3.06Å
651	G	76.4	Confident	74.7	Confident	12 Å²	12	65.1 Å²	65.1	12%	0.124	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	65.6	9.1	-171.1	0	0	0	0	0	114.1	E645 V648 D649 C653 Y664 H679	E645-G651 WeakPolarHBondContact O-CA 3.47Å; E645-G651 PolarHBondContact O-N 2.91Å; E645-G651 VanDerWaalsContact O-N 3.1Å; V648-G651 PolarHBondContact O-N 3.35Å; D649-G651 PolarHBondContact O-N 3.34Å; G651-C653 VanDerWaalsContact C-N 3.27Å; G651-Y664 WeakPolarHBondContact O-CE2 3.4Å; G651-Y664 PolarHBondContact O-OH 3.04Å; G651-H679 PolarHBondContact O-CE1 2.84Å; G651-H679 VanDerWaalsContact O-CE1 3.31Å
652	G	81.2	Confident	74.9	Confident	35 Å²	35	61.5 Å²	61.5	36%	0.361	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	73.3	15.4	-164.9	0	0	0	0	0	113.7	D649 N650 H679	D649-G652 WeakPolarHBondContact O-CA 3.18Å; D649-G652 PolarHBondContact O-N 2.91Å; N650-G652 PolarHBondContact O-N 3Å; N650-G652 VanDerWaalsContact O-N 3.14Å; G652-H679 VanDerWaalsContact C-ND1 3.34Å; G652-H679 WeakPolarHBondContact O-CB 3.45Å; G652-H679 PolarHBondContact O-ND1 2.81Å
653	C	86.3	Confident	75.4	Confident	9 Å²	9	63.7 Å²	63.7	6%	0.061	35%	0.346	C	S	.	.			trans	-77.2	136.2	172	-56	0	0	0	0	110.4	N650 G651 Q655 C657 C666	N650-C653 PolarHBondContact ND2-O 2.84Å; N650-C653 WeakPolarHBondContact O-CB 3.36Å; N650-C653 PolarHBondContact O-N 3.13Å; N650-C653 PolarHBondContact O-SG 2.81Å; G651-C653 VanDerWaalsContact C-N 3.27Å; C653-Q655 VanDerWaalsContact C-N 3.31Å; C653-Q655 PolarHBondContact O-N 2.85Å; C653-C657 HydrophobicContact CB-CB 4.03Å; C653-C657 VanDerWaalsContact SG-CB 3.57Å; C653-C657 VanDerWaalsContact SG-SG 3.66Å; C653-C666 WeakPolarHBondContact CA-SG 3.43Å; C653-C666 HydrophobicContact CB-CB 3.57Å; C653-C666 WeakPolarHBondContact CB-SG 3.22Å; C653-C666 WeakPolarHBondContact SG-CA 3.46Å; C653-C666 WeakPolarHBondContact SG-CB 3.19Å; C653-C666 CovalentContact SG-SG 2.02Å; C653-C666 PolarHBondContact SG-SG 2.81Å
654	E	83.9	Confident	76.1	Confident	107 Å²	107	59.9 Å²	59.9	50%	0.5	33%	0.333	S	S	.	.	S	Bend	trans	-69.4	-28.1	-178.9	-175.6	172	177.2	0	0	113.1	H679 H680 C681	E654-H679 PolarHBondContact N-O 3.36Å; E654-H680 WeakPolarHBondContact OE2-CA 3.16Å; E654-H680 WeakPolarHBondContact OE2-CB 3.39Å; E654-H680 IonicContact OE2-CD2 3.38Å; E654-H680 IonicContact OE2-CG 3.22Å; E654-C681 HydrophobicContact CB-CB 4.39Å; E654-C681 PolarHBondContact OE2-N 2.81Å
655	Q	83.1	Confident	76.9	Confident	36 Å²	36	60.7 Å²	60.7	17%	0.168	34%	0.339	C	S	.	.	S	Bend	trans	-130.4	-81.1	-176.8	-67.6	174.6	-5.8	0	0	112	N650 C653 E669 C681	N650-Q655 PolarHBondContact ND2-O 2.94Å; C653-Q655 VanDerWaalsContact C-N 3.31Å; C653-Q655 PolarHBondContact O-N 2.85Å; Q655-E669 HydrophobicContact CB-CG 4.35Å; Q655-C681 HydrophobicContact CG-CB 3.93Å; Q655-C681 PolarHBondContact OE1-SG 2.99Å; Q655-C681 VanDerWaalsContact OE1-SG 3.41Å
656	I	81.2	Confident	77.1	Confident	60 Å²	60	58.7 Å²	58.7	31%	0.308	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.8	-174.1	-52.5	175.5	0	0	0	109.3	K658 C666 E667 E669	I656-K658 HydrophobicContact CG2-CG 4.44Å; I656-C666 CarbonylContact O-C 3.57Å; I656-C666 VanDerWaalsContact O-CA 3.32Å; I656-C666 WeakPolarHBondContact O-CA 3.44Å; I656-E667 HydrophobicContact CB-CB 4.07Å; I656-E667 WeakPolarHBondContact CB-O 3.39Å; I656-E667 HydrophobicContact CG2-CB 4.31Å; I656-E667 PolarHBondContact N-O 3.23Å; I656-E667 PolarHBondContact O-N 2.92Å; I656-E667 VanDerWaalsContact O-O 3.04Å; I656-E669 HydrophobicContact CD1-CG 4.15Å; I656-E669 HydrophobicContact CG1-CG 4.25Å
657	C	82.2	Confident	76.9	Confident	20 Å²	20	61 Å²	61	14%	0.135	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	130.7	169.1	-173.1	0	0	0	0	110.6	C646 N650 C653	C646-C657 WeakPolarHBondContact CA-SG 3.37Å; C646-C657 HydrophobicContact CB-CB 3.57Å; C646-C657 WeakPolarHBondContact CB-SG 3.44Å; C646-C657 WeakPolarHBondContact SG-CB 3.39Å; C646-C657 CovalentContact SG-SG 2.03Å; C646-C657 PolarHBondContact SG-SG 3.46Å; N650-C657 VanDerWaalsContact O-CB 3.27Å; N650-C657 WeakPolarHBondContact O-CB 3.41Å; N650-C657 PolarHBondContact O-SG 2.99Å; N650-C657 WeakPolarHBondContact OD1-CB 3.06Å; C653-C657 HydrophobicContact CB-CB 4.03Å; C653-C657 VanDerWaalsContact SG-CB 3.57Å; C653-C657 VanDerWaalsContact SG-SG 3.66Å
658	K	73.5	Confident	76.9	Confident	93 Å²	93	55.2 Å²	55.2	40%	0.404	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	112.4	171.9	-69.8	-171.2	-174.7	169.8	0	110.5	I656 M660 Y664 V665 E667	I656-K658 HydrophobicContact CG2-CG 4.44Å; K658-M660 PolarHBondContact O-N 3.47Å; K658-Y664 CarbonylContact O-C 3.5Å; K658-Y664 WeakPolarHBondContact O-CA 3.36Å; K658-V665 HydrophobicContact CB-CG1 4.02Å; K658-V665 PolarHBondContact N-O 2.74Å; K658-V665 PolarHBondContact O-N 3.1Å; K658-E667 HydrophobicContact CD-CG 4.49Å; K658-E667 WeakPolarHBondContact CD-OE1 3.46Å; K658-E667 WeakPolarHBondContact CE-OE1 3.34Å; K658-E667 WeakPolarHBondContact CE-OE2 3.34Å; K658-E667 IonicContact NZ-OE1 2.85Å; K658-E667 PolarHBondContact NZ-OE1 2.68Å; K658-E667 IonicContact NZ-OE2 2.72Å; K658-E667 PolarHBondContact NZ-OE2 2.79Å
659	N	67.5	Low	76.7	Confident	24 Å²	24	56.9 Å²	56.9	13%	0.128	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	126.4	175	-170.5	80.8	0	0	0	110.9	D642 R643 D644 C646	D642-N659 PolarHBondContact OD2-ND2 2.78Å; R643-N659 PolarHBondContact O-OD1 2.65Å; D644-N659 WeakPolarHBondContact CA-OD1 3.29Å; C646-N659 PolarHBondContact SG-N 3.03Å; C646-N659 VanDerWaalsContact SG-N 3.39Å
660	M	65.8	Low	75.7	Confident	75 Å²	75	53.7 Å²	53.7	37%	0.369	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	-177.7	172.4	-55.7	-171.9	-64.9	0	0	109	K658 G662 S663 V665	K658-M660 PolarHBondContact O-N 3.47Å; M660-G662 PolarHBondContact O-N 3.5Å; M660-S663 CarbonylContact C-O 3.37Å; M660-S663 WeakPolarHBondContact CA-O 3.33Å; M660-S663 VanDerWaalsContact CB-O 3.28Å; M660-S663 WeakPolarHBondContact CB-O 3.06Å; M660-S663 PolarHBondContact N-O 3.48Å; M660-V665 HydrophobicContact CE-CB 3.77Å; M660-V665 HydrophobicContact CE-CG1 4.06Å; M660-V665 HydrophobicContact CG-CG1 4.24Å; M660-V665 HydrophobicContact SD-CB 4.2Å; M660-V665 HydrophobicContact SD-CG1 3.81Å
661	I	60.7	Low	74.3	Confident	77 Å²	77	51.1 Å²	51.1	40%	0.395	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	108.9	-176.9	-62.3	146.7	0	0	0	109.9	F560 F635 D642 S663	F560-I661 HydrophobicContact CD1-CD1 3.91Å; F560-I661 HydrophobicContact CD1-CG1 4.02Å; F560-I661 HydrophobicContact CD2-CD1 4.36Å; F560-I661 HydrophobicContact CD2-CG1 4.29Å; F560-I661 HydrophobicContact CE1-CD1 3.92Å; F560-I661 HydrophobicContact CE1-CG1 3.5Å; F560-I661 HydrophobicContact CE2-CD1 4.39Å; F560-I661 HydrophobicContact CE2-CG1 3.83Å; F560-I661 HydrophobicContact CG-CD1 4.13Å; F560-I661 HydrophobicContact CG-CG1 4.38Å; F560-I661 HydrophobicContact CZ-CD1 4.17Å; F560-I661 HydrophobicContact CZ-CG1 3.4Å; F560-I661 VanDerWaalsContact CZ-CG1 3.4Å; F635-I661 HydrophobicContact CE2-CD1 3.49Å; F635-I661 VanDerWaalsContact CE2-CD1 3.49Å; F635-I661 HydrophobicContact CZ-CD1 3.53Å; D642-I661 WeakPolarHBondContact OD1-CA 3.37Å; I661-S663 VanDerWaalsContact C-N 3.31Å
662	G	65.8	Low	73.8	Confident	59 Å²	59	54.5 Å²	54.5	61%	0.608	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	19.5	179.9	0	0	0	0	0	114.5	D642 M660	D642-G662 PolarHBondContact OD1-N 3.47Å; M660-G662 PolarHBondContact O-N 3.5Å
663	S	71.9	Confident	73	Confident	50 Å²	50	57.5 Å²	57.5	35%	0.35	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	169	176	52.6	0	0	0	0	110	M660 I661	M660-S663 CarbonylContact C-O 3.37Å; M660-S663 WeakPolarHBondContact CA-O 3.33Å; M660-S663 VanDerWaalsContact CB-O 3.28Å; M660-S663 WeakPolarHBondContact CB-O 3.06Å; M660-S663 PolarHBondContact N-O 3.48Å; I661-S663 VanDerWaalsContact C-N 3.31Å
664	Y	79.8	Confident	72.4	Confident	71 Å²	71	60 Å²	60	28%	0.278	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	162.6	169.1	56	-75.3	0	0	0	109.6	E645 G651 K658 H679	E645-Y664 HydrophobicContact CB-CD1 3.25Å; E645-Y664 HydrophobicContact CB-CE1 3.7Å; E645-Y664 HydrophobicContact CB-CG 3.92Å; E645-Y664 HydrophobicContact CG-CD1 3.61Å; E645-Y664 HydrophobicContact CG-CE1 3.7Å; E645-Y664 WeakPolarHBondContact OE2-CD1 3.17Å; G651-Y664 WeakPolarHBondContact O-CE2 3.4Å; G651-Y664 PolarHBondContact O-OH 3.04Å; K658-Y664 CarbonylContact O-C 3.5Å; K658-Y664 WeakPolarHBondContact O-CA 3.36Å; Y664-H679 AromaticContact CE2-CE1 3.74Å; Y664-H679 AromaticContact CZ-CE1 3.89Å; Y664-H679 PolarHBondContact OH-CE1 3.34Å
665	V	83.1	Confident	71.8	Confident	48 Å²	48	55.3 Å²	55.3	29%	0.291	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.3	164.9	62.2	0	0	0	0	108.6	K658 M660	K658-V665 HydrophobicContact CB-CG1 4.02Å; K658-V665 PolarHBondContact N-O 2.74Å; K658-V665 PolarHBondContact O-N 3.1Å; M660-V665 HydrophobicContact CE-CB 3.77Å; M660-V665 HydrophobicContact CE-CG1 4.06Å; M660-V665 HydrophobicContact CG-CG1 4.24Å; M660-V665 HydrophobicContact SD-CB 4.2Å; M660-V665 HydrophobicContact SD-CG1 3.81Å
666	C	83.8	Confident	71.5	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.02	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	132.1	168.7	-56.4	0	0	0	0	109	C653 I656 L674 G678	C653-C666 WeakPolarHBondContact CA-SG 3.43Å; C653-C666 HydrophobicContact CB-CB 3.57Å; C653-C666 WeakPolarHBondContact CB-SG 3.22Å; C653-C666 WeakPolarHBondContact SG-CA 3.46Å; C653-C666 WeakPolarHBondContact SG-CB 3.19Å; C653-C666 CovalentContact SG-SG 2.02Å; C653-C666 PolarHBondContact SG-SG 2.81Å; I656-C666 CarbonylContact O-C 3.57Å; I656-C666 VanDerWaalsContact O-CA 3.32Å; I656-C666 WeakPolarHBondContact O-CA 3.44Å; C666-L674 HydrophobicContact CB-CD1 3.55Å; C666-L674 HydrophobicContact CB-CD2 4.46Å; C666-L674 VanDerWaalsContact O-CD2 3.27Å; C666-L674 WeakPolarHBondContact O-CD2 3.13Å; C666-G678 VanDerWaalsContact CB-O 3.29Å; C666-G678 WeakPolarHBondContact CB-O 3.23Å; C666-G678 PolarHBondContact SG-O 3.01Å
667	E	78.6	Confident	71.6	Confident	75 Å²	75	60.2 Å²	60.2	35%	0.35	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	168.6	165.4	-81.8	-175.4	-153.8	0	0	109.4	I656 K658	I656-E667 HydrophobicContact CB-CB 4.07Å; I656-E667 WeakPolarHBondContact CB-O 3.39Å; I656-E667 HydrophobicContact CG2-CB 4.31Å; I656-E667 PolarHBondContact N-O 3.23Å; I656-E667 PolarHBondContact O-N 2.92Å; I656-E667 VanDerWaalsContact O-O 3.04Å; K658-E667 HydrophobicContact CD-CG 4.49Å; K658-E667 WeakPolarHBondContact CD-OE1 3.46Å; K658-E667 WeakPolarHBondContact CE-OE1 3.34Å; K658-E667 WeakPolarHBondContact CE-OE2 3.34Å; K658-E667 IonicContact NZ-OE1 2.85Å; K658-E667 PolarHBondContact NZ-OE1 2.68Å; K658-E667 IonicContact NZ-OE2 2.72Å; K658-E667 PolarHBondContact NZ-OE2 2.79Å
668	C	75.5	Confident	71.5	Confident	24 Å²	24	60.7 Å²	60.7	16%	0.162	35%	0.346	C	S	.	.			trans	-120.7	151.5	-180	-59.3	0	0	0	0	110.4	C681	C668-C681 WeakPolarHBondContact CA-SG 3.45Å; C668-C681 HydrophobicContact CB-CB 3.82Å; C668-C681 WeakPolarHBondContact CB-SG 2.98Å; C668-C681 WeakPolarHBondContact SG-CA 3.37Å; C668-C681 WeakPolarHBondContact SG-CB 3.32Å; C668-C681 CovalentContact SG-SG 2.04Å; C668-C681 PolarHBondContact SG-SG 2.98Å
669	E	70	Confident	71.9	Confident	113 Å²	113	58.9 Å²	58.9	53%	0.528	34%	0.339	S	S	.	.			trans	-63.3	155.8	169.8	-66.4	-179.4	163.9	0	0	110.5	Q655 I656 G671 Y672	Q655-E669 HydrophobicContact CB-CG 4.35Å; I656-E669 HydrophobicContact CD1-CG 4.15Å; I656-E669 HydrophobicContact CG1-CG 4.25Å; E669-G671 PolarHBondContact O-N 2.87Å; E669-Y672 PolarHBondContact O-N 2.73Å; E669-Y672 VanDerWaalsContact O-N 3.16Å
670	S	56.9	Low	72.7	Confident	79 Å²	79	62.2 Å²	62.2	55%	0.552	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	100	171.5	-64.8	0	0	0	0	110	K705 F706	S670-K705 CarbonylContact C-O 3.57Å; S670-F706 WeakPolarHBondContact O-CD1 3.41Å; S670-F706 WeakPolarHBondContact O-CE1 3.48Å
671	G	52.7	Low	73.2	Confident	3 Å²	3	59 Å²	59	3%	0.031	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	159.6	-43.2	-170.1	0	0	0	0	0	111.5	E669 G684 C704 K705	E669-G671 PolarHBondContact O-N 2.87Å; G671-G684 PolarHBondContact O-N 2.89Å; G671-G684 VanDerWaalsContact O-N 3.11Å; G671-C704 WeakPolarHBondContact O-CA 3.43Å; G671-K705 WeakPolarHBondContact CA-O 3.35Å; G671-K705 PolarHBondContact N-O 2.7Å; G671-K705 PolarHBondContact O-N 3.48Å; G671-K705 VanDerWaalsContact O-N 3.08Å
672	Y	66	Low	73.2	Confident	84 Å²	84	59.4 Å²	59.4	33%	0.329	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	156	-160.5	-45.1	-108.5	0	0	0	111.9	E669 C681 E683	E669-Y672 PolarHBondContact O-N 2.73Å; E669-Y672 VanDerWaalsContact O-N 3.16Å; Y672-C681 HydrophobicContact CD1-CB 4.45Å; Y672-C681 WeakPolarHBondContact CD1-O 3.19Å; Y672-C681 HydrophobicContact CG-CB 4.22Å; Y672-E683 HydrophobicContact CD1-CB 4.33Å; Y672-E683 HydrophobicContact CD1-CG 3.56Å; Y672-E683 HydrophobicContact CE1-CG 3.49Å; Y672-E683 VanDerWaalsContact CE1-CG 3.49Å
673	I	65.8	Low	72.5	Confident	98 Å²	98	58.6 Å²	58.6	50%	0.503	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	139.7	171.6	-52.6	161.5	0	0	0	107.9	A675 K682	I673-A675 PolarHBondContact O-N 2.73Å; I673-K682 PolarHBondContact N-O 3.47Å; I673-K682 PolarHBondContact O-N 3.49Å
674	L	72.7	Confident	71.4	Confident	60 Å²	60	56.5 Å²	56.5	31%	0.314	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	130.6	173	-167.1	72.7	0	0	0	110.9	C666	C666-L674 HydrophobicContact CB-CD1 3.55Å; C666-L674 HydrophobicContact CB-CD2 4.46Å; C666-L674 VanDerWaalsContact O-CD2 3.27Å; C666-L674 WeakPolarHBondContact O-CD2 3.13Å
675	A	72.1	Confident	69.6	Low	9 Å²	9	57.9 Å²	57.9	7%	0.074	32%	0.315	C	S	.	.			trans	-65.4	160.3	179.4	0	0	0	0	0	112.8	I673 D677 G678 H680 K682	I673-A675 PolarHBondContact O-N 2.73Å; A675-D677 WeakPolarHBondContact CB-OD1 3.14Å; A675-D677 VanDerWaalsContact CB-OD2 3.32Å; A675-D677 WeakPolarHBondContact CB-OD2 3.2Å; A675-D677 PolarHBondContact O-N 2.97Å; A675-G678 PolarHBondContact O-N 3.27Å; A675-H680 HydrophobicContact CB-CB 3.85Å; A675-H680 WeakPolarHBondContact CB-O 3.41Å; A675-H680 PolarHBondContact N-O 3.11Å; A675-K682 HydrophobicContact CB-CD 3.62Å; A675-K682 HydrophobicContact CB-CG 4.08Å
676	S	76.4	Confident	67.6	Low	127 Å²	127	57.9 Å²	57.9	89%	0.888	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-6	174.1	59.5	0	0	0	0	115.5
677	D	82.6	Confident	65.3	Low	72 Å²	72	66 Å²	66	39%	0.385	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-13.5	171.3	46.3	68.6	0	0	0	112.8	A675 H679 H680 K682	A675-D677 WeakPolarHBondContact CB-OD1 3.14Å; A675-D677 VanDerWaalsContact CB-OD2 3.32Å; A675-D677 WeakPolarHBondContact CB-OD2 3.2Å; A675-D677 PolarHBondContact O-N 2.97Å; D677-H679 VanDerWaalsContact C-N 3.34Å; D677-H679 PolarHBondContact O-CD2 2.95Å; D677-H679 PolarHBondContact OD1-N 2.6Å; D677-H680 IonicContact OD1-CG 3.06Å; D677-H680 PolarHBondContact OD1-N 2.84Å; D677-H680 IonicContact OD1-ND1 3.31Å; D677-H680 PolarHBondContact OD1-ND1 2.78Å; D677-H680 IonicContact OD2-ND1 3.85Å; D677-H680 PolarHBondContact OD2-ND1 3.16Å; D677-K682 IonicContact OD2-NZ 3.05Å; D677-K682 PolarHBondContact OD2-NZ 3.3Å
678	G	79.9	Confident	63.1	Low	30 Å²	30	67.5 Å²	67.5	31%	0.309	37%	0.369	S	S	.	.	S	Bend	trans	82.3	5.8	-180	0	0	0	0	0	114.9	C666 A675	C666-G678 VanDerWaalsContact CB-O 3.29Å; C666-G678 WeakPolarHBondContact CB-O 3.23Å; C666-G678 PolarHBondContact SG-O 3.01Å; A675-G678 PolarHBondContact O-N 3.27Å
679	H	83.4	Confident	61.2	Low	56 Å²	56	71.6 Å²	71.6	26%	0.259	39%	0.389	S	S	.	.	S	Bend	trans	-126.7	-45.9	-171.4	-80.3	-90.2	0	0	0	114	G651 G652 E654 Y664 D677	G651-H679 PolarHBondContact O-CE1 2.84Å; G651-H679 VanDerWaalsContact O-CE1 3.31Å; G652-H679 VanDerWaalsContact C-ND1 3.34Å; G652-H679 WeakPolarHBondContact O-CB 3.45Å; G652-H679 PolarHBondContact O-ND1 2.81Å; E654-H679 PolarHBondContact N-O 3.36Å; Y664-H679 AromaticContact CE2-CE1 3.74Å; Y664-H679 AromaticContact CZ-CE1 3.89Å; Y664-H679 PolarHBondContact OH-CE1 3.34Å; D677-H679 VanDerWaalsContact C-N 3.34Å; D677-H679 PolarHBondContact O-CD2 2.95Å; D677-H679 PolarHBondContact OD1-N 2.6Å
680	H	82.3	Confident	59.5	Low	94 Å²	94	75.3 Å²	75.3	44%	0.435	40%	0.403	S	S	.	.			trans	-85.1	152.4	-175.1	-61.7	87.3	0	0	0	111.8	E654 A675 D677	E654-H680 WeakPolarHBondContact OE2-CA 3.16Å; E654-H680 WeakPolarHBondContact OE2-CB 3.39Å; E654-H680 IonicContact OE2-CD2 3.38Å; E654-H680 IonicContact OE2-CG 3.22Å; A675-H680 HydrophobicContact CB-CB 3.85Å; A675-H680 WeakPolarHBondContact CB-O 3.41Å; A675-H680 PolarHBondContact N-O 3.11Å; D677-H680 IonicContact OD1-CG 3.06Å; D677-H680 PolarHBondContact OD1-N 2.84Å; D677-H680 IonicContact OD1-ND1 3.31Å; D677-H680 PolarHBondContact OD1-ND1 2.78Å; D677-H680 IonicContact OD2-ND1 3.85Å; D677-H680 PolarHBondContact OD2-ND1 3.16Å
681	C	78	Confident	58.2	Low	6 Å²	6	77.4 Å²	77.4	4%	0.041	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	98.9	-179.8	-75.3	0	0	0	0	109.9	E654 Q655 C668 Y672	E654-C681 HydrophobicContact CB-CB 4.39Å; E654-C681 PolarHBondContact OE2-N 2.81Å; Q655-C681 HydrophobicContact CG-CB 3.93Å; Q655-C681 PolarHBondContact OE1-SG 2.99Å; Q655-C681 VanDerWaalsContact OE1-SG 3.41Å; C668-C681 WeakPolarHBondContact CA-SG 3.45Å; C668-C681 HydrophobicContact CB-CB 3.82Å; C668-C681 WeakPolarHBondContact CB-SG 2.98Å; C668-C681 WeakPolarHBondContact SG-CA 3.37Å; C668-C681 WeakPolarHBondContact SG-CB 3.32Å; C668-C681 CovalentContact SG-SG 2.04Å; C668-C681 PolarHBondContact SG-SG 2.98Å; Y672-C681 HydrophobicContact CD1-CB 4.45Å; Y672-C681 WeakPolarHBondContact CD1-O 3.19Å; Y672-C681 HydrophobicContact CG-CB 4.22Å
682	K	61	Low	57.3	Low	87 Å²	87	83.7 Å²	83.7	38%	0.378	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.2	-177.2	-75.5	169.4	-174.2	155.3	0	109.9	I673 A675 D677 G684	I673-K682 PolarHBondContact N-O 3.47Å; I673-K682 PolarHBondContact O-N 3.49Å; A675-K682 HydrophobicContact CB-CD 3.62Å; A675-K682 HydrophobicContact CB-CG 4.08Å; D677-K682 IonicContact OD2-NZ 3.05Å; D677-K682 PolarHBondContact OD2-NZ 3.3Å; K682-G684 PolarHBondContact O-N 3.24Å
683	E	50.4	Low	55.7	Low	42 Å²	42	83.6 Å²	83.6	20%	0.196	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-36	123.9	173.6	-83.6	-177.2	116.2	0	0	113.3	Y672 I685 L701 G702 G703 K728	Y672-E683 HydrophobicContact CD1-CB 4.33Å; Y672-E683 HydrophobicContact CD1-CG 3.56Å; Y672-E683 HydrophobicContact CE1-CG 3.49Å; Y672-E683 VanDerWaalsContact CE1-CG 3.49Å; E683-I685 PolarHBondContact O-N 2.9Å; E683-L701 VanDerWaalsContact OE2-C 3.27Å; E683-G702 VanDerWaalsContact CD-C 3.49Å; E683-G702 VanDerWaalsContact CD-CA 3.43Å; E683-G702 WeakPolarHBondContact OE1-CA 3.35Å; E683-G702 WeakPolarHBondContact OE2-CA 3.28Å; E683-G702 PolarHBondContact OE2-N 3.09Å; E683-G702 VanDerWaalsContact OE2-N 3.12Å; E683-G703 CarbonylContact C-O 3.59Å; E683-G703 WeakPolarHBondContact CA-O 3.03Å; E683-G703 WeakPolarHBondContact CB-O 3.38Å; E683-G703 WeakPolarHBondContact CG-O 3.48Å; E683-G703 PolarHBondContact OE1-N 2.88Å; E683-K728 VanDerWaalsContact CD-NZ 3.33Å; E683-K728 IonicContact OE1-NZ 2.64Å; E683-K728 PolarHBondContact OE1-NZ 3.34Å; E683-K728 IonicContact OE2-NZ 2.99Å; E683-K728 PolarHBondContact OE2-NZ 2.95Å
684	G	48.7	Very low	54.1	Low	5 Å²	5	82.7 Å²	82.7	5%	0.052	50%	0.499	C	S	.	.			trans	-92.1	93.8	-149.9	0	0	0	0	0	115.8	G671 K682 P686 G703	G671-G684 PolarHBondContact O-N 2.89Å; G671-G684 VanDerWaalsContact O-N 3.11Å; K682-G684 PolarHBondContact O-N 3.24Å; G684-P686 VanDerWaalsContact O-CD 3.25Å; G684-P686 WeakPolarHBondContact O-CD 3.41Å; G684-G703 PolarHBondContact N-O 3.17Å
685	I	41	Very low	52.2	Low	101 Å²	101	87.9 Å²	87.9	52%	0.518	52%	0.522	S	S	.	.			trans	-66.3	115.7	177.5	-48.6	171.9	0	0	0	111.7	E683 F687 F699	E683-I685 PolarHBondContact O-N 2.9Å; I685-F687 PolarHBondContact O-N 3.04Å; I685-F699 HydrophobicContact CG1-CD1 4.46Å
686	P	41.2	Very low	50.2	Low	47 Å²	47	99.4 Å²	99.4	31%	0.305	56%	0.563	S	S	.	*			trans	-83.8	98.4	168.8	28.5	-20.1	0	0	0	110.7	G684 C688 I731	G684-P686 VanDerWaalsContact O-CD 3.25Å; G684-P686 WeakPolarHBondContact O-CD 3.41Å; P686-C688 PolarHBondContact O-N 2.88Å; P686-I731 HydrophobicContact CG-CD1 3.26Å
687	F	36.9	Very low	48	Very low	173 Å²	173	102.7 Å²	102.7	76%	0.759	56%	0.558	S	S	*	*			trans	33.4	53.3	148.2	-146.7	-98.6	0	0	0	119.2	I685 L689	I685-F687 PolarHBondContact O-N 3.04Å; F687-L689 HydrophobicContact CD1-CB 4.2Å; F687-L689 HydrophobicContact CD1-CD1 4.23Å; F687-L689 HydrophobicContact CE1-CB 4.04Å; F687-L689 HydrophobicContact CE1-CD1 3.53Å; F687-L689 HydrophobicContact CE1-CG 4.41Å; F687-L689 HydrophobicContact CE2-CD1 4.12Å; F687-L689 HydrophobicContact CZ-CD1 3.47Å; F687-L689 VanDerWaalsContact CZ-CD1 3.47Å; F687-L689 PolarHBondContact O-N 2.81Å; F687-L689 VanDerWaalsContact O-N 3.09Å
688	C	32.5	Very low	45.9	Very low	108 Å²	108	104.8 Å²	104.8	73%	0.73	58%	0.575	S	S	*	*			trans	-68.7	106.5	171.9	-172	0	0	0	0	111.1	P686	P686-C688 PolarHBondContact O-N 2.88Å
689	L	35.2	Very low	43.7	Very low	110 Å²	110	107 Å²	107	58%	0.576	58%	0.576	S	S	*	*			trans	-145.1	108	-178.2	-112	168.8	0	0	0	114.8	F687	F687-L689 HydrophobicContact CD1-CB 4.2Å; F687-L689 HydrophobicContact CD1-CD1 4.23Å; F687-L689 HydrophobicContact CE1-CB 4.04Å; F687-L689 HydrophobicContact CE1-CD1 3.53Å; F687-L689 HydrophobicContact CE1-CG 4.41Å; F687-L689 HydrophobicContact CE2-CD1 4.12Å; F687-L689 HydrophobicContact CZ-CD1 3.47Å; F687-L689 VanDerWaalsContact CZ-CD1 3.47Å; F687-L689 PolarHBondContact O-N 2.81Å; F687-L689 VanDerWaalsContact O-N 3.09Å
690	K	33.2	Very low	41.5	Very low	190 Å²	190	111 Å²	111	83%	0.826	59%	0.589	S	S	*	*	S	Bend	trans	87.4	68.2	160.3	-47.2	173.5	-171	164.9	0	119.4
691	S	30.4	Very low	39.5	Very low	123 Å²	123	113.3 Å²	113.3	86%	0.86	60%	0.604	S	S	*	*	S	Bend	trans	-153.4	47.2	136.3	-147.7	0	0	0	0	116
692	C	33.7	Very low	38	Very low	136 Å²	136	113.1 Å²	113.1	92%	0.919	60%	0.603	S	S	*	*	S	Bend	trans	-152.3	144.9	157.7	-107.8	0	0	0	0	112.4	G694	C692-G694 PolarHBondContact O-N 2.93Å
693	G	33.1	Very low	37.8	Very low	82 Å²	82	109.3 Å²	109.3	85%	0.845	59%	0.589	S	S	*	*			trans	-88.8	104.7	-172.9	0	0	0	0	0	113.8
694	G	30.7	Very low	39	Very low	79 Å²	79	108 Å²	108	81%	0.814	58%	0.584	S	S	*	*	S	Bend	trans	73.7	40.3	141.7	0	0	0	0	0	119	C692	C692-G694 PolarHBondContact O-N 2.93Å
695	Q	34.3	Very low	40.4	Very low	169 Å²	169	111 Å²	111	79%	0.79	60%	0.595	S	S	*	*			trans	-124.7	126.6	153.6	-93.2	-177.3	-19.2	0	0	111	Y697	Q695-Y697 PolarHBondContact O-N 2.78Å
696	R	29.6	Very low	42.2	Very low	250 Å²	250	109 Å²	109	94%	0.943	58%	0.583	S	S	*	*			trans	-81.4	106.3	175.6	-79.5	178.5	168.5	171.9	-5.5	109.5
697	Y	30.6	Very low	44.2	Very low	197 Å²	197	111.4 Å²	111.4	77%	0.773	59%	0.59	S	S	*	*			trans	-105.4	127	153	-80.6	-90.6	0	0	0	108.1	Q695 F699	Q695-Y697 PolarHBondContact O-N 2.78Å; Y697-F699 PolarHBondContact O-N 2.85Å
698	P	37.7	Very low	46.5	Very low	115 Å²	115	104.9 Å²	104.9	75%	0.747	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-71.1	125.2	170.2	29.9	-30.8	0	0	0	107.9
699	F	33.3	Very low	48.9	Very low	77 Å²	77	104.4 Å²	104.4	34%	0.338	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-64.9	138.6	170.7	-164.4	-97.5	0	0	0	109.5	I685 Y697 E729	I685-F699 HydrophobicContact CG1-CD1 4.46Å; Y697-F699 PolarHBondContact O-N 2.85Å; F699-E729 HydrophobicContact CE1-CB 4.06Å; F699-E729 HydrophobicContact CE1-CG 4.37Å; F699-E729 HydrophobicContact CE2-CG 3.99Å; F699-E729 WeakPolarHBondContact CE2-OE1 3.44Å; F699-E729 VanDerWaalsContact CE2-OE2 3.32Å; F699-E729 WeakPolarHBondContact CE2-OE2 3.43Å; F699-E729 HydrophobicContact CZ-CB 3.64Å; F699-E729 HydrophobicContact CZ-CG 3.47Å; F699-E729 VanDerWaalsContact CZ-CG 3.47Å; F699-E729 VanDerWaalsContact CZ-OE2 3.28Å; F699-E729 WeakPolarHBondContact CZ-OE2 3.27Å
700	R	38.3	Very low	50.9	Low	141 Å²	141	101 Å²	101	53%	0.532	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-75.7	152.1	-174.7	-62	-170.2	-167.6	-173.8	26.1	109.9	G702 D727	R700-G702 PolarHBondContact O-N 3.4Å; R700-D727 WeakPolarHBondContact CD-OD1 3.38Å; R700-D727 IonicContact CZ-OD1 3.69Å; R700-D727 IonicContact CZ-OD2 3.86Å; R700-D727 IonicContact NE-OD1 3.1Å; R700-D727 PolarHBondContact NE-OD1 2.85Å; R700-D727 IonicContact NH1-OD1 2.84Å; R700-D727 PolarHBondContact NH1-OD1 3.5Å; R700-D727 IonicContact NH1-OD2 3.99Å; R700-D727 PolarHBondContact NH1-OD2 3.11Å; R700-D727 IonicContact NH2-OD1 3.78Å; R700-D727 PolarHBondContact NH2-OD1 2.85Å; R700-D727 IonicContact NH2-OD2 2.72Å
701	L	38.8	Very low	53.2	Low	142 Å²	142	92.4 Å²	92.4	74%	0.743	51%	0.505	S	S	*	.	S	Bend	trans	-71.3	98.5	171.6	-77	71.3	0	0	0	106.8	E683	E683-L701 VanDerWaalsContact OE2-C 3.27Å
702	G	47.7	Very low	56	Low	1 Å²	1	93.1 Å²	93.1	1%	0.01	49%	0.493	C	S	.	.			trans	-169.3	8.7	-170.4	0	0	0	0	0	116.5	E683 R700 K728 E729	E683-G702 VanDerWaalsContact CD-C 3.49Å; E683-G702 VanDerWaalsContact CD-CA 3.43Å; E683-G702 WeakPolarHBondContact OE1-CA 3.35Å; E683-G702 WeakPolarHBondContact OE2-CA 3.28Å; E683-G702 PolarHBondContact OE2-N 3.09Å; E683-G702 VanDerWaalsContact OE2-N 3.12Å; R700-G702 PolarHBondContact O-N 3.4Å; G702-K728 CarbonylContact O-C 3.52Å; G702-K728 WeakPolarHBondContact O-CA 3.42Å; G702-K728 WeakPolarHBondContact O-CD 3.1Å; G702-E729 PolarHBondContact O-N 2.86Å
703	G	56.1	Low	58.5	Low	8 Å²	8	87.6 Å²	87.6	8%	0.082	46%	0.459	C	S	.	.			trans	-106.2	131.9	-173.1	0	0	0	0	0	116.7	E683 G684 E729	E683-G703 CarbonylContact C-O 3.59Å; E683-G703 WeakPolarHBondContact CA-O 3.03Å; E683-G703 WeakPolarHBondContact CB-O 3.38Å; E683-G703 WeakPolarHBondContact CG-O 3.48Å; E683-G703 PolarHBondContact OE1-N 2.88Å; G684-G703 PolarHBondContact N-O 3.17Å; G703-E729 CarbonylContact C-O 3.55Å; G703-E729 WeakPolarHBondContact CA-O 3.24Å
704	C	75.3	Confident	61.2	Low	14 Å²	14	89.6 Å²	89.6	10%	0.095	45%	0.446	C	S	.	.			trans	-118.6	107.6	-179.5	75	0	0	0	0	113.1	G671 F706 E729 C730 I731	G671-C704 WeakPolarHBondContact O-CA 3.43Å; C704-F706 HydrophobicContact CB-CE2 4.24Å; C704-F706 HydrophobicContact CB-CZ 4.42Å; C704-F706 WeakPolarHBondContact SG-CE2 3.29Å; C704-E729 PolarHBondContact N-O 3.19Å; C704-E729 VanDerWaalsContact N-O 3.17Å; C704-C730 HydrophobicContact CB-CB 4.23Å; C704-C730 WeakPolarHBondContact CB-SG 3.48Å; C704-C730 PolarHBondContact N-SG 2.8Å; C704-C730 VanDerWaalsContact N-SG 3.43Å; C704-C730 CarbonylContact O-C 3.57Å; C704-C730 VanDerWaalsContact O-CA 3.23Å; C704-C730 WeakPolarHBondContact O-CA 3.36Å; C704-C730 WeakPolarHBondContact O-CB 3.37Å; C704-C730 WeakPolarHBondContact SG-CB 3.15Å; C704-C730 CovalentContact SG-SG 2.04Å; C704-C730 PolarHBondContact SG-SG 3.14Å; C704-I731 PolarHBondContact O-N 2.67Å
705	K	78.9	Confident	64.1	Low	67 Å²	67	86.3 Å²	86.3	29%	0.291	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.7	-177.8	-172.3	-143.2	167.1	-167.9	0	113.9	S670 G671 E707 I731	S670-K705 CarbonylContact C-O 3.57Å; G671-K705 WeakPolarHBondContact CA-O 3.35Å; G671-K705 PolarHBondContact N-O 2.7Å; G671-K705 PolarHBondContact O-N 3.48Å; G671-K705 VanDerWaalsContact O-N 3.08Å; K705-E707 WeakPolarHBondContact CE-OE1 3.42Å; K705-E707 IonicContact NZ-OE1 3.13Å; K705-E707 PolarHBondContact NZ-OE1 2.83Å; K705-I731 CarbonylContact C-O 3.42Å; K705-I731 WeakPolarHBondContact CA-O 3Å; K705-I731 HydrophobicContact CB-CB 4.39Å; K705-I731 HydrophobicContact CG-CB 4.21Å; K705-I731 HydrophobicContact CG-CG2 3.89Å
706	F	78.8	Confident	66.8	Low	59 Å²	59	81 Å²	81	26%	0.259	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	148.1	173.6	-51.5	-89.3	0	0	0	112.5	S670 C704 I731 W732 H733	S670-F706 WeakPolarHBondContact O-CD1 3.41Å; S670-F706 WeakPolarHBondContact O-CE1 3.48Å; C704-F706 HydrophobicContact CB-CE2 4.24Å; C704-F706 HydrophobicContact CB-CZ 4.42Å; C704-F706 WeakPolarHBondContact SG-CE2 3.29Å; F706-I731 PolarHBondContact N-O 3.3Å; F706-W732 HydrophobicContact CB-CG 4.35Å; F706-W732 AromaticContact CD2-CD1 3.41Å; F706-W732 VanDerWaalsContact CD2-CD1 3.41Å; F706-W732 HydrophobicContact CD2-CD2 4.02Å; F706-W732 AromaticContact CD2-CE2 3.54Å; F706-W732 AromaticContact CD2-CG 3.97Å; F706-W732 HydrophobicContact CD2-CG 3.97Å; F706-W732 HydrophobicContact CD2-CZ2 4.17Å; F706-W732 AromaticContact CD2-NE1 3.12Å; F706-W732 AromaticContact CE2-CE2 3.67Å; F706-W732 AromaticContact CE2-CZ2 3.83Å; F706-W732 HydrophobicContact CE2-CZ2 3.83Å; F706-W732 AromaticContact CE2-NE1 3.47Å; F706-W732 AromaticContact CG-CD1 3.78Å; F706-W732 AromaticContact CG-NE1 3.8Å; F706-H733 PolarHBondContact O-N 2.77Å
707	E	83	Confident	69.7	Low	99 Å²	99	69.2 Å²	69.2	46%	0.463	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.8	164.5	-61.6	-167.1	166.9	0	0	109	K705 H733	K705-E707 WeakPolarHBondContact CE-OE1 3.42Å; K705-E707 IonicContact NZ-OE1 3.13Å; K705-E707 PolarHBondContact NZ-OE1 2.83Å; E707-H733 CarbonylContact C-O 3.54Å; E707-H733 WeakPolarHBondContact CA-O 3.49Å; E707-H733 HydrophobicContact CG-CB 4.41Å
708	L	84.8	Confident	72.3	Confident	35 Å²	35	61.1 Å²	61.1	18%	0.183	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	102.4	-167.9	-67.7	179.6	0	0	0	110.4	W732 H733 F734 V735 Y813	L708-W732 HydrophobicContact CD1-CB 4.44Å; L708-H733 PolarHBondContact N-O 2.77Å; L708-F734 HydrophobicContact CB-CD1 3.96Å; L708-F734 HydrophobicContact CD1-CD1 3.68Å; L708-F734 HydrophobicContact CD1-CE1 3.42Å; L708-F734 VanDerWaalsContact CD1-CE1 3.42Å; L708-F734 HydrophobicContact CD1-CZ 4.1Å; L708-F734 HydrophobicContact CG-CD1 4.46Å; L708-F734 WeakPolarHBondContact O-CA 3.48Å; L708-V735 PolarHBondContact O-N 3.3Å; L708-Y813 HydrophobicContact CB-CE2 4.47Å; L708-Y813 HydrophobicContact CD1-CE1 3.93Å
709	N	82.7	Confident	74.5	Confident	98 Å²	98	59.1 Å²	59.1	52%	0.524	31%	0.305	S	S	.	.			trans	-106	6.5	-170.7	-61.5	-15.6	0	0	0	114	T573 V735	T573-N709 WeakPolarHBondContact CG2-O 3.49Å; N709-V735 WeakPolarHBondContact CA-O 3.3Å
710	A	78.1	Confident	76.8	Confident	38 Å²	38	58.1 Å²	58.1	31%	0.314	30%	0.3	S	S	.	.	S	Bend	trans	-81.5	156.3	-179.7	0	0	0	0	0	111.7	F712	A710-F712 WeakPolarHBondContact CB-O 3.37Å; A710-F712 PolarHBondContact O-N 3.38Å
711	A	81	Confident	79.1	Confident	10 Å²	10	55.7 Å²	55.7	8%	0.083	30%	0.303	C	S	.	.	S	Bend	trans	-67.7	-21.3	174.6	0	0	0	0	0	113.2	S815 A834 M835	A711-S815 WeakPolarHBondContact O-CB 3.44Å; A711-S815 PolarHBondContact O-N 2.93Å; A711-A834 HydrophobicContact CB-CB 3.7Å; A711-M835 HydrophobicContact CB-CG 3.99Å; A711-M835 HydrophobicContact CB-SD 3.46Å; A711-M835 WeakPolarHBondContact CB-SD 3.38Å
712	F	90	Very high	81.3	Confident	139 Å²	139	55.7 Å²	55.7	61%	0.61	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.8	163.4	173.9	59.3	-91.2	0	0	0	110.2	A710 Y813 T814	A710-F712 WeakPolarHBondContact CB-O 3.37Å; A710-F712 PolarHBondContact O-N 3.38Å; F712-Y813 CarbonylContact C-O 3.56Å; F712-Y813 WeakPolarHBondContact CA-O 3.35Å; F712-T814 HydrophobicContact CB-CG2 4.15Å
713	G	86.7	Confident	83.2	Confident	20 Å²	20	60 Å²	60	21%	0.206	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-177.9	170.8	0	0	0	0	0	113.5	H812 Y813	G713-H812 WeakPolarHBondContact O-CA 3.32Å; G713-Y813 VanDerWaalsContact C-CE1 3.47Å; G713-Y813 PolarHBondContact N-O 3.39Å; G713-Y813 VanDerWaalsContact O-CD1 3.28Å; G713-Y813 WeakPolarHBondContact O-CD1 3.14Å; G713-Y813 PolarHBondContact O-N 2.03Å
714	Q	89.5	Confident	84.8	Confident	123 Å²	123	59.7 Å²	59.7	58%	0.575	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	152.6	171.2	-47.6	-166.4	11.4	0	0	109.7	A811 H812	Q714-A811 WeakPolarHBondContact CA-O 3.46Å; Q714-H812 WeakPolarHBondContact CG-NE2 3.39Å; Q714-H812 PolarHBondContact NE2-NE2 3.23Å; Q714-H812 PolarHBondContact OE1-NE2 3.5Å
715	L	90.7	Very high	85.3	Confident	11 Å²	11	61 Å²	61	6%	0.058	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	157.6	167	65.5	153.6	0	0	0	110.3	W732 F734 L744 M796 F809 A811 Y813	L715-W732 HydrophobicContact CD1-CB 4.47Å; L715-W732 HydrophobicContact CD1-CD2 3.97Å; L715-W732 HydrophobicContact CD1-CG 3.79Å; L715-F734 HydrophobicContact CD1-CE1 4.4Å; L715-F734 HydrophobicContact CD1-CZ 3.76Å; L715-F734 HydrophobicContact CD2-CE1 3.9Å; L715-F734 HydrophobicContact CD2-CZ 3.93Å; L715-L744 HydrophobicContact CD2-CD1 3.99Å; L715-M796 HydrophobicContact CD1-CE 3.49Å; L715-M796 VanDerWaalsContact CD1-CE 3.49Å; L715-F809 HydrophobicContact CD1-CE2 4.14Å; L715-F809 HydrophobicContact CG-CE2 4.48Å; L715-A811 HydrophobicContact CD2-CB 4.09Å; L715-A811 HydrophobicContact CG-CB 4.26Å; L715-A811 PolarHBondContact N-O 3.1Å; L715-A811 PolarHBondContact O-N 3.01Å; L715-Y813 HydrophobicContact CD2-CD1 3.74Å; L715-Y813 HydrophobicContact CD2-CE1 4.47Å
716	T	91.9	Very high	85.5	Confident	57 Å²	57	59.8 Å²	59.8	35%	0.35	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	163.2	178.2	56.5	0	0	0	0	110.8	Y720 F809 Q810	T716-Y720 HydrophobicContact CG2-CD1 3.5Å; T716-Y720 HydrophobicContact CG2-CE1 4.02Å; T716-Y720 HydrophobicContact CG2-CG 4Å; T716-F809 CarbonylContact C-O 3.51Å; T716-F809 WeakPolarHBondContact CA-O 3.31Å; T716-Q810 HydrophobicContact CG2-CB 4.12Å; T716-Q810 HydrophobicContact CG2-CG 4.01Å
717	S	90.3	Very high	85.7	Confident	2 Å²	2	59 Å²	59	1%	0.014	32%	0.321	C	S	.	.			trans	-60.6	157.4	161.3	44.9	0	0	0	0	111.3	Y720 K807 G808 F809	S717-Y720 WeakPolarHBondContact O-CB 3.42Å; S717-Y720 PolarHBondContact O-N 2.87Å; S717-K807 PolarHBondContact OG-O 2.87Å; S717-G808 WeakPolarHBondContact OG-CA 3.12Å; S717-F809 PolarHBondContact N-O 2.81Å; S717-F809 PolarHBondContact OG-N 3.25Å; S717-F809 PolarHBondContact OG-O 2.53Å
718	P	85.3	Confident	85.7	Confident	28 Å²	28	56.2 Å²	56.2	18%	0.182	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	142.8	165.7	-25.5	35.2	0	0	0	111.4	Y720 C730	P718-Y720 PolarHBondContact O-N 2.93Å; P718-Y720 VanDerWaalsContact O-N 3.08Å; P718-C730 HydrophobicContact CG-CB 4.41Å; P718-C730 VanDerWaalsContact CG-SG 3.51Å
719	S	82.9	Confident	85.8	Confident	72 Å²	72	56.4 Å²	56.4	50%	0.503	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	-8	179.9	-61.5	0	0	0	0	118.2	E722	S719-E722 CarbonylContact C-O 3.56Å; S719-E722 WeakPolarHBondContact O-CA 3.4Å; S719-E722 VanDerWaalsContact O-CB 3.31Å; S719-E722 WeakPolarHBondContact O-CB 3.5Å; S719-E722 PolarHBondContact O-N 2.85Å
720	Y	82.7	Confident	86	Confident	56 Å²	56	51.8 Å²	51.8	22%	0.22	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	134.5	177.8	-175.4	-89.6	0	0	0	112.4	T716 S717 P718 E748 K807 Q810	T716-Y720 HydrophobicContact CG2-CD1 3.5Å; T716-Y720 HydrophobicContact CG2-CE1 4.02Å; T716-Y720 HydrophobicContact CG2-CG 4Å; S717-Y720 WeakPolarHBondContact O-CB 3.42Å; S717-Y720 PolarHBondContact O-N 2.87Å; P718-Y720 PolarHBondContact O-N 2.93Å; P718-Y720 VanDerWaalsContact O-N 3.08Å; Y720-E748 HydrophobicContact CE2-CB 4.35Å; Y720-K807 WeakPolarHBondContact CD2-O 3.42Å; Y720-Q810 HydrophobicContact CE1-CB 3.88Å; Y720-Q810 HydrophobicContact CE1-CG 4.36Å; Y720-Q810 HydrophobicContact CE2-CB 4.13Å; Y720-Q810 WeakPolarHBondContact OH-CB 3.35Å; Y720-Q810 PolarHBondContact OH-OE1 3.39Å
721	P	85.2	Confident	86.6	Confident	91 Å²	91	50.3 Å²	50.3	59%	0.591	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.8	2.4	10.9	36.1	-38.5	0	0	0	115.5
722	E	85.1	Confident	87.1	Confident	142 Å²	142	50.1 Å²	50.1	66%	0.664	27%	0.267	S	S	*	.	S	Bend	trans	-74.2	164.3	171	-57.7	-64.6	140.1	0	0	110.9	S719 Y724	S719-E722 CarbonylContact C-O 3.56Å; S719-E722 WeakPolarHBondContact O-CA 3.4Å; S719-E722 VanDerWaalsContact O-CB 3.31Å; S719-E722 WeakPolarHBondContact O-CB 3.5Å; S719-E722 PolarHBondContact O-N 2.85Å; E722-Y724 PolarHBondContact O-N 2.95Å
723	D	88.4	Confident	87.1	Confident	91 Å²	91	44.5 Å²	44.5	49%	0.487	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-56.8	132.8	176.8	-82.8	-22.4	0	0	0	112.1	Q805 R806 K807	D723-Q805 HydrophobicContact CB-CB 3.82Å; D723-Q805 HydrophobicContact CB-CG 4.49Å; D723-R806 CarbonylContact C-O 3.56Å; D723-R806 VanDerWaalsContact CA-O 3.29Å; D723-R806 WeakPolarHBondContact CA-O 3.28Å; D723-R806 VanDerWaalsContact OD1-CA 3.23Å; D723-R806 WeakPolarHBondContact OD1-CA 3.41Å; D723-K807 PolarHBondContact OD1-N 2.84Å
724	Y	89.2	Confident	87.3	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-66.5	152.8	179.1	55.8	-110.8	0	0	0	111.8	E722 I751 E752 D760 F798 Q805 R806 G808	E722-Y724 PolarHBondContact O-N 2.95Å; Y724-I751 HydrophobicContact CE1-CD1 3.98Å; Y724-E752 PolarHBondContact OH-N 3.01Å; Y724-D760 WeakPolarHBondContact CE2-OD2 3.41Å; Y724-D760 PolarHBondContact OH-OD2 2.92Å; Y724-F798 AromaticContact CD1-CZ 3.99Å; Y724-F798 HydrophobicContact CD1-CZ 3.99Å; Y724-F798 AromaticContact CD2-CZ 3.95Å; Y724-F798 HydrophobicContact CD2-CZ 3.95Å; Y724-F798 HydrophobicContact CE1-CZ 4.24Å; Y724-F798 HydrophobicContact CE2-CZ 4.22Å; Y724-F798 HydrophobicContact CG-CE1 4.38Å; Y724-F798 AromaticContact CG-CZ 3.86Å; Y724-F798 HydrophobicContact CG-CZ 3.86Å; Y724-Q805 WeakPolarHBondContact O-CG 3.37Å; Y724-R806 WeakPolarHBondContact CD1-O 3.4Å; Y724-R806 HydrophobicContact CE1-CB 3.85Å; Y724-R806 WeakPolarHBondContact CE1-O 3.43Å; Y724-R806 PolarHBondContact N-O 3.46Å; Y724-G808 VanDerWaalsContact CD1-CA 3.4Å
725	P	85.3	Confident	87.4	Confident	42 Å²	42	39.4 Å²	39.4	27%	0.273	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-74.2	151.1	177.9	-12	27.8	0	0	0	112.8	K728 S800	P725-K728 HydrophobicContact CB-CD 4.43Å; P725-K728 HydrophobicContact CB-CG 3.76Å; P725-K728 HydrophobicContact CG-CG 4.17Å; P725-K728 WeakPolarHBondContact O-CG 3.3Å; P725-S800 PolarHBondContact O-OG 3.46Å
726	N	84.7	Confident	87.2	Confident	41 Å²	41	39.3 Å²	39.3	22%	0.219	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	159.3	171.1	-66.3	1.7	0	0	0	111.7	K728 D801 S802 S803 Q805	N726-K728 VanDerWaalsContact C-N 3.27Å; N726-K728 PolarHBondContact O-N 2.96Å; N726-D801 CarbonylContact C-O 3.59Å; N726-D801 VanDerWaalsContact CA-O 3.31Å; N726-D801 WeakPolarHBondContact CA-O 3.06Å; N726-D801 VanDerWaalsContact CB-O 3.26Å; N726-D801 WeakPolarHBondContact CB-O 3Å; N726-S802 PolarHBondContact ND2-O 3.16Å; N726-S803 WeakPolarHBondContact ND2-CA 3.48Å; N726-S803 PolarHBondContact ND2-N 3.31Å; N726-Q805 PolarHBondContact ND2-NE2 2.88Å; N726-Q805 WeakPolarHBondContact OD1-CG 3.46Å; N726-Q805 PolarHBondContact OD1-NE2 2.9Å
727	D	82.9	Confident	86.9	Confident	42 Å²	42	37.5 Å²	37.5	23%	0.225	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	34.3	176.3	-67.4	-73	0	0	0	113.7	R700 S800 D801	R700-D727 WeakPolarHBondContact CD-OD1 3.38Å; R700-D727 IonicContact CZ-OD1 3.69Å; R700-D727 IonicContact CZ-OD2 3.86Å; R700-D727 IonicContact NE-OD1 3.1Å; R700-D727 PolarHBondContact NE-OD1 2.85Å; R700-D727 IonicContact NH1-OD1 2.84Å; R700-D727 PolarHBondContact NH1-OD1 3.5Å; R700-D727 IonicContact NH1-OD2 3.99Å; R700-D727 PolarHBondContact NH1-OD2 3.11Å; R700-D727 IonicContact NH2-OD1 3.78Å; R700-D727 PolarHBondContact NH2-OD1 2.85Å; R700-D727 IonicContact NH2-OD2 2.72Å; D727-S800 WeakPolarHBondContact CA-O 3.33Å; D727-S800 PolarHBondContact N-O 2.68Å; D727-S800 PolarHBondContact N-OG 2.99Å; D727-D801 PolarHBondContact N-O 2.6Å
728	K	82.5	Confident	86.7	Confident	41 Å²	41	39.9 Å²	39.9	18%	0.178	22%	0.22	C	C	.	.			trans	-102.2	142.2	-179.6	-68	-63.1	-172	-179.8	0	112.6	E683 G702 P725 N726 H799 S800	E683-K728 VanDerWaalsContact CD-NZ 3.33Å; E683-K728 IonicContact OE1-NZ 2.64Å; E683-K728 PolarHBondContact OE1-NZ 3.34Å; E683-K728 IonicContact OE2-NZ 2.99Å; E683-K728 PolarHBondContact OE2-NZ 2.95Å; G702-K728 CarbonylContact O-C 3.52Å; G702-K728 WeakPolarHBondContact O-CA 3.42Å; G702-K728 WeakPolarHBondContact O-CD 3.1Å; P725-K728 HydrophobicContact CB-CD 4.43Å; P725-K728 HydrophobicContact CB-CG 3.76Å; P725-K728 HydrophobicContact CG-CG 4.17Å; P725-K728 WeakPolarHBondContact O-CG 3.3Å; N726-K728 VanDerWaalsContact C-N 3.27Å; N726-K728 PolarHBondContact O-N 2.96Å; K728-H799 CarbonylContact O-C 3.57Å; K728-H799 VanDerWaalsContact O-CA 3.3Å; K728-H799 WeakPolarHBondContact O-CA 3.36Å; K728-S800 PolarHBondContact N-OG 2.78Å; K728-S800 PolarHBondContact O-N 3.39Å
729	E	87.3	Confident	86.8	Confident	40 Å²	40	38.7 Å²	38.7	19%	0.187	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	93.9	173	-88.3	-171.5	-170.7	0	0	112.2	F699 G702 G703 C704 F797 F798 H799	F699-E729 HydrophobicContact CE1-CB 4.06Å; F699-E729 HydrophobicContact CE1-CG 4.37Å; F699-E729 HydrophobicContact CE2-CG 3.99Å; F699-E729 WeakPolarHBondContact CE2-OE1 3.44Å; F699-E729 VanDerWaalsContact CE2-OE2 3.32Å; F699-E729 WeakPolarHBondContact CE2-OE2 3.43Å; F699-E729 HydrophobicContact CZ-CB 3.64Å; F699-E729 HydrophobicContact CZ-CG 3.47Å; F699-E729 VanDerWaalsContact CZ-CG 3.47Å; F699-E729 VanDerWaalsContact CZ-OE2 3.28Å; F699-E729 WeakPolarHBondContact CZ-OE2 3.27Å; G702-E729 PolarHBondContact O-N 2.86Å; G703-E729 CarbonylContact C-O 3.55Å; G703-E729 WeakPolarHBondContact CA-O 3.24Å; C704-E729 PolarHBondContact N-O 3.19Å; C704-E729 VanDerWaalsContact N-O 3.17Å; E729-F797 HydrophobicContact CB-CE2 4.28Å; E729-F797 HydrophobicContact CG-CE2 3.98Å; E729-F797 HydrophobicContact CG-CZ 3.77Å; E729-F797 WeakPolarHBondContact OE1-CZ 3.31Å; E729-F797 WeakPolarHBondContact OE2-CE2 3.3Å; E729-F798 CarbonylContact C-O 3.6Å; E729-F798 VanDerWaalsContact CA-O 3.24Å; E729-F798 WeakPolarHBondContact CA-O 3.33Å; E729-H799 HydrophobicContact CG-CB 4.03Å; E729-H799 WeakPolarHBondContact CG-ND1 3.41Å; E729-H799 IonicContact OE1-CE1 2.81Å; E729-H799 PolarHBondContact OE1-CE1 3.24Å; E729-H799 IonicContact OE1-CG 3.63Å; E729-H799 IonicContact OE1-ND1 3.75Å; E729-H799 PolarHBondContact OE1-ND1 2.58Å
730	C	87	Confident	87.2	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	145.2	-175.8	-69.3	0	0	0	0	112.6	C704 P718 W732 F797 F798	C704-C730 HydrophobicContact CB-CB 4.23Å; C704-C730 WeakPolarHBondContact CB-SG 3.48Å; C704-C730 PolarHBondContact N-SG 2.8Å; C704-C730 VanDerWaalsContact N-SG 3.43Å; C704-C730 CarbonylContact O-C 3.57Å; C704-C730 VanDerWaalsContact O-CA 3.23Å; C704-C730 WeakPolarHBondContact O-CA 3.36Å; C704-C730 WeakPolarHBondContact O-CB 3.37Å; C704-C730 WeakPolarHBondContact SG-CB 3.15Å; C704-C730 CovalentContact SG-SG 2.04Å; C704-C730 PolarHBondContact SG-SG 3.14Å; P718-C730 HydrophobicContact CG-CB 4.41Å; P718-C730 VanDerWaalsContact CG-SG 3.51Å; C730-W732 HydrophobicContact CB-CH2 3.35Å; C730-W732 HydrophobicContact CB-CZ2 4.07Å; C730-W732 HydrophobicContact CB-CZ3 3.62Å; C730-W732 VanDerWaalsContact O-CZ3 3.23Å; C730-W732 WeakPolarHBondContact O-CZ3 3.47Å; C730-F797 CarbonylContact O-C 3.58Å; C730-F797 WeakPolarHBondContact O-CA 3.38Å; C730-F798 HydrophobicContact CB-CD1 4.42Å; C730-F798 PolarHBondContact N-O 2.98Å; C730-F798 PolarHBondContact O-N 2.8Å
731	I	89.9	Confident	87.7	Confident	6 Å²	6	35.6 Å²	35.6	3%	0.031	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.5	-165.5	-73.6	169.7	0	0	0	109.1	P686 C704 K705 F706 Y795 M796 F797	P686-I731 HydrophobicContact CG-CD1 3.26Å; C704-I731 PolarHBondContact O-N 2.67Å; K705-I731 CarbonylContact C-O 3.42Å; K705-I731 WeakPolarHBondContact CA-O 3Å; K705-I731 HydrophobicContact CB-CB 4.39Å; K705-I731 HydrophobicContact CG-CB 4.21Å; K705-I731 HydrophobicContact CG-CG2 3.89Å; F706-I731 PolarHBondContact N-O 3.3Å; I731-Y795 HydrophobicContact CG2-CE1 3.77Å; I731-Y795 HydrophobicContact CG2-CE2 3.92Å; I731-Y795 VanDerWaalsContact CG2-CZ 3.44Å; I731-Y795 WeakPolarHBondContact CG2-OH 3.43Å; I731-M796 CarbonylContact C-O 3.59Å; I731-M796 VanDerWaalsContact CA-O 3.25Å; I731-M796 WeakPolarHBondContact CA-O 3.27Å; I731-F797 HydrophobicContact CD1-CD2 3.82Å; I731-F797 HydrophobicContact CD1-CE2 4.3Å; I731-F797 HydrophobicContact CG1-CD2 3.69Å; I731-F797 HydrophobicContact CG1-CE2 4.5Å
732	W	90.8	Very high	88.1	Confident	6 Å²	6	31.3 Å²	31.3	2%	0.023	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	112.8	175.3	-61.6	-102.8	0	0	0	108.3	F706 L708 L715 C730 F734 M796 F798 F809	F706-W732 HydrophobicContact CB-CG 4.35Å; F706-W732 AromaticContact CD2-CD1 3.41Å; F706-W732 VanDerWaalsContact CD2-CD1 3.41Å; F706-W732 HydrophobicContact CD2-CD2 4.02Å; F706-W732 AromaticContact CD2-CE2 3.54Å; F706-W732 AromaticContact CD2-CG 3.97Å; F706-W732 HydrophobicContact CD2-CG 3.97Å; F706-W732 HydrophobicContact CD2-CZ2 4.17Å; F706-W732 AromaticContact CD2-NE1 3.12Å; F706-W732 AromaticContact CE2-CE2 3.67Å; F706-W732 AromaticContact CE2-CZ2 3.83Å; F706-W732 HydrophobicContact CE2-CZ2 3.83Å; F706-W732 AromaticContact CE2-NE1 3.47Å; F706-W732 AromaticContact CG-CD1 3.78Å; F706-W732 AromaticContact CG-NE1 3.8Å; L708-W732 HydrophobicContact CD1-CB 4.44Å; L715-W732 HydrophobicContact CD1-CB 4.47Å; L715-W732 HydrophobicContact CD1-CD2 3.97Å; L715-W732 HydrophobicContact CD1-CG 3.79Å; C730-W732 HydrophobicContact CB-CH2 3.35Å; C730-W732 HydrophobicContact CB-CZ2 4.07Å; C730-W732 HydrophobicContact CB-CZ3 3.62Å; C730-W732 VanDerWaalsContact O-CZ3 3.23Å; C730-W732 WeakPolarHBondContact O-CZ3 3.47Å; W732-F734 HydrophobicContact CB-CD2 4.18Å; W732-F734 HydrophobicContact CB-CE2 3.52Å; W732-F734 HydrophobicContact CB-CZ 3.78Å; W732-F734 HydrophobicContact CG-CZ 4.45Å; W732-F734 WeakPolarHBondContact O-CD2 3.32Å; W732-M796 HydrophobicContact CB-CB 4.34Å; W732-M796 HydrophobicContact CD2-CE 3.67Å; W732-M796 HydrophobicContact CE3-CB 4.37Å; W732-M796 HydrophobicContact CE3-CE 3.28Å; W732-M796 HydrophobicContact CE3-CG 4.4Å; W732-M796 HydrophobicContact CG-CE 4.28Å; W732-M796 HydrophobicContact CH2-CE 4.27Å; W732-M796 HydrophobicContact CZ3-CE 3.62Å; W732-M796 PolarHBondContact N-O 2.69Å; W732-M796 PolarHBondContact O-N 2.9Å; W732-F798 HydrophobicContact CH2-CB 4.06Å; W732-F798 HydrophobicContact CZ3-CB 3.66Å; W732-F809 HydrophobicContact CH2-CE1 4.35Å; W732-F809 AromaticContact CH2-CZ 3.64Å; W732-F809 HydrophobicContact CH2-CZ 3.64Å; W732-F809 HydrophobicContact CZ2-CZ 4.02Å; W732-F809 HydrophobicContact CZ3-CZ 4.09Å
733	H	90.8	Very high	88.6	Confident	21 Å²	21	27 Å²	27	10%	0.097	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	111.6	170	179.7	-137.4	0	0	0	108.5	F706 E707 L708 V735 S768 Y795	F706-H733 PolarHBondContact O-N 2.77Å; E707-H733 CarbonylContact C-O 3.54Å; E707-H733 WeakPolarHBondContact CA-O 3.49Å; E707-H733 HydrophobicContact CG-CB 4.41Å; L708-H733 PolarHBondContact N-O 2.77Å; H733-V735 WeakPolarHBondContact CE1-CG2 3.33Å; H733-S768 WeakPolarHBondContact NE2-CA 3.49Å; H733-S768 VanDerWaalsContact NE2-CB 3.31Å; H733-S768 WeakPolarHBondContact NE2-CB 3.29Å; H733-Y795 HydrophobicContact CB-CD2 4.01Å; H733-Y795 HydrophobicContact CB-CE2 4.3Å; H733-Y795 AromaticContact CD2-CD2 3.96Å
734	F	92	Very high	88.9	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.4	179.4	-55.7	-100	0	0	0	109	L708 L715 W732 L742 L744 E793 L794 M796 Y813	L708-F734 HydrophobicContact CB-CD1 3.96Å; L708-F734 HydrophobicContact CD1-CD1 3.68Å; L708-F734 HydrophobicContact CD1-CE1 3.42Å; L708-F734 VanDerWaalsContact CD1-CE1 3.42Å; L708-F734 HydrophobicContact CD1-CZ 4.1Å; L708-F734 HydrophobicContact CG-CD1 4.46Å; L708-F734 WeakPolarHBondContact O-CA 3.48Å; L715-F734 HydrophobicContact CD1-CE1 4.4Å; L715-F734 HydrophobicContact CD1-CZ 3.76Å; L715-F734 HydrophobicContact CD2-CE1 3.9Å; L715-F734 HydrophobicContact CD2-CZ 3.93Å; W732-F734 HydrophobicContact CB-CD2 4.18Å; W732-F734 HydrophobicContact CB-CE2 3.52Å; W732-F734 HydrophobicContact CB-CZ 3.78Å; W732-F734 HydrophobicContact CG-CZ 4.45Å; W732-F734 WeakPolarHBondContact O-CD2 3.32Å; F734-L742 HydrophobicContact CB-CD1 3.66Å; F734-L742 HydrophobicContact CB-CD2 4.07Å; F734-L742 HydrophobicContact CB-CG 4.41Å; F734-L742 WeakPolarHBondContact O-CD1 3.28Å; F734-L744 HydrophobicContact CZ-CD1 4.36Å; F734-E793 WeakPolarHBondContact O-CA 3.36Å; F734-L794 HydrophobicContact CB-CB 4.2Å; F734-L794 HydrophobicContact CD2-CB 4.25Å; F734-L794 HydrophobicContact CD2-CD2 4.17Å; F734-L794 HydrophobicContact CD2-CG 4.25Å; F734-L794 WeakPolarHBondContact CD2-O 3.28Å; F734-L794 HydrophobicContact CE2-CD2 4.43Å; F734-L794 PolarHBondContact N-O 2.66Å; F734-L794 PolarHBondContact O-N 2.8Å; F734-M796 HydrophobicContact CE2-CB 4.02Å; F734-Y813 HydrophobicContact CD1-CD1 4.1Å; F734-Y813 AromaticContact CD1-CD2 3.74Å; F734-Y813 HydrophobicContact CD1-CD2 3.74Å; F734-Y813 HydrophobicContact CD1-CE1 4.43Å; F734-Y813 HydrophobicContact CD1-CE2 4.1Å; F734-Y813 AromaticContact CD1-CG 3.73Å; F734-Y813 HydrophobicContact CD1-CG 3.73Å; F734-Y813 AromaticContact CE1-CD1 3.64Å; F734-Y813 HydrophobicContact CE1-CD1 3.64Å; F734-Y813 HydrophobicContact CE1-CD2 4.1Å; F734-Y813 HydrophobicContact CE1-CE1 4.15Å; F734-Y813 AromaticContact CE1-CG 3.59Å; F734-Y813 HydrophobicContact CE1-CG 3.59Å
735	V	89.7	Confident	89.1	Confident	37 Å²	37	25.1 Å²	25.1	22%	0.224	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	130.3	175.2	-173.8	0	0	0	0	108.5	L708 N709 H733	L708-V735 PolarHBondContact O-N 3.3Å; N709-V735 WeakPolarHBondContact CA-O 3.3Å; H733-V735 WeakPolarHBondContact CE1-CG2 3.33Å
736	T	87.4	Confident	89.5	Confident	9 Å²	9	23.7 Å²	23.7	6%	0.055	12%	0.122	C	C	.	.			trans	-127.1	177.5	177	-157.3	0	0	0	0	112	H740 L742 N792 S815	T736-H740 HydrophobicContact CG2-CB 3.99Å; T736-L742 HydrophobicContact CG2-CD1 4.05Å; T736-L742 HydrophobicContact CG2-CD2 4.29Å; T736-L742 HydrophobicContact CG2-CG 3.77Å; T736-N792 HydrophobicContact CG2-CB 3.85Å; T736-N792 PolarHBondContact N-O 3.43Å; T736-N792 WeakPolarHBondContact O-CB 3.32Å; T736-N792 PolarHBondContact O-ND2 3.27Å; T736-S815 WeakPolarHBondContact CG2-OG 3Å; T736-S815 VanDerWaalsContact OG1-CB 3.29Å; T736-S815 WeakPolarHBondContact OG1-CB 3.33Å; T736-S815 PolarHBondContact OG1-OG 2.04Å
737	T	86.4	Confident	89.8	Confident	19 Å²	19	26.2 Å²	26.2	12%	0.117	13%	0.134	C	C	.	.			trans	-58.7	134.9	-174.5	-59	0	0	0	0	111.9	G739 H740 Y831 A834	T737-G739 PolarHBondContact O-N 2.99Å; T737-H740 WeakPolarHBondContact O-CB 3.22Å; T737-H740 PolarHBondContact O-CD2 3.41Å; T737-H740 PolarHBondContact O-N 3.39Å; T737-Y831 HydrophobicContact CG2-CD2 3.54Å; T737-Y831 HydrophobicContact CG2-CE2 4.33Å; T737-Y831 HydrophobicContact CG2-CG 3.66Å; T737-A834 PolarHBondContact OG1-O 3.41Å
738	P	86	Confident	90.3	Very high	51 Å²	51	29 Å²	29	33%	0.331	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	136.2	-178.3	-29.9	36.3	0	0	0	113.8	H740 Y829 Y831	P738-H740 VanDerWaalsContact C-N 3.3Å; P738-Y829 CarbonylContact C-O 3.59Å; P738-Y829 WeakPolarHBondContact CB-O 3.44Å; P738-Y831 HydrophobicContact CB-CD2 4.18Å; P738-Y831 HydrophobicContact CB-CE2 3.99Å; P738-Y831 HydrophobicContact CG-CD2 4.46Å; P738-Y831 HydrophobicContact CG-CE2 3.97Å
739	G	86	Confident	90.9	Very high	4 Å²	4	27.5 Å²	27.5	4%	0.041	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	-2.2	-174.4	0	0	0	0	0	115.2	T737 W849	T737-G739 PolarHBondContact O-N 2.99Å; G739-W849 PolarHBondContact O-NE1 2.84Å
740	H	91.8	Very high	91.2	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.009	15%	0.145	C	C	.	.			trans	-98.5	169.6	168.3	-62.9	-98.2	0	0	0	110.7	T736 T737 P738 K791 N792 S815 C817 Y831 H833	T736-H740 HydrophobicContact CG2-CB 3.99Å; T737-H740 WeakPolarHBondContact O-CB 3.22Å; T737-H740 PolarHBondContact O-CD2 3.41Å; T737-H740 PolarHBondContact O-N 3.39Å; P738-H740 VanDerWaalsContact C-N 3.3Å; H740-K791 CarbonylContact O-C 3.53Å; H740-N792 WeakPolarHBondContact O-CA 3.13Å; H740-N792 VanDerWaalsContact O-CB 3.27Å; H740-N792 WeakPolarHBondContact O-CB 3.5Å; H740-N792 PolarHBondContact O-N 2.81Å; H740-S815 WeakPolarHBondContact CB-OG 3.23Å; H740-C817 VanDerWaalsContact CE1-CB 3.42Å; H740-C817 WeakPolarHBondContact CE1-CB 3.18Å; H740-C817 VanDerWaalsContact ND1-CA 3.27Å; H740-C817 WeakPolarHBondContact ND1-CA 3.43Å; H740-C817 VanDerWaalsContact ND1-CB 3.34Å; H740-C817 WeakPolarHBondContact ND1-CB 3.21Å; H740-Y831 PolarHBondContact NE2-O 2.83Å; H740-H833 VanDerWaalsContact CE1-C 3.44Å
741	R	93.7	Very high	91.5	Very high	61 Å²	61	28.9 Å²	28.9	23%	0.23	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	163.7	173.8	-68.2	169.1	-67.1	144.1	5.5	109.5	T788 S789 S790 S815 V816 C817 G818	R741-T788 HydrophobicContact CB-CG2 4.06Å; R741-S789 WeakPolarHBondContact CD-O 3.32Å; R741-S789 WeakPolarHBondContact CG-O 3.01Å; R741-S790 WeakPolarHBondContact CG-O 3.37Å; R741-S815 CarbonylContact O-C 3.55Å; R741-S815 WeakPolarHBondContact O-CA 3.46Å; R741-V816 PolarHBondContact N-O 2.81Å; R741-V816 PolarHBondContact O-N 3.09Å; R741-C817 PolarHBondContact NH2-O 3.48Å; R741-G818 PolarHBondContact NE-O 3.46Å; R741-G818 PolarHBondContact NH2-O 3.21Å
742	L	93.5	Very high	91.7	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	125.7	176.6	-77.2	144.8	0	0	0	109.3	F734 T736 T788 S789 L794 Y813	F734-L742 HydrophobicContact CB-CD1 3.66Å; F734-L742 HydrophobicContact CB-CD2 4.07Å; F734-L742 HydrophobicContact CB-CG 4.41Å; F734-L742 WeakPolarHBondContact O-CD1 3.28Å; T736-L742 HydrophobicContact CG2-CD1 4.05Å; T736-L742 HydrophobicContact CG2-CD2 4.29Å; T736-L742 HydrophobicContact CG2-CG 3.77Å; L742-T788 CarbonylContact O-C 3.55Å; L742-T788 VanDerWaalsContact O-CA 3.28Å; L742-T788 WeakPolarHBondContact O-CA 3.29Å; L742-S789 PolarHBondContact N-OG 2.83Å; L742-S789 PolarHBondContact O-N 3.22Å; L742-S789 PolarHBondContact O-OG 3.21Å; L742-L794 HydrophobicContact CB-CB 4.08Å; L742-L794 HydrophobicContact CB-CD2 4.28Å; L742-L794 HydrophobicContact CD1-CB 3.99Å; L742-Y813 HydrophobicContact CD2-CD2 4.07Å
743	Q	94.6	Very high	91.7	Very high	52 Å²	52	33.2 Å²	33.2	24%	0.243	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133	168.5	178.8	162	78.3	0	0	109.9	K786 I787 T788 Y813 T814 V816	Q743-K786 HydrophobicContact CG-CB 4.15Å; Q743-I787 CarbonylContact C-O 3.5Å; Q743-I787 VanDerWaalsContact CA-O 3.28Å; Q743-I787 WeakPolarHBondContact CA-O 3.5Å; Q743-T788 HydrophobicContact CB-CG2 4.48Å; Q743-T788 PolarHBondContact NE2-OG1 3.46Å; Q743-T788 VanDerWaalsContact NE2-OG1 3.07Å; Q743-Y813 CarbonylContact O-C 3.5Å; Q743-Y813 VanDerWaalsContact O-CA 3.28Å; Q743-Y813 WeakPolarHBondContact O-CA 3.07Å; Q743-T814 PolarHBondContact N-O 2.66Å; Q743-T814 PolarHBondContact O-N 2.97Å; Q743-V816 HydrophobicContact CB-CG2 3.64Å
744	L	94.5	Very high	91.7	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.9	178.5	-176.1	66	0	0	0	109.6	L715 F734 F746 L764 I787 L794 M796 A811	L715-L744 HydrophobicContact CD2-CD1 3.99Å; F734-L744 HydrophobicContact CZ-CD1 4.36Å; L744-F746 HydrophobicContact CD2-CE2 3.62Å; L744-F746 HydrophobicContact CD2-CZ 3.72Å; L744-F746 HydrophobicContact CG-CD2 4.4Å; L744-F746 HydrophobicContact CG-CE2 3.83Å; L744-F746 HydrophobicContact CG-CZ 4.22Å; L744-L764 HydrophobicContact CD2-CD1 3.92Å; L744-L764 HydrophobicContact CD2-CD2 3.89Å; L744-I787 PolarHBondContact N-O 3.14Å; L744-I787 PolarHBondContact O-N 2.86Å; L744-L794 HydrophobicContact CB-CD2 4.25Å; L744-L794 HydrophobicContact CD2-CD2 4.48Å; L744-M796 HydrophobicContact CD2-SD 3.84Å; L744-A811 HydrophobicContact CD1-CB 3.87Å
745	D	94.7	Very high	91.4	Very high	50 Å²	50	43.3 Å²	43.3	27%	0.267	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	115	-171.4	-167.7	27.1	0	0	0	109.6	K786 A811 H812	D745-K786 HydrophobicContact CB-CD 4.17Å; D745-K786 VanDerWaalsContact CG-CE 3.41Å; D745-K786 VanDerWaalsContact CG-NZ 3.3Å; D745-K786 WeakPolarHBondContact OD1-CD 3.21Å; D745-K786 WeakPolarHBondContact OD1-CE 3.44Å; D745-K786 WeakPolarHBondContact OD1-CG 3.39Å; D745-K786 IonicContact OD1-NZ 3.73Å; D745-K786 VanDerWaalsContact OD2-CE 3.27Å; D745-K786 WeakPolarHBondContact OD2-CE 3.2Å; D745-K786 IonicContact OD2-NZ 3.89Å; D745-K786 PolarHBondContact OD2-NZ 2.79Å; D745-A811 CarbonylContact O-C 3.27Å; D745-A811 VanDerWaalsContact O-CA 3.27Å; D745-A811 WeakPolarHBondContact O-CA 3.31Å; D745-H812 PolarHBondContact N-O 3.39Å; D745-H812 PolarHBondContact O-N 2.86Å
746	F	93.8	Very high	91.3	Very high	13 Å²	13	47 Å²	47	6%	0.057	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.5	-176.2	-71.4	-93	0	0	0	110.4	L744 F749 I762 L764 A783 P784 I787 M796 F809 A811	L744-F746 HydrophobicContact CD2-CE2 3.62Å; L744-F746 HydrophobicContact CD2-CZ 3.72Å; L744-F746 HydrophobicContact CG-CD2 4.4Å; L744-F746 HydrophobicContact CG-CE2 3.83Å; L744-F746 HydrophobicContact CG-CZ 4.22Å; F746-F749 HydrophobicContact CB-CD2 4.17Å; F746-F749 AromaticContact CD1-CD2 3.58Å; F746-F749 HydrophobicContact CD1-CD2 3.58Å; F746-F749 HydrophobicContact CD1-CE2 4.07Å; F746-F749 HydrophobicContact CE1-CD2 4.05Å; F746-F749 HydrophobicContact CE1-CE2 4.09Å; F746-F749 AromaticContact CG-CD2 3.89Å; F746-F749 HydrophobicContact CG-CD2 3.89Å; F746-F749 HydrophobicContact CG-CE2 4.43Å; F746-F749 HydrophobicContact CZ-CE2 4.46Å; F746-I762 HydrophobicContact CE1-CD1 4.06Å; F746-I762 HydrophobicContact CZ-CD1 4.44Å; F746-I762 HydrophobicContact CZ-CG2 4.49Å; F746-L764 HydrophobicContact CE2-CD1 4.41Å; F746-A783 HydrophobicContact CB-CB 4.05Å; F746-P784 HydrophobicContact CD2-CG 3.54Å; F746-P784 HydrophobicContact CE2-CG 3.85Å; F746-P784 HydrophobicContact CG-CG 4.34Å; F746-I787 HydrophobicContact CE2-CD1 4.49Å; F746-M796 HydrophobicContact CZ-SD 3.96Å; F746-F809 HydrophobicContact CD1-CB 4.13Å; F746-F809 HydrophobicContact CD1-CD2 4.24Å; F746-F809 HydrophobicContact CD1-CG 4.41Å; F746-F809 HydrophobicContact CE1-CB 4.31Å; F746-F809 AromaticContact CE1-CD2 3.86Å; F746-F809 HydrophobicContact CE1-CD2 3.86Å; F746-F809 HydrophobicContact CE1-CE2 4.43Å; F746-F809 HydrophobicContact CE1-CG 4.14Å; F746-A811 HydrophobicContact CD1-CB 3.64Å; F746-A811 HydrophobicContact CE1-CB 3.88Å; F746-A811 HydrophobicContact CG-CB 4.08Å; F746-A811 HydrophobicContact CZ-CB 4.5Å
747	I	91.5	Very high	91.5	Very high	93 Å²	93	47.2 Å²	47.2	48%	0.477	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-48.9	-178.9	-60.6	179.1	0	0	0	110.3	Q810 H812	I747-Q810 PolarHBondContact N-O 3.39Å; I747-H812 VanDerWaalsContact CD1-NE2 3.3Å; I747-H812 WeakPolarHBondContact CD1-NE2 3.44Å
748	E	92.1	Very high	91.5	Very high	100 Å²	100	49 Å²	49	47%	0.467	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.2	173.1	-77.9	-75.2	-167.5	0	0	108.6	Y720 F809 Q810	Y720-E748 HydrophobicContact CE2-CB 4.35Å; E748-F809 WeakPolarHBondContact O-CA 3.18Å; E748-F809 WeakPolarHBondContact O-CB 3.2Å; E748-Q810 HydrophobicContact CB-CB 4.34Å; E748-Q810 PolarHBondContact N-O 2.74Å; E748-Q810 PolarHBondContact O-N 2.04Å
749	F	94.4	Very high	91.7	Very high	11 Å²	11	51.3 Å²	51.3	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	98.2	-175	-166.3	-79.1	0	0	0	110.7	F746 I751 I762 G780 P781 A783 F809	F746-F749 HydrophobicContact CB-CD2 4.17Å; F746-F749 AromaticContact CD1-CD2 3.58Å; F746-F749 HydrophobicContact CD1-CD2 3.58Å; F746-F749 HydrophobicContact CD1-CE2 4.07Å; F746-F749 HydrophobicContact CE1-CD2 4.05Å; F746-F749 HydrophobicContact CE1-CE2 4.09Å; F746-F749 AromaticContact CG-CD2 3.89Å; F746-F749 HydrophobicContact CG-CD2 3.89Å; F746-F749 HydrophobicContact CG-CE2 4.43Å; F746-F749 HydrophobicContact CZ-CE2 4.46Å; F749-I751 HydrophobicContact CD1-CG1 4.29Å; F749-I751 HydrophobicContact CE1-CB 4.26Å; F749-I751 HydrophobicContact CE1-CG1 3.8Å; F749-I751 HydrophobicContact CE2-CG1 4.46Å; F749-I751 HydrophobicContact CZ-CG1 3.89Å; F749-I762 HydrophobicContact CE2-CD1 3.71Å; F749-I762 HydrophobicContact CZ-CD1 4.19Å; F749-G780 VanDerWaalsContact CD1-O 3.25Å; F749-G780 WeakPolarHBondContact CD1-O 3.42Å; F749-G780 WeakPolarHBondContact CE1-O 3.36Å; F749-P781 CarbonylContact O-C 3.49Å; F749-P781 WeakPolarHBondContact O-CA 3.43Å; F749-A783 HydrophobicContact CB-CB 3.75Å; F749-A783 HydrophobicContact CG-CB 4.26Å; F749-F809 HydrophobicContact CD2-CB 4.46Å
750	E	93.6	Very high	92.1	Very high	68 Å²	68	51.1 Å²	51.1	32%	0.318	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	93.8	174.8	-162.8	178.7	-173.2	0	0	109.6	P781 R806 G808	E750-P781 HydrophobicContact CG-CB 4.49Å; E750-R806 HydrophobicContact CB-CB 4.41Å; E750-R806 HydrophobicContact CG-CB 4.04Å; E750-R806 HydrophobicContact CG-CG 4.1Å; E750-R806 WeakPolarHBondContact O-CB 3.48Å; E750-R806 IonicContact OE1-NE 2.61Å; E750-G808 CarbonylContact C-O 3.56Å; E750-G808 PolarHBondContact N-O 3.42Å; E750-G808 WeakPolarHBondContact O-CA 3.37Å; E750-G808 PolarHBondContact O-N 2.85Å
751	I	93.7	Very high	92.2	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.263	C	S	.	.			trans	-110.4	160.5	174.8	-55.5	-58.9	0	0	0	108.4	Y724 F749 P753 D760 I762 C779 G780 F798 F809	Y724-I751 HydrophobicContact CE1-CD1 3.98Å; F749-I751 HydrophobicContact CD1-CG1 4.29Å; F749-I751 HydrophobicContact CE1-CB 4.26Å; F749-I751 HydrophobicContact CE1-CG1 3.8Å; F749-I751 HydrophobicContact CE2-CG1 4.46Å; F749-I751 HydrophobicContact CZ-CG1 3.89Å; I751-P753 WeakPolarHBondContact O-CD 3.34Å; I751-D760 HydrophobicContact CG2-CB 3.61Å; I751-I762 HydrophobicContact CD1-CD1 4.26Å; I751-I762 HydrophobicContact CG1-CD1 4.32Å; I751-C779 HydrophobicContact CB-CB 4.5Å; I751-C779 HydrophobicContact CG2-CB 3.98Å; I751-G780 PolarHBondContact N-O 2.79Å; I751-G780 CarbonylContact O-C 3.26Å; I751-G780 VanDerWaalsContact O-C 3.27Å; I751-G780 WeakPolarHBondContact O-CA 3.47Å; I751-G780 PolarHBondContact O-N 3.27Å; I751-F798 HydrophobicContact CD1-CE2 3.95Å; I751-F809 HydrophobicContact CD1-CD1 4.29Å
752	E	94.2	Very high	92.2	Very high	26 Å²	26	49.7 Å²	49.7	12%	0.121	25%	0.252	C	S	.	.			trans	-58.7	130.3	176	-162	-171.3	-166.9	0	0	111.8	Y724 H754 Y759 D760 C779 G780 V804	Y724-E752 PolarHBondContact OH-N 3.01Å; E752-H754 PolarHBondContact O-N 2.88Å; E752-Y759 VanDerWaalsContact OE2-CB 3.27Å; E752-Y759 WeakPolarHBondContact OE2-CB 3.11Å; E752-Y759 WeakPolarHBondContact OE2-CD2 3.2Å; E752-D760 HydrophobicContact CB-CB 3.96Å; E752-C779 WeakPolarHBondContact O-CB 3.44Å; E752-G780 PolarHBondContact O-N 2.63Å; E752-V804 HydrophobicContact CG-CB 4.22Å; E752-V804 HydrophobicContact CG-CG1 3.83Å; E752-V804 WeakPolarHBondContact OE1-CB 3.23Å; E752-V804 WeakPolarHBondContact OE1-CG1 3.5Å
753	P	90.9	Very high	92.2	Very high	77 Å²	77	51 Å²	51	50%	0.5	26%	0.258	S	S	.	.			trans	-81.2	113.1	178.2	30	-33.7	0	0	0	112.8	I751	I751-P753 WeakPolarHBondContact O-CD 3.34Å
754	H	90.7	Very high	92.2	Very high	52 Å²	52	48.5 Å²	48.5	24%	0.241	25%	0.247	C	C	.	.			trans	-124	146.1	164.7	-178.1	-88.6	0	0	0	111.1	E752 D756 C757 A758 Y759 C779	E752-H754 PolarHBondContact O-N 2.88Å; H754-D756 VanDerWaalsContact C-N 3.3Å; H754-D756 IonicContact CE1-OD2 3.89Å; H754-D756 PolarHBondContact ND1-N 2.79Å; H754-D756 PolarHBondContact O-N 2.89Å; H754-C757 PolarHBondContact ND1-N 2.82Å; H754-C757 PolarHBondContact O-N 2.79Å; H754-A758 WeakPolarHBondContact ND1-CB 3.45Å; H754-A758 PolarHBondContact ND1-N 2.96Å; H754-A758 VanDerWaalsContact ND1-N 3.2Å; H754-Y759 HydrophobicContact CB-CD2 3.73Å; H754-Y759 HydrophobicContact CB-CE2 4.07Å; H754-Y759 HydrophobicContact CB-CG 4.27Å; H754-Y759 AromaticContact CD2-CD2 3.97Å; H754-Y759 AromaticContact CD2-CE2 3.48Å; H754-Y759 VanDerWaalsContact CD2-CE2 3.48Å; H754-Y759 WeakPolarHBondContact CD2-CE2 3.21Å; H754-Y759 AromaticContact CD2-CZ 3.56Å; H754-C779 PolarHBondContact O-SG 3.38Å
755	Q	85.9	Confident	92.2	Very high	181 Å²	181	50 Å²	50	85%	0.846	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-42.6	-175.8	-178.1	173.6	-35.3	0	0	113.4
756	D	88.4	Confident	92.2	Very high	114 Å²	114	49 Å²	49	61%	0.61	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.5	15.6	176.6	-45.3	-71.3	0	0	0	113.1	H754 A758	H754-D756 VanDerWaalsContact C-N 3.3Å; H754-D756 IonicContact CE1-OD2 3.89Å; H754-D756 PolarHBondContact ND1-N 2.79Å; H754-D756 PolarHBondContact O-N 2.89Å; D756-A758 VanDerWaalsContact C-N 3.35Å; D756-A758 PolarHBondContact O-N 2.91Å
757	C	90.3	Very high	92	Very high	15 Å²	15	48.6 Å²	48.6	10%	0.101	25%	0.247	C	C	.	.			trans	48.5	50.8	-172.8	-58.2	0	0	0	0	113.4	H754 R761 K777 C779	H754-C757 PolarHBondContact ND1-N 2.82Å; H754-C757 PolarHBondContact O-N 2.79Å; C757-R761 HydrophobicContact CB-CB 4.27Å; C757-R761 WeakPolarHBondContact O-CD 3.46Å; C757-K777 HydrophobicContact CB-CD 4.44Å; C757-K777 HydrophobicContact CB-CG 4.01Å; C757-K777 WeakPolarHBondContact O-CE 3.33Å; C757-K777 PolarHBondContact O-NZ 3.29Å; C757-C779 WeakPolarHBondContact CA-SG 3.4Å; C757-C779 HydrophobicContact CB-CB 3.61Å; C757-C779 WeakPolarHBondContact CB-SG 3.47Å; C757-C779 WeakPolarHBondContact SG-CB 3.33Å; C757-C779 PolarHBondContact SG-N 3.33Å; C757-C779 VanDerWaalsContact SG-N 3.38Å; C757-C779 CovalentContact SG-SG 2.04Å; C757-C779 PolarHBondContact SG-SG 3.24Å
758	A	88	Confident	91.7	Very high	57 Å²	57	46.8 Å²	46.8	47%	0.471	24%	0.242	S	C	.	.			trans	-84.3	-28.4	-173.6	0	0	0	0	0	113.2	H754 D756	H754-A758 WeakPolarHBondContact ND1-CB 3.45Å; H754-A758 PolarHBondContact ND1-N 2.96Å; H754-A758 VanDerWaalsContact ND1-N 3.2Å; D756-A758 VanDerWaalsContact C-N 3.35Å; D756-A758 PolarHBondContact O-N 2.91Å
759	Y	89.4	Confident	91.4	Very high	99 Å²	99	43.8 Å²	43.8	39%	0.388	23%	0.233	S	C	.	.	S	Bend	trans	-81.9	-129	169.8	-43.4	-39.1	0	0	0	108.5	E752 H754 R761	E752-Y759 VanDerWaalsContact OE2-CB 3.27Å; E752-Y759 WeakPolarHBondContact OE2-CB 3.11Å; E752-Y759 WeakPolarHBondContact OE2-CD2 3.2Å; H754-Y759 HydrophobicContact CB-CD2 3.73Å; H754-Y759 HydrophobicContact CB-CE2 4.07Å; H754-Y759 HydrophobicContact CB-CG 4.27Å; H754-Y759 AromaticContact CD2-CD2 3.97Å; H754-Y759 AromaticContact CD2-CE2 3.48Å; H754-Y759 VanDerWaalsContact CD2-CE2 3.48Å; H754-Y759 WeakPolarHBondContact CD2-CE2 3.21Å; H754-Y759 AromaticContact CD2-CZ 3.56Å; Y759-R761 PolarHBondContact O-NH1 2.96Å
760	D	93.7	Very high	91	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-61.8	141.1	177.8	-66.1	28.1	0	0	0	113.3	Y724 I751 E752 C779 H799 S800 D801	Y724-D760 WeakPolarHBondContact CE2-OD2 3.41Å; Y724-D760 PolarHBondContact OH-OD2 2.92Å; I751-D760 HydrophobicContact CG2-CB 3.61Å; E752-D760 HydrophobicContact CB-CB 3.96Å; D760-C779 VanDerWaalsContact O-CB 3.23Å; D760-C779 WeakPolarHBondContact O-CB 3.4Å; D760-H799 VanDerWaalsContact CA-O 3.29Å; D760-H799 WeakPolarHBondContact CA-O 3.17Å; D760-S800 WeakPolarHBondContact OD1-CA 3.32Å; D760-S800 VanDerWaalsContact OD2-CB 3.3Å; D760-S800 WeakPolarHBondContact OD2-CB 3.02Å; D760-D801 WeakPolarHBondContact OD1-CB 3.28Å; D760-D801 PolarHBondContact OD1-N 2.86Å
761	R	93.4	Very high	90.6	Very high	32 Å²	32	50.4 Å²	50.4	12%	0.121	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	157.5	-169.4	59.9	-167.4	-172.5	-77.6	-15.6	114	C757 Y759 E763 Y778 F798 H799	C757-R761 HydrophobicContact CB-CB 4.27Å; C757-R761 WeakPolarHBondContact O-CD 3.46Å; Y759-R761 PolarHBondContact O-NH1 2.96Å; R761-E763 WeakPolarHBondContact CD-OE1 3.14Å; R761-E763 HydrophobicContact CG-CG 4.48Å; R761-E763 IonicContact CZ-OE1 2.62Å; R761-E763 IonicContact NE-OE1 3.12Å; R761-E763 PolarHBondContact NE-OE1 3.43Å; R761-Y778 CarbonylContact C-O 3.6Å; R761-Y778 VanDerWaalsContact CA-O 3.3Å; R761-Y778 WeakPolarHBondContact CA-O 3.31Å; R761-F798 WeakPolarHBondContact O-CA 3.04Å; R761-F798 WeakPolarHBondContact O-CD2 3.46Å; R761-H799 HydrophobicContact CG-CB 4.18Å; R761-H799 VanDerWaalsContact CZ-CD2 3.45Å; R761-H799 PolarHBondContact N-O 2.65Å; R761-H799 PolarHBondContact NH1-CD2 3.16Å; R761-H799 PolarHBondContact NH1-NE2 2.8Å; R761-H799 VanDerWaalsContact NH1-NE2 3.11Å; R761-H799 PolarHBondContact NH2-CD2 3.15Å; R761-H799 VanDerWaalsContact NH2-CG 3.29Å; R761-H799 PolarHBondContact NH2-ND1 3.3Å; R761-H799 PolarHBondContact O-N 3.18Å
762	I	94.4	Very high	90.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	124.4	164.7	-63.1	165.8	0	0	0	107.9	F746 F749 I751 L764 K777 Y778 M796 F797 F798 F809	F746-I762 HydrophobicContact CE1-CD1 4.06Å; F746-I762 HydrophobicContact CZ-CD1 4.44Å; F746-I762 HydrophobicContact CZ-CG2 4.49Å; F749-I762 HydrophobicContact CE2-CD1 3.71Å; F749-I762 HydrophobicContact CZ-CD1 4.19Å; I751-I762 HydrophobicContact CD1-CD1 4.26Å; I751-I762 HydrophobicContact CG1-CD1 4.32Å; I762-L764 HydrophobicContact CG2-CD1 4.43Å; I762-L764 HydrophobicContact CG2-CG 4.43Å; I762-K777 CarbonylContact O-C 3.55Å; I762-K777 WeakPolarHBondContact O-CA 3.42Å; I762-Y778 PolarHBondContact N-O 2.89Å; I762-Y778 PolarHBondContact O-N 2.71Å; I762-M796 HydrophobicContact CG2-CG 3.61Å; I762-M796 HydrophobicContact CG2-SD 3.66Å; I762-F797 CarbonylContact C-O 3.38Å; I762-F797 WeakPolarHBondContact CA-O 3.21Å; I762-F798 HydrophobicContact CG1-CB 4.29Å; I762-F798 HydrophobicContact CG1-CD2 3.79Å; I762-F798 HydrophobicContact CG1-CG 4.48Å; I762-F809 HydrophobicContact CD1-CD1 3.48Å; I762-F809 VanDerWaalsContact CD1-CD1 3.48Å; I762-F809 HydrophobicContact CD1-CE1 3.67Å; I762-F809 HydrophobicContact CD1-CG 4.03Å; I762-F809 HydrophobicContact CD1-CZ 4.37Å; I762-F809 HydrophobicContact CG1-CD1 4.49Å; I762-F809 HydrophobicContact CG1-CE1 4.3Å
763	E	93.7	Very high	90.2	Very high	29 Å²	29	54.7 Å²	54.7	14%	0.136	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.1	175.6	-64	178.2	-174.5	0	0	108.5	R761 Y765 K777 F797	R761-E763 WeakPolarHBondContact CD-OE1 3.14Å; R761-E763 HydrophobicContact CG-CG 4.48Å; R761-E763 IonicContact CZ-OE1 2.62Å; R761-E763 IonicContact NE-OE1 3.12Å; R761-E763 PolarHBondContact NE-OE1 3.43Å; E763-Y765 HydrophobicContact CB-CE2 3.87Å; E763-Y765 PolarHBondContact OE2-OH 2.97Å; E763-K777 HydrophobicContact CG-CB 4.1Å; E763-K777 HydrophobicContact CG-CD 4.08Å; E763-K777 HydrophobicContact CG-CG 3.85Å; E763-K777 WeakPolarHBondContact OE1-CD 3.33Å; E763-K777 WeakPolarHBondContact OE1-CE 3.46Å; E763-K777 IonicContact OE1-NZ 2.67Å; E763-K777 PolarHBondContact OE1-NZ 2.64Å; E763-F797 HydrophobicContact CB-CD1 4.24Å; E763-F797 PolarHBondContact N-O 2.84Å; E763-F797 PolarHBondContact O-N 3.49Å
764	L	94.5	Very high	90.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	141.9	-176.4	-84.6	156.9	0	0	0	110.7	L744 F746 I762 S774 L775 G776 Y778 I787 L794 M796	L744-L764 HydrophobicContact CD2-CD1 3.92Å; L744-L764 HydrophobicContact CD2-CD2 3.89Å; F746-L764 HydrophobicContact CE2-CD1 4.41Å; I762-L764 HydrophobicContact CG2-CD1 4.43Å; I762-L764 HydrophobicContact CG2-CG 4.43Å; L764-S774 CarbonylContact O-C 3.52Å; L764-S774 VanDerWaalsContact O-CA 3.3Å; L764-S774 WeakPolarHBondContact O-CA 3.21Å; L764-S774 PolarHBondContact O-OG 2.97Å; L764-S774 VanDerWaalsContact O-OG 3.05Å; L764-L775 HydrophobicContact CB-CB 4.26Å; L764-L775 PolarHBondContact O-N 2.87Å; L764-G776 PolarHBondContact N-O 2.79Å; L764-Y778 HydrophobicContact CD1-CD2 4.32Å; L764-Y778 HydrophobicContact CD1-CE2 3.99Å; L764-I787 HydrophobicContact CD1-CD1 3.36Å; L764-I787 HydrophobicContact CD1-CG2 4.47Å; L764-L794 HydrophobicContact CD2-CD1 4.16Å; L764-L794 HydrophobicContact CD2-CD2 4.29Å; L764-L794 HydrophobicContact CD2-CG 4.23Å; L764-M796 HydrophobicContact CD2-CB 3.53Å; L764-M796 HydrophobicContact CD2-CG 3.61Å; L764-M796 HydrophobicContact CD2-SD 4.1Å; L764-M796 HydrophobicContact CG-CB 4.33Å; L764-M796 HydrophobicContact CG-CG 3.93Å; L764-M796 HydrophobicContact CG-SD 4.45Å
765	Y	95.5	Very high	90.3	Very high	31 Å²	31	54.7 Å²	54.7	12%	0.122	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	138.5	-172.7	-55.7	-95.6	0	0	0	111.9	E763 G767 S769 I770 S772 P773 Y795 F797	E763-Y765 HydrophobicContact CB-CE2 3.87Å; E763-Y765 PolarHBondContact OE2-OH 2.97Å; Y765-G767 PolarHBondContact O-N 2.99Å; Y765-G767 VanDerWaalsContact O-N 3.16Å; Y765-S769 WeakPolarHBondContact CB-O 3.16Å; Y765-I770 HydrophobicContact CD2-CG2 4.47Å; Y765-I770 HydrophobicContact CE1-CB 4.4Å; Y765-I770 VanDerWaalsContact CE1-O 3.31Å; Y765-I770 WeakPolarHBondContact CE1-O 3.03Å; Y765-I770 HydrophobicContact CE2-CB 4.34Å; Y765-I770 HydrophobicContact CE2-CG2 4.01Å; Y765-S772 WeakPolarHBondContact CD1-O 3.43Å; Y765-P773 CarbonylContact C-O 3.54Å; Y765-P773 WeakPolarHBondContact CA-O 3.19Å; Y765-Y795 HydrophobicContact CD2-CD1 4.3Å; Y765-Y795 PolarHBondContact N-O 2.85Å; Y765-Y795 PolarHBondContact O-N 3.27Å; Y765-F797 HydrophobicContact CE2-CB 4.28Å
766	D	92.9	Very high	90.6	Very high	29 Å²	29	46.9 Å²	46.9	16%	0.155	27%	0.272	C	S	.	.	S	Bend	trans	-88	74.6	-172.2	-168.4	25	0	0	0	112.3	P773 L775 S789 S790	D766-P773 HydrophobicContact CB-CB 4.45Å; D766-P773 WeakPolarHBondContact CB-O 3.39Å; D766-P773 PolarHBondContact N-O 3.26Å; D766-L775 HydrophobicContact CB-CD1 4.16Å; D766-L775 HydrophobicContact CB-CD2 3.92Å; D766-L775 HydrophobicContact CB-CG 3.93Å; D766-S789 VanDerWaalsContact OD1-CA 3.3Å; D766-S789 WeakPolarHBondContact OD1-CA 3.27Å; D766-S789 VanDerWaalsContact OD1-CB 3.27Å; D766-S789 WeakPolarHBondContact OD1-CB 3.01Å; D766-S790 VanDerWaalsContact CG-OG 3.28Å; D766-S790 PolarHBondContact OD1-N 2.88Å; D766-S790 PolarHBondContact OD1-OG 3.04Å; D766-S790 WeakPolarHBondContact OD2-CB 3.4Å; D766-S790 PolarHBondContact OD2-N 2.95Å; D766-S790 PolarHBondContact OD2-OG 2.68Å
767	G	89.6	Confident	90.8	Very high	6 Å²	6	45.6 Å²	45.6	6%	0.062	26%	0.26	C	S	.	.	S	Bend	trans	154.4	-153.7	-178.9	0	0	0	0	0	112	Y765 L794 Y795	Y765-G767 PolarHBondContact O-N 2.99Å; Y765-G767 VanDerWaalsContact O-N 3.16Å; G767-L794 CarbonylContact O-C 3.18Å; G767-L794 WeakPolarHBondContact O-CA 3.38Å; G767-L794 PolarHBondContact O-N 3.08Å; G767-Y795 WeakPolarHBondContact O-CB 3.36Å; G767-Y795 PolarHBondContact O-N 3.33Å
768	S	85.7	Confident	91	Very high	54 Å²	54	47.5 Å²	47.5	38%	0.378	27%	0.266	S	S	.	.	S	Bend	trans	-94.7	5.5	-172.6	25.9	0	0	0	0	115.6	H733 E793 Y795	H733-S768 WeakPolarHBondContact NE2-CA 3.49Å; H733-S768 VanDerWaalsContact NE2-CB 3.31Å; H733-S768 WeakPolarHBondContact NE2-CB 3.29Å; S768-E793 WeakPolarHBondContact CB-OE2 3.18Å; S768-E793 PolarHBondContact N-OE2 2.88Å; S768-E793 PolarHBondContact OG-OE2 2.87Å; S768-Y795 VanDerWaalsContact C-CD2 3.47Å; S768-Y795 VanDerWaalsContact O-CD2 3.23Å; S768-Y795 WeakPolarHBondContact O-CD2 3.3Å; S768-Y795 WeakPolarHBondContact O-CE2 3.02Å
769	S	86.1	Confident	91.3	Very high	38 Å²	38	45.8 Å²	45.8	27%	0.266	25%	0.251	S	S	.	.	S	Bend	trans	-160	171.2	-176.8	71.2	0	0	0	0	114.7	Y765 D771 S772	Y765-S769 WeakPolarHBondContact CB-O 3.16Å; S769-D771 PolarHBondContact O-N 3.5Å; S769-D771 PolarHBondContact OG-N 2.99Å; S769-S772 WeakPolarHBondContact O-CB 3.41Å; S769-S772 PolarHBondContact O-N 2.93Å; S769-S772 VanDerWaalsContact O-N 3.16Å; S769-S772 PolarHBondContact O-OG 2.73Å
770	I	85.5	Confident	91.4	Very high	66 Å²	66	41.3 Å²	41.3	34%	0.338	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.9	170.1	65	175.8	0	0	0	114.4	Y765 S772 Y795	Y765-I770 HydrophobicContact CD2-CG2 4.47Å; Y765-I770 HydrophobicContact CE1-CB 4.4Å; Y765-I770 VanDerWaalsContact CE1-O 3.31Å; Y765-I770 WeakPolarHBondContact CE1-O 3.03Å; Y765-I770 HydrophobicContact CE2-CB 4.34Å; Y765-I770 HydrophobicContact CE2-CG2 4.01Å; I770-S772 VanDerWaalsContact C-N 3.29Å; I770-Y795 HydrophobicContact CG2-CD1 4.12Å; I770-Y795 HydrophobicContact CG2-CE1 3.55Å
771	D	86.3	Confident	91.3	Very high	152 Å²	152	46 Å²	46	81%	0.813	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-7.3	175	-67.7	-45.4	0	0	0	112.1	S769	S769-D771 PolarHBondContact O-N 3.5Å; S769-D771 PolarHBondContact OG-N 2.99Å
772	S	87.8	Confident	91.2	Very high	25 Å²	25	52 Å²	52	18%	0.175	29%	0.292	C	S	.	.	S	Bend	trans	-74.1	163.9	173.8	-60.3	0	0	0	0	111.8	Y765 S769 I770 S774	Y765-S772 WeakPolarHBondContact CD1-O 3.43Å; S769-S772 WeakPolarHBondContact O-CB 3.41Å; S769-S772 PolarHBondContact O-N 2.93Å; S769-S772 VanDerWaalsContact O-N 3.16Å; S769-S772 PolarHBondContact O-OG 2.73Å; I770-S772 VanDerWaalsContact C-N 3.29Å; S772-S774 PolarHBondContact O-N 3.06Å
773	P	91.8	Very high	90.9	Very high	91 Å²	91	53.6 Å²	53.6	59%	0.591	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-61.1	127.5	179.6	-22.6	34.2	0	0	0	111.9	Y765 D766 L775	Y765-P773 CarbonylContact C-O 3.54Å; Y765-P773 WeakPolarHBondContact CA-O 3.19Å; D766-P773 HydrophobicContact CB-CB 4.45Å; D766-P773 WeakPolarHBondContact CB-O 3.39Å; D766-P773 PolarHBondContact N-O 3.26Å; P773-L775 PolarHBondContact O-N 2.88Å
774	S	91.9	Very high	90.8	Very high	71 Å²	71	53.3 Å²	53.3	50%	0.497	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	129	177.5	-174.1	0	0	0	0	111.6	L764 S772 G776	L764-S774 CarbonylContact O-C 3.52Å; L764-S774 VanDerWaalsContact O-CA 3.3Å; L764-S774 WeakPolarHBondContact O-CA 3.21Å; L764-S774 PolarHBondContact O-OG 2.97Å; L764-S774 VanDerWaalsContact O-OG 3.05Å; S772-S774 PolarHBondContact O-N 3.06Å; S774-G776 PolarHBondContact OG-N 2.02Å
775	L	92	Very high	90.7	Very high	59 Å²	59	61.3 Å²	61.3	31%	0.309	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-26.2	174.5	-66	172.2	0	0	0	112	L764 D766 P773 Y778 I787 L794	L764-L775 HydrophobicContact CB-CB 4.26Å; L764-L775 PolarHBondContact O-N 2.87Å; D766-L775 HydrophobicContact CB-CD1 4.16Å; D766-L775 HydrophobicContact CB-CD2 3.92Å; D766-L775 HydrophobicContact CB-CG 3.93Å; P773-L775 PolarHBondContact O-N 2.88Å; L775-Y778 PolarHBondContact O-OH 2.9Å; L775-I787 HydrophobicContact CB-CG2 4.18Å; L775-I787 HydrophobicContact CD1-CG2 3.8Å; L775-L794 HydrophobicContact CD1-CD1 3.53Å
776	G	91.2	Very high	90.5	Very high	17 Å²	17	65.4 Å²	65.4	18%	0.175	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.5	176.9	175.9	0	0	0	0	0	114.2	L764 S774 Y778	L764-G776 PolarHBondContact N-O 2.79Å; S774-G776 PolarHBondContact OG-N 2.02Å; G776-Y778 VanDerWaalsContact C-CE2 3.43Å
777	K	92.9	Very high	90.6	Very high	86 Å²	86	64.6 Å²	64.6	37%	0.374	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	125.6	-177.4	173.2	171.3	174.8	136.1	0	108.6	C757 I762 E763	C757-K777 HydrophobicContact CB-CD 4.44Å; C757-K777 HydrophobicContact CB-CG 4.01Å; C757-K777 WeakPolarHBondContact O-CE 3.33Å; C757-K777 PolarHBondContact O-NZ 3.29Å; I762-K777 CarbonylContact O-C 3.55Å; I762-K777 WeakPolarHBondContact O-CA 3.42Å; E763-K777 HydrophobicContact CG-CB 4.1Å; E763-K777 HydrophobicContact CG-CD 4.08Å; E763-K777 HydrophobicContact CG-CG 3.85Å; E763-K777 WeakPolarHBondContact OE1-CD 3.33Å; E763-K777 WeakPolarHBondContact OE1-CE 3.46Å; E763-K777 IonicContact OE1-NZ 2.67Å; E763-K777 PolarHBondContact OE1-NZ 2.64Å
778	Y	94.7	Very high	90.7	Very high	55 Å²	55	66.4 Å²	66.4	22%	0.216	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.9	-163	-50.9	-79.5	0	0	0	111.6	R761 I762 L764 L775 G776 P784 I787	R761-Y778 CarbonylContact C-O 3.6Å; R761-Y778 VanDerWaalsContact CA-O 3.3Å; R761-Y778 WeakPolarHBondContact CA-O 3.31Å; I762-Y778 PolarHBondContact N-O 2.89Å; I762-Y778 PolarHBondContact O-N 2.71Å; L764-Y778 HydrophobicContact CD1-CD2 4.32Å; L764-Y778 HydrophobicContact CD1-CE2 3.99Å; L775-Y778 PolarHBondContact O-OH 2.9Å; G776-Y778 VanDerWaalsContact C-CE2 3.43Å; Y778-P784 HydrophobicContact CD1-CB 3.7Å; Y778-P784 HydrophobicContact CD1-CG 4.27Å; Y778-P784 HydrophobicContact CE1-CB 3.62Å; Y778-P784 HydrophobicContact CE1-CG 4.46Å; Y778-P784 HydrophobicContact CG-CB 4.3Å; Y778-P784 HydrophobicContact CG-CG 4.39Å; Y778-I787 HydrophobicContact CD2-CD1 4.3Å; Y778-I787 HydrophobicContact CE1-CD1 4.38Å; Y778-I787 HydrophobicContact CE2-CD1 3.48Å; Y778-I787 VanDerWaalsContact CE2-CD1 3.48Å; Y778-I787 WeakPolarHBondContact OH-CD1 3.35Å
779	C	93.6	Very high	91.1	Very high	22 Å²	22	64 Å²	64	15%	0.149	35%	0.35	C	S	.	.			trans	-160.7	177.8	179.2	68.4	0	0	0	0	110.6	I751 E752 H754 C757 D760	I751-C779 HydrophobicContact CB-CB 4.5Å; I751-C779 HydrophobicContact CG2-CB 3.98Å; E752-C779 WeakPolarHBondContact O-CB 3.44Å; H754-C779 PolarHBondContact O-SG 3.38Å; C757-C779 WeakPolarHBondContact CA-SG 3.4Å; C757-C779 HydrophobicContact CB-CB 3.61Å; C757-C779 WeakPolarHBondContact CB-SG 3.47Å; C757-C779 WeakPolarHBondContact SG-CB 3.33Å; C757-C779 PolarHBondContact SG-N 3.33Å; C757-C779 VanDerWaalsContact SG-N 3.38Å; C757-C779 CovalentContact SG-SG 2.04Å; C757-C779 PolarHBondContact SG-SG 3.24Å; D760-C779 VanDerWaalsContact O-CB 3.23Å; D760-C779 WeakPolarHBondContact O-CB 3.4Å
780	G	92.6	Very high	91.3	Very high	4 Å²	4	64.7 Å²	64.7	4%	0.041	36%	0.355	C	S	.	.	S	Bend	trans	77	-169.5	-176.2	0	0	0	0	0	114.6	F749 I751 E752 K782	F749-G780 VanDerWaalsContact CD1-O 3.25Å; F749-G780 WeakPolarHBondContact CD1-O 3.42Å; F749-G780 WeakPolarHBondContact CE1-O 3.36Å; I751-G780 PolarHBondContact N-O 2.79Å; I751-G780 CarbonylContact O-C 3.26Å; I751-G780 VanDerWaalsContact O-C 3.27Å; I751-G780 WeakPolarHBondContact O-CA 3.47Å; I751-G780 PolarHBondContact O-N 3.27Å; E752-G780 PolarHBondContact O-N 2.63Å; G780-K782 PolarHBondContact O-N 3.25Å
781	P	90.5	Very high	91.5	Very high	98 Å²	98	66.7 Å²	66.7	64%	0.636	36%	0.361	S	S	*	.	S	Bend	trans	-95.1	25.8	-173.8	39.4	-38.4	0	0	0	113.7	F749 E750	F749-P781 CarbonylContact O-C 3.49Å; F749-P781 WeakPolarHBondContact O-CA 3.43Å; E750-P781 HydrophobicContact CG-CB 4.49Å
782	K	91.3	Very high	91.7	Very high	159 Å²	159	61.5 Å²	61.5	69%	0.691	33%	0.333	S	S	*	.			trans	-126.2	110.4	179.1	-169.1	-158.2	168.3	-166.8	0	110	G780	G780-K782 PolarHBondContact O-N 3.25Å
783	A	89.4	Confident	91.9	Very high	34 Å²	34	62.9 Å²	62.9	28%	0.281	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-53.3	142.9	170.7	0	0	0	0	0	112	F746 F749	F746-A783 HydrophobicContact CB-CB 4.05Å; F749-A783 HydrophobicContact CB-CB 3.75Å; F749-A783 HydrophobicContact CG-CB 4.26Å
784	P	90.9	Very high	91.9	Very high	23 Å²	23	58.6 Å²	58.6	15%	0.149	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-69.7	161.8	170.4	30.9	-34.9	0	0	0	111.6	F746 Y778 I787	F746-P784 HydrophobicContact CD2-CG 3.54Å; F746-P784 HydrophobicContact CE2-CG 3.85Å; F746-P784 HydrophobicContact CG-CG 4.34Å; Y778-P784 HydrophobicContact CD1-CB 3.7Å; Y778-P784 HydrophobicContact CD1-CG 4.27Å; Y778-P784 HydrophobicContact CE1-CB 3.62Å; Y778-P784 HydrophobicContact CE1-CG 4.46Å; Y778-P784 HydrophobicContact CG-CB 4.3Å; Y778-P784 HydrophobicContact CG-CG 4.39Å; P784-I787 HydrophobicContact CB-CD1 4.05Å; P784-I787 HydrophobicContact CB-CG1 4.47Å; P784-I787 HydrophobicContact CG-CD1 3.92Å
785	E	91.4	Very high	92	Very high	168 Å²	168	56 Å²	56	79%	0.785	29%	0.289	S	S	*	.	S	Bend	trans	-69.2	154	164.6	-67.2	177.5	-166	0	0	109.9	I787	E785-I787 VanDerWaalsContact O-CG1 3.28Å; E785-I787 WeakPolarHBondContact O-CG1 3.48Å; E785-I787 PolarHBondContact O-N 3.27Å
786	K	92.6	Very high	92	Very high	116 Å²	116	53.2 Å²	53.2	50%	0.504	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-53.6	122.5	-169.4	-49.5	-157.1	-177	-157.3	0	112.2	Q743 D745	Q743-K786 HydrophobicContact CG-CB 4.15Å; D745-K786 HydrophobicContact CB-CD 4.17Å; D745-K786 VanDerWaalsContact CG-CE 3.41Å; D745-K786 VanDerWaalsContact CG-NZ 3.3Å; D745-K786 WeakPolarHBondContact OD1-CD 3.21Å; D745-K786 WeakPolarHBondContact OD1-CE 3.44Å; D745-K786 WeakPolarHBondContact OD1-CG 3.39Å; D745-K786 IonicContact OD1-NZ 3.73Å; D745-K786 VanDerWaalsContact OD2-CE 3.27Å; D745-K786 WeakPolarHBondContact OD2-CE 3.2Å; D745-K786 IonicContact OD2-NZ 3.89Å; D745-K786 PolarHBondContact OD2-NZ 2.79Å
787	I	93.7	Very high	92.1	Very high	13 Å²	13	53.4 Å²	53.4	7%	0.067	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129.7	-172.7	-57.3	174.7	0	0	0	108.1	Q743 L744 F746 L764 L775 Y778 P784 E785	Q743-I787 CarbonylContact C-O 3.5Å; Q743-I787 VanDerWaalsContact CA-O 3.28Å; Q743-I787 WeakPolarHBondContact CA-O 3.5Å; L744-I787 PolarHBondContact N-O 3.14Å; L744-I787 PolarHBondContact O-N 2.86Å; F746-I787 HydrophobicContact CE2-CD1 4.49Å; L764-I787 HydrophobicContact CD1-CD1 3.36Å; L764-I787 HydrophobicContact CD1-CG2 4.47Å; L775-I787 HydrophobicContact CB-CG2 4.18Å; L775-I787 HydrophobicContact CD1-CG2 3.8Å; Y778-I787 HydrophobicContact CD2-CD1 4.3Å; Y778-I787 HydrophobicContact CE1-CD1 4.38Å; Y778-I787 HydrophobicContact CE2-CD1 3.48Å; Y778-I787 VanDerWaalsContact CE2-CD1 3.48Å; Y778-I787 WeakPolarHBondContact OH-CD1 3.35Å; P784-I787 HydrophobicContact CB-CD1 4.05Å; P784-I787 HydrophobicContact CB-CG1 4.47Å; P784-I787 HydrophobicContact CG-CD1 3.92Å; E785-I787 VanDerWaalsContact O-CG1 3.28Å; E785-I787 WeakPolarHBondContact O-CG1 3.48Å; E785-I787 PolarHBondContact O-N 3.27Å
788	T	93	Very high	92.1	Very high	43 Å²	43	49.3 Å²	49.3	26%	0.264	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	129.6	179.4	-53.7	0	0	0	0	110.5	R741 L742 Q743	R741-T788 HydrophobicContact CB-CG2 4.06Å; L742-T788 CarbonylContact O-C 3.55Å; L742-T788 VanDerWaalsContact O-CA 3.28Å; L742-T788 WeakPolarHBondContact O-CA 3.29Å; Q743-T788 HydrophobicContact CB-CG2 4.48Å; Q743-T788 PolarHBondContact NE2-OG1 3.46Å; Q743-T788 VanDerWaalsContact NE2-OG1 3.07Å
789	S	94.1	Very high	91.9	Very high	4 Å²	4	48.6 Å²	48.6	3%	0.028	25%	0.251	C	S	.	.			trans	-67.7	163.3	173.5	60.7	0	0	0	0	112.4	R741 L742 D766 K791 E793	R741-S789 WeakPolarHBondContact CD-O 3.32Å; R741-S789 WeakPolarHBondContact CG-O 3.01Å; L742-S789 PolarHBondContact N-OG 2.83Å; L742-S789 PolarHBondContact O-N 3.22Å; L742-S789 PolarHBondContact O-OG 3.21Å; D766-S789 VanDerWaalsContact OD1-CA 3.3Å; D766-S789 WeakPolarHBondContact OD1-CA 3.27Å; D766-S789 VanDerWaalsContact OD1-CB 3.27Å; D766-S789 WeakPolarHBondContact OD1-CB 3.01Å; S789-K791 WeakPolarHBondContact CB-O 3.4Å; S789-K791 PolarHBondContact OG-O 2.83Å; S789-E793 WeakPolarHBondContact CB-O 3.17Å
790	S	90.9	Very high	91.8	Very high	53 Å²	53	47.7 Å²	47.7	37%	0.371	24%	0.244	S	C	.	.	S	Bend	trans	-84.2	-28.3	170.5	68.4	0	0	0	0	113.1	R741 D766	R741-S790 WeakPolarHBondContact CG-O 3.37Å; D766-S790 VanDerWaalsContact CG-OG 3.28Å; D766-S790 PolarHBondContact OD1-N 2.88Å; D766-S790 PolarHBondContact OD1-OG 3.04Å; D766-S790 WeakPolarHBondContact OD2-CB 3.4Å; D766-S790 PolarHBondContact OD2-N 2.95Å; D766-S790 PolarHBondContact OD2-OG 2.68Å
791	K	89.1	Confident	91.7	Very high	108 Å²	108	49.4 Å²	49.4	47%	0.47	25%	0.253	S	S	.	.	S	Bend	trans	-120.3	-178.5	-179.5	-68.5	-171	175.2	-169.6	0	112.2	H740 S789 E793	H740-K791 CarbonylContact O-C 3.53Å; S789-K791 WeakPolarHBondContact CB-O 3.4Å; S789-K791 PolarHBondContact OG-O 2.83Å; K791-E793 PolarHBondContact O-N 2.82Å; K791-E793 VanDerWaalsContact O-N 3.15Å
792	N	90	Very high	91.6	Very high	42 Å²	42	47.9 Å²	47.9	23%	0.225	24%	0.244	C	C	.	.	S	Bend	trans	-77.1	14.1	179	70.5	-69.2	0	0	0	114.7	T736 H740	T736-N792 HydrophobicContact CG2-CB 3.85Å; T736-N792 PolarHBondContact N-O 3.43Å; T736-N792 WeakPolarHBondContact O-CB 3.32Å; T736-N792 PolarHBondContact O-ND2 3.27Å; H740-N792 WeakPolarHBondContact O-CA 3.13Å; H740-N792 VanDerWaalsContact O-CB 3.27Å; H740-N792 WeakPolarHBondContact O-CB 3.5Å; H740-N792 PolarHBondContact O-N 2.81Å
793	E	91.4	Very high	91.3	Very high	55 Å²	55	42.6 Å²	42.6	26%	0.257	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.3	175.9	-62.5	-176.6	146.5	0	0	109.6	F734 S768 S789 K791	F734-E793 WeakPolarHBondContact O-CA 3.36Å; S768-E793 WeakPolarHBondContact CB-OE2 3.18Å; S768-E793 PolarHBondContact N-OE2 2.88Å; S768-E793 PolarHBondContact OG-OE2 2.87Å; S789-E793 WeakPolarHBondContact CB-O 3.17Å; K791-E793 PolarHBondContact O-N 2.82Å; K791-E793 VanDerWaalsContact O-N 3.15Å
794	L	93.3	Very high	91.1	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.6	172.7	178.5	73	0	0	0	108.7	F734 L742 L744 L764 G767 L775	F734-L794 HydrophobicContact CB-CB 4.2Å; F734-L794 HydrophobicContact CD2-CB 4.25Å; F734-L794 HydrophobicContact CD2-CD2 4.17Å; F734-L794 HydrophobicContact CD2-CG 4.25Å; F734-L794 WeakPolarHBondContact CD2-O 3.28Å; F734-L794 HydrophobicContact CE2-CD2 4.43Å; F734-L794 PolarHBondContact N-O 2.66Å; F734-L794 PolarHBondContact O-N 2.8Å; L742-L794 HydrophobicContact CB-CB 4.08Å; L742-L794 HydrophobicContact CB-CD2 4.28Å; L742-L794 HydrophobicContact CD1-CB 3.99Å; L744-L794 HydrophobicContact CB-CD2 4.25Å; L744-L794 HydrophobicContact CD2-CD2 4.48Å; L764-L794 HydrophobicContact CD2-CD1 4.16Å; L764-L794 HydrophobicContact CD2-CD2 4.29Å; L764-L794 HydrophobicContact CD2-CG 4.23Å; G767-L794 CarbonylContact O-C 3.18Å; G767-L794 WeakPolarHBondContact O-CA 3.38Å; G767-L794 PolarHBondContact O-N 3.08Å; L775-L794 HydrophobicContact CD1-CD1 3.53Å
795	Y	92.6	Very high	91	Very high	16 Å²	16	46 Å²	46	6%	0.063	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.4	-179.8	-164.2	-84.8	0	0	0	110.5	I731 H733 Y765 G767 S768 I770	I731-Y795 HydrophobicContact CG2-CE1 3.77Å; I731-Y795 HydrophobicContact CG2-CE2 3.92Å; I731-Y795 VanDerWaalsContact CG2-CZ 3.44Å; I731-Y795 WeakPolarHBondContact CG2-OH 3.43Å; H733-Y795 HydrophobicContact CB-CD2 4.01Å; H733-Y795 HydrophobicContact CB-CE2 4.3Å; H733-Y795 AromaticContact CD2-CD2 3.96Å; Y765-Y795 HydrophobicContact CD2-CD1 4.3Å; Y765-Y795 PolarHBondContact N-O 2.85Å; Y765-Y795 PolarHBondContact O-N 3.27Å; G767-Y795 WeakPolarHBondContact O-CB 3.36Å; G767-Y795 PolarHBondContact O-N 3.33Å; S768-Y795 VanDerWaalsContact C-CD2 3.47Å; S768-Y795 VanDerWaalsContact O-CD2 3.23Å; S768-Y795 WeakPolarHBondContact O-CD2 3.3Å; S768-Y795 WeakPolarHBondContact O-CE2 3.02Å; I770-Y795 HydrophobicContact CG2-CD1 4.12Å; I770-Y795 HydrophobicContact CG2-CE1 3.55Å
796	M	93	Very high	91	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140	177.6	-168.6	170.2	80.7	0	0	110.9	L715 I731 W732 F734 L744 F746 I762 L764 F809	L715-M796 HydrophobicContact CD1-CE 3.49Å; L715-M796 VanDerWaalsContact CD1-CE 3.49Å; I731-M796 CarbonylContact C-O 3.59Å; I731-M796 VanDerWaalsContact CA-O 3.25Å; I731-M796 WeakPolarHBondContact CA-O 3.27Å; W732-M796 HydrophobicContact CB-CB 4.34Å; W732-M796 HydrophobicContact CD2-CE 3.67Å; W732-M796 HydrophobicContact CE3-CB 4.37Å; W732-M796 HydrophobicContact CE3-CE 3.28Å; W732-M796 HydrophobicContact CE3-CG 4.4Å; W732-M796 HydrophobicContact CG-CE 4.28Å; W732-M796 HydrophobicContact CH2-CE 4.27Å; W732-M796 HydrophobicContact CZ3-CE 3.62Å; W732-M796 PolarHBondContact N-O 2.69Å; W732-M796 PolarHBondContact O-N 2.9Å; F734-M796 HydrophobicContact CE2-CB 4.02Å; L744-M796 HydrophobicContact CD2-SD 3.84Å; F746-M796 HydrophobicContact CZ-SD 3.96Å; I762-M796 HydrophobicContact CG2-CG 3.61Å; I762-M796 HydrophobicContact CG2-SD 3.66Å; L764-M796 HydrophobicContact CD2-CB 3.53Å; L764-M796 HydrophobicContact CD2-CG 3.61Å; L764-M796 HydrophobicContact CD2-SD 4.1Å; L764-M796 HydrophobicContact CG-CB 4.33Å; L764-M796 HydrophobicContact CG-CG 3.93Å; L764-M796 HydrophobicContact CG-SD 4.45Å; M796-F809 HydrophobicContact CE-CE2 3.73Å; M796-F809 HydrophobicContact CE-CZ 3.61Å
797	F	92.5	Very high	90.9	Very high	22 Å²	22	41 Å²	41	10%	0.096	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	112.2	178.4	173.4	-93.5	0	0	0	109.5	E729 C730 I731 I762 E763 Y765 H799	E729-F797 HydrophobicContact CB-CE2 4.28Å; E729-F797 HydrophobicContact CG-CE2 3.98Å; E729-F797 HydrophobicContact CG-CZ 3.77Å; E729-F797 WeakPolarHBondContact OE1-CZ 3.31Å; E729-F797 WeakPolarHBondContact OE2-CE2 3.3Å; C730-F797 CarbonylContact O-C 3.58Å; C730-F797 WeakPolarHBondContact O-CA 3.38Å; I731-F797 HydrophobicContact CD1-CD2 3.82Å; I731-F797 HydrophobicContact CD1-CE2 4.3Å; I731-F797 HydrophobicContact CG1-CD2 3.69Å; I731-F797 HydrophobicContact CG1-CE2 4.5Å; I762-F797 CarbonylContact C-O 3.38Å; I762-F797 WeakPolarHBondContact CA-O 3.21Å; E763-F797 HydrophobicContact CB-CD1 4.24Å; E763-F797 PolarHBondContact N-O 2.84Å; E763-F797 PolarHBondContact O-N 3.49Å; Y765-F797 HydrophobicContact CE2-CB 4.28Å; F797-H799 HydrophobicContact CD1-CB 4.5Å; F797-H799 HydrophobicContact CE1-CB 3.75Å; F797-H799 HydrophobicContact CZ-CB 4.17Å
798	F	92.8	Very high	90.8	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	139.4	169.5	171.2	-119.8	0	0	0	109.4	Y724 E729 C730 W732 I751 R761 I762 F809	Y724-F798 AromaticContact CD1-CZ 3.99Å; Y724-F798 HydrophobicContact CD1-CZ 3.99Å; Y724-F798 AromaticContact CD2-CZ 3.95Å; Y724-F798 HydrophobicContact CD2-CZ 3.95Å; Y724-F798 HydrophobicContact CE1-CZ 4.24Å; Y724-F798 HydrophobicContact CE2-CZ 4.22Å; Y724-F798 HydrophobicContact CG-CE1 4.38Å; Y724-F798 AromaticContact CG-CZ 3.86Å; Y724-F798 HydrophobicContact CG-CZ 3.86Å; E729-F798 CarbonylContact C-O 3.6Å; E729-F798 VanDerWaalsContact CA-O 3.24Å; E729-F798 WeakPolarHBondContact CA-O 3.33Å; C730-F798 HydrophobicContact CB-CD1 4.42Å; C730-F798 PolarHBondContact N-O 2.98Å; C730-F798 PolarHBondContact O-N 2.8Å; W732-F798 HydrophobicContact CH2-CB 4.06Å; W732-F798 HydrophobicContact CZ3-CB 3.66Å; I751-F798 HydrophobicContact CD1-CE2 3.95Å; R761-F798 WeakPolarHBondContact O-CA 3.04Å; R761-F798 WeakPolarHBondContact O-CD2 3.46Å; I762-F798 HydrophobicContact CG1-CB 4.29Å; I762-F798 HydrophobicContact CG1-CD2 3.79Å; I762-F798 HydrophobicContact CG1-CG 4.48Å; F798-F809 HydrophobicContact CB-CE1 4.4Å; F798-F809 HydrophobicContact CD2-CE1 4.34Å; F798-F809 HydrophobicContact CG-CE1 4.22Å
799	H	91.9	Very high	90.8	Very high	40 Å²	40	38.4 Å²	38.4	19%	0.185	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	132.8	174	172.4	114.6	0	0	0	109.8	K728 E729 D760 R761 F797	K728-H799 CarbonylContact O-C 3.57Å; K728-H799 VanDerWaalsContact O-CA 3.3Å; K728-H799 WeakPolarHBondContact O-CA 3.36Å; E729-H799 HydrophobicContact CG-CB 4.03Å; E729-H799 WeakPolarHBondContact CG-ND1 3.41Å; E729-H799 IonicContact OE1-CE1 2.81Å; E729-H799 PolarHBondContact OE1-CE1 3.24Å; E729-H799 IonicContact OE1-CG 3.63Å; E729-H799 IonicContact OE1-ND1 3.75Å; E729-H799 PolarHBondContact OE1-ND1 2.58Å; D760-H799 VanDerWaalsContact CA-O 3.29Å; D760-H799 WeakPolarHBondContact CA-O 3.17Å; R761-H799 HydrophobicContact CG-CB 4.18Å; R761-H799 VanDerWaalsContact CZ-CD2 3.45Å; R761-H799 PolarHBondContact N-O 2.65Å; R761-H799 PolarHBondContact NH1-CD2 3.16Å; R761-H799 PolarHBondContact NH1-NE2 2.8Å; R761-H799 VanDerWaalsContact NH1-NE2 3.11Å; R761-H799 PolarHBondContact NH2-CD2 3.15Å; R761-H799 VanDerWaalsContact NH2-CG 3.29Å; R761-H799 PolarHBondContact NH2-ND1 3.3Å; R761-H799 PolarHBondContact O-N 3.18Å; F797-H799 HydrophobicContact CD1-CB 4.5Å; F797-H799 HydrophobicContact CE1-CB 3.75Å; F797-H799 HydrophobicContact CZ-CB 4.17Å
800	S	90.5	Very high	90.8	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.014	21%	0.206	C	C	.	.			trans	-114.2	144.3	168	61.5	0	0	0	0	112.9	P725 D727 K728 D760	P725-S800 PolarHBondContact O-OG 3.46Å; D727-S800 WeakPolarHBondContact CA-O 3.33Å; D727-S800 PolarHBondContact N-O 2.68Å; D727-S800 PolarHBondContact N-OG 2.99Å; K728-S800 PolarHBondContact N-OG 2.78Å; K728-S800 PolarHBondContact O-N 3.39Å; D760-S800 WeakPolarHBondContact OD1-CA 3.32Å; D760-S800 VanDerWaalsContact OD2-CB 3.3Å; D760-S800 WeakPolarHBondContact OD2-CB 3.02Å
801	D	90.2	Very high	90.9	Very high	40 Å²	40	37.8 Å²	37.8	21%	0.214	19%	0.188	C	C	.	.			trans	-70.8	174.6	176.7	179.3	-71.9	0	0	0	111	N726 D727 D760 S803	N726-D801 CarbonylContact C-O 3.59Å; N726-D801 VanDerWaalsContact CA-O 3.31Å; N726-D801 WeakPolarHBondContact CA-O 3.06Å; N726-D801 VanDerWaalsContact CB-O 3.26Å; N726-D801 WeakPolarHBondContact CB-O 3Å; D727-D801 PolarHBondContact N-O 2.6Å; D760-D801 WeakPolarHBondContact OD1-CB 3.28Å; D760-D801 PolarHBondContact OD1-N 2.86Å; D801-S803 PolarHBondContact O-N 3.29Å; D801-S803 VanDerWaalsContact O-N 3.16Å; D801-S803 PolarHBondContact OD1-N 2.89Å; D801-S803 PolarHBondContact OD1-OG 2.92Å
802	S	88.4	Confident	91.2	Very high	66 Å²	66	35.6 Å²	35.6	46%	0.462	18%	0.18	S	C	.	.	S	Bend	trans	-65.5	-1.6	169.4	60.5	0	0	0	0	115.5	N726	N726-S802 PolarHBondContact ND2-O 3.16Å
803	S	86.1	Confident	91.3	Very high	49 Å²	49	34.1 Å²	34.1	34%	0.343	17%	0.171	S	C	.	.	S	Bend	trans	-152.7	167.9	-169.6	64.5	0	0	0	0	113.9	N726 D801	N726-S803 WeakPolarHBondContact ND2-CA 3.48Å; N726-S803 PolarHBondContact ND2-N 3.31Å; D801-S803 PolarHBondContact O-N 3.29Å; D801-S803 VanDerWaalsContact O-N 3.16Å; D801-S803 PolarHBondContact OD1-N 2.89Å; D801-S803 PolarHBondContact OD1-OG 2.92Å
804	V	85.6	Confident	91.4	Very high	50 Å²	50	34.3 Å²	34.3	30%	0.303	18%	0.176	S	C	.	.			trans	58.4	64.4	168.3	-161.6	0	0	0	0	116	E752	E752-V804 HydrophobicContact CG-CB 4.22Å; E752-V804 HydrophobicContact CG-CG1 3.83Å; E752-V804 WeakPolarHBondContact OE1-CB 3.23Å; E752-V804 WeakPolarHBondContact OE1-CG1 3.5Å
805	Q	87.9	Confident	91.4	Very high	78 Å²	78	35.3 Å²	35.3	36%	0.364	18%	0.183	S	C	.	.			trans	-57.9	155.7	170.6	-56.5	84.6	-19.8	0	0	114.2	D723 Y724 N726	D723-Q805 HydrophobicContact CB-CB 3.82Å; D723-Q805 HydrophobicContact CB-CG 4.49Å; Y724-Q805 WeakPolarHBondContact O-CG 3.37Å; N726-Q805 PolarHBondContact ND2-NE2 2.88Å; N726-Q805 WeakPolarHBondContact OD1-CG 3.46Å; N726-Q805 PolarHBondContact OD1-NE2 2.9Å
806	R	91.2	Very high	91.4	Very high	75 Å²	75	36.6 Å²	36.6	28%	0.283	19%	0.193	S	C	.	.			trans	-143	174.1	164.5	-67.7	-64.4	-178.1	-78.6	-13.9	109.2	D723 Y724 E750 G808	D723-R806 CarbonylContact C-O 3.56Å; D723-R806 VanDerWaalsContact CA-O 3.29Å; D723-R806 WeakPolarHBondContact CA-O 3.28Å; D723-R806 VanDerWaalsContact OD1-CA 3.23Å; D723-R806 WeakPolarHBondContact OD1-CA 3.41Å; Y724-R806 WeakPolarHBondContact CD1-O 3.4Å; Y724-R806 HydrophobicContact CE1-CB 3.85Å; Y724-R806 WeakPolarHBondContact CE1-O 3.43Å; Y724-R806 PolarHBondContact N-O 3.46Å; E750-R806 HydrophobicContact CB-CB 4.41Å; E750-R806 HydrophobicContact CG-CB 4.04Å; E750-R806 HydrophobicContact CG-CG 4.1Å; E750-R806 WeakPolarHBondContact O-CB 3.48Å; E750-R806 IonicContact OE1-NE 2.61Å; R806-G808 PolarHBondContact O-N 3.29Å; R806-G808 VanDerWaalsContact O-N 3.11Å
807	K	89.9	Confident	91.4	Very high	104 Å²	104	37.9 Å²	37.9	45%	0.452	20%	0.201	S	C	.	.			trans	-55	-28.2	176.4	-64.3	179.8	177.6	-180	0	114.2	S717 Y720 D723	S717-K807 PolarHBondContact OG-O 2.87Å; Y720-K807 WeakPolarHBondContact CD2-O 3.42Å; D723-K807 PolarHBondContact OD1-N 2.84Å
808	G	92.3	Very high	91.3	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.6	-125.1	-178	0	0	0	0	0	112.9	S717 Y724 E750 R806	S717-G808 WeakPolarHBondContact OG-CA 3.12Å; Y724-G808 VanDerWaalsContact CD1-CA 3.4Å; E750-G808 CarbonylContact C-O 3.56Å; E750-G808 PolarHBondContact N-O 3.42Å; E750-G808 WeakPolarHBondContact O-CA 3.37Å; E750-G808 PolarHBondContact O-N 2.85Å; R806-G808 PolarHBondContact O-N 3.29Å; R806-G808 VanDerWaalsContact O-N 3.11Å
809	F	93.4	Very high	91.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	154.8	-171.5	65.1	-91	0	0	0	114	L715 T716 S717 W732 F746 E748 F749 I751 I762 M796 F798 A811	L715-F809 HydrophobicContact CD1-CE2 4.14Å; L715-F809 HydrophobicContact CG-CE2 4.48Å; T716-F809 CarbonylContact C-O 3.51Å; T716-F809 WeakPolarHBondContact CA-O 3.31Å; S717-F809 PolarHBondContact N-O 2.81Å; S717-F809 PolarHBondContact OG-N 3.25Å; S717-F809 PolarHBondContact OG-O 2.53Å; W732-F809 HydrophobicContact CH2-CE1 4.35Å; W732-F809 AromaticContact CH2-CZ 3.64Å; W732-F809 HydrophobicContact CH2-CZ 3.64Å; W732-F809 HydrophobicContact CZ2-CZ 4.02Å; W732-F809 HydrophobicContact CZ3-CZ 4.09Å; F746-F809 HydrophobicContact CD1-CB 4.13Å; F746-F809 HydrophobicContact CD1-CD2 4.24Å; F746-F809 HydrophobicContact CD1-CG 4.41Å; F746-F809 HydrophobicContact CE1-CB 4.31Å; F746-F809 AromaticContact CE1-CD2 3.86Å; F746-F809 HydrophobicContact CE1-CD2 3.86Å; F746-F809 HydrophobicContact CE1-CE2 4.43Å; F746-F809 HydrophobicContact CE1-CG 4.14Å; E748-F809 WeakPolarHBondContact O-CA 3.18Å; E748-F809 WeakPolarHBondContact O-CB 3.2Å; F749-F809 HydrophobicContact CD2-CB 4.46Å; I751-F809 HydrophobicContact CD1-CD1 4.29Å; I762-F809 HydrophobicContact CD1-CD1 3.48Å; I762-F809 VanDerWaalsContact CD1-CD1 3.48Å; I762-F809 HydrophobicContact CD1-CE1 3.67Å; I762-F809 HydrophobicContact CD1-CG 4.03Å; I762-F809 HydrophobicContact CD1-CZ 4.37Å; I762-F809 HydrophobicContact CG1-CD1 4.49Å; I762-F809 HydrophobicContact CG1-CE1 4.3Å; M796-F809 HydrophobicContact CE-CE2 3.73Å; M796-F809 HydrophobicContact CE-CZ 3.61Å; F798-F809 HydrophobicContact CB-CE1 4.4Å; F798-F809 HydrophobicContact CD2-CE1 4.34Å; F798-F809 HydrophobicContact CG-CE1 4.22Å; F809-A811 HydrophobicContact CD2-CB 4.43Å
810	Q	93.6	Very high	91.2	Very high	43 Å²	43	39.5 Å²	39.5	20%	0.201	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.4	162.7	-180	174.1	3.4	0	0	108.2	T716 Y720 I747 E748	T716-Q810 HydrophobicContact CG2-CB 4.12Å; T716-Q810 HydrophobicContact CG2-CG 4.01Å; Y720-Q810 HydrophobicContact CE1-CB 3.88Å; Y720-Q810 HydrophobicContact CE1-CG 4.36Å; Y720-Q810 HydrophobicContact CE2-CB 4.13Å; Y720-Q810 WeakPolarHBondContact OH-CB 3.35Å; Y720-Q810 PolarHBondContact OH-OE1 3.39Å; I747-Q810 PolarHBondContact N-O 3.39Å; E748-Q810 HydrophobicContact CB-CB 4.34Å; E748-Q810 PolarHBondContact N-O 2.74Å; E748-Q810 PolarHBondContact O-N 2.04Å
811	A	93.3	Very high	91.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	147.9	-177.4	0	0	0	0	0	111.3	Q714 L715 L744 D745 F746 F809	Q714-A811 WeakPolarHBondContact CA-O 3.46Å; L715-A811 HydrophobicContact CD2-CB 4.09Å; L715-A811 HydrophobicContact CG-CB 4.26Å; L715-A811 PolarHBondContact N-O 3.1Å; L715-A811 PolarHBondContact O-N 3.01Å; L744-A811 HydrophobicContact CD1-CB 3.87Å; D745-A811 CarbonylContact O-C 3.27Å; D745-A811 VanDerWaalsContact O-CA 3.27Å; D745-A811 WeakPolarHBondContact O-CA 3.31Å; F746-A811 HydrophobicContact CD1-CB 3.64Å; F746-A811 HydrophobicContact CE1-CB 3.88Å; F746-A811 HydrophobicContact CG-CB 4.08Å; F746-A811 HydrophobicContact CZ-CB 4.5Å; F809-A811 HydrophobicContact CD2-CB 4.43Å
812	H	94.4	Very high	91.2	Very high	62 Å²	62	45.2 Å²	45.2	29%	0.287	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.4	169.3	-70.2	-167.6	0	0	0	108.9	G713 Q714 D745 I747	G713-H812 WeakPolarHBondContact O-CA 3.32Å; Q714-H812 WeakPolarHBondContact CG-NE2 3.39Å; Q714-H812 PolarHBondContact NE2-NE2 3.23Å; Q714-H812 PolarHBondContact OE1-NE2 3.5Å; D745-H812 PolarHBondContact N-O 3.39Å; D745-H812 PolarHBondContact O-N 2.86Å; I747-H812 VanDerWaalsContact CD1-NE2 3.3Å; I747-H812 WeakPolarHBondContact CD1-NE2 3.44Å
813	Y	93.8	Very high	91.1	Very high	12 Å²	12	42.1 Å²	42.1	5%	0.047	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142.5	169.7	70.2	-81.3	0	0	0	110.2	L708 F712 G713 L715 F734 L742 Q743	L708-Y813 HydrophobicContact CB-CE2 4.47Å; L708-Y813 HydrophobicContact CD1-CE1 3.93Å; F712-Y813 CarbonylContact C-O 3.56Å; F712-Y813 WeakPolarHBondContact CA-O 3.35Å; G713-Y813 VanDerWaalsContact C-CE1 3.47Å; G713-Y813 PolarHBondContact N-O 3.39Å; G713-Y813 VanDerWaalsContact O-CD1 3.28Å; G713-Y813 WeakPolarHBondContact O-CD1 3.14Å; G713-Y813 PolarHBondContact O-N 2.03Å; L715-Y813 HydrophobicContact CD2-CD1 3.74Å; L715-Y813 HydrophobicContact CD2-CE1 4.47Å; F734-Y813 HydrophobicContact CD1-CD1 4.1Å; F734-Y813 AromaticContact CD1-CD2 3.74Å; F734-Y813 HydrophobicContact CD1-CD2 3.74Å; F734-Y813 HydrophobicContact CD1-CE1 4.43Å; F734-Y813 HydrophobicContact CD1-CE2 4.1Å; F734-Y813 AromaticContact CD1-CG 3.73Å; F734-Y813 HydrophobicContact CD1-CG 3.73Å; F734-Y813 AromaticContact CE1-CD1 3.64Å; F734-Y813 HydrophobicContact CE1-CD1 3.64Å; F734-Y813 HydrophobicContact CE1-CD2 4.1Å; F734-Y813 HydrophobicContact CE1-CE1 4.15Å; F734-Y813 AromaticContact CE1-CG 3.59Å; F734-Y813 HydrophobicContact CE1-CG 3.59Å; L742-Y813 HydrophobicContact CD2-CD2 4.07Å; Q743-Y813 CarbonylContact O-C 3.5Å; Q743-Y813 VanDerWaalsContact O-CA 3.28Å; Q743-Y813 WeakPolarHBondContact O-CA 3.07Å
814	T	93.7	Very high	91.2	Very high	58 Å²	58	44.6 Å²	44.6	36%	0.356	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	143.9	177.7	54.9	0	0	0	0	111	F712 Q743	F712-T814 HydrophobicContact CB-CG2 4.15Å; Q743-T814 PolarHBondContact N-O 2.66Å; Q743-T814 PolarHBondContact O-N 2.97Å
815	S	92.2	Very high	91.1	Very high	23 Å²	23	50.2 Å²	50.2	16%	0.161	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	129	169.8	-163.6	0	0	0	0	109.4	A711 T736 H740 R741 A834	A711-S815 WeakPolarHBondContact O-CB 3.44Å; A711-S815 PolarHBondContact O-N 2.93Å; T736-S815 WeakPolarHBondContact CG2-OG 3Å; T736-S815 VanDerWaalsContact OG1-CB 3.29Å; T736-S815 WeakPolarHBondContact OG1-CB 3.33Å; T736-S815 PolarHBondContact OG1-OG 2.04Å; H740-S815 WeakPolarHBondContact CB-OG 3.23Å; R741-S815 CarbonylContact O-C 3.55Å; R741-S815 WeakPolarHBondContact O-CA 3.46Å; S815-A834 WeakPolarHBondContact OG-CB 3.34Å
816	V	92.4	Very high	90.7	Very high	43 Å²	43	50 Å²	50	26%	0.261	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	121	-176.3	179.5	0	0	0	0	108.6	R741 Q743	R741-V816 PolarHBondContact N-O 2.81Å; R741-V816 PolarHBondContact O-N 3.09Å; Q743-V816 HydrophobicContact CB-CG2 3.64Å
817	C	92.5	Very high	90.3	Very high	26 Å²	26	49.4 Å²	49.4	18%	0.176	25%	0.25	C	S	.	.			trans	-71.9	172.2	-176.8	70.1	0	0	0	0	113.9	H740 R741 C847 W849	H740-C817 VanDerWaalsContact CE1-CB 3.42Å; H740-C817 WeakPolarHBondContact CE1-CB 3.18Å; H740-C817 VanDerWaalsContact ND1-CA 3.27Å; H740-C817 WeakPolarHBondContact ND1-CA 3.43Å; H740-C817 VanDerWaalsContact ND1-CB 3.34Å; H740-C817 WeakPolarHBondContact ND1-CB 3.21Å; R741-C817 PolarHBondContact NH2-O 3.48Å; C817-C847 HydrophobicContact CB-CB 3.76Å; C817-C847 WeakPolarHBondContact CB-SG 3.44Å; C817-C847 WeakPolarHBondContact SG-CA 3.35Å; C817-C847 WeakPolarHBondContact SG-CB 3.43Å; C817-C847 CovalentContact SG-SG 2.03Å; C817-C847 PolarHBondContact SG-SG 2.93Å; C817-W849 HydrophobicContact CB-CZ2 4.16Å
818	G	91.2	Very high	89.8	Confident	2 Å²	2	45.2 Å²	45.2	2%	0.021	24%	0.236	C	C	.	.			trans	68.6	-175.5	-174.6	0	0	0	0	0	113.2	R741 E848	R741-G818 PolarHBondContact NE-O 3.46Å; R741-G818 PolarHBondContact NH2-O 3.21Å; G818-E848 CarbonylContact C-O 3.58Å; G818-E848 WeakPolarHBondContact CA-O 3.19Å
819	G	90.2	Very high	89.6	Confident	11 Å²	11	49.3 Å²	49.3	11%	0.113	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	131.9	-175	-178.8	0	0	0	0	0	112.6	E848 W849 T850	G819-E848 PolarHBondContact N-O 3.12Å; G819-W849 CarbonylContact O-C 3.49Å; G819-W849 WeakPolarHBondContact O-CA 3.12Å; G819-T850 PolarHBondContact O-N 3.04Å
820	T	91.9	Very high	89.4	Confident	83 Å²	83	49.3 Å²	49.3	51%	0.509	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.3	178.3	-54	0	0	0	0	109.5	T850 L852	T820-T850 CarbonylContact C-O 3.55Å; T820-T850 WeakPolarHBondContact CA-O 3.15Å; T820-L852 HydrophobicContact CG2-CD1 3.43Å; T820-L852 VanDerWaalsContact CG2-CD1 3.43Å; T820-L852 HydrophobicContact CG2-CG 3.76Å
821	L	90.7	Very high	89.2	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.8	-178.1	-53.8	175.5	0	0	0	109.2	V830 T850 L851 L852 Y930	L821-V830 HydrophobicContact CD1-CG2 3.62Å; L821-T850 PolarHBondContact N-O 3.16Å; L821-L851 HydrophobicContact CB-CD2 3.86Å; L821-L851 HydrophobicContact CD1-CD2 3.88Å; L821-L851 HydrophobicContact CG-CD2 4.29Å; L821-L851 CarbonylContact O-C 3.58Å; L821-L851 WeakPolarHBondContact O-CA 3.01Å; L821-L852 PolarHBondContact O-N 3.46Å; L821-Y930 HydrophobicContact CB-CE2 4.38Å; L821-Y930 HydrophobicContact CD1-CE1 4.11Å
822	R	90.1	Very high	89.1	Confident	147 Å²	147	49.8 Å²	49.8	56%	0.555	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.1	172.8	-173.5	173.3	178.9	154.8	-6.6	109.1	L852 E854	R822-L852 CarbonylContact C-O 3.57Å; R822-L852 WeakPolarHBondContact CA-O 3.22Å; R822-E854 IonicContact CZ-OE1 3.39Å; R822-E854 IonicContact NE-OE1 3.92Å; R822-E854 IonicContact NH2-OE1 2.85Å; R822-E854 PolarHBondContact NH2-OE1 2.97Å
823	A	87.6	Confident	88.9	Confident	2 Å²	2	47.2 Å²	47.2	2%	0.017	24%	0.24	C	C	.	.			trans	-74.3	133.8	172.7	0	0	0	0	0	109.9	L852 V859 Y930 L932	A823-L852 PolarHBondContact N-O 2.65Å; A823-V859 HydrophobicContact CB-CG1 4.28Å; A823-V859 HydrophobicContact CB-CG2 4.05Å; A823-Y930 HydrophobicContact CB-CD2 4.31Å; A823-L932 HydrophobicContact CB-CB 4.26Å; A823-L932 HydrophobicContact CB-CD1 4.44Å
824	E	88.2	Confident	88.4	Confident	101 Å²	101	47.4 Å²	47.4	47%	0.472	24%	0.244	S	C	.	.			trans	-119.5	172.6	175.3	-65.8	-178.8	-165	0	0	109.3	S826 L932	E824-S826 PolarHBondContact O-N 3.11Å; E824-L932 VanDerWaalsContact C-CB 3.48Å; E824-L932 VanDerWaalsContact O-CB 3.28Å; E824-L932 WeakPolarHBondContact O-CB 3.14Å; E824-L932 PolarHBondContact O-N 2.98Å
825	R	83	Confident	87.8	Confident	168 Å²	168	46.3 Å²	46.3	63%	0.634	24%	0.235	S	C	*	.	S	Bend	trans	-73.1	-9	175.7	-69	-169.4	178.7	-93.8	3.1	113.1	M857 L932 D934	R825-M857 VanDerWaalsContact NH2-CE 3.27Å; R825-L932 HydrophobicContact CG-CB 4.36Å; R825-L932 HydrophobicContact CG-CD2 3.69Å; R825-D934 IonicContact CZ-OD1 2.73Å; R825-D934 IonicContact NH1-OD1 3.5Å; R825-D934 PolarHBondContact NH1-OD1 2.95Å; R825-D934 IonicContact NH2-OD1 3.23Å; R825-D934 PolarHBondContact NH2-OD1 2.88Å
826	S	78.6	Confident	87	Confident	72 Å²	72	45.8 Å²	45.8	50%	0.503	23%	0.23	S	C	.	.	S	Bend	trans	-85.4	142	164.3	24.7	0	0	0	0	110.9	E824 G828	E824-S826 PolarHBondContact O-N 3.11Å; S826-G828 PolarHBondContact O-N 2.9Å
827	V	82.9	Confident	85.6	Confident	64 Å²	64	43.9 Å²	43.9	39%	0.388	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-66.5	118.6	175.8	-179	0	0	0	0	110.2	Y829 E929 F931	V827-Y829 HydrophobicContact CB-CE2 4.46Å; V827-Y829 HydrophobicContact CG1-CE2 3.93Å; V827-E929 HydrophobicContact CG1-CB 3.64Å; V827-E929 HydrophobicContact CG1-CG 3.67Å; V827-F931 HydrophobicContact CG2-CD1 4.13Å
828	G	80.3	Confident	84.2	Confident	16 Å²	16	42.6 Å²	42.6	17%	0.165	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	158.1	165.4	0	0	0	0	0	111.3	S826 E929 Y930	S826-G828 PolarHBondContact O-N 2.9Å; G828-E929 CarbonylContact O-C 3.5Å; G828-E929 WeakPolarHBondContact O-CA 3.39Å; G828-Y930 VanDerWaalsContact C-CD1 3.42Å; G828-Y930 PolarHBondContact N-O 2.66Å; G828-Y930 WeakPolarHBondContact O-CD1 3.32Å; G828-Y930 PolarHBondContact O-N 2.93Å
829	Y	87.1	Confident	83.4	Confident	87 Å²	87	43.9 Å²	43.9	34%	0.341	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	141.2	-178.7	-69.2	-92	0	0	0	110.6	P738 V827 V927 E929	P738-Y829 CarbonylContact C-O 3.59Å; P738-Y829 WeakPolarHBondContact CB-O 3.44Å; V827-Y829 HydrophobicContact CB-CE2 4.46Å; V827-Y829 HydrophobicContact CG1-CE2 3.93Å; Y829-V927 HydrophobicContact CD1-CG1 4.34Å; Y829-E929 HydrophobicContact CD1-CG 3.89Å; Y829-E929 HydrophobicContact CE1-CG 3.39Å; Y829-E929 WeakPolarHBondContact CE1-OE1 3.03Å; Y829-E929 VanDerWaalsContact CZ-OE1 3.25Å; Y829-E929 PolarHBondContact OH-OE1 2.93Å
830	V	90	Very high	83.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.1	167.5	-179.9	0	0	0	0	109.7	L821 W849 V927 Y928 Y930	L821-V830 HydrophobicContact CD1-CG2 3.62Å; V830-W849 HydrophobicContact CG1-CD2 3.81Å; V830-W849 HydrophobicContact CG1-CE3 4.47Å; V830-W849 HydrophobicContact CG1-CG 4.13Å; V830-W849 HydrophobicContact CG1-CH2 4.35Å; V830-W849 HydrophobicContact CG1-CZ2 3.67Å; V830-V927 WeakPolarHBondContact O-CA 3.38Å; V830-Y928 HydrophobicContact CB-CD1 4.14Å; V830-Y928 HydrophobicContact CB-CD2 4.17Å; V830-Y928 HydrophobicContact CB-CE1 3.69Å; V830-Y928 HydrophobicContact CB-CE2 3.72Å; V830-Y928 HydrophobicContact CB-CG 4.37Å; V830-Y928 VanDerWaalsContact CB-CZ 3.47Å; V830-Y928 HydrophobicContact CG1-CD1 4.43Å; V830-Y928 HydrophobicContact CG1-CE1 3.68Å; V830-Y928 HydrophobicContact CG1-CE2 4.46Å; V830-Y928 HydrophobicContact CG2-CD2 4.39Å; V830-Y928 HydrophobicContact CG2-CE1 4.35Å; V830-Y928 HydrophobicContact CG2-CE2 3.63Å; V830-Y928 PolarHBondContact N-O 2.77Å; V830-Y928 PolarHBondContact O-N 3.46Å; V830-Y930 HydrophobicContact CG2-CD1 3.83Å; V830-Y930 HydrophobicContact CG2-CE1 3.62Å
831	Y	89.5	Confident	83.1	Confident	53 Å²	53	42.6 Å²	42.6	21%	0.208	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	141	176.9	-61.3	-96.8	0	0	0	109.7	T737 P738 H740 H833 Y836 V927	T737-Y831 HydrophobicContact CG2-CD2 3.54Å; T737-Y831 HydrophobicContact CG2-CE2 4.33Å; T737-Y831 HydrophobicContact CG2-CG 3.66Å; P738-Y831 HydrophobicContact CB-CD2 4.18Å; P738-Y831 HydrophobicContact CB-CE2 3.99Å; P738-Y831 HydrophobicContact CG-CD2 4.46Å; P738-Y831 HydrophobicContact CG-CE2 3.97Å; H740-Y831 PolarHBondContact NE2-O 2.83Å; Y831-H833 VanDerWaalsContact C-N 3.27Å; Y831-H833 PolarHBondContact O-N 3.41Å; Y831-Y836 AromaticContact CD1-CD1 3.55Å; Y831-Y836 HydrophobicContact CD1-CD1 3.55Å; Y831-Y836 HydrophobicContact CD1-CE1 4.35Å; Y831-Y836 AromaticContact CD1-CG 3.82Å; Y831-Y836 HydrophobicContact CD1-CG 3.82Å; Y831-Y836 HydrophobicContact CE1-CD1 4.1Å; Y831-V927 HydrophobicContact CD1-CB 4.43Å; Y831-V927 HydrophobicContact CD1-CG1 4.09Å; Y831-V927 HydrophobicContact CD1-CG2 3.52Å; Y831-V927 HydrophobicContact CE1-CG1 3.97Å; Y831-V927 HydrophobicContact CE1-CG2 3.78Å; Y831-V927 HydrophobicContact CG-CG2 4.42Å
832	S	91.1	Very high	82.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-57.3	-34.3	-176.1	55.9	0	0	0	0	115.3	F926	S832-F926 PolarHBondContact N-O 2.04Å; S832-F926 PolarHBondContact OG-N 2.9Å; S832-F926 PolarHBondContact OG-O 3.46Å
833	H	88.8	Confident	83	Confident	9 Å²	9	45 Å²	45	4%	0.042	23%	0.226	C	C	.	.	S	Bend	trans	-146.5	161.6	-179.2	64.9	-72.8	0	0	0	109.9	H740 Y831 M835 Y836 S839 N840 Y841	H740-H833 VanDerWaalsContact CE1-C 3.44Å; Y831-H833 VanDerWaalsContact C-N 3.27Å; Y831-H833 PolarHBondContact O-N 3.41Å; H833-M835 VanDerWaalsContact C-N 3.34Å; H833-M835 PolarHBondContact O-N 2.71Å; H833-Y836 AromaticContact CE1-CD2 3.68Å; H833-Y836 AromaticContact ND1-CD2 3.85Å; H833-Y836 WeakPolarHBondContact NE2-CA 3.41Å; H833-Y836 PolarHBondContact NE2-N 3.26Å; H833-Y836 WeakPolarHBondContact O-CB 3.03Å; H833-Y836 PolarHBondContact O-N 3.3Å; H833-S839 PolarHBondContact CE1-O 2.78Å; H833-S839 PolarHBondContact NE2-O 3.13Å; H833-N840 PolarHBondContact NE2-O 3.25Å; H833-Y841 PolarHBondContact CE1-N 3.18Å
834	A	84.1	Confident	83.1	Confident	16 Å²	16	52.8 Å²	52.8	13%	0.132	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-34.1	-172.4	0	0	0	0	0	113.3	A711 T737 S815 Y836	A711-A834 HydrophobicContact CB-CB 3.7Å; T737-A834 PolarHBondContact OG1-O 3.41Å; S815-A834 WeakPolarHBondContact OG-CB 3.34Å; A834-Y836 VanDerWaalsContact C-N 3.29Å; A834-Y836 PolarHBondContact O-N 2.74Å
835	M	80.4	Confident	83.1	Confident	34 Å²	34	49.1 Å²	49.1	17%	0.167	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	19.4	178.9	-62.4	-63.3	-76.2	0	0	113.7	N574 A711 H833 G837 G838 S839	N574-M835 HydrophobicContact CB-CE 3.61Å; A711-M835 HydrophobicContact CB-CG 3.99Å; A711-M835 HydrophobicContact CB-SD 3.46Å; A711-M835 WeakPolarHBondContact CB-SD 3.38Å; H833-M835 VanDerWaalsContact C-N 3.34Å; H833-M835 PolarHBondContact O-N 2.71Å; M835-G837 PolarHBondContact O-N 2.85Å; M835-G838 CarbonylContact O-C 3.53Å; M835-G838 WeakPolarHBondContact O-CA 3.44Å; M835-G838 PolarHBondContact O-N 2.78Å; M835-S839 WeakPolarHBondContact CB-OG 3.27Å; M835-S839 PolarHBondContact O-N 2.92Å
836	Y	75.8	Confident	83.6	Confident	12 Å²	12	44.3 Å²	44.3	5%	0.047	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-57.1	130.7	-179.5	-171.4	-79.8	0	0	0	111.8	V571 Y831 H833 A834 G838 N865 K924 V927	V571-Y836 WeakPolarHBondContact CG2-O 3.29Å; Y831-Y836 AromaticContact CD1-CD1 3.55Å; Y831-Y836 HydrophobicContact CD1-CD1 3.55Å; Y831-Y836 HydrophobicContact CD1-CE1 4.35Å; Y831-Y836 AromaticContact CD1-CG 3.82Å; Y831-Y836 HydrophobicContact CD1-CG 3.82Å; Y831-Y836 HydrophobicContact CE1-CD1 4.1Å; H833-Y836 AromaticContact CE1-CD2 3.68Å; H833-Y836 AromaticContact ND1-CD2 3.85Å; H833-Y836 WeakPolarHBondContact NE2-CA 3.41Å; H833-Y836 PolarHBondContact NE2-N 3.26Å; H833-Y836 WeakPolarHBondContact O-CB 3.03Å; H833-Y836 PolarHBondContact O-N 3.3Å; A834-Y836 VanDerWaalsContact C-N 3.29Å; A834-Y836 PolarHBondContact O-N 2.74Å; Y836-G838 VanDerWaalsContact C-N 3.3Å; Y836-N865 VanDerWaalsContact OH-CB 3.3Å; Y836-N865 WeakPolarHBondContact OH-CB 3.36Å; Y836-N865 PolarHBondContact OH-ND2 2.72Å; Y836-K924 WeakPolarHBondContact CD2-O 3.31Å; Y836-K924 WeakPolarHBondContact CE2-O 3.37Å; Y836-V927 HydrophobicContact CD1-CG2 3.8Å; Y836-V927 HydrophobicContact CD2-CG2 4.42Å; Y836-V927 HydrophobicContact CE1-CG2 3.34Å; Y836-V927 HydrophobicContact CE2-CG2 4.02Å; Y836-V927 HydrophobicContact CG-CG2 4.33Å; Y836-V927 VanDerWaalsContact CZ-CG2 3.49Å
837	G	63.5	Low	84.3	Confident	3 Å²	3	41 Å²	41	3%	0.031	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	0.7	-171.5	0	0	0	0	0	113.8	G570 V571 Y577 M835	G570-G837 WeakPolarHBondContact CA-O 3.33Å; V571-G837 PolarHBondContact N-O 2.98Å; Y577-G837 WeakPolarHBondContact CD2-O 3.37Å; M835-G837 PolarHBondContact O-N 2.85Å
838	G	63.6	Low	84.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142	-1.1	178.9	0	0	0	0	0	115.6	N574 E576 M835 Y836	N574-G838 PolarHBondContact ND2-O 3.36Å; N574-G838 WeakPolarHBondContact O-CA 3.43Å; E576-G838 VanDerWaalsContact CG-O 3.3Å; E576-G838 WeakPolarHBondContact CG-O 3.04Å; M835-G838 CarbonylContact O-C 3.53Å; M835-G838 WeakPolarHBondContact O-CA 3.44Å; M835-G838 PolarHBondContact O-N 2.78Å; Y836-G838 VanDerWaalsContact C-N 3.3Å
839	S	73	Confident	85.5	Confident	28 Å²	28	40.3 Å²	40.3	20%	0.196	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-161.7	177.1	162.2	69	0	0	0	0	109.5	Y577 H833 M835	Y577-S839 VanDerWaalsContact OH-C 3.27Å; Y577-S839 PolarHBondContact OH-O 2.64Å; H833-S839 PolarHBondContact CE1-O 2.78Å; H833-S839 PolarHBondContact NE2-O 3.13Å; M835-S839 WeakPolarHBondContact CB-OG 3.27Å; M835-S839 PolarHBondContact O-N 2.92Å
840	N	87.3	Confident	85.9	Confident	64 Å²	64	37 Å²	37	34%	0.342	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-73.8	165.6	158.9	-75.4	8.7	0	0	0	110.5	Y577 H833 T922 A923	Y577-N840 PolarHBondContact OH-OD1 3.43Å; H833-N840 PolarHBondContact NE2-O 3.25Å; N840-T922 PolarHBondContact ND2-O 2.87Å; N840-A923 WeakPolarHBondContact CA-O 3.47Å; N840-A923 WeakPolarHBondContact CB-O 3.47Å; N840-A923 VanDerWaalsContact CG-O 3.24Å; N840-A923 WeakPolarHBondContact ND2-CA 3.43Å
841	Y	88.6	Confident	86	Confident	4 Å²	4	37 Å²	37	2%	0.016	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-68.6	159.5	174.6	56.6	-95.7	0	0	0	112.6	H833 L868 E869 D877 F915 A917 V921 T922 A923	H833-Y841 PolarHBondContact CE1-N 3.18Å; Y841-L868 HydrophobicContact CD1-CD2 4.23Å; Y841-L868 HydrophobicContact CE1-CD2 3.46Å; Y841-L868 VanDerWaalsContact CE1-CD2 3.46Å; Y841-E869 PolarHBondContact OH-N 2.93Å; Y841-D877 WeakPolarHBondContact CE2-OD2 3.43Å; Y841-D877 PolarHBondContact OH-OD2 2.97Å; Y841-F915 HydrophobicContact CD1-CZ 4.3Å; Y841-F915 HydrophobicContact CD2-CE1 4.39Å; Y841-F915 AromaticContact CD2-CZ 3.79Å; Y841-F915 HydrophobicContact CD2-CZ 3.79Å; Y841-F915 HydrophobicContact CE1-CZ 4.47Å; Y841-F915 AromaticContact CE2-CZ 3.98Å; Y841-F915 HydrophobicContact CE2-CZ 3.98Å; Y841-F915 HydrophobicContact CG-CE1 4.35Å; Y841-F915 AromaticContact CG-CZ 3.96Å; Y841-F915 HydrophobicContact CG-CZ 3.96Å; Y841-A917 HydrophobicContact CD2-CB 4.07Å; Y841-A917 HydrophobicContact CE2-CB 3.88Å; Y841-V921 PolarHBondContact OH-O 3.36Å; Y841-T922 HydrophobicContact CD2-CG2 3.91Å; Y841-T922 HydrophobicContact CE2-CG2 3.81Å; Y841-T922 WeakPolarHBondContact O-CB 3.13Å; Y841-T922 VanDerWaalsContact O-CG2 3.23Å; Y841-T922 WeakPolarHBondContact O-CG2 3.46Å; Y841-T922 PolarHBondContact O-OG1 3.41Å; Y841-A923 WeakPolarHBondContact CD1-O 3.04Å; Y841-A923 HydrophobicContact CE1-CB 4Å; Y841-A923 VanDerWaalsContact CE1-N 3.28Å; Y841-A923 WeakPolarHBondContact CE1-O 3.01Å; Y841-A923 VanDerWaalsContact CZ-N 3.29Å; Y841-A923 PolarHBondContact N-O 3.35Å; Y841-A923 PolarHBondContact OH-N 2.87Å
842	E	88.3	Confident	86.2	Confident	133 Å²	133	37.2 Å²	37.2	62%	0.621	19%	0.194	S	C	*	.	P	Polyproline II helix	trans	-80.4	153	-179.7	-67.6	171.7	-139.1	0	0	112.7	V845	E842-V845 HydrophobicContact CB-CG2 3.63Å; E842-V845 WeakPolarHBondContact O-CG2 3.34Å
843	N	90.2	Very high	86.1	Confident	78 Å²	78	37.9 Å²	37.9	42%	0.417	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	150	175	-43.1	-87.5	0	0	0	111.2	K114 V845 D918 D919 T920 T922	K114-N843 PolarHBondContact NZ-OD1 3.35Å; N843-V845 PolarHBondContact O-N 3.16Å; N843-D918 CarbonylContact C-O 3.49Å; N843-D919 PolarHBondContact OD1-O 3.31Å; N843-T920 PolarHBondContact OD1-O 2.87Å; N843-T922 WeakPolarHBondContact OD1-CG2 3.19Å
844	R	89.9	Confident	86.1	Confident	166 Å²	166	41.9 Å²	41.9	63%	0.626	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	20	177.3	-55	-178	177	128.5	3	114.8	A917 D918 D919	R844-A917 WeakPolarHBondContact CA-O 3.4Å; R844-D918 PolarHBondContact N-O 3.39Å; R844-D919 HydrophobicContact CG-CB 4.2Å; R844-D919 IonicContact CZ-OD2 2.78Å; R844-D919 IonicContact NE-OD2 3.94Å; R844-D919 PolarHBondContact NE-OD2 2.98Å; R844-D919 IonicContact NH2-OD2 3.17Å; R844-D919 PolarHBondContact NH2-OD2 2.76Å
845	V	88.4	Confident	86	Confident	24 Å²	24	50.5 Å²	50.5	15%	0.145	26%	0.256	C	S	.	.			trans	-69.2	136.9	177.2	167.2	0	0	0	0	110.9	E842 N843 C847 F915 R916 A917	E842-V845 HydrophobicContact CB-CG2 3.63Å; E842-V845 WeakPolarHBondContact O-CG2 3.34Å; N843-V845 PolarHBondContact O-N 3.16Å; V845-C847 WeakPolarHBondContact CG1-SG 3.48Å; V845-F915 HydrophobicContact CB-CE1 4.45Å; V845-F915 HydrophobicContact CG1-CD1 4Å; V845-F915 HydrophobicContact CG1-CE1 3.9Å; V845-R916 CarbonylContact O-C 3.55Å; V845-R916 WeakPolarHBondContact O-CA 3.31Å; V845-A917 HydrophobicContact CB-CB 4.42Å; V845-A917 PolarHBondContact O-N 3.47Å
846	A	93.8	Very high	86.1	Confident	68 Å²	68	51.5 Å²	51.5	56%	0.562	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	99.5	173.4	0	0	0	0	0	109.9	F915 R916	A846-F915 CarbonylContact C-O 3.43Å; A846-F915 WeakPolarHBondContact CA-O 3.35Å; A846-R916 HydrophobicContact CB-CG 4.34Å
847	C	94.4	Very high	86.7	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.7	-178	-52.4	0	0	0	0	110.8	C817 V845 W849 R914 F915	C817-C847 HydrophobicContact CB-CB 3.76Å; C817-C847 WeakPolarHBondContact CB-SG 3.44Å; C817-C847 WeakPolarHBondContact SG-CA 3.35Å; C817-C847 WeakPolarHBondContact SG-CB 3.43Å; C817-C847 CovalentContact SG-SG 2.03Å; C817-C847 PolarHBondContact SG-SG 2.93Å; V845-C847 WeakPolarHBondContact CG1-SG 3.48Å; C847-W849 HydrophobicContact CB-CE3 4.14Å; C847-W849 HydrophobicContact CB-CH2 3.28Å; C847-W849 HydrophobicContact CB-CZ2 3.75Å; C847-W849 HydrophobicContact CB-CZ3 3.49Å; C847-W849 VanDerWaalsContact CB-CZ3 3.49Å; C847-R914 CarbonylContact O-C 3.55Å; C847-R914 WeakPolarHBondContact O-CA 3.27Å; C847-F915 HydrophobicContact CB-CB 4.27Å; C847-F915 PolarHBondContact N-O 2.89Å; C847-F915 PolarHBondContact O-N 2.77Å
848	E	94.3	Very high	87.9	Confident	67 Å²	67	52 Å²	52	31%	0.313	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	116.6	176	-170.6	161.5	123.8	0	0	110.4	G818 G819 R912 V913 R914	G818-E848 CarbonylContact C-O 3.58Å; G818-E848 WeakPolarHBondContact CA-O 3.19Å; G819-E848 PolarHBondContact N-O 3.12Å; E848-R912 HydrophobicContact CG-CG 3.98Å; E848-R912 WeakPolarHBondContact OE1-CD 3.46Å; E848-R912 IonicContact OE1-CZ 3.42Å; E848-R912 IonicContact OE1-NE 3.24Å; E848-R912 IonicContact OE1-NH1 2.72Å; E848-R912 PolarHBondContact OE1-NH1 3.23Å; E848-R912 IonicContact OE2-NH1 3.19Å; E848-V913 WeakPolarHBondContact CA-O 3.39Å; E848-R914 IonicContact OE1-NH2 3.64Å; E848-R914 IonicContact OE2-CZ 2.63Å; E848-R914 IonicContact OE2-NE 3.58Å; E848-R914 PolarHBondContact OE2-NE 3.39Å; E848-R914 IonicContact OE2-NH2 2.8Å; E848-R914 PolarHBondContact OE2-NH2 3.4Å
849	W	94.5	Very high	89.3	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.2	179.3	-62.5	-87.1	0	0	0	110	G739 C817 G819 V830 C847 L851 R912 V913 F915 F926 Y928	G739-W849 PolarHBondContact O-NE1 2.84Å; C817-W849 HydrophobicContact CB-CZ2 4.16Å; G819-W849 CarbonylContact O-C 3.49Å; G819-W849 WeakPolarHBondContact O-CA 3.12Å; V830-W849 HydrophobicContact CG1-CD2 3.81Å; V830-W849 HydrophobicContact CG1-CE3 4.47Å; V830-W849 HydrophobicContact CG1-CG 4.13Å; V830-W849 HydrophobicContact CG1-CH2 4.35Å; V830-W849 HydrophobicContact CG1-CZ2 3.67Å; C847-W849 HydrophobicContact CB-CE3 4.14Å; C847-W849 HydrophobicContact CB-CH2 3.28Å; C847-W849 HydrophobicContact CB-CZ2 3.75Å; C847-W849 HydrophobicContact CB-CZ3 3.49Å; C847-W849 VanDerWaalsContact CB-CZ3 3.49Å; W849-L851 HydrophobicContact CB-CD2 4.49Å; W849-R912 CarbonylContact O-C 3.57Å; W849-R912 WeakPolarHBondContact O-CA 3.39Å; W849-V913 HydrophobicContact CE3-CB 4.4Å; W849-V913 HydrophobicContact CE3-CG1 4.37Å; W849-V913 PolarHBondContact N-O 2.91Å; W849-V913 PolarHBondContact O-N 2.84Å; W849-F915 HydrophobicContact CH2-CB 4.25Å; W849-F915 HydrophobicContact CZ3-CB 3.77Å; W849-F926 HydrophobicContact CH2-CE2 4.25Å; W849-F926 AromaticContact CH2-CZ 3.85Å; W849-F926 HydrophobicContact CH2-CZ 3.85Å; W849-F926 HydrophobicContact CZ3-CE2 4.26Å; W849-F926 AromaticContact CZ3-CZ 3.81Å; W849-F926 HydrophobicContact CZ3-CZ 3.81Å; W849-Y928 WeakPolarHBondContact CB-OH 3.29Å
850	T	93.7	Very high	90.1	Very high	17 Å²	17	51.9 Å²	51.9	10%	0.104	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.9	173.4	-60.6	0	0	0	0	108.6	G819 T820 L821 L852 V910	G819-T850 PolarHBondContact O-N 3.04Å; T820-T850 CarbonylContact C-O 3.55Å; T820-T850 WeakPolarHBondContact CA-O 3.15Å; L821-T850 PolarHBondContact N-O 3.16Å; T850-L852 HydrophobicContact CG2-CD2 3.97Å; T850-V910 HydrophobicContact CG2-CG1 3.65Å
851	L	92.9	Very high	90.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.9	-180	-48.3	-178.7	0	0	0	109.1	L821 W849 V859 I861 V910 L911 Y928 Y930	L821-L851 HydrophobicContact CB-CD2 3.86Å; L821-L851 HydrophobicContact CD1-CD2 3.88Å; L821-L851 HydrophobicContact CG-CD2 4.29Å; L821-L851 CarbonylContact O-C 3.58Å; L821-L851 WeakPolarHBondContact O-CA 3.01Å; W849-L851 HydrophobicContact CB-CD2 4.49Å; L851-V859 HydrophobicContact CB-CG1 3.88Å; L851-V859 HydrophobicContact CB-CG2 4.12Å; L851-V859 HydrophobicContact CD1-CG1 3.79Å; L851-I861 HydrophobicContact CD1-CG2 3.5Å; L851-V910 WeakPolarHBondContact O-CA 3.25Å; L851-L911 WeakPolarHBondContact CA-O 3.41Å; L851-L911 HydrophobicContact CB-CB 4.48Å; L851-L911 WeakPolarHBondContact CB-O 3.15Å; L851-L911 HydrophobicContact CD1-CD2 4.02Å; L851-L911 PolarHBondContact N-O 2.86Å; L851-L911 PolarHBondContact O-N 2.89Å; L851-Y928 HydrophobicContact CD1-CE2 4.05Å; L851-Y930 HydrophobicContact CD1-CG 4.24Å; L851-Y930 HydrophobicContact CD2-CD2 4.38Å; L851-Y930 HydrophobicContact CD2-CG 4.44Å
852	L	92.7	Very high	90.4	Very high	58 Å²	58	53 Å²	53	30%	0.304	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123	-178.6	-58.6	-177.2	0	0	0	111.1	T820 L821 R822 A823 T850 V910	T820-L852 HydrophobicContact CG2-CD1 3.43Å; T820-L852 VanDerWaalsContact CG2-CD1 3.43Å; T820-L852 HydrophobicContact CG2-CG 3.76Å; L821-L852 PolarHBondContact O-N 3.46Å; R822-L852 CarbonylContact C-O 3.57Å; R822-L852 WeakPolarHBondContact CA-O 3.22Å; A823-L852 PolarHBondContact N-O 2.65Å; T850-L852 HydrophobicContact CG2-CD2 3.97Å; L852-V910 HydrophobicContact CD2-CB 4.34Å; L852-V910 HydrophobicContact CD2-CG1 3.98Å; L852-V910 HydrophobicContact CD2-CG2 3.69Å
853	A	90.3	Very high	90.4	Very high	14 Å²	14	47 Å²	47	12%	0.116	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-91.1	170.5	165.9	0	0	0	0	0	111.3	M857 V859 S909 L932	A853-M857 HydrophobicContact CB-CB 4.04Å; A853-M857 WeakPolarHBondContact CB-O 3.41Å; A853-V859 HydrophobicContact CB-CG2 3.79Å; A853-S909 PolarHBondContact N-O 3.1Å; A853-L932 HydrophobicContact CB-CD1 3.67Å
854	E	87.5	Confident	89.9	Confident	93 Å²	93	45.7 Å²	45.7	44%	0.435	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-73	162.4	171.5	-51.5	-163.5	135.3	0	0	111.4	R822 G856 M857 L932	R822-E854 IonicContact CZ-OE1 3.39Å; R822-E854 IonicContact NE-OE1 3.92Å; R822-E854 IonicContact NH2-OE1 2.85Å; R822-E854 PolarHBondContact NH2-OE1 2.97Å; E854-G856 PolarHBondContact O-N 3.09Å; E854-M857 HydrophobicContact CB-CG 4.29Å; E854-M857 WeakPolarHBondContact O-CB 3.29Å; E854-M857 PolarHBondContact O-N 3.01Å; E854-L932 HydrophobicContact CG-CD1 4.18Å
855	E	82.4	Confident	89.6	Confident	196 Å²	196	39.7 Å²	39.7	92%	0.916	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	125	178	-68.5	-171.3	161.2	0	0	111
856	G	82.9	Confident	89.6	Confident	56 Å²	56	39 Å²	39	58%	0.577	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.9	15.2	-175.4	0	0	0	0	0	114.9	E854 Q935	E854-G856 PolarHBondContact O-N 3.09Å; G856-Q935 WeakPolarHBondContact O-CG 3.47Å
857	M	89.1	Confident	89.4	Confident	24 Å²	24	39.7 Å²	39.7	12%	0.118	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	158	174.2	-64.9	-61.9	-66.2	0	0	111	R825 A853 E854 S909 L932 T933 D934	R825-M857 VanDerWaalsContact NH2-CE 3.27Å; A853-M857 HydrophobicContact CB-CB 4.04Å; A853-M857 WeakPolarHBondContact CB-O 3.41Å; E854-M857 HydrophobicContact CB-CG 4.29Å; E854-M857 WeakPolarHBondContact O-CB 3.29Å; E854-M857 PolarHBondContact O-N 3.01Å; M857-S909 WeakPolarHBondContact O-CA 3.36Å; M857-L932 HydrophobicContact CB-CD1 3.75Å; M857-L932 HydrophobicContact CB-CG 4.09Å; M857-L932 HydrophobicContact CE-CD2 3.52Å; M857-L932 HydrophobicContact CE-CG 3.67Å; M857-L932 HydrophobicContact CG-CD1 4.24Å; M857-L932 HydrophobicContact CG-CD2 4.23Å; M857-L932 HydrophobicContact CG-CG 4.32Å; M857-T933 VanDerWaalsContact CE-C 3.47Å; M857-T933 WeakPolarHBondContact CE-O 3.45Å; M857-D934 VanDerWaalsContact CE-OD1 3.27Å; M857-D934 WeakPolarHBondContact CE-OD1 3.38Å
858	S	89.1	Confident	89.3	Confident	1 Å²	1	40 Å²	40	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	162.2	175.7	-75.3	0	0	0	0	111.4	S906 T933 Q935	S858-S906 VanDerWaalsContact CB-O 3.29Å; S858-S906 WeakPolarHBondContact CB-O 3.28Å; S858-S906 PolarHBondContact OG-O 3.34Å; S858-T933 PolarHBondContact N-O 2.88Å; S858-T933 PolarHBondContact O-N 3.31Å; S858-Q935 PolarHBondContact OG-NE2 3.04Å
859	V	91.1	Very high	89.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	132	168.4	-174	0	0	0	0	108.8	A823 L851 A853 I861 I905 S906 L911	A823-V859 HydrophobicContact CB-CG1 4.28Å; A823-V859 HydrophobicContact CB-CG2 4.05Å; L851-V859 HydrophobicContact CB-CG1 3.88Å; L851-V859 HydrophobicContact CB-CG2 4.12Å; L851-V859 HydrophobicContact CD1-CG1 3.79Å; A853-V859 HydrophobicContact CB-CG2 3.79Å; V859-I861 HydrophobicContact CG1-CG2 4.14Å; V859-I905 WeakPolarHBondContact O-CA 3.18Å; V859-S906 PolarHBondContact N-OG 3.06Å; V859-S906 PolarHBondContact O-N 3.22Å; V859-S906 PolarHBondContact O-OG 2.72Å; V859-L911 HydrophobicContact CB-CB 3.97Å; V859-L911 HydrophobicContact CG1-CB 4.36Å; V859-L911 HydrophobicContact CG2-CB 4.42Å
860	E	90.7	Very high	88.9	Confident	25 Å²	25	44.9 Å²	44.9	12%	0.117	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.6	170.6	-170.9	163.2	159.7	0	0	109	M903 F904 I905 Y930 F931 T933	E860-M903 HydrophobicContact CG-CE 4.35Å; E860-M903 WeakPolarHBondContact OE1-CE 3.46Å; E860-F904 CarbonylContact C-O 3.22Å; E860-F904 WeakPolarHBondContact CA-O 3.41Å; E860-I905 HydrophobicContact CB-CG1 4.16Å; E860-I905 HydrophobicContact CG-CD1 4.42Å; E860-I905 HydrophobicContact CG-CG1 3.75Å; E860-Y930 VanDerWaalsContact O-CA 3.28Å; E860-Y930 WeakPolarHBondContact O-CA 3.34Å; E860-F931 HydrophobicContact CB-CD2 4.06Å; E860-F931 HydrophobicContact CB-CE1 4.42Å; E860-F931 HydrophobicContact CB-CE2 3.7Å; E860-F931 HydrophobicContact CB-CZ 3.9Å; E860-F931 VanDerWaalsContact CD-CE2 3.42Å; E860-F931 HydrophobicContact CG-CE1 4.23Å; E860-F931 HydrophobicContact CG-CE2 3.81Å; E860-F931 HydrophobicContact CG-CZ 3.58Å; E860-F931 PolarHBondContact N-O 3.42Å; E860-F931 PolarHBondContact O-N 3.03Å; E860-F931 WeakPolarHBondContact OE1-CZ 3.45Å; E860-F931 WeakPolarHBondContact OE2-CE2 3.41Å; E860-T933 HydrophobicContact CB-CG2 3.85Å; E860-T933 VanDerWaalsContact OE2-CB 3.24Å; E860-T933 WeakPolarHBondContact OE2-CB 3.48Å; E860-T933 PolarHBondContact OE2-OG1 3.21Å
861	I	92.6	Very high	88.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.6	174.3	65.8	162.4	0	0	0	112.1	L851 V859 F863 V881 M903 F904 L911 V913 Y928 E929	L851-I861 HydrophobicContact CD1-CG2 3.5Å; V859-I861 HydrophobicContact CG1-CG2 4.14Å; I861-F863 HydrophobicContact CD1-CE2 4.28Å; I861-V881 HydrophobicContact CD1-CG1 4.09Å; I861-V881 HydrophobicContact CD1-CG2 4.23Å; I861-M903 WeakPolarHBondContact O-CA 3.31Å; I861-F904 HydrophobicContact CD1-CB 4.33Å; I861-F904 HydrophobicContact CD1-CD2 4.04Å; I861-F904 HydrophobicContact CG1-CB 3.81Å; I861-F904 HydrophobicContact CG1-CD2 4.11Å; I861-F904 HydrophobicContact CG1-CG 4.48Å; I861-F904 PolarHBondContact N-O 2.93Å; I861-F904 PolarHBondContact O-N 2.97Å; I861-L911 HydrophobicContact CD1-CD2 3.8Å; I861-L911 HydrophobicContact CG1-CD1 4.31Å; I861-L911 HydrophobicContact CG1-CD2 4.23Å; I861-L911 HydrophobicContact CG2-CD2 4.05Å; I861-V913 HydrophobicContact CD1-CG2 3.88Å; I861-Y928 HydrophobicContact CB-CD2 4.34Å; I861-Y928 HydrophobicContact CG2-CD2 4.25Å; I861-Y928 HydrophobicContact CG2-CE2 4.33Å; I861-E929 VanDerWaalsContact CA-O 3.29Å; I861-E929 WeakPolarHBondContact CA-O 3.23Å
862	Q	89.3	Confident	88.1	Confident	91 Å²	91	51.5 Å²	51.5	43%	0.425	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	125.9	175.6	179.1	175	-20.4	0	0	110.4	Y928 E929	Q862-Y928 CarbonylContact O-C 3.55Å; Q862-Y928 VanDerWaalsContact O-CA 3.3Å; Q862-Y928 WeakPolarHBondContact O-CA 3.22Å; Q862-Y928 WeakPolarHBondContact O-CB 3.36Å; Q862-E929 PolarHBondContact N-O 2.92Å; Q862-E929 PolarHBondContact O-N 3.42Å
863	F	89	Confident	87.8	Confident	7 Å²	7	55 Å²	55	3%	0.031	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	132.2	171	-67.9	-89.3	0	0	0	110.1	I861 F866 V879 L900 P901 F904 F926 Y928	I861-F863 HydrophobicContact CD1-CE2 4.28Å; F863-F866 AromaticContact CD1-CD2 3.59Å; F863-F866 HydrophobicContact CD1-CD2 3.59Å; F863-F866 HydrophobicContact CD1-CE2 4.2Å; F863-F866 AromaticContact CE1-CD2 3.89Å; F863-F866 HydrophobicContact CE1-CD2 3.89Å; F863-F866 HydrophobicContact CE1-CE2 4.02Å; F863-F866 HydrophobicContact CG-CD2 4.17Å; F863-V879 HydrophobicContact CE1-CG1 4.42Å; F863-V879 HydrophobicContact CZ-CG1 3.96Å; F863-L900 HydrophobicContact CB-CD2 4.11Å; F863-P901 HydrophobicContact CD2-CB 3.74Å; F863-P901 HydrophobicContact CD2-CG 3.76Å; F863-P901 HydrophobicContact CE2-CB 4.12Å; F863-P901 HydrophobicContact CE2-CG 4.08Å; F863-P901 HydrophobicContact CG-CB 4.48Å; F863-P901 HydrophobicContact CG-CG 4.11Å; F863-F904 HydrophobicContact CE2-CD2 4.4Å; F863-F904 HydrophobicContact CE2-CE2 4.15Å; F863-F926 HydrophobicContact CD1-CB 4.18Å; F863-F926 HydrophobicContact CD1-CD2 4.38Å; F863-F926 HydrophobicContact CD1-CG 4.46Å; F863-F926 HydrophobicContact CE1-CB 4.39Å; F863-F926 AromaticContact CE1-CD2 3.98Å; F863-F926 HydrophobicContact CE1-CD2 3.98Å; F863-F926 HydrophobicContact CE1-CG 4.2Å; F863-Y928 HydrophobicContact CD1-CD1 4.48Å; F863-Y928 AromaticContact CE1-CD1 3.89Å; F863-Y928 HydrophobicContact CE1-CD1 3.89Å; F863-Y928 HydrophobicContact CE1-CG 4.33Å; F863-Y928 HydrophobicContact CZ-CD1 4.32Å
864	T	79.7	Confident	87.7	Confident	51 Å²	51	55.1 Å²	55.1	31%	0.313	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	-37.6	178.7	51.4	0	0	0	0	111.8	V927 E929	T864-V927 PolarHBondContact N-O 2.85Å; T864-V927 PolarHBondContact OG1-O 3Å; T864-E929 HydrophobicContact CG2-CG 3.85Å
865	N	82.5	Confident	87.7	Confident	40 Å²	40	56.8 Å²	56.8	21%	0.214	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	143.1	164.4	-81.4	11.2	0	0	0	108.9	Y836 F926 V927	Y836-N865 VanDerWaalsContact OH-CB 3.3Å; Y836-N865 WeakPolarHBondContact OH-CB 3.36Å; Y836-N865 PolarHBondContact OH-ND2 2.72Å; N865-F926 VanDerWaalsContact O-CA 3.24Å; N865-F926 WeakPolarHBondContact O-CA 3.44Å; N865-F926 WeakPolarHBondContact O-CB 3.43Å; N865-V927 HydrophobicContact CB-CG2 4.43Å; N865-V927 PolarHBondContact N-O 2.94Å; N865-V927 PolarHBondContact O-N 2.9Å
866	F	88.7	Confident	88.1	Confident	11 Å²	11	51.8 Å²	51.8	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	110.4	174.7	-166.8	-87.3	0	0	0	111.6	F863 L868 V879 F895 G897 N898 L900 P901 F926	F863-F866 AromaticContact CD1-CD2 3.59Å; F863-F866 HydrophobicContact CD1-CD2 3.59Å; F863-F866 HydrophobicContact CD1-CE2 4.2Å; F863-F866 AromaticContact CE1-CD2 3.89Å; F863-F866 HydrophobicContact CE1-CD2 3.89Å; F863-F866 HydrophobicContact CE1-CE2 4.02Å; F863-F866 HydrophobicContact CG-CD2 4.17Å; F866-L868 HydrophobicContact CE1-CD1 4.2Å; F866-L868 HydrophobicContact CE1-CG 4.3Å; F866-L868 HydrophobicContact CE2-CD1 4.23Å; F866-L868 HydrophobicContact CZ-CD1 3.65Å; F866-L868 HydrophobicContact CZ-CG 4.16Å; F866-V879 HydrophobicContact CE2-CB 4.16Å; F866-V879 HydrophobicContact CE2-CG2 4.09Å; F866-V879 HydrophobicContact CZ-CB 4.44Å; F866-F895 HydrophobicContact CE1-CB 4.16Å; F866-F895 HydrophobicContact CE2-CB 4.3Å; F866-F895 HydrophobicContact CZ-CB 3.62Å; F866-G897 WeakPolarHBondContact CD1-O 3.24Å; F866-G897 WeakPolarHBondContact CE1-O 3.43Å; F866-N898 CarbonylContact O-C 3.52Å; F866-N898 WeakPolarHBondContact O-CA 3.33Å; F866-L900 HydrophobicContact CB-CD2 3.93Å; F866-L900 HydrophobicContact CB-CG 4.37Å; F866-P901 HydrophobicContact CD2-CG 3.96Å; F866-P901 HydrophobicContact CE2-CG 3.99Å; F866-P901 HydrophobicContact CG-CG 4.23Å; F866-P901 HydrophobicContact CZ-CG 4.29Å; F866-F926 HydrophobicContact CB-CB 4.48Å; F866-F926 HydrophobicContact CD2-CB 3.67Å; F866-F926 HydrophobicContact CD2-CG 4.34Å; F866-F926 HydrophobicContact CE2-CB 4.28Å; F866-F926 HydrophobicContact CE2-CD1 4.47Å; F866-F926 HydrophobicContact CG-CB 4.37Å
867	E	90	Very high	88.6	Confident	81 Å²	81	49.2 Å²	49.2	38%	0.379	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	102	178.9	-166.2	-174.6	159.7	0	0	110	G897 A923 K924 G925	E867-G897 WeakPolarHBondContact CA-O 3.15Å; E867-A923 HydrophobicContact CG-CB 4.17Å; E867-A923 WeakPolarHBondContact O-CB 3.42Å; E867-K924 HydrophobicContact CB-CB 4.13Å; E867-K924 HydrophobicContact CG-CB 4.45Å; E867-K924 WeakPolarHBondContact OE2-CB 3.48Å; E867-G925 PolarHBondContact N-O 3.5Å; E867-G925 CarbonylContact O-C 3.46Å; E867-G925 WeakPolarHBondContact O-CA 3.5Å; E867-G925 PolarHBondContact O-N 2.85Å
868	L	91.8	Very high	88.9	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.037	24%	0.241	C	C	.	.			trans	-120	175.9	173.4	-61.1	-179.9	0	0	0	109.7	Y841 F866 E870 D877 V879 G897 F915 F926	Y841-L868 HydrophobicContact CD1-CD2 4.23Å; Y841-L868 HydrophobicContact CE1-CD2 3.46Å; Y841-L868 VanDerWaalsContact CE1-CD2 3.46Å; F866-L868 HydrophobicContact CE1-CD1 4.2Å; F866-L868 HydrophobicContact CE1-CG 4.3Å; F866-L868 HydrophobicContact CE2-CD1 4.23Å; F866-L868 HydrophobicContact CZ-CD1 3.65Å; F866-L868 HydrophobicContact CZ-CG 4.16Å; L868-E870 PolarHBondContact O-N 3.12Å; L868-D877 HydrophobicContact CB-CB 4.39Å; L868-V879 HydrophobicContact CD1-CG2 4.04Å; L868-G897 PolarHBondContact N-O 2.69Å; L868-G897 CarbonylContact O-C 3.49Å; L868-G897 VanDerWaalsContact O-CA 3.22Å; L868-G897 WeakPolarHBondContact O-CA 3.39Å; L868-G897 PolarHBondContact O-N 2.03Å; L868-F915 HydrophobicContact CD1-CD2 4.4Å; L868-F915 HydrophobicContact CD1-CE2 4.12Å; L868-F915 HydrophobicContact CD2-CD2 4.48Å; L868-F915 HydrophobicContact CD2-CE2 3.62Å; L868-F915 HydrophobicContact CD2-CZ 4.01Å; L868-F926 HydrophobicContact CD2-CD1 4.25Å
869	E	92	Very high	89.1	Confident	32 Å²	32	49.5 Å²	49.5	15%	0.15	24%	0.241	C	C	.	.			trans	-52.3	137.8	168.6	-169.8	169.8	-154	0	0	111.4	Y841 Y876 D877 C896 G897 T920 V921	Y841-E869 PolarHBondContact OH-N 2.93Å; E869-Y876 HydrophobicContact CG-CD2 4.37Å; E869-Y876 WeakPolarHBondContact OE2-CB 3.44Å; E869-Y876 WeakPolarHBondContact OE2-CD2 3.42Å; E869-D877 HydrophobicContact CB-CB 4.05Å; E869-C896 WeakPolarHBondContact O-CB 3.43Å; E869-G897 PolarHBondContact O-N 3.39Å; E869-T920 PolarHBondContact OE2-OG1 3.36Å; E869-V921 HydrophobicContact CB-CB 4.48Å; E869-V921 HydrophobicContact CG-CB 4.02Å; E869-V921 WeakPolarHBondContact OE1-CB 3.44Å; E869-V921 WeakPolarHBondContact OE1-CG2 3.42Å
870	E	89	Confident	89.3	Confident	139 Å²	139	50 Å²	50	65%	0.65	24%	0.243	S	C	*	.			trans	-97.7	108.7	-178.8	-168.1	171.1	157.5	0	0	110.7	L868 N898	L868-E870 PolarHBondContact O-N 3.12Å; E870-N898 PolarHBondContact OE2-ND2 2.81Å
871	E	87.5	Confident	89.4	Confident	45 Å²	45	48.8 Å²	48.8	21%	0.21	24%	0.237	C	C	.	.			trans	-130	149.6	178.2	-161.6	-74.6	113.6	0	0	109.5	H873 C874 E875 Y876 C896	E871-H873 VanDerWaalsContact C-N 3.26Å; E871-H873 VanDerWaalsContact CD-N 3.28Å; E871-H873 PolarHBondContact O-N 2.87Å; E871-H873 PolarHBondContact OE1-N 2.87Å; E871-H873 VanDerWaalsContact OE2-C 3.23Å; E871-H873 VanDerWaalsContact OE2-CA 3.27Å; E871-H873 WeakPolarHBondContact OE2-CA 3.49Å; E871-H873 WeakPolarHBondContact OE2-CB 3.32Å; E871-H873 PolarHBondContact OE2-N 2.85Å; E871-C874 PolarHBondContact OE2-N 2.03Å; E871-E875 PolarHBondContact OE2-N 2.69Å; E871-Y876 HydrophobicContact CB-CD2 3.98Å; E871-Y876 HydrophobicContact CB-CE2 4.3Å; E871-Y876 HydrophobicContact CG-CD2 3.68Å; E871-Y876 HydrophobicContact CG-CE2 3.58Å; E871-Y876 HydrophobicContact CG-CG 4.31Å; E871-C896 PolarHBondContact O-SG 2.87Å; E871-C896 VanDerWaalsContact O-SG 3.34Å
872	V	82.9	Confident	89.4	Confident	110 Å²	110	49.7 Å²	49.7	67%	0.667	24%	0.241	S	C	*	.	S	Bend	trans	-66.6	-24.9	-172.2	-170.8	0	0	0	0	112.8
873	H	85.5	Confident	89.5	Confident	131 Å²	131	46.3 Å²	46.3	61%	0.606	23%	0.226	S	C	*	.	S	Bend	trans	-121.6	-1.5	-178.6	-63.8	-16.7	0	0	0	113.6	E871 E875	E871-H873 VanDerWaalsContact C-N 3.26Å; E871-H873 VanDerWaalsContact CD-N 3.28Å; E871-H873 PolarHBondContact O-N 2.87Å; E871-H873 PolarHBondContact OE1-N 2.87Å; E871-H873 VanDerWaalsContact OE2-C 3.23Å; E871-H873 VanDerWaalsContact OE2-CA 3.27Å; E871-H873 WeakPolarHBondContact OE2-CA 3.49Å; E871-H873 WeakPolarHBondContact OE2-CB 3.32Å; E871-H873 PolarHBondContact OE2-N 2.85Å; H873-E875 HydrophobicContact CB-CG 4Å
874	C	88.2	Confident	89.4	Confident	18 Å²	18	47 Å²	47	12%	0.122	23%	0.234	C	C	.	.			trans	53.1	49.7	-172.1	-54.4	0	0	0	0	112	E871 Y878 R894 C896	E871-C874 PolarHBondContact OE2-N 2.03Å; C874-Y878 WeakPolarHBondContact O-CD1 3.04Å; C874-R894 HydrophobicContact CB-CG 3.98Å; C874-R894 VanDerWaalsContact O-CD 3.26Å; C874-R894 WeakPolarHBondContact O-CD 3.44Å; C874-R894 PolarHBondContact O-NH1 3.45Å; C874-C896 WeakPolarHBondContact CA-SG 3.07Å; C874-C896 HydrophobicContact CB-CB 3.59Å; C874-C896 WeakPolarHBondContact CB-SG 2.98Å; C874-C896 WeakPolarHBondContact SG-CB 3.36Å; C874-C896 PolarHBondContact SG-N 2.65Å; C874-C896 VanDerWaalsContact SG-N 3.36Å; C874-C896 CovalentContact SG-SG 2.04Å; C874-C896 PolarHBondContact SG-SG 2.04Å
875	E	87.9	Confident	89.4	Confident	127 Å²	127	50.8 Å²	50.8	59%	0.593	25%	0.248	S	C	*	.			trans	-86.3	-22.7	177.2	-68	-163.6	163.3	0	0	114.3	E871 H873	E871-E875 PolarHBondContact OE2-N 2.69Å; H873-E875 HydrophobicContact CB-CG 4Å
876	Y	90.1	Very high	89.1	Confident	91 Å²	91	52.1 Å²	52.1	36%	0.357	26%	0.261	S	S	.	.	S	Bend	trans	-83.6	-106.6	175.7	-48.5	-33.9	0	0	0	111.2	E869 E871 Y878	E869-Y876 HydrophobicContact CG-CD2 4.37Å; E869-Y876 WeakPolarHBondContact OE2-CB 3.44Å; E869-Y876 WeakPolarHBondContact OE2-CD2 3.42Å; E871-Y876 HydrophobicContact CB-CD2 3.98Å; E871-Y876 HydrophobicContact CB-CE2 4.3Å; E871-Y876 HydrophobicContact CG-CD2 3.68Å; E871-Y876 HydrophobicContact CG-CE2 3.58Å; E871-Y876 HydrophobicContact CG-CG 4.31Å; Y876-Y878 WeakPolarHBondContact O-CD1 3.45Å; Y876-Y878 WeakPolarHBondContact O-CE1 3.06Å
877	D	94	Very high	88.3	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.011	29%	0.294	C	S	.	.	S	Bend	trans	-80.8	130.4	175.2	-67.2	-4.9	0	0	0	112.1	Y841 L868 E869 C896 R916 A917 D918	Y841-D877 WeakPolarHBondContact CE2-OD2 3.43Å; Y841-D877 PolarHBondContact OH-OD2 2.97Å; L868-D877 HydrophobicContact CB-CB 4.39Å; E869-D877 HydrophobicContact CB-CB 4.05Å; D877-C896 WeakPolarHBondContact O-CB 3.48Å; D877-R916 WeakPolarHBondContact CA-O 3.36Å; D877-A917 WeakPolarHBondContact OD1-CA 3.36Å; D877-A917 WeakPolarHBondContact OD1-CB 3.38Å; D877-D918 PolarHBondContact OD1-N 2.85Å
878	Y	95	Very high	87.8	Confident	32 Å²	32	62.7 Å²	62.7	13%	0.125	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	154.5	179.3	57.2	-94.5	0	0	0	115.4	C874 Y876 E880 R894 F895 F915 R916	C874-Y878 WeakPolarHBondContact O-CD1 3.04Å; Y876-Y878 WeakPolarHBondContact O-CD1 3.45Å; Y876-Y878 WeakPolarHBondContact O-CE1 3.06Å; Y878-E880 HydrophobicContact CD2-CG 3.84Å; Y878-E880 HydrophobicContact CE2-CG 4.08Å; Y878-R894 HydrophobicContact CD2-CG 4.08Å; Y878-R894 VanDerWaalsContact CE1-NH1 3.25Å; Y878-R894 HydrophobicContact CG-CG 4.03Å; Y878-F895 VanDerWaalsContact CA-O 3.3Å; Y878-F895 WeakPolarHBondContact CA-O 3.08Å; Y878-F915 WeakPolarHBondContact O-CA 3.41Å; Y878-F915 WeakPolarHBondContact O-CD2 3.4Å; Y878-R916 HydrophobicContact CE1-CB 4.44Å; Y878-R916 HydrophobicContact CE2-CB 4.16Å; Y878-R916 PolarHBondContact N-O 3.01Å; Y878-R916 PolarHBondContact O-N 2.82Å; Y878-R916 WeakPolarHBondContact OH-CD 3.46Å
879	V	94.8	Very high	87.2	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127	163.4	172.9	0	0	0	0	110.2	F863 F866 L868 V881 R894 F895 V913 R914 F915 F926	F863-V879 HydrophobicContact CE1-CG1 4.42Å; F863-V879 HydrophobicContact CZ-CG1 3.96Å; F866-V879 HydrophobicContact CE2-CB 4.16Å; F866-V879 HydrophobicContact CE2-CG2 4.09Å; F866-V879 HydrophobicContact CZ-CB 4.44Å; L868-V879 HydrophobicContact CD1-CG2 4.04Å; V879-V881 HydrophobicContact CG1-CG2 4.36Å; V879-R894 CarbonylContact O-C 3.58Å; V879-R894 WeakPolarHBondContact O-CA 3.25Å; V879-F895 PolarHBondContact N-O 3.46Å; V879-F895 PolarHBondContact O-N 2.78Å; V879-V913 HydrophobicContact CG1-CG1 3.65Å; V879-R914 CarbonylContact C-O 3.55Å; V879-R914 VanDerWaalsContact CA-O 3.3Å; V879-R914 WeakPolarHBondContact CA-O 3.3Å; V879-F915 HydrophobicContact CG2-CB 4.09Å; V879-F915 HydrophobicContact CG2-CD2 3.93Å; V879-F915 HydrophobicContact CG2-CG 4.36Å; V879-F926 HydrophobicContact CG2-CD1 3.63Å; V879-F926 HydrophobicContact CG2-CE1 3.28Å; V879-F926 HydrophobicContact CG2-CG 4.44Å; V879-F926 HydrophobicContact CG2-CZ 3.84Å
880	E	93.7	Very high	87	Confident	9 Å²	9	66.5 Å²	66.5	4%	0.042	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	138.4	168	-73.7	-178.2	133.1	0	0	110.7	Y878 Y882 R891 G893 R894 R914	Y878-E880 HydrophobicContact CD2-CG 3.84Å; Y878-E880 HydrophobicContact CE2-CG 4.08Å; E880-Y882 HydrophobicContact CB-CD2 4.45Å; E880-Y882 HydrophobicContact CB-CE2 3.69Å; E880-Y882 PolarHBondContact OE2-OH 2.96Å; E880-Y882 VanDerWaalsContact OE2-OH 3.12Å; E880-R891 WeakPolarHBondContact OE1-CD 3.05Å; E880-R891 IonicContact OE1-CZ 2.79Å; E880-R891 IonicContact OE1-NE 2.69Å; E880-R891 IonicContact OE1-NH1 2.6Å; E880-R891 PolarHBondContact OE1-NH1 3.29Å; E880-G893 WeakPolarHBondContact CA-O 3.32Å; E880-R894 VanDerWaalsContact CD-NH2 3.26Å; E880-R894 HydrophobicContact CG-CB 3.84Å; E880-R894 HydrophobicContact CG-CG 3.78Å; E880-R894 IonicContact OE1-CZ 3.07Å; E880-R894 VanDerWaalsContact OE1-CZ 3.3Å; E880-R894 IonicContact OE1-NE 2.68Å; E880-R894 PolarHBondContact OE1-NE 3.13Å; E880-R894 IonicContact OE1-NH2 2.74Å; E880-R894 PolarHBondContact OE1-NH2 2.96Å; E880-R894 IonicContact OE2-NH2 3.35Å; E880-R894 PolarHBondContact OE2-NH2 2.85Å; E880-R914 PolarHBondContact N-O 2.89Å; E880-R914 PolarHBondContact O-N 2.64Å
881	V	93.8	Very high	86.9	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133	176.1	-176.3	0	0	0	0	108.8	I861 V879 R891 L892 G893 F895 F904 L911	I861-V881 HydrophobicContact CD1-CG1 4.09Å; I861-V881 HydrophobicContact CD1-CG2 4.23Å; V879-V881 HydrophobicContact CG1-CG2 4.36Å; V881-R891 CarbonylContact O-C 3.5Å; V881-R891 WeakPolarHBondContact O-CA 3.16Å; V881-L892 HydrophobicContact CB-CB 4.38Å; V881-L892 HydrophobicContact CG1-CB 4.34Å; V881-L892 HydrophobicContact CG1-CD1 4.09Å; V881-L892 HydrophobicContact CG1-CG 4.5Å; V881-L892 PolarHBondContact O-N 2.8Å; V881-G893 PolarHBondContact N-O 3.34Å; V881-F895 HydrophobicContact CG2-CE2 4.34Å; V881-F904 HydrophobicContact CG1-CB 4.46Å; V881-F904 HydrophobicContact CG1-CD2 4.41Å; V881-F904 HydrophobicContact CG1-CG 4.35Å; V881-F904 HydrophobicContact CG2-CD2 4.25Å; V881-F904 HydrophobicContact CG2-CE2 4.3Å; V881-L911 HydrophobicContact CG1-CD1 4.48Å; V881-L911 HydrophobicContact CG1-CD2 3.99Å; V881-L911 HydrophobicContact CG1-CG 4.33Å
882	Y	92.8	Very high	87	Confident	20 Å²	20	63.8 Å²	63.8	8%	0.078	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.4	-179.7	-58.2	-95.8	0	0	0	111.4	E880 A889 M890 R891 R912 R914	E880-Y882 HydrophobicContact CB-CD2 4.45Å; E880-Y882 HydrophobicContact CB-CE2 3.69Å; E880-Y882 PolarHBondContact OE2-OH 2.96Å; E880-Y882 VanDerWaalsContact OE2-OH 3.12Å; Y882-A889 HydrophobicContact CD1-CB 4.46Å; Y882-M890 CarbonylContact C-O 3.51Å; Y882-M890 WeakPolarHBondContact CA-O 3.47Å; Y882-R891 HydrophobicContact CD1-CB 3.79Å; Y882-R891 HydrophobicContact CD1-CG 4.22Å; Y882-R891 HydrophobicContact CE1-CB 3.79Å; Y882-R891 HydrophobicContact CE1-CG 4.02Å; Y882-R912 PolarHBondContact N-O 2.89Å; Y882-R912 PolarHBondContact O-N 2.77Å; Y882-R914 HydrophobicContact CE2-CB 4.2Å; Y882-R914 PolarHBondContact OH-NH1 2.86Å
883	D	91.1	Very high	87.2	Confident	20 Å²	20	59.2 Å²	59.2	11%	0.107	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	105.1	172	-171.2	16.1	0	0	0	109.3	A889 M890 L892 S906 S907	D883-A889 WeakPolarHBondContact O-CB 3.32Å; D883-M890 PolarHBondContact N-O 2.88Å; D883-M890 PolarHBondContact O-N 2.71Å; D883-L892 HydrophobicContact CB-CD1 4.27Å; D883-L892 HydrophobicContact CB-CD2 3.96Å; D883-L892 HydrophobicContact CB-CG 4.12Å; D883-S906 VanDerWaalsContact OD1-CA 3.3Å; D883-S906 WeakPolarHBondContact OD1-CA 3.3Å; D883-S906 WeakPolarHBondContact OD1-CB 3.39Å; D883-S907 VanDerWaalsContact CG-N 3.3Å; D883-S907 PolarHBondContact OD1-N 2.91Å; D883-S907 WeakPolarHBondContact OD2-CB 3.24Å; D883-S907 PolarHBondContact OD2-N 2.84Å; D883-S907 PolarHBondContact OD2-OG 3.38Å
884	G	87.1	Confident	87.5	Confident	20 Å²	20	56.4 Å²	56.4	21%	0.206	28%	0.28	C	S	.	.	S	Bend	trans	106.6	160.7	-171.6	0	0	0	0	0	115.9	A889 V910	G884-A889 WeakPolarHBondContact O-CB 3.41Å; G884-V910 WeakPolarHBondContact CA-O 3.5Å; G884-V910 PolarHBondContact N-O 2.91Å
885	E	79.1	Confident	87.8	Confident	131 Å²	131	57.7 Å²	57.7	61%	0.612	28%	0.283	S	S	*	.	S	Bend	trans	-79	-33.3	-175.2	-165.3	177	-154.6	0	0	114	V910 R912	E885-V910 HydrophobicContact CB-CG1 3.99Å; E885-R912 VanDerWaalsContact O-CZ 3.26Å; E885-R912 PolarHBondContact O-NH2 2.94Å; E885-R912 VanDerWaalsContact O-NH2 3.14Å
886	S	77	Confident	88.1	Confident	68 Å²	68	52.4 Å²	52.4	48%	0.476	26%	0.26	S	S	.	.	S	Bend	trans	-63.9	151.4	-171.9	-171	0	0	0	0	113.1	N888 A889 R912	S886-N888 PolarHBondContact O-N 2.98Å; S886-N888 VanDerWaalsContact O-N 3.16Å; S886-N888 PolarHBondContact OG-N 2.92Å; S886-A889 WeakPolarHBondContact O-CB 3.49Å; S886-A889 PolarHBondContact O-N 3.33Å; S886-R912 VanDerWaalsContact C-NH2 3.26Å; S886-R912 PolarHBondContact O-NH2 3.21Å
887	E	72.1	Confident	88.1	Confident	162 Å²	162	48.1 Å²	48.1	76%	0.757	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	-22.8	165.5	-62.5	-162.8	129.5	0	0	113.3
888	N	78.7	Confident	87.7	Confident	153 Å²	153	53 Å²	53	82%	0.818	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	14.7	173.8	-59.5	-57.8	0	0	0	113.4	S886	S886-N888 PolarHBondContact O-N 2.98Å; S886-N888 VanDerWaalsContact O-N 3.16Å; S886-N888 PolarHBondContact OG-N 2.92Å
889	A	79.5	Confident	87.4	Confident	17 Å²	17	59.2 Å²	59.2	14%	0.14	30%	0.298	C	S	.	.	S	Bend	trans	-61.1	153.2	175	0	0	0	0	0	112.1	Y882 D883 G884 S886 R891	Y882-A889 HydrophobicContact CD1-CB 4.46Å; D883-A889 WeakPolarHBondContact O-CB 3.32Å; G884-A889 WeakPolarHBondContact O-CB 3.41Å; S886-A889 WeakPolarHBondContact O-CB 3.49Å; S886-A889 PolarHBondContact O-N 3.33Å; A889-R891 PolarHBondContact O-N 2.85Å; A889-R891 VanDerWaalsContact O-N 3.16Å
890	M	87.1	Confident	86.9	Confident	102 Å²	102	63.7 Å²	63.7	50%	0.502	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	113.1	179.4	177	170.6	166	0	0	109.8	Y882 D883 L892	Y882-M890 CarbonylContact C-O 3.51Å; Y882-M890 WeakPolarHBondContact CA-O 3.47Å; D883-M890 PolarHBondContact N-O 2.88Å; D883-M890 PolarHBondContact O-N 2.71Å; M890-L892 HydrophobicContact CE-CD2 4.28Å; M890-L892 HydrophobicContact CG-CD2 4.38Å; M890-L892 PolarHBondContact O-N 2.83Å
891	R	87.7	Confident	86.6	Confident	105 Å²	105	64 Å²	64	40%	0.396	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	112.3	172.1	-172.2	-177.5	62.4	178.2	0	109.5	E880 V881 Y882 A889 G893	E880-R891 WeakPolarHBondContact OE1-CD 3.05Å; E880-R891 IonicContact OE1-CZ 2.79Å; E880-R891 IonicContact OE1-NE 2.69Å; E880-R891 IonicContact OE1-NH1 2.6Å; E880-R891 PolarHBondContact OE1-NH1 3.29Å; V881-R891 CarbonylContact O-C 3.5Å; V881-R891 WeakPolarHBondContact O-CA 3.16Å; Y882-R891 HydrophobicContact CD1-CB 3.79Å; Y882-R891 HydrophobicContact CD1-CG 4.22Å; Y882-R891 HydrophobicContact CE1-CB 3.79Å; Y882-R891 HydrophobicContact CE1-CG 4.02Å; A889-R891 PolarHBondContact O-N 2.85Å; A889-R891 VanDerWaalsContact O-N 3.16Å; R891-G893 VanDerWaalsContact C-N 3.31Å; R891-G893 WeakPolarHBondContact CG-O 3.44Å
892	L	88.1	Confident	86.2	Confident	21 Å²	21	67.4 Å²	67.4	11%	0.11	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-26.2	176.7	-58.7	-173.7	0	0	0	112.3	V881 D883 M890 F904 Y941	V881-L892 HydrophobicContact CB-CB 4.38Å; V881-L892 HydrophobicContact CG1-CB 4.34Å; V881-L892 HydrophobicContact CG1-CD1 4.09Å; V881-L892 HydrophobicContact CG1-CG 4.5Å; V881-L892 PolarHBondContact O-N 2.8Å; D883-L892 HydrophobicContact CB-CD1 4.27Å; D883-L892 HydrophobicContact CB-CD2 3.96Å; D883-L892 HydrophobicContact CB-CG 4.12Å; M890-L892 HydrophobicContact CE-CD2 4.28Å; M890-L892 HydrophobicContact CG-CD2 4.38Å; M890-L892 PolarHBondContact O-N 2.83Å; L892-F904 HydrophobicContact CB-CD1 4.02Å; L892-F904 HydrophobicContact CB-CE1 4.33Å; L892-F904 HydrophobicContact CD1-CB 3.98Å; L892-F904 HydrophobicContact CD1-CD1 4.03Å; L892-F904 HydrophobicContact CD1-CG 4.3Å; L892-Y941 HydrophobicContact CD1-CD2 4.47Å; L892-Y941 HydrophobicContact CD1-CE2 4.29Å; L892-Y941 HydrophobicContact CD2-CD2 3.71Å; L892-Y941 HydrophobicContact CD2-CE2 4.32Å; L892-Y941 HydrophobicContact CD2-CG 4.09Å
893	G	87.3	Confident	85.9	Confident	15 Å²	15	70.7 Å²	70.7	16%	0.155	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.8	-180	170	0	0	0	0	0	114.2	E880 V881 R891	E880-G893 WeakPolarHBondContact CA-O 3.32Å; V881-G893 PolarHBondContact N-O 3.34Å; R891-G893 VanDerWaalsContact C-N 3.31Å; R891-G893 WeakPolarHBondContact CG-O 3.44Å
894	R	92.8	Very high	85.8	Confident	72 Å²	72	69.9 Å²	69.9	27%	0.272	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.3	169.3	-177.5	-176.7	-74.6	-147	-9.2	108.3	C874 Y878 V879 E880	C874-R894 HydrophobicContact CB-CG 3.98Å; C874-R894 VanDerWaalsContact O-CD 3.26Å; C874-R894 WeakPolarHBondContact O-CD 3.44Å; C874-R894 PolarHBondContact O-NH1 3.45Å; Y878-R894 HydrophobicContact CD2-CG 4.08Å; Y878-R894 VanDerWaalsContact CE1-NH1 3.25Å; Y878-R894 HydrophobicContact CG-CG 4.03Å; V879-R894 CarbonylContact O-C 3.58Å; V879-R894 WeakPolarHBondContact O-CA 3.25Å; E880-R894 VanDerWaalsContact CD-NH2 3.26Å; E880-R894 HydrophobicContact CG-CB 3.84Å; E880-R894 HydrophobicContact CG-CG 3.78Å; E880-R894 IonicContact OE1-CZ 3.07Å; E880-R894 VanDerWaalsContact OE1-CZ 3.3Å; E880-R894 IonicContact OE1-NE 2.68Å; E880-R894 PolarHBondContact OE1-NE 3.13Å; E880-R894 IonicContact OE1-NH2 2.74Å; E880-R894 PolarHBondContact OE1-NH2 2.96Å; E880-R894 IonicContact OE2-NH2 3.35Å; E880-R894 PolarHBondContact OE2-NH2 2.85Å
895	F	94.3	Very high	85.8	Confident	44 Å²	44	70 Å²	70	19%	0.193	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	143.1	-172.4	-49.8	-76.2	0	0	0	111.8	F866 Y878 V879 V881 P901 F904	F866-F895 HydrophobicContact CE1-CB 4.16Å; F866-F895 HydrophobicContact CE2-CB 4.3Å; F866-F895 HydrophobicContact CZ-CB 3.62Å; Y878-F895 VanDerWaalsContact CA-O 3.3Å; Y878-F895 WeakPolarHBondContact CA-O 3.08Å; V879-F895 PolarHBondContact N-O 3.46Å; V879-F895 PolarHBondContact O-N 2.78Å; V881-F895 HydrophobicContact CG2-CE2 4.34Å; F895-P901 HydrophobicContact CB-CG 3.84Å; F895-P901 HydrophobicContact CD1-CB 4.03Å; F895-P901 HydrophobicContact CD1-CG 4.05Å; F895-P901 HydrophobicContact CD2-CB 4.27Å; F895-P901 HydrophobicContact CD2-CG 4.16Å; F895-P901 HydrophobicContact CE1-CB 4.3Å; F895-P901 HydrophobicContact CG-CB 4.04Å; F895-P901 HydrophobicContact CG-CG 3.71Å; F895-F904 HydrophobicContact CE1-CZ 4.21Å; F895-F904 HydrophobicContact CE2-CE1 4.4Å; F895-F904 AromaticContact CE2-CE2 3.93Å; F895-F904 HydrophobicContact CE2-CE2 3.93Å; F895-F904 AromaticContact CE2-CZ 3.54Å; F895-F904 HydrophobicContact CE2-CZ 3.54Å; F895-F904 HydrophobicContact CZ-CE1 4.04Å; F895-F904 HydrophobicContact CZ-CE2 4.15Å; F895-F904 AromaticContact CZ-CZ 3.32Å; F895-F904 HydrophobicContact CZ-CZ 3.32Å
896	C	93.2	Very high	86.3	Confident	16 Å²	16	63.9 Å²	63.9	11%	0.108	33%	0.328	C	S	.	.			trans	-153.8	179.1	177.5	66.7	0	0	0	0	109.8	E869 E871 C874 D877	E869-C896 WeakPolarHBondContact O-CB 3.43Å; E871-C896 PolarHBondContact O-SG 2.87Å; E871-C896 VanDerWaalsContact O-SG 3.34Å; C874-C896 WeakPolarHBondContact CA-SG 3.07Å; C874-C896 HydrophobicContact CB-CB 3.59Å; C874-C896 WeakPolarHBondContact CB-SG 2.98Å; C874-C896 WeakPolarHBondContact SG-CB 3.36Å; C874-C896 PolarHBondContact SG-N 2.65Å; C874-C896 VanDerWaalsContact SG-N 3.36Å; C874-C896 CovalentContact SG-SG 2.04Å; C874-C896 PolarHBondContact SG-SG 2.04Å; D877-C896 WeakPolarHBondContact O-CB 3.48Å
897	G	90.6	Very high	86.8	Confident	2 Å²	2	65 Å²	65	2%	0.021	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	-160.5	-175.3	0	0	0	0	0	114.5	F866 E867 L868 E869	F866-G897 WeakPolarHBondContact CD1-O 3.24Å; F866-G897 WeakPolarHBondContact CE1-O 3.43Å; E867-G897 WeakPolarHBondContact CA-O 3.15Å; L868-G897 PolarHBondContact N-O 2.69Å; L868-G897 CarbonylContact O-C 3.49Å; L868-G897 VanDerWaalsContact O-CA 3.22Å; L868-G897 WeakPolarHBondContact O-CA 3.39Å; L868-G897 PolarHBondContact O-N 2.03Å; E869-G897 PolarHBondContact O-N 3.39Å
898	N	86.9	Confident	87.4	Confident	104 Å²	104	58.6 Å²	58.6	56%	0.556	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	2.2	-176	54.1	54	0	0	0	115	F866 E870 L900	F866-N898 CarbonylContact O-C 3.52Å; F866-N898 WeakPolarHBondContact O-CA 3.33Å; E870-N898 PolarHBondContact OE2-ND2 2.81Å; N898-L900 PolarHBondContact O-N 2.76Å
899	K	87.1	Confident	87.9	Confident	163 Å²	163	53.6 Å²	53.6	71%	0.709	29%	0.29	S	S	*	.			trans	-91.9	107.2	-173.6	-174.2	-172.6	172	-168.5	0	111.3	P901	K899-P901 WeakPolarHBondContact O-CD 3.44Å
900	L	85.1	Confident	88.5	Confident	93 Å²	93	53.9 Å²	53.9	49%	0.487	29%	0.29	S	S	.	.			trans	-43.3	119.4	169.9	-77.2	157.9	0	0	0	112.4	F863 F866 N898	F863-L900 HydrophobicContact CB-CD2 4.11Å; F866-L900 HydrophobicContact CB-CD2 3.93Å; F866-L900 HydrophobicContact CB-CG 4.37Å; N898-L900 PolarHBondContact O-N 2.76Å
901	P	88	Confident	88.7	Confident	17 Å²	17	49 Å²	49	11%	0.11	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-64	161.1	171.9	-22.8	33.9	0	0	0	112.7	F863 F866 F895 K899 F904	F863-P901 HydrophobicContact CD2-CB 3.74Å; F863-P901 HydrophobicContact CD2-CG 3.76Å; F863-P901 HydrophobicContact CE2-CB 4.12Å; F863-P901 HydrophobicContact CE2-CG 4.08Å; F863-P901 HydrophobicContact CG-CB 4.48Å; F863-P901 HydrophobicContact CG-CG 4.11Å; F866-P901 HydrophobicContact CD2-CG 3.96Å; F866-P901 HydrophobicContact CE2-CG 3.99Å; F866-P901 HydrophobicContact CG-CG 4.23Å; F866-P901 HydrophobicContact CZ-CG 4.29Å; F895-P901 HydrophobicContact CB-CG 3.84Å; F895-P901 HydrophobicContact CD1-CB 4.03Å; F895-P901 HydrophobicContact CD1-CG 4.05Å; F895-P901 HydrophobicContact CD2-CB 4.27Å; F895-P901 HydrophobicContact CD2-CG 4.16Å; F895-P901 HydrophobicContact CE1-CB 4.3Å; F895-P901 HydrophobicContact CG-CB 4.04Å; F895-P901 HydrophobicContact CG-CG 3.71Å; K899-P901 WeakPolarHBondContact O-CD 3.44Å; P901-F904 HydrophobicContact CB-CE2 3.95Å; P901-F904 HydrophobicContact CB-CZ 4.26Å
902	S	85.4	Confident	89	Confident	71 Å²	71	44.6 Å²	44.6	50%	0.497	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-65.9	163.9	169	51.4	0	0	0	0	112	F904	S902-F904 VanDerWaalsContact O-CD2 3.28Å; S902-F904 WeakPolarHBondContact O-CD2 3.41Å; S902-F904 WeakPolarHBondContact O-CE2 3.48Å; S902-F904 WeakPolarHBondContact O-CZ 3.38Å; S902-F904 WeakPolarHBondContact OG-CZ 3.41Å
903	M	86.1	Confident	89.3	Confident	88 Å²	88	43.6 Å²	43.6	43%	0.433	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-61	147.7	165.4	66.5	-168.8	-62.7	0	0	111.8	E860 I861 I905	E860-M903 HydrophobicContact CG-CE 4.35Å; E860-M903 WeakPolarHBondContact OE1-CE 3.46Å; I861-M903 WeakPolarHBondContact O-CA 3.31Å; M903-I905 HydrophobicContact CE-CD1 4.31Å
904	F	88.6	Confident	89.6	Confident	3 Å²	3	44.8 Å²	44.8	1%	0.013	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	138.9	173.9	-55.9	-76.7	0	0	0	111	E860 I861 F863 V881 L892 F895 P901 S902 L911 Y941	E860-F904 CarbonylContact C-O 3.22Å; E860-F904 WeakPolarHBondContact CA-O 3.41Å; I861-F904 HydrophobicContact CD1-CB 4.33Å; I861-F904 HydrophobicContact CD1-CD2 4.04Å; I861-F904 HydrophobicContact CG1-CB 3.81Å; I861-F904 HydrophobicContact CG1-CD2 4.11Å; I861-F904 HydrophobicContact CG1-CG 4.48Å; I861-F904 PolarHBondContact N-O 2.93Å; I861-F904 PolarHBondContact O-N 2.97Å; F863-F904 HydrophobicContact CE2-CD2 4.4Å; F863-F904 HydrophobicContact CE2-CE2 4.15Å; V881-F904 HydrophobicContact CG1-CB 4.46Å; V881-F904 HydrophobicContact CG1-CD2 4.41Å; V881-F904 HydrophobicContact CG1-CG 4.35Å; V881-F904 HydrophobicContact CG2-CD2 4.25Å; V881-F904 HydrophobicContact CG2-CE2 4.3Å; L892-F904 HydrophobicContact CB-CD1 4.02Å; L892-F904 HydrophobicContact CB-CE1 4.33Å; L892-F904 HydrophobicContact CD1-CB 3.98Å; L892-F904 HydrophobicContact CD1-CD1 4.03Å; L892-F904 HydrophobicContact CD1-CG 4.3Å; F895-F904 HydrophobicContact CE1-CZ 4.21Å; F895-F904 HydrophobicContact CE2-CE1 4.4Å; F895-F904 AromaticContact CE2-CE2 3.93Å; F895-F904 HydrophobicContact CE2-CE2 3.93Å; F895-F904 AromaticContact CE2-CZ 3.54Å; F895-F904 HydrophobicContact CE2-CZ 3.54Å; F895-F904 HydrophobicContact CZ-CE1 4.04Å; F895-F904 HydrophobicContact CZ-CE2 4.15Å; F895-F904 AromaticContact CZ-CZ 3.32Å; F895-F904 HydrophobicContact CZ-CZ 3.32Å; P901-F904 HydrophobicContact CB-CE2 3.95Å; P901-F904 HydrophobicContact CB-CZ 4.26Å; S902-F904 VanDerWaalsContact O-CD2 3.28Å; S902-F904 WeakPolarHBondContact O-CD2 3.41Å; S902-F904 WeakPolarHBondContact O-CE2 3.48Å; S902-F904 WeakPolarHBondContact O-CZ 3.38Å; S902-F904 WeakPolarHBondContact OG-CZ 3.41Å; F904-L911 HydrophobicContact CB-CD1 4.49Å; F904-Y941 WeakPolarHBondContact CA-OH 3.42Å; F904-Y941 HydrophobicContact CD1-CD1 4.41Å; F904-Y941 AromaticContact CD1-CE1 3.85Å; F904-Y941 HydrophobicContact CD1-CE1 3.85Å; F904-Y941 HydrophobicContact CE1-CE1 4.37Å
905	I	88.1	Confident	89.8	Confident	23 Å²	23	41.4 Å²	41.4	12%	0.118	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.4	174.2	-62.7	166.8	0	0	0	107.4	V859 E860 M903 T933 V936 Y941	V859-I905 WeakPolarHBondContact O-CA 3.18Å; E860-I905 HydrophobicContact CB-CG1 4.16Å; E860-I905 HydrophobicContact CG-CD1 4.42Å; E860-I905 HydrophobicContact CG-CG1 3.75Å; M903-I905 HydrophobicContact CE-CD1 4.31Å; I905-T933 HydrophobicContact CG2-CG2 3.85Å; I905-V936 HydrophobicContact CD1-CG2 4.49Å; I905-Y941 PolarHBondContact N-OH 3.21Å
906	S	89.3	Confident	89.8	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.021	24%	0.243	C	C	.	.			trans	-73.7	144.4	175.7	57.1	0	0	0	0	112.7	S858 V859 D883 G908	S858-S906 VanDerWaalsContact CB-O 3.29Å; S858-S906 WeakPolarHBondContact CB-O 3.28Å; S858-S906 PolarHBondContact OG-O 3.34Å; V859-S906 PolarHBondContact N-OG 3.06Å; V859-S906 PolarHBondContact O-N 3.22Å; V859-S906 PolarHBondContact O-OG 2.72Å; D883-S906 VanDerWaalsContact OD1-CA 3.3Å; D883-S906 WeakPolarHBondContact OD1-CA 3.3Å; D883-S906 WeakPolarHBondContact OD1-CB 3.39Å; S906-G908 VanDerWaalsContact C-N 3.34Å; S906-G908 VanDerWaalsContact CB-O 3.23Å; S906-G908 WeakPolarHBondContact CB-O 3.41Å; S906-G908 PolarHBondContact OG-O 3.13Å
907	S	85.9	Confident	89.8	Confident	91 Å²	91	44.6 Å²	44.6	64%	0.636	24%	0.242	S	C	*	.	S	Bend	trans	-78.6	-20.8	169.3	67.2	0	0	0	0	112.6	D883 Q935	D883-S907 VanDerWaalsContact CG-N 3.3Å; D883-S907 PolarHBondContact OD1-N 2.91Å; D883-S907 WeakPolarHBondContact OD2-CB 3.24Å; D883-S907 PolarHBondContact OD2-N 2.84Å; D883-S907 PolarHBondContact OD2-OG 3.38Å; S907-Q935 PolarHBondContact O-NE2 2.94Å
908	G	86	Confident	89.9	Confident	28 Å²	28	46.4 Å²	46.4	29%	0.289	25%	0.252	S	S	.	.	S	Bend	trans	-113.5	-173.9	171.6	0	0	0	0	0	113.6	S906 V910	S906-G908 VanDerWaalsContact C-N 3.34Å; S906-G908 VanDerWaalsContact CB-O 3.23Å; S906-G908 WeakPolarHBondContact CB-O 3.41Å; S906-G908 PolarHBondContact OG-O 3.13Å; G908-V910 PolarHBondContact O-N 3.22Å
909	S	89.5	Confident	90.1	Very high	47 Å²	47	43.1 Å²	43.1	33%	0.329	23%	0.234	S	C	.	.	S	Bend	trans	-80.9	10.7	176.5	54.1	0	0	0	0	114.5	A853 M857	A853-S909 PolarHBondContact N-O 3.1Å; M857-S909 WeakPolarHBondContact O-CA 3.36Å
910	V	91.2	Very high	90.1	Very high	23 Å²	23	36.2 Å²	36.2	14%	0.139	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.4	178.9	-172.6	0	0	0	0	110.9	T850 L851 L852 G884 E885 G908	T850-V910 HydrophobicContact CG2-CG1 3.65Å; L851-V910 WeakPolarHBondContact O-CA 3.25Å; L852-V910 HydrophobicContact CD2-CB 4.34Å; L852-V910 HydrophobicContact CD2-CG1 3.98Å; L852-V910 HydrophobicContact CD2-CG2 3.69Å; G884-V910 WeakPolarHBondContact CA-O 3.5Å; G884-V910 PolarHBondContact N-O 2.91Å; E885-V910 HydrophobicContact CB-CG1 3.99Å; G908-V910 PolarHBondContact O-N 3.22Å
911	L	92.3	Very high	90	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	133.8	170.1	-169.8	145.8	0	0	0	108.9	L851 V859 I861 V881 F904 V913	L851-L911 WeakPolarHBondContact CA-O 3.41Å; L851-L911 HydrophobicContact CB-CB 4.48Å; L851-L911 WeakPolarHBondContact CB-O 3.15Å; L851-L911 HydrophobicContact CD1-CD2 4.02Å; L851-L911 PolarHBondContact N-O 2.86Å; L851-L911 PolarHBondContact O-N 2.89Å; V859-L911 HydrophobicContact CB-CB 3.97Å; V859-L911 HydrophobicContact CG1-CB 4.36Å; V859-L911 HydrophobicContact CG2-CB 4.42Å; I861-L911 HydrophobicContact CD1-CD2 3.8Å; I861-L911 HydrophobicContact CG1-CD1 4.31Å; I861-L911 HydrophobicContact CG1-CD2 4.23Å; I861-L911 HydrophobicContact CG2-CD2 4.05Å; V881-L911 HydrophobicContact CG1-CD1 4.48Å; V881-L911 HydrophobicContact CG1-CD2 3.99Å; V881-L911 HydrophobicContact CG1-CG 4.33Å; F904-L911 HydrophobicContact CB-CD1 4.49Å; L911-V913 HydrophobicContact CD2-CG2 3.67Å
912	R	93.4	Very high	90	Very high	13 Å²	13	36.5 Å²	36.5	5%	0.049	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.9	-178.2	-175.9	168.8	62.7	156.5	-13.2	111.8	E848 W849 Y882 E885 S886	E848-R912 HydrophobicContact CG-CG 3.98Å; E848-R912 WeakPolarHBondContact OE1-CD 3.46Å; E848-R912 IonicContact OE1-CZ 3.42Å; E848-R912 IonicContact OE1-NE 3.24Å; E848-R912 IonicContact OE1-NH1 2.72Å; E848-R912 PolarHBondContact OE1-NH1 3.23Å; E848-R912 IonicContact OE2-NH1 3.19Å; W849-R912 CarbonylContact O-C 3.57Å; W849-R912 WeakPolarHBondContact O-CA 3.39Å; Y882-R912 PolarHBondContact N-O 2.89Å; Y882-R912 PolarHBondContact O-N 2.77Å; E885-R912 VanDerWaalsContact O-CZ 3.26Å; E885-R912 PolarHBondContact O-NH2 2.94Å; E885-R912 VanDerWaalsContact O-NH2 3.14Å; S886-R912 VanDerWaalsContact C-NH2 3.26Å; S886-R912 PolarHBondContact O-NH2 3.21Å
913	V	94.1	Very high	90	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128	177.4	-173.4	0	0	0	0	108.9	E848 W849 I861 V879 L911 Y928	E848-V913 WeakPolarHBondContact CA-O 3.39Å; W849-V913 HydrophobicContact CE3-CB 4.4Å; W849-V913 HydrophobicContact CE3-CG1 4.37Å; W849-V913 PolarHBondContact N-O 2.91Å; W849-V913 PolarHBondContact O-N 2.84Å; I861-V913 HydrophobicContact CD1-CG2 3.88Å; V879-V913 HydrophobicContact CG1-CG1 3.65Å; L911-V913 HydrophobicContact CD2-CG2 3.67Å; V913-Y928 HydrophobicContact CB-CE1 4.21Å; V913-Y928 HydrophobicContact CG1-CE1 3.84Å; V913-Y928 HydrophobicContact CG2-CE1 4.25Å; V913-Y928 HydrophobicContact CG2-CE2 4.4Å
914	R	94.5	Very high	89.8	Confident	40 Å²	40	29.9 Å²	29.9	15%	0.151	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	120.3	179.5	173.6	-177.8	-72.4	163.8	-5.7	109.3	C847 E848 V879 E880 Y882 R916	C847-R914 CarbonylContact O-C 3.55Å; C847-R914 WeakPolarHBondContact O-CA 3.27Å; E848-R914 IonicContact OE1-NH2 3.64Å; E848-R914 IonicContact OE2-CZ 2.63Å; E848-R914 IonicContact OE2-NE 3.58Å; E848-R914 PolarHBondContact OE2-NE 3.39Å; E848-R914 IonicContact OE2-NH2 2.8Å; E848-R914 PolarHBondContact OE2-NH2 3.4Å; V879-R914 CarbonylContact C-O 3.55Å; V879-R914 VanDerWaalsContact CA-O 3.3Å; V879-R914 WeakPolarHBondContact CA-O 3.3Å; E880-R914 PolarHBondContact N-O 2.89Å; E880-R914 PolarHBondContact O-N 2.64Å; Y882-R914 HydrophobicContact CE2-CB 4.2Å; Y882-R914 PolarHBondContact OH-NH1 2.86Å; R914-R916 HydrophobicContact CG-CG 4.47Å
915	F	95.6	Very high	89.8	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	135.1	169	172	-135.2	0	0	0	109.5	Y841 V845 A846 C847 W849 L868 Y878 V879 A917 F926	Y841-F915 HydrophobicContact CD1-CZ 4.3Å; Y841-F915 HydrophobicContact CD2-CE1 4.39Å; Y841-F915 AromaticContact CD2-CZ 3.79Å; Y841-F915 HydrophobicContact CD2-CZ 3.79Å; Y841-F915 HydrophobicContact CE1-CZ 4.47Å; Y841-F915 AromaticContact CE2-CZ 3.98Å; Y841-F915 HydrophobicContact CE2-CZ 3.98Å; Y841-F915 HydrophobicContact CG-CE1 4.35Å; Y841-F915 AromaticContact CG-CZ 3.96Å; Y841-F915 HydrophobicContact CG-CZ 3.96Å; V845-F915 HydrophobicContact CB-CE1 4.45Å; V845-F915 HydrophobicContact CG1-CD1 4Å; V845-F915 HydrophobicContact CG1-CE1 3.9Å; A846-F915 CarbonylContact C-O 3.43Å; A846-F915 WeakPolarHBondContact CA-O 3.35Å; C847-F915 HydrophobicContact CB-CB 4.27Å; C847-F915 PolarHBondContact N-O 2.89Å; C847-F915 PolarHBondContact O-N 2.77Å; W849-F915 HydrophobicContact CH2-CB 4.25Å; W849-F915 HydrophobicContact CZ3-CB 3.77Å; L868-F915 HydrophobicContact CD1-CD2 4.4Å; L868-F915 HydrophobicContact CD1-CE2 4.12Å; L868-F915 HydrophobicContact CD2-CD2 4.48Å; L868-F915 HydrophobicContact CD2-CE2 3.62Å; L868-F915 HydrophobicContact CD2-CZ 4.01Å; Y878-F915 WeakPolarHBondContact O-CA 3.41Å; Y878-F915 WeakPolarHBondContact O-CD2 3.4Å; V879-F915 HydrophobicContact CG2-CB 4.09Å; V879-F915 HydrophobicContact CG2-CD2 3.93Å; V879-F915 HydrophobicContact CG2-CG 4.36Å; F915-A917 HydrophobicContact CE2-CB 4.33Å; F915-A917 HydrophobicContact CZ-CB 3.94Å; F915-F926 HydrophobicContact CB-CE1 3.86Å; F915-F926 HydrophobicContact CB-CZ 3.8Å; F915-F926 AromaticContact CD1-CE1 3.93Å; F915-F926 HydrophobicContact CD1-CE1 3.93Å; F915-F926 HydrophobicContact CD1-CZ 4.21Å; F915-F926 AromaticContact CD2-CE1 3.73Å; F915-F926 HydrophobicContact CD2-CE1 3.73Å; F915-F926 HydrophobicContact CE1-CE1 4.4Å; F915-F926 HydrophobicContact CE2-CE1 4.24Å; F915-F926 AromaticContact CG-CE1 3.57Å; F915-F926 HydrophobicContact CG-CE1 3.57Å; F915-F926 AromaticContact CG-CZ 3.95Å; F915-F926 HydrophobicContact CG-CZ 3.95Å
916	R	95	Very high	89.9	Confident	117 Å²	117	28.6 Å²	28.6	44%	0.442	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135	167.4	-74.9	178.7	169.4	-115.9	-2.8	109.1	V845 A846 D877 Y878 R914	V845-R916 CarbonylContact O-C 3.55Å; V845-R916 WeakPolarHBondContact O-CA 3.31Å; A846-R916 HydrophobicContact CB-CG 4.34Å; D877-R916 WeakPolarHBondContact CA-O 3.36Å; Y878-R916 HydrophobicContact CE1-CB 4.44Å; Y878-R916 HydrophobicContact CE2-CB 4.16Å; Y878-R916 PolarHBondContact N-O 3.01Å; Y878-R916 PolarHBondContact O-N 2.82Å; Y878-R916 WeakPolarHBondContact OH-CD 3.46Å; R914-R916 HydrophobicContact CG-CG 4.47Å
917	A	93.4	Very high	89.9	Confident	11 Å²	11	28.9 Å²	28.9	9%	0.091	17%	0.168	C	C	.	.			trans	-113.7	148	163.3	0	0	0	0	0	109.9	Y841 R844 V845 D877 F915	Y841-A917 HydrophobicContact CD2-CB 4.07Å; Y841-A917 HydrophobicContact CE2-CB 3.88Å; R844-A917 WeakPolarHBondContact CA-O 3.4Å; V845-A917 HydrophobicContact CB-CB 4.42Å; V845-A917 PolarHBondContact O-N 3.47Å; D877-A917 WeakPolarHBondContact OD1-CA 3.36Å; D877-A917 WeakPolarHBondContact OD1-CB 3.38Å; F915-A917 HydrophobicContact CE2-CB 4.33Å; F915-A917 HydrophobicContact CZ-CB 3.94Å
918	D	92.5	Very high	90.1	Very high	40 Å²	40	24.6 Å²	24.6	21%	0.214	14%	0.138	C	C	.	.			trans	-91.1	-163.5	172.8	80.2	-3.3	0	0	0	111.4	N843 R844 D877 T920	N843-D918 CarbonylContact C-O 3.49Å; R844-D918 PolarHBondContact N-O 3.39Å; D877-D918 PolarHBondContact OD1-N 2.85Å; D918-T920 PolarHBondContact O-N 2.63Å; D918-T920 WeakPolarHBondContact OD1-CA 3.06Å; D918-T920 WeakPolarHBondContact OD1-CB 3.47Å; D918-T920 WeakPolarHBondContact OD1-CG2 3.36Å; D918-T920 PolarHBondContact OD1-N 2.91Å; D918-T920 PolarHBondContact OD1-OG1 2.86Å; D918-T920 WeakPolarHBondContact OD2-CG2 3.44Å; D918-T920 PolarHBondContact OD2-OG1 3.11Å
919	D	90.4	Very high	90.3	Very high	34 Å²	34	25.4 Å²	25.4	18%	0.182	13%	0.134	C	C	.	.	S	Bend	trans	-73.7	-1.8	176	-5.7	65.7	0	0	0	113.3	K114 N115 N843 R844	K114-D919 PolarHBondContact NZ-O 2.9Å; N115-D919 HydrophobicContact CB-CB 4.29Å; N115-D919 VanDerWaalsContact CG-OD1 3.27Å; N115-D919 VanDerWaalsContact CG-OD2 3.27Å; N115-D919 PolarHBondContact ND2-OD1 3.2Å; N115-D919 PolarHBondContact ND2-OD2 2.97Å; N115-D919 PolarHBondContact OD1-OD2 2.93Å; N843-D919 PolarHBondContact OD1-O 3.31Å; R844-D919 HydrophobicContact CG-CB 4.2Å; R844-D919 IonicContact CZ-OD2 2.78Å; R844-D919 IonicContact NE-OD2 3.94Å; R844-D919 PolarHBondContact NE-OD2 2.98Å; R844-D919 IonicContact NH2-OD2 3.17Å; R844-D919 PolarHBondContact NH2-OD2 2.76Å
920	T	87.4	Confident	90.4	Very high	19 Å²	19	24.5 Å²	24.5	12%	0.117	12%	0.124	C	C	.	.	S	Bend	trans	-113.2	-146.5	-157.4	93.7	0	0	0	0	112.7	K114 N843 E869 D918 T922	K114-T920 HydrophobicContact CB-CG2 3.63Å; K114-T920 VanDerWaalsContact NZ-C 3.29Å; K114-T920 PolarHBondContact NZ-O 3.01Å; N843-T920 PolarHBondContact OD1-O 2.87Å; E869-T920 PolarHBondContact OE2-OG1 3.36Å; D918-T920 PolarHBondContact O-N 2.63Å; D918-T920 WeakPolarHBondContact OD1-CA 3.06Å; D918-T920 WeakPolarHBondContact OD1-CB 3.47Å; D918-T920 WeakPolarHBondContact OD1-CG2 3.36Å; D918-T920 PolarHBondContact OD1-N 2.91Å; D918-T920 PolarHBondContact OD1-OG1 2.86Å; D918-T920 WeakPolarHBondContact OD2-CG2 3.44Å; D918-T920 PolarHBondContact OD2-OG1 3.11Å; T920-T922 PolarHBondContact O-N 3.2Å
921	V	83.9	Confident	90.4	Very high	76 Å²	76	25.6 Å²	25.6	46%	0.461	13%	0.127	S	C	.	.			trans	-68.7	107.6	-147.4	-176.7	0	0	0	0	114	Y841 E869	Y841-V921 PolarHBondContact OH-O 3.36Å; E869-V921 HydrophobicContact CB-CB 4.48Å; E869-V921 HydrophobicContact CG-CB 4.02Å; E869-V921 WeakPolarHBondContact OE1-CB 3.44Å; E869-V921 WeakPolarHBondContact OE1-CG2 3.42Å
922	T	87.1	Confident	90.3	Very high	40 Å²	40	26.2 Å²	26.2	25%	0.245	13%	0.13	C	C	.	.			trans	-85.4	135.7	-179.7	67.5	0	0	0	0	113	N840 Y841 N843 T920	N840-T922 PolarHBondContact ND2-O 2.87Å; Y841-T922 HydrophobicContact CD2-CG2 3.91Å; Y841-T922 HydrophobicContact CE2-CG2 3.81Å; Y841-T922 WeakPolarHBondContact O-CB 3.13Å; Y841-T922 VanDerWaalsContact O-CG2 3.23Å; Y841-T922 WeakPolarHBondContact O-CG2 3.46Å; Y841-T922 PolarHBondContact O-OG1 3.41Å; N843-T922 WeakPolarHBondContact OD1-CG2 3.19Å; T920-T922 PolarHBondContact O-N 3.2Å
923	A	86.2	Confident	90	Very high	14 Å²	14	26.8 Å²	26.8	12%	0.116	14%	0.135	C	C	.	.			trans	-119.9	-169.9	178.5	0	0	0	0	0	111.8	N840 Y841 E867 G925	N840-A923 WeakPolarHBondContact CA-O 3.47Å; N840-A923 WeakPolarHBondContact CB-O 3.47Å; N840-A923 VanDerWaalsContact CG-O 3.24Å; N840-A923 WeakPolarHBondContact ND2-CA 3.43Å; Y841-A923 WeakPolarHBondContact CD1-O 3.04Å; Y841-A923 HydrophobicContact CE1-CB 4Å; Y841-A923 VanDerWaalsContact CE1-N 3.28Å; Y841-A923 WeakPolarHBondContact CE1-O 3.01Å; Y841-A923 VanDerWaalsContact CZ-N 3.29Å; Y841-A923 PolarHBondContact N-O 3.35Å; Y841-A923 PolarHBondContact OH-N 2.87Å; E867-A923 HydrophobicContact CG-CB 4.17Å; E867-A923 WeakPolarHBondContact O-CB 3.42Å; A923-G925 PolarHBondContact O-N 2.69Å
924	K	81.5	Confident	89.4	Confident	5 Å²	5	31.2 Å²	31.2	2%	0.022	16%	0.159	C	C	.	.			trans	-61	-28.9	-177.6	-162.1	146.6	-170.1	161.5	0	113.2	E569 Y577 D622 S624 Y836 E867	E569-K924 VanDerWaalsContact CD-NZ 3.32Å; E569-K924 WeakPolarHBondContact OE1-CE 3.2Å; E569-K924 IonicContact OE1-NZ 3.22Å; E569-K924 PolarHBondContact OE1-NZ 2.74Å; E569-K924 WeakPolarHBondContact OE2-CE 3.34Å; E569-K924 IonicContact OE2-NZ 2.71Å; E569-K924 PolarHBondContact OE2-NZ 3.03Å; Y577-K924 HydrophobicContact CD1-CD 4.41Å; Y577-K924 HydrophobicContact CE1-CD 3.88Å; Y577-K924 HydrophobicContact CE1-CG 4.31Å; Y577-K924 HydrophobicContact CE2-CD 4.34Å; Y577-K924 HydrophobicContact CE2-CG 4.27Å; D622-K924 IonicContact OD1-NZ 2.67Å; D622-K924 IonicContact OD2-NZ 3.88Å; D622-K924 PolarHBondContact OD2-NZ 3.32Å; S624-K924 PolarHBondContact OG-NZ 3.16Å; Y836-K924 WeakPolarHBondContact CD2-O 3.31Å; Y836-K924 WeakPolarHBondContact CE2-O 3.37Å; E867-K924 HydrophobicContact CB-CB 4.13Å; E867-K924 HydrophobicContact CG-CB 4.45Å; E867-K924 WeakPolarHBondContact OE2-CB 3.48Å
925	G	88.2	Confident	88	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89	-157.4	-177.8	0	0	0	0	0	112.6	E867 A923	E867-G925 PolarHBondContact N-O 3.5Å; E867-G925 CarbonylContact O-C 3.46Å; E867-G925 WeakPolarHBondContact O-CA 3.5Å; E867-G925 PolarHBondContact O-N 2.85Å; A923-G925 PolarHBondContact O-N 2.69Å
926	F	91.1	Very high	86.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	161.4	-179.2	60.9	-94	0	0	0	113.1	S832 W849 F863 N865 F866 L868 V879 F915 Y928	S832-F926 PolarHBondContact N-O 2.04Å; S832-F926 PolarHBondContact OG-N 2.9Å; S832-F926 PolarHBondContact OG-O 3.46Å; W849-F926 HydrophobicContact CH2-CE2 4.25Å; W849-F926 AromaticContact CH2-CZ 3.85Å; W849-F926 HydrophobicContact CH2-CZ 3.85Å; W849-F926 HydrophobicContact CZ3-CE2 4.26Å; W849-F926 AromaticContact CZ3-CZ 3.81Å; W849-F926 HydrophobicContact CZ3-CZ 3.81Å; F863-F926 HydrophobicContact CD1-CB 4.18Å; F863-F926 HydrophobicContact CD1-CD2 4.38Å; F863-F926 HydrophobicContact CD1-CG 4.46Å; F863-F926 HydrophobicContact CE1-CB 4.39Å; F863-F926 AromaticContact CE1-CD2 3.98Å; F863-F926 HydrophobicContact CE1-CD2 3.98Å; F863-F926 HydrophobicContact CE1-CG 4.2Å; N865-F926 VanDerWaalsContact O-CA 3.24Å; N865-F926 WeakPolarHBondContact O-CA 3.44Å; N865-F926 WeakPolarHBondContact O-CB 3.43Å; F866-F926 HydrophobicContact CB-CB 4.48Å; F866-F926 HydrophobicContact CD2-CB 3.67Å; F866-F926 HydrophobicContact CD2-CG 4.34Å; F866-F926 HydrophobicContact CE2-CB 4.28Å; F866-F926 HydrophobicContact CE2-CD1 4.47Å; F866-F926 HydrophobicContact CG-CB 4.37Å; L868-F926 HydrophobicContact CD2-CD1 4.25Å; V879-F926 HydrophobicContact CG2-CD1 3.63Å; V879-F926 HydrophobicContact CG2-CE1 3.28Å; V879-F926 HydrophobicContact CG2-CG 4.44Å; V879-F926 HydrophobicContact CG2-CZ 3.84Å; F915-F926 HydrophobicContact CB-CE1 3.86Å; F915-F926 HydrophobicContact CB-CZ 3.8Å; F915-F926 AromaticContact CD1-CE1 3.93Å; F915-F926 HydrophobicContact CD1-CE1 3.93Å; F915-F926 HydrophobicContact CD1-CZ 4.21Å; F915-F926 AromaticContact CD2-CE1 3.73Å; F915-F926 HydrophobicContact CD2-CE1 3.73Å; F915-F926 HydrophobicContact CE1-CE1 4.4Å; F915-F926 HydrophobicContact CE2-CE1 4.24Å; F915-F926 AromaticContact CG-CE1 3.57Å; F915-F926 HydrophobicContact CG-CE1 3.57Å; F915-F926 AromaticContact CG-CZ 3.95Å; F915-F926 HydrophobicContact CG-CZ 3.95Å; F926-Y928 AromaticContact CD2-CD1 3.94Å; F926-Y928 HydrophobicContact CD2-CD1 3.94Å; F926-Y928 AromaticContact CE2-CD1 3.84Å; F926-Y928 HydrophobicContact CE2-CD1 3.84Å; F926-Y928 AromaticContact CE2-CE1 3.95Å; F926-Y928 HydrophobicContact CE2-CE1 3.95Å
927	V	88.5	Confident	84.3	Confident	9 Å²	9	41.5 Å²	41.5	6%	0.055	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.5	162.2	-173.3	0	0	0	0	107.7	Y829 V830 Y831 Y836 T864 N865	Y829-V927 HydrophobicContact CD1-CG1 4.34Å; V830-V927 WeakPolarHBondContact O-CA 3.38Å; Y831-V927 HydrophobicContact CD1-CB 4.43Å; Y831-V927 HydrophobicContact CD1-CG1 4.09Å; Y831-V927 HydrophobicContact CD1-CG2 3.52Å; Y831-V927 HydrophobicContact CE1-CG1 3.97Å; Y831-V927 HydrophobicContact CE1-CG2 3.78Å; Y831-V927 HydrophobicContact CG-CG2 4.42Å; Y836-V927 HydrophobicContact CD1-CG2 3.8Å; Y836-V927 HydrophobicContact CD2-CG2 4.42Å; Y836-V927 HydrophobicContact CE1-CG2 3.34Å; Y836-V927 HydrophobicContact CE2-CG2 4.02Å; Y836-V927 HydrophobicContact CG-CG2 4.33Å; Y836-V927 VanDerWaalsContact CZ-CG2 3.49Å; T864-V927 PolarHBondContact N-O 2.85Å; T864-V927 PolarHBondContact OG1-O 3Å; N865-V927 HydrophobicContact CB-CG2 4.43Å; N865-V927 PolarHBondContact N-O 2.94Å; N865-V927 PolarHBondContact O-N 2.9Å
928	Y	90.1	Very high	82.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.6	166.3	68.1	-98.8	0	0	0	112	V830 W849 L851 I861 Q862 F863 V913 F926 Y930	V830-Y928 HydrophobicContact CB-CD1 4.14Å; V830-Y928 HydrophobicContact CB-CD2 4.17Å; V830-Y928 HydrophobicContact CB-CE1 3.69Å; V830-Y928 HydrophobicContact CB-CE2 3.72Å; V830-Y928 HydrophobicContact CB-CG 4.37Å; V830-Y928 VanDerWaalsContact CB-CZ 3.47Å; V830-Y928 HydrophobicContact CG1-CD1 4.43Å; V830-Y928 HydrophobicContact CG1-CE1 3.68Å; V830-Y928 HydrophobicContact CG1-CE2 4.46Å; V830-Y928 HydrophobicContact CG2-CD2 4.39Å; V830-Y928 HydrophobicContact CG2-CE1 4.35Å; V830-Y928 HydrophobicContact CG2-CE2 3.63Å; V830-Y928 PolarHBondContact N-O 2.77Å; V830-Y928 PolarHBondContact O-N 3.46Å; W849-Y928 WeakPolarHBondContact CB-OH 3.29Å; L851-Y928 HydrophobicContact CD1-CE2 4.05Å; I861-Y928 HydrophobicContact CB-CD2 4.34Å; I861-Y928 HydrophobicContact CG2-CD2 4.25Å; I861-Y928 HydrophobicContact CG2-CE2 4.33Å; Q862-Y928 CarbonylContact O-C 3.55Å; Q862-Y928 VanDerWaalsContact O-CA 3.3Å; Q862-Y928 WeakPolarHBondContact O-CA 3.22Å; Q862-Y928 WeakPolarHBondContact O-CB 3.36Å; F863-Y928 HydrophobicContact CD1-CD1 4.48Å; F863-Y928 AromaticContact CE1-CD1 3.89Å; F863-Y928 HydrophobicContact CE1-CD1 3.89Å; F863-Y928 HydrophobicContact CE1-CG 4.33Å; F863-Y928 HydrophobicContact CZ-CD1 4.32Å; V913-Y928 HydrophobicContact CB-CE1 4.21Å; V913-Y928 HydrophobicContact CG1-CE1 3.84Å; V913-Y928 HydrophobicContact CG2-CE1 4.25Å; V913-Y928 HydrophobicContact CG2-CE2 4.4Å; F926-Y928 AromaticContact CD2-CD1 3.94Å; F926-Y928 HydrophobicContact CD2-CD1 3.94Å; F926-Y928 AromaticContact CE2-CD1 3.84Å; F926-Y928 HydrophobicContact CE2-CD1 3.84Å; F926-Y928 AromaticContact CE2-CE1 3.95Å; F926-Y928 HydrophobicContact CE2-CE1 3.95Å; Y928-Y930 HydrophobicContact CE2-CD1 4.27Å
929	E	90.7	Very high	80.2	Confident	45 Å²	45	45.4 Å²	45.4	21%	0.21	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	143	167.2	-73.5	-177.5	163.2	0	0	108.8	V827 G828 Y829 I861 Q862 T864	V827-E929 HydrophobicContact CG1-CB 3.64Å; V827-E929 HydrophobicContact CG1-CG 3.67Å; G828-E929 CarbonylContact O-C 3.5Å; G828-E929 WeakPolarHBondContact O-CA 3.39Å; Y829-E929 HydrophobicContact CD1-CG 3.89Å; Y829-E929 HydrophobicContact CE1-CG 3.39Å; Y829-E929 WeakPolarHBondContact CE1-OE1 3.03Å; Y829-E929 VanDerWaalsContact CZ-OE1 3.25Å; Y829-E929 PolarHBondContact OH-OE1 2.93Å; I861-E929 VanDerWaalsContact CA-O 3.29Å; I861-E929 WeakPolarHBondContact CA-O 3.23Å; Q862-E929 PolarHBondContact N-O 2.92Å; Q862-E929 PolarHBondContact O-N 3.42Å; T864-E929 HydrophobicContact CG2-CG 3.85Å
930	Y	91.8	Very high	77.9	Confident	28 Å²	28	49.8 Å²	49.8	11%	0.11	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	143.5	173.7	70.6	-86.2	0	0	0	111.9	L821 A823 G828 V830 L851 E860 Y928	L821-Y930 HydrophobicContact CB-CE2 4.38Å; L821-Y930 HydrophobicContact CD1-CE1 4.11Å; A823-Y930 HydrophobicContact CB-CD2 4.31Å; G828-Y930 VanDerWaalsContact C-CD1 3.42Å; G828-Y930 PolarHBondContact N-O 2.66Å; G828-Y930 WeakPolarHBondContact O-CD1 3.32Å; G828-Y930 PolarHBondContact O-N 2.93Å; V830-Y930 HydrophobicContact CG2-CD1 3.83Å; V830-Y930 HydrophobicContact CG2-CE1 3.62Å; L851-Y930 HydrophobicContact CD1-CG 4.24Å; L851-Y930 HydrophobicContact CD2-CD2 4.38Å; L851-Y930 HydrophobicContact CD2-CG 4.44Å; E860-Y930 VanDerWaalsContact O-CA 3.28Å; E860-Y930 WeakPolarHBondContact O-CA 3.34Å; Y928-Y930 HydrophobicContact CE2-CD1 4.27Å
931	F	90.2	Very high	75.9	Confident	47 Å²	47	51.5 Å²	51.5	21%	0.206	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	165.5	176.5	54	-89.7	0	0	0	112.7	V827 E860	V827-F931 HydrophobicContact CG2-CD1 4.13Å; E860-F931 HydrophobicContact CB-CD2 4.06Å; E860-F931 HydrophobicContact CB-CE1 4.42Å; E860-F931 HydrophobicContact CB-CE2 3.7Å; E860-F931 HydrophobicContact CB-CZ 3.9Å; E860-F931 VanDerWaalsContact CD-CE2 3.42Å; E860-F931 HydrophobicContact CG-CE1 4.23Å; E860-F931 HydrophobicContact CG-CE2 3.81Å; E860-F931 HydrophobicContact CG-CZ 3.58Å; E860-F931 PolarHBondContact N-O 3.42Å; E860-F931 PolarHBondContact O-N 3.03Å; E860-F931 WeakPolarHBondContact OE1-CZ 3.45Å; E860-F931 WeakPolarHBondContact OE2-CE2 3.41Å
932	L	90.7	Very high	73.5	Confident	12 Å²	12	53.3 Å²	53.3	6%	0.063	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	117.3	178.1	-173	99	0	0	0	110.4	A823 E824 R825 A853 E854 M857	A823-L932 HydrophobicContact CB-CB 4.26Å; A823-L932 HydrophobicContact CB-CD1 4.44Å; E824-L932 VanDerWaalsContact C-CB 3.48Å; E824-L932 VanDerWaalsContact O-CB 3.28Å; E824-L932 WeakPolarHBondContact O-CB 3.14Å; E824-L932 PolarHBondContact O-N 2.98Å; R825-L932 HydrophobicContact CG-CB 4.36Å; R825-L932 HydrophobicContact CG-CD2 3.69Å; A853-L932 HydrophobicContact CB-CD1 3.67Å; E854-L932 HydrophobicContact CG-CD1 4.18Å; M857-L932 HydrophobicContact CB-CD1 3.75Å; M857-L932 HydrophobicContact CB-CG 4.09Å; M857-L932 HydrophobicContact CE-CD2 3.52Å; M857-L932 HydrophobicContact CE-CG 3.67Å; M857-L932 HydrophobicContact CG-CD1 4.24Å; M857-L932 HydrophobicContact CG-CD2 4.23Å; M857-L932 HydrophobicContact CG-CG 4.32Å
933	T	85.9	Confident	71	Confident	25 Å²	25	59.1 Å²	59.1	15%	0.153	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	151.4	-178.2	-151.9	0	0	0	0	111	M857 S858 E860 I905	M857-T933 VanDerWaalsContact CE-C 3.47Å; M857-T933 WeakPolarHBondContact CE-O 3.45Å; S858-T933 PolarHBondContact N-O 2.88Å; S858-T933 PolarHBondContact O-N 3.31Å; E860-T933 HydrophobicContact CB-CG2 3.85Å; E860-T933 VanDerWaalsContact OE2-CB 3.24Å; E860-T933 WeakPolarHBondContact OE2-CB 3.48Å; E860-T933 PolarHBondContact OE2-OG1 3.21Å; I905-T933 HydrophobicContact CG2-CG2 3.85Å
934	D	81.9	Confident	68.6	Low	94 Å²	94	66.6 Å²	66.6	50%	0.503	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	142.7	177.8	-52.9	-37	0	0	0	109.3	R825 M857 V936	R825-D934 IonicContact CZ-OD1 2.73Å; R825-D934 IonicContact NH1-OD1 3.5Å; R825-D934 PolarHBondContact NH1-OD1 2.95Å; R825-D934 IonicContact NH2-OD1 3.23Å; R825-D934 PolarHBondContact NH2-OD1 2.88Å; M857-D934 VanDerWaalsContact CE-OD1 3.27Å; M857-D934 WeakPolarHBondContact CE-OD1 3.38Å; D934-V936 PolarHBondContact O-N 2.99Å
935	Q	65.8	Low	66.3	Low	95 Å²	95	70.8 Å²	70.8	44%	0.444	39%	0.385	S	S	.	.			trans	-61.4	126.1	-173.1	-67.4	-130.2	-78.9	0	0	113.2	G856 S858 S907	G856-Q935 WeakPolarHBondContact O-CG 3.47Å; S858-Q935 PolarHBondContact OG-NE2 3.04Å; S907-Q935 PolarHBondContact O-NE2 2.94Å
936	V	60.8	Low	63.7	Low	78 Å²	78	73.4 Å²	73.4	47%	0.473	41%	0.412	S	S	.	.			trans	-100.1	101.6	177.9	-172.1	0	0	0	0	110.6	I905 D934 G938 V939	I905-V936 HydrophobicContact CD1-CG2 4.49Å; D934-V936 PolarHBondContact O-N 2.99Å; V936-G938 PolarHBondContact O-N 2.9Å; V936-V939 HydrophobicContact CB-CG2 3.91Å; V936-V939 HydrophobicContact CG1-CG2 3.59Å
937	E	52.7	Low	60.8	Low	200 Å²	200	78.2 Å²	78.2	94%	0.935	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	122.9	171.4	-72.5	-166.5	140.5	0	0	111.2
938	G	49.6	Very low	58	Low	67 Å²	67	83 Å²	83	69%	0.691	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.7	12.7	164.8	0	0	0	0	0	117.6	V936 T940	V936-G938 PolarHBondContact O-N 2.9Å; G938-T940 VanDerWaalsContact C-N 3.29Å; G938-T940 PolarHBondContact O-N 2.83Å
939	V	50.1	Low	55.2	Low	66 Å²	66	88.7 Å²	88.7	40%	0.4	51%	0.508	S	S	.	.			trans	-72.7	80.8	173.1	-169.8	0	0	0	0	110.9	V936 Y941	V936-V939 HydrophobicContact CB-CG2 3.91Å; V936-V939 HydrophobicContact CG1-CG2 3.59Å; V939-Y941 HydrophobicContact CB-CE2 4.37Å; V939-Y941 HydrophobicContact CG1-CD2 4.12Å; V939-Y941 HydrophobicContact CG1-CE1 4.38Å; V939-Y941 HydrophobicContact CG1-CE2 3.55Å; V939-Y941 PolarHBondContact O-N 2.98Å; V939-Y941 VanDerWaalsContact O-N 3.12Å
940	T	40.6	Very low	52.3	Low	125 Å²	125	96 Å²	96	77%	0.767	53%	0.533	S	S	*	.			trans	-76.7	96.4	174.1	54.9	0	0	0	0	110.6	G938 T942	G938-T940 VanDerWaalsContact C-N 3.29Å; G938-T940 PolarHBondContact O-N 2.83Å; T940-T942 PolarHBondContact O-N 3.27Å
941	Y	45.4	Very low	49.5	Very low	56 Å²	56	99.5 Å²	99.5	22%	0.22	56%	0.559	C	S	.	*			trans	-63.8	100.4	164.2	-68.1	-79.7	0	0	0	109.5	L892 F904 I905 V939	L892-Y941 HydrophobicContact CD1-CD2 4.47Å; L892-Y941 HydrophobicContact CD1-CE2 4.29Å; L892-Y941 HydrophobicContact CD2-CD2 3.71Å; L892-Y941 HydrophobicContact CD2-CE2 4.32Å; L892-Y941 HydrophobicContact CD2-CG 4.09Å; F904-Y941 WeakPolarHBondContact CA-OH 3.42Å; F904-Y941 HydrophobicContact CD1-CD1 4.41Å; F904-Y941 AromaticContact CD1-CE1 3.85Å; F904-Y941 HydrophobicContact CD1-CE1 3.85Å; F904-Y941 HydrophobicContact CE1-CE1 4.37Å; I905-Y941 PolarHBondContact N-OH 3.21Å; V939-Y941 HydrophobicContact CB-CE2 4.37Å; V939-Y941 HydrophobicContact CG1-CD2 4.12Å; V939-Y941 HydrophobicContact CG1-CE1 4.38Å; V939-Y941 HydrophobicContact CG1-CE2 3.55Å; V939-Y941 PolarHBondContact O-N 2.98Å; V939-Y941 VanDerWaalsContact O-N 3.12Å
942	T	35.4	Very low	46.9	Very low	113 Å²	113	102.8 Å²	102.8	69%	0.693	59%	0.585	S	S	*	*			trans	-68.2	132.4	163.2	47.9	0	0	0	0	108.4	T940 Q944	T940-T942 PolarHBondContact O-N 3.27Å; T942-Q944 PolarHBondContact O-N 2.81Å
943	E	34	Very low	44.1	Very low	163 Å²	163	109.6 Å²	109.6	76%	0.762	62%	0.621	S	S	*	*			trans	-55.6	108.1	162.1	-78.1	-170.2	126.4	0	0	107.7	P945	E943-P945 WeakPolarHBondContact O-CD 3.44Å
944	Q	35	Very low	41.5	Very low	171 Å²	171	116.5 Å²	116.5	80%	0.799	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-71.2	120	155.2	-70.4	-165	3.5	0	0	106	T942 G946	T942-Q944 PolarHBondContact O-N 2.81Å; Q944-G946 PolarHBondContact O-N 3.23Å
945	P	34.1	Very low	39.2	Very low	93 Å²	93	116.7 Å²	116.7	60%	0.604	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-60.5	117.3	169.5	-18.3	32.1	0	0	0	107.6	E943 T948	E943-P945 WeakPolarHBondContact O-CD 3.44Å; P945-T948 HydrophobicContact CB-CG2 4.14Å
946	G	32.6	Very low	37.6	Very low	55 Å²	55	118.8 Å²	118.8	57%	0.567	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.4	132.5	167.8	0	0	0	0	0	108.4	Q944 T948	Q944-G946 PolarHBondContact O-N 3.23Å; G946-T948 WeakPolarHBondContact O-CG2 3.1Å; G946-T948 PolarHBondContact O-N 2.8Å
947	P	30.9	Very low	36.4	Very low	100 Å²	100	122.1 Å²	122.1	65%	0.649	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	97	-139.9	16.7	-32.1	0	0	0	113.1	T949	P947-T949 PolarHBondContact O-N 2.91Å; P947-T949 PolarHBondContact O-OG1 3.16Å
948	T	28.8	Very low	35.3	Very low	111 Å²	111	119 Å²	119	68%	0.681	68%	0.68	S	S	*	*			trans	-77.2	57.1	172.2	62.9	0	0	0	0	109.8	P945 G946 R950	P945-T948 HydrophobicContact CB-CG2 4.14Å; G946-T948 WeakPolarHBondContact O-CG2 3.1Å; G946-T948 PolarHBondContact O-N 2.8Å; T948-R950 PolarHBondContact O-N 2.88Å
949	T	31.9	Very low	34.5	Very low	119 Å²	119	123.1 Å²	123.1	73%	0.73	68%	0.681	S	S	*	*			trans	-68.7	61.1	160.4	47.6	0	0	0	0	109	P947 P951	P947-T949 PolarHBondContact O-N 2.91Å; P947-T949 PolarHBondContact O-OG1 3.16Å; T949-P951 WeakPolarHBondContact O-CD 3.1Å; T949-P951 VanDerWaalsContact O-N 3.07Å
950	R	29.7	Very low	33.6	Very low	199 Å²	199	131 Å²	131	75%	0.751	70%	0.704	S	S	*	*			trans	-50.2	115.2	155	179.7	-171.6	-61.8	-149.9	0.5	105	T948	T948-R950 PolarHBondContact O-N 2.88Å
951	P	33	Very low	33.5	Very low	100 Å²	100	129.5 Å²	129.5	65%	0.649	70%	0.704	S	S	*	*			trans	-54.9	141.9	176.8	-24.3	34.6	0	0	0	108.2	T949 L953	T949-P951 WeakPolarHBondContact O-CD 3.1Å; T949-P951 VanDerWaalsContact O-N 3.07Å; P951-L953 PolarHBondContact O-N 3.48Å; P951-L953 VanDerWaalsContact O-N 3.11Å
952	P	35.3	Very low	33.2	Very low	117 Å²	117	134.4 Å²	134.4	76%	0.76	73%	0.734	S	S	*	*			trans	-48.7	126.9	168.8	-25.9	34.8	0	0	0	108.4	E954	P952-E954 PolarHBondContact O-N 2.83Å
953	L	32.9	Very low	33.2	Very low	155 Å²	155	136.8 Å²	136.8	81%	0.812	74%	0.743	S	S	*	*			trans	-68.5	83.2	172.5	-87.3	160.3	0	0	0	107.2	P951	P951-L953 PolarHBondContact O-N 3.48Å; P951-L953 VanDerWaalsContact O-N 3.11Å
954	E	32.1	Very low	33.3	Very low	169 Å²	169	139.7 Å²	139.7	79%	0.79	75%	0.747	S	S	*	*			trans	-56.7	125	176.8	-82.6	-159.6	133.4	0	0	108.5	P952 V956	P952-E954 PolarHBondContact O-N 2.83Å; E954-V956 PolarHBondContact O-N 2.89Å
955	P	31.9	Very low	33.3	Very low	99 Å²	99	141.1 Å²	141.1	64%	0.643	75%	0.751	S	S	*	*			trans	-65.1	126.7	177.4	27.1	-32.7	0	0	0	108	I957	P955-I957 HydrophobicContact CB-CG1 4.36Å; P955-I957 HydrophobicContact CG-CD1 4.31Å; P955-I957 HydrophobicContact CG-CG1 4.28Å; P955-I957 PolarHBondContact O-N 3.44Å
956	V	33.1	Very low	33.4	Very low	138 Å²	138	140.8 Å²	140.8	84%	0.836	76%	0.756	S	S	*	*			trans	-70	80	174.9	-177.1	0	0	0	0	109.1	E954 N958	E954-V956 PolarHBondContact O-N 2.89Å; V956-N958 PolarHBondContact O-N 2.75Å; V956-N958 VanDerWaalsContact O-N 3.14Å
957	I	35.3	Very low	33.5	Very low	149 Å²	149	143.5 Å²	143.5	76%	0.764	77%	0.766	S	S	*	*			trans	-71.7	105.1	174.5	-64.2	175.8	0	0	0	107.4	P955	P955-I957 HydrophobicContact CB-CG1 4.36Å; P955-I957 HydrophobicContact CG-CD1 4.31Å; P955-I957 HydrophobicContact CG-CG1 4.28Å; P955-I957 PolarHBondContact O-N 3.44Å
958	N	29.2	Very low	33.7	Very low	135 Å²	135	149.2 Å²	149.2	72%	0.722	78%	0.775	S	S	*	*			trans	-73.6	163.5	171.2	-116.4	-53.5	0	0	0	110.9	V956	V956-N958 PolarHBondContact O-N 2.75Å; V956-N958 VanDerWaalsContact O-N 3.14Å
959	E	32.9	Very low	34.1	Very low	152 Å²	152	151.7 Å²	151.7	71%	0.71	78%	0.782	S	S	*	*			trans	80	94.9	168.4	-48.2	-144.2	111.7	0	0	119.3
960	R	32.7	Very low	34.3	Very low	232 Å²	232	150.2 Å²	150.2	88%	0.875	78%	0.782	S	S	*	*				45.5	98.1	119.1	-62.9	166.5	161.5	175.6	-8.9	118.7
961	A	38.2	Very low	34.6	Very low	93 Å²	93	145.2 Å²	145.2	77%	0.769	78%	0.783	S	S	*	*			trans	-155.3	128.5	141.8	0	0	0	0	0	114.3
962	N	39.4	Very low	34.8	Very low	160 Å²	160	151.7 Å²	151.7	86%	0.856	79%	0.794	S	S	*	*			trans	44.8	108.2	147.7	-61.2	-21.7	0	0	0	121.8
963	N	34.8	Very low	35	Very low	162 Å²	162	150.9 Å²	150.9	87%	0.866	79%	0.791	S	S	*	*			trans	-47.5	143.2	143.3	-63.8	-45.6	0	0	0	112.1
964	R	35.7	Very low	35.3	Very low	225 Å²	225	154.3 Å²	154.3	85%	0.849	80%	0.795	S	S	*	*				-179.5	156.6	119.8	-102.2	171.6	-177.5	-167.3	0.8	114.7
965	F	35.3	Very low	36	Very low	201 Å²	201	151.9 Å²	151.9	88%	0.882	79%	0.791	S	S	*	*			trans	71.9	141.3	174.3	-73.1	-75.3	0	0	0	117.9
966	A	35.3	Very low	36.3	Very low	86 Å²	86	158.8 Å²	158.8	71%	0.711	82%	0.815	S	S	*	*			trans	-154.1	158.1	-165.9	0	0	0	0	0	110.8
967	S	35.3	Very low	36.5	Very low	112 Å²	112	159.9 Å²	159.9	78%	0.783	81%	0.814	S	S	*	*			trans	65.7	153.5	178.9	81.2	0	0	0	0	114.1
968	R	34.9	Very low	36.6	Very low	220 Å²	220	160.4 Å²	160.4	83%	0.83	82%	0.816	S	S	*	*			cis	-169.9	173.3	42.6	-146	176.7	-170.4	-173.4	2.7	111.7
969	I	37.7	Very low	37	Very low	163 Å²	163	161.8 Å²	161.8	84%	0.836	82%	0.821	S	S	*	*			trans	83.5	145.8	161.5	-62.3	158.6	0	0	0	115.8
970	A	35.7	Very low	37.2	Very low	88 Å²	88	162.4 Å²	162.4	73%	0.727	83%	0.828	S	S	*	*			trans	-134.5	171	-169.3	0	0	0	0	0	111.8
971	A	36.7	Very low	37.5	Very low	93 Å²	93	158.1 Å²	158.1	77%	0.769	83%	0.825	S	S	*	*			trans	61.3	118.3	160.1	0	0	0	0	0	119.4
972	R	37.1	Very low	37.4	Very low	237 Å²	237	162.4 Å²	162.4	89%	0.894	83%	0.829	S	S	*	*				-169.9	110.7	114.6	-104.4	171.1	178.9	-170.5	-1.8	114.1
973	S	39.2	Very low	37.3	Very low	99 Å²	99	162.6 Å²	162.6	69%	0.692	83%	0.827	S	S	*	*			trans	26.9	135.9	131.9	-5.7	0	0	0	0	123.5
974	Y	38.3	Very low	37.5	Very low	228 Å²	228	162.6 Å²	162.6	89%	0.894	82%	0.824	S	S	*	*			trans	89.7	139.8	132	-96	-67.3	0	0	0	122.6
975	V	48.3	Very low	37.7	Very low	117 Å²	117	157.4 Å²	157.4	71%	0.709	82%	0.822	S	S	*	*			trans	76.3	95.5	167.3	-162.6	0	0	0	0	116.8
976	H	38.1	Very low	37.9	Very low	245 Å²	245	153.5 Å²	153.5	100%	1.134	82%	0.816	S	S	*	*				-141.4	0	90.7	-136.7	-49.5	0	0	0	112.7

Retrieved 976 of 976 residues in 398.9 ms (Link to these results)

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