A0A096MTF6_PAPAN Loading...

TAF5-like RNA polymerase II p300/CBP-associated factor-associated factor 65 kDa subunit 5L

Functions as a component of the PCAF complex. The PCAF complex is capable of efficiently acetylating histones in a nucleosomal context. The PCAF complex could be considered as the human version of the yeast SAGA complex. With TAF6L, acts as an epigenetic regulator essential for somatic reprogramming. Regulates target genes through H3K9ac deposition and MYC recruitment which trigger MYC regulatory network to orchestrate gene expression programs to control embryonic stem cell state.

AlphaFold DB (F6YMW6), UniProt , Accession A0A096MTF6, Species PAPAN (Papio anubis, Olive baboon), Gene TAF5L, Length 589 aa.

Structure Viewer

Loading PAE data...

(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	52.4	Low	72.4	Confident	212 Å²	212	138.5 Å²	138.5	100%	1.044	64%	0.642	S	S	*	*				0	-52.4	0	-84.9	-163.8	-95.9	0	0	114.5	R3 V4 R5	M1-R3 PolarHBondContact O-N 3.38Å; M1-V4 PolarHBondContact O-N 3.36Å; M1-R5 PolarHBondContact O-N 3.35Å
2	K	51.8	Low	73.9	Confident	181 Å²	181	132.1 Å²	132.1	79%	0.787	63%	0.63	S	S	*	*	H	α-helix	trans	-59.5	-44	-178	-73.8	-175.9	178.1	179	0	114.9	R5 T6	K2-R5 PolarHBondContact O-N 3.06Å; K2-T6 PolarHBondContact O-N 3.44Å; K2-T6 VanDerWaalsContact O-N 3.1Å; K2-T6 PolarHBondContact O-OG1 3.05Å
3	R	57.7	Low	74.9	Confident	206 Å²	206	127.8 Å²	127.8	78%	0.777	62%	0.617	S	S	*	*	H	α-helix	trans	-61.8	-44.2	176.8	-83.3	-173.7	178.4	175.3	-0.9	113.6	M1 R5 T6 E7	M1-R3 PolarHBondContact O-N 3.38Å; R3-R5 VanDerWaalsContact C-N 3.27Å; R3-R5 PolarHBondContact O-N 3.48Å; R3-T6 WeakPolarHBondContact CA-OG1 3.42Å; R3-T6 PolarHBondContact O-N 3.46Å; R3-T6 PolarHBondContact O-OG1 3.33Å; R3-E7 WeakPolarHBondContact O-CG 3.47Å; R3-E7 PolarHBondContact O-N 3.34Å
4	V	59.5	Low	75.6	Confident	79 Å²	79	121.3 Å²	121.3	48%	0.479	59%	0.592	S	S	.	*	H	α-helix	trans	-61	-38.4	177.4	-178.9	0	0	0	0	111.1	M1 Q8	M1-V4 PolarHBondContact O-N 3.36Å; V4-Q8 VanDerWaalsContact O-CG 3.25Å; V4-Q8 WeakPolarHBondContact O-CG 3.38Å; V4-Q8 PolarHBondContact O-N 3.49Å; V4-Q8 VanDerWaalsContact O-N 3.07Å
5	R	73.8	Confident	76.3	Confident	179 Å²	179	117.1 Å²	117.1	68%	0.675	58%	0.579	S	S	*	*	H	α-helix	trans	-70.2	-37.6	177.6	-161.7	175.7	-176.9	172.2	0.3	112.4	M1 K2 R3 Q8 I9	M1-R5 PolarHBondContact O-N 3.35Å; K2-R5 PolarHBondContact O-N 3.06Å; R3-R5 VanDerWaalsContact C-N 3.27Å; R3-R5 PolarHBondContact O-N 3.48Å; R5-Q8 PolarHBondContact O-N 3.05Å; R5-I9 HydrophobicContact CG-CD1 4.4Å; R5-I9 WeakPolarHBondContact O-CD1 3.45Å; R5-I9 VanDerWaalsContact O-CG1 3.24Å; R5-I9 WeakPolarHBondContact O-CG1 3.31Å; R5-I9 PolarHBondContact O-N 2.91Å
6	T	79.9	Confident	77	Confident	73 Å²	73	117.3 Å²	117.3	45%	0.448	57%	0.572	S	S	.	*	H	α-helix	trans	-67.4	-39.6	175.5	41.5	0	0	0	0	112.4	K2 R3 I9 Q10	K2-T6 PolarHBondContact O-N 3.44Å; K2-T6 VanDerWaalsContact O-N 3.1Å; K2-T6 PolarHBondContact O-OG1 3.05Å; R3-T6 WeakPolarHBondContact CA-OG1 3.42Å; R3-T6 PolarHBondContact O-N 3.46Å; R3-T6 PolarHBondContact O-OG1 3.33Å; T6-I9 PolarHBondContact O-N 3Å; T6-Q10 WeakPolarHBondContact O-CG 3.41Å; T6-Q10 PolarHBondContact O-N 3.38Å
7	E	79.7	Confident	77.6	Confident	115 Å²	115	114.4 Å²	114.4	54%	0.537	56%	0.559	S	S	.	*	H	α-helix	trans	-64.7	-41.2	175.6	-71.8	163.9	-164.7	0	0	111.4	R3 I9 Q10 M11	R3-E7 WeakPolarHBondContact O-CG 3.47Å; R3-E7 PolarHBondContact O-N 3.34Å; E7-I9 PolarHBondContact O-N 2.97Å; E7-Q10 PolarHBondContact O-N 3.25Å; E7-M11 WeakPolarHBondContact O-CB 3.43Å; E7-M11 PolarHBondContact O-N 3.31Å
8	Q	85.4	Confident	78.1	Confident	125 Å²	125	115.5 Å²	115.5	58%	0.584	56%	0.561	S	S	*	*	H	α-helix	trans	-61.8	-40.8	173.5	-74.8	172.8	-7.9	0	0	112.6	V4 R5 M11 A12	V4-Q8 VanDerWaalsContact O-CG 3.25Å; V4-Q8 WeakPolarHBondContact O-CG 3.38Å; V4-Q8 PolarHBondContact O-N 3.49Å; V4-Q8 VanDerWaalsContact O-N 3.07Å; R5-Q8 PolarHBondContact O-N 3.05Å; Q8-M11 PolarHBondContact O-N 3.24Å; Q8-A12 WeakPolarHBondContact O-CB 3.47Å; Q8-A12 PolarHBondContact O-N 3.18Å
9	I	85	Confident	78.6	Confident	96 Å²	96	120.8 Å²	120.8	49%	0.492	57%	0.574	S	S	.	*	H	α-helix	trans	-65	-46.2	175.9	-69	163.3	0	0	0	110.3	R5 T6 E7 M11 A12 V13	R5-I9 HydrophobicContact CG-CD1 4.4Å; R5-I9 WeakPolarHBondContact O-CD1 3.45Å; R5-I9 VanDerWaalsContact O-CG1 3.24Å; R5-I9 WeakPolarHBondContact O-CG1 3.31Å; R5-I9 PolarHBondContact O-N 2.91Å; T6-I9 PolarHBondContact O-N 3Å; E7-I9 PolarHBondContact O-N 2.97Å; I9-M11 VanDerWaalsContact C-N 3.28Å; I9-M11 PolarHBondContact O-N 3.16Å; I9-A12 PolarHBondContact O-N 3.33Å; I9-A12 VanDerWaalsContact O-N 3.14Å; I9-V13 HydrophobicContact CG2-CG2 4.32Å; I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.3Å; I9-V13 PolarHBondContact O-N 3.43Å
10	Q	84.9	Confident	78.9	Confident	136 Å²	136	122.8 Å²	122.8	64%	0.636	58%	0.576	S	S	*	*	H	α-helix	trans	-59.2	-40.7	176.8	-74.9	176.9	-15.6	0	0	111.8	T6 E7 V13 S14	T6-Q10 WeakPolarHBondContact O-CG 3.41Å; T6-Q10 PolarHBondContact O-N 3.38Å; E7-Q10 PolarHBondContact O-N 3.25Å; Q10-V13 PolarHBondContact O-N 3.41Å; Q10-S14 PolarHBondContact O-N 3.09Å; Q10-S14 PolarHBondContact O-OG 3.29Å
11	M	86.8	Confident	78.9	Confident	122 Å²	122	125.1 Å²	125.1	60%	0.601	59%	0.587	S	S	*	*	H	α-helix	trans	-63.4	-44.6	174.1	-168.6	65.8	67.9	0	0	111.9	E7 Q8 I9 V13 S14 C15	E7-M11 WeakPolarHBondContact O-CB 3.43Å; E7-M11 PolarHBondContact O-N 3.31Å; Q8-M11 PolarHBondContact O-N 3.24Å; I9-M11 VanDerWaalsContact C-N 3.28Å; I9-M11 PolarHBondContact O-N 3.16Å; M11-V13 VanDerWaalsContact C-N 3.33Å; M11-V13 PolarHBondContact O-N 3.48Å; M11-S14 PolarHBondContact O-N 2.74Å; M11-S14 PolarHBondContact O-OG 2.84Å; M11-C15 WeakPolarHBondContact O-CB 3.36Å; M11-C15 PolarHBondContact O-N 2.78Å; M11-C15 PolarHBondContact O-SG 3.04Å
12	A	89.6	Confident	79.7	Confident	61 Å²	61	122.5 Å²	122.5	50%	0.504	57%	0.566	S	S	.	*	H	α-helix	trans	-63	-40.6	177.6	0	0	0	0	0	111.9	Q8 I9 C15 Y16	Q8-A12 WeakPolarHBondContact O-CB 3.47Å; Q8-A12 PolarHBondContact O-N 3.18Å; I9-A12 PolarHBondContact O-N 3.33Å; I9-A12 VanDerWaalsContact O-N 3.14Å; A12-C15 PolarHBondContact O-N 3.15Å; A12-Y16 WeakPolarHBondContact O-CB 3.43Å; A12-Y16 PolarHBondContact O-N 3.17Å
13	V	87.6	Confident	80.2	Confident	76 Å²	76	120.1 Å²	120.1	46%	0.461	57%	0.567	S	S	.	*	H	α-helix	trans	-64.1	-46.7	175.9	171.9	0	0	0	0	110.8	I9 Q10 M11 C15 Y16 L17	I9-V13 HydrophobicContact CG2-CG2 4.32Å; I9-V13 VanDerWaalsContact O-CG2 3.31Å; I9-V13 WeakPolarHBondContact O-CG2 3.3Å; I9-V13 PolarHBondContact O-N 3.43Å; Q10-V13 PolarHBondContact O-N 3.41Å; M11-V13 VanDerWaalsContact C-N 3.33Å; M11-V13 PolarHBondContact O-N 3.48Å; V13-C15 PolarHBondContact O-N 2.89Å; V13-Y16 WeakPolarHBondContact O-CB 3.29Å; V13-Y16 PolarHBondContact O-N 3.32Å; V13-Y16 VanDerWaalsContact O-N 3.14Å; V13-L17 HydrophobicContact CG1-CD1 3.95Å; V13-L17 HydrophobicContact CG1-CG 4.32Å; V13-L17 WeakPolarHBondContact O-CG 3.39Å; V13-L17 PolarHBondContact O-N 3.09Å
14	S	84.3	Confident	79.9	Confident	37 Å²	37	115.6 Å²	115.6	26%	0.259	56%	0.558	S	S	.	*	H	α-helix	trans	-63.9	-41.2	178.7	71.6	0	0	0	0	111.6	Q10 M11 Y16 L17 K18	Q10-S14 PolarHBondContact O-N 3.09Å; Q10-S14 PolarHBondContact O-OG 3.29Å; M11-S14 PolarHBondContact O-N 2.74Å; M11-S14 PolarHBondContact O-OG 2.84Å; S14-Y16 VanDerWaalsContact C-N 3.33Å; S14-Y16 PolarHBondContact O-N 3.24Å; S14-L17 PolarHBondContact O-N 2.9Å; S14-K18 WeakPolarHBondContact O-CB 3.49Å; S14-K18 VanDerWaalsContact O-CG 3.28Å; S14-K18 WeakPolarHBondContact O-CG 3.18Å; S14-K18 PolarHBondContact O-N 3.41Å
15	C	86.3	Confident	79.2	Confident	59 Å²	59	117.2 Å²	117.2	40%	0.399	57%	0.572	S	S	.	*	H	α-helix	trans	-60.1	-41.4	172	-72.3	0	0	0	0	112.2	M11 A12 V13 R19	M11-C15 WeakPolarHBondContact O-CB 3.36Å; M11-C15 PolarHBondContact O-N 2.78Å; M11-C15 PolarHBondContact O-SG 3.04Å; A12-C15 PolarHBondContact O-N 3.15Å; V13-C15 PolarHBondContact O-N 2.89Å; C15-R19 VanDerWaalsContact O-CG 3.31Å; C15-R19 WeakPolarHBondContact O-CG 3.48Å; C15-R19 PolarHBondContact O-N 2.88Å
16	Y	87.2	Confident	77.7	Confident	119 Å²	119	116.6 Å²	116.6	47%	0.467	58%	0.583	S	S	.	*	H	α-helix	trans	-64.4	-46	177.3	175.6	-94.5	0	0	0	112.2	A12 V13 S14 R19 R20	A12-Y16 WeakPolarHBondContact O-CB 3.43Å; A12-Y16 PolarHBondContact O-N 3.17Å; V13-Y16 WeakPolarHBondContact O-CB 3.29Å; V13-Y16 PolarHBondContact O-N 3.32Å; V13-Y16 VanDerWaalsContact O-N 3.14Å; S14-Y16 VanDerWaalsContact C-N 3.33Å; S14-Y16 PolarHBondContact O-N 3.24Å; Y16-R19 PolarHBondContact O-N 2.58Å; Y16-R20 PolarHBondContact O-N 2.95Å; Y16-R20 VanDerWaalsContact O-N 3.16Å; Y16-R20 PolarHBondContact OH-NE 2.91Å; Y16-R20 PolarHBondContact OH-NH2 3.17Å
17	L	88.2	Confident	75.6	Confident	69 Å²	69	115.4 Å²	115.4	36%	0.361	59%	0.585	S	S	.	*	H	α-helix	trans	-63.2	-44.3	178.1	-69.9	174.1	0	0	0	111.5	V13 S14 R19 R20 Q21 Y22	V13-L17 HydrophobicContact CG1-CD1 3.95Å; V13-L17 HydrophobicContact CG1-CG 4.32Å; V13-L17 WeakPolarHBondContact O-CG 3.39Å; V13-L17 PolarHBondContact O-N 3.09Å; S14-L17 PolarHBondContact O-N 2.9Å; L17-R19 VanDerWaalsContact C-N 3.35Å; L17-R19 PolarHBondContact O-N 3.35Å; L17-R20 CarbonylContact O-C 3.53Å; L17-R20 PolarHBondContact O-N 3.24Å; L17-Q21 PolarHBondContact O-N 3.48Å; L17-Y22 HydrophobicContact CD2-CD2 4Å; L17-Y22 HydrophobicContact CD2-CG 4.26Å; L17-Y22 PolarHBondContact O-N 3.13Å; L17-Y22 VanDerWaalsContact O-N 3.11Å
18	K	85	Confident	73.5	Confident	134 Å²	134	116.1 Å²	116.1	58%	0.583	60%	0.6	S	S	*	*	H	α-helix	trans	-59.1	-42.9	174.8	-74.7	177.4	179.6	-176.5	0	112.2	S14 R20 Q21	S14-K18 WeakPolarHBondContact O-CB 3.49Å; S14-K18 VanDerWaalsContact O-CG 3.28Å; S14-K18 WeakPolarHBondContact O-CG 3.18Å; S14-K18 PolarHBondContact O-N 3.41Å; K18-R20 PolarHBondContact O-N 3.09Å; K18-Q21 PolarHBondContact O-N 3.37Å; K18-Q21 VanDerWaalsContact O-N 3.09Å
19	R	87.8	Confident	71.3	Confident	217 Å²	217	118.3 Å²	118.3	82%	0.819	61%	0.614	S	S	*	*	H	α-helix	trans	-61.6	-31.2	175.3	-76.9	176.5	-176.9	-172.5	1.9	112.9	C15 Y16 L17 Q21	C15-R19 VanDerWaalsContact O-CG 3.31Å; C15-R19 WeakPolarHBondContact O-CG 3.48Å; C15-R19 PolarHBondContact O-N 2.88Å; Y16-R19 PolarHBondContact O-N 2.58Å; L17-R19 VanDerWaalsContact C-N 3.35Å; L17-R19 PolarHBondContact O-N 3.35Å; R19-Q21 VanDerWaalsContact C-N 3.3Å
20	R	84.8	Confident	68.9	Low	159 Å²	159	122.4 Å²	122.4	60%	0.6	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	13.5	176.7	-70.9	-156.1	175.5	-146.5	3.4	113.9	Y16 L17 K18 Y22	Y16-R20 PolarHBondContact O-N 2.95Å; Y16-R20 VanDerWaalsContact O-N 3.16Å; Y16-R20 PolarHBondContact OH-NE 2.91Å; Y16-R20 PolarHBondContact OH-NH2 3.17Å; L17-R20 CarbonylContact O-C 3.53Å; L17-R20 PolarHBondContact O-N 3.24Å; K18-R20 PolarHBondContact O-N 3.09Å; R20-Y22 HydrophobicContact CB-CD2 3.82Å; R20-Y22 HydrophobicContact CB-CE2 3.97Å; R20-Y22 PolarHBondContact O-N 3.44Å
21	Q	79.9	Confident	66.5	Low	173 Å²	173	125.5 Å²	125.5	81%	0.808	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.8	27.9	176.8	-55.1	178.3	-11.5	0	0	113.9	L17 K18 R19 V23	L17-Q21 PolarHBondContact O-N 3.48Å; K18-Q21 PolarHBondContact O-N 3.37Å; K18-Q21 VanDerWaalsContact O-N 3.09Å; R19-Q21 VanDerWaalsContact C-N 3.3Å; Q21-V23 PolarHBondContact O-N 3.34Å
22	Y	69.3	Low	64.1	Low	157 Å²	157	122.2 Å²	122.2	62%	0.616	64%	0.641	S	S	*	*			trans	-74	111.9	163.1	-73.7	-85.1	0	0	0	107.6	L17 R20	L17-Y22 HydrophobicContact CD2-CD2 4Å; L17-Y22 HydrophobicContact CD2-CG 4.26Å; L17-Y22 PolarHBondContact O-N 3.13Å; L17-Y22 VanDerWaalsContact O-N 3.11Å; R20-Y22 HydrophobicContact CB-CD2 3.82Å; R20-Y22 HydrophobicContact CB-CE2 3.97Å; R20-Y22 PolarHBondContact O-N 3.44Å
23	V	61.6	Low	61.5	Low	131 Å²	131	126.6 Å²	126.6	79%	0.794	65%	0.654	S	S	*	*			trans	-81.8	121.6	-178.5	-178.7	0	0	0	0	108.7	Q21 S25	Q21-V23 PolarHBondContact O-N 3.34Å; V23-S25 PolarHBondContact O-N 3.47Å; V23-S25 VanDerWaalsContact O-N 3.07Å
24	D	50.7	Low	58.9	Low	111 Å²	111	130.6 Å²	130.6	59%	0.594	66%	0.661	S	S	*	*			trans	-62.8	105.6	163.5	-74.4	-37.6	0	0	0	106.8	D26	D24-D26 VanDerWaalsContact C-N 3.33Å; D24-D26 PolarHBondContact O-N 2.88Å
25	S	45.8	Very low	56.8	Low	112 Å²	112	136.9 Å²	136.9	78%	0.783	69%	0.691	S	S	*	*			trans	-71.4	95.7	168.1	42.9	0	0	0	0	107.9	V23 G27	V23-S25 PolarHBondContact O-N 3.47Å; V23-S25 VanDerWaalsContact O-N 3.07Å; S25-G27 PolarHBondContact O-N 3.15Å
26	D	42.1	Very low	54.8	Low	167 Å²	167	138 Å²	138	89%	0.893	70%	0.7	S	S	*	*			trans	-60.5	73.5	170.4	-87.2	-27.6	0	0	0	111.1	D24	D24-D26 VanDerWaalsContact C-N 3.33Å; D24-D26 PolarHBondContact O-N 2.88Å
27	G	36.4	Very low	52.4	Low	48 Å²	48	137.7 Å²	137.7	50%	0.495	70%	0.703	S	S	.	*	S	Bend	trans	-101.3	151.9	152	0	0	0	0	0	108.4	S25 L29	S25-G27 PolarHBondContact O-N 3.15Å; G27-L29 PolarHBondContact O-N 2.98Å; G27-L29 VanDerWaalsContact O-N 3.09Å
28	P	34.4	Very low	50.4	Low	130 Å²	130	137.2 Å²	137.2	84%	0.844	70%	0.703	S	S	*	*			trans	-52.2	128.6	174.4	25.5	-32	0	0	0	107	K30	P28-K30 PolarHBondContact O-N 3.14Å
29	L	39.4	Very low	48.5	Very low	171 Å²	171	134.8 Å²	134.8	90%	0.895	71%	0.708	S	S	*	*			trans	-36	108.8	174.4	-90.8	133.6	0	0	0	107.5	G27 Q31	G27-L29 PolarHBondContact O-N 2.98Å; G27-L29 VanDerWaalsContact O-N 3.09Å; L29-Q31 PolarHBondContact O-N 3.27Å
30	K	34.2	Very low	46.4	Very low	182 Å²	182	132.1 Å²	132.1	79%	0.791	71%	0.705	S	S	*	*			trans	-61.1	92.1	161.9	-90.8	-172.2	177.6	-178.8	0	104.4	P28 G32 L33	P28-K30 PolarHBondContact O-N 3.14Å; K30-G32 PolarHBondContact O-N 3.4Å; K30-L33 PolarHBondContact O-N 3.16Å
31	Q	36	Very low	44.4	Very low	201 Å²	201	128 Å²	128	94%	0.939	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	78.8	155.5	-161.9	161.3	12.9	0	0	104.9	L29	L29-Q31 PolarHBondContact O-N 3.27Å
32	G	35.2	Very low	42.6	Very low	53 Å²	53	123.3 Å²	123.3	55%	0.546	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	148.4	24.6	-163.5	0	0	0	0	0	117.7	K30 R34	K30-G32 PolarHBondContact O-N 3.4Å; G32-R34 PolarHBondContact O-N 3.09Å
33	L	35	Very low	41.4	Very low	152 Å²	152	118.3 Å²	118.3	80%	0.796	66%	0.662	S	S	*	*			trans	-74.2	92.7	139.9	-84.4	163.5	0	0	0	105.1	K30 L35	K30-L33 PolarHBondContact O-N 3.16Å; L33-L35 VanDerWaalsContact C-N 3.29Å; L33-L35 PolarHBondContact O-N 2.9Å
34	R	33.8	Very low	40.3	Very low	160 Å²	160	114.5 Å²	114.5	60%	0.604	65%	0.645	S	S	*	*			trans	-56.5	96.5	174.8	-94.5	-172.5	175.3	170.2	1.3	108.2	G32 S36 E41	G32-R34 PolarHBondContact O-N 3.09Å; R34-S36 PolarHBondContact O-N 3.45Å; R34-E41 IonicContact CZ-OE1 3.71Å; R34-E41 IonicContact CZ-OE2 3.98Å; R34-E41 IonicContact NH1-OE1 3.63Å; R34-E41 PolarHBondContact NH1-OE1 3.09Å; R34-E41 IonicContact NH1-OE2 2.82Å; R34-E41 PolarHBondContact NH1-OE2 3.18Å
35	L	40.3	Very low	39.8	Very low	169 Å²	169	113.2 Å²	113.2	89%	0.885	64%	0.638	S	S	*	*	S	Bend	trans	-79.1	10.5	171.5	-79	159.6	0	0	0	112	L33	L33-L35 VanDerWaalsContact C-N 3.29Å; L33-L35 PolarHBondContact O-N 2.9Å
36	S	42.9	Very low	39.5	Very low	84 Å²	84	113.6 Å²	113.6	59%	0.587	63%	0.63	S	S	*	*	S	Bend	trans	-144.7	120.4	172.1	58.5	0	0	0	0	108.6	R34	R34-S36 PolarHBondContact O-N 3.45Å
37	Q	37	Very low	39.4	Very low	112 Å²	112	109.9 Å²	109.9	52%	0.523	61%	0.614	S	S	.	*			trans	-77.6	135	163.4	-77.7	175.6	-11.3	0	0	108.3	M42	Q37-M42 HydrophobicContact CB-CE 4.08Å
38	T	47.3	Very low	39.3	Very low	59 Å²	59	112.6 Å²	112.6	36%	0.362	62%	0.621	S	S	.	*			trans	-71.5	152.5	170.8	53.3	0	0	0	0	109.5	E40 E41 M42	T38-E40 PolarHBondContact O-N 3.13Å; T38-E40 VanDerWaalsContact O-N 3.11Å; T38-E41 PolarHBondContact O-N 3.01Å; T38-M42 PolarHBondContact O-N 3.37Å; T38-M42 VanDerWaalsContact O-N 3.13Å
39	A	44.3	Very low	39.4	Very low	83 Å²	83	113.5 Å²	113.5	69%	0.686	61%	0.613	S	S	*	*	H	α-helix	trans	-56.2	-30	-179.5	0	0	0	0	0	112.6	M42 A43	A39-M42 PolarHBondContact O-N 3.14Å; A39-A43 WeakPolarHBondContact O-CB 3.4Å; A39-A43 PolarHBondContact O-N 2.95Å
40	E	43.2	Very low	39.3	Very low	161 Å²	161	109.8 Å²	109.8	75%	0.752	60%	0.602	S	S	*	*	H	α-helix	trans	-68	-37.8	175.4	-69.4	165.7	162.2	0	0	112.9	T38 A43 A44	T38-E40 PolarHBondContact O-N 3.13Å; T38-E40 VanDerWaalsContact O-N 3.11Å; E40-A43 PolarHBondContact O-N 3.3Å; E40-A44 WeakPolarHBondContact O-CB 3.36Å; E40-A44 PolarHBondContact O-N 2.98Å
41	E	43.3	Very low	39.4	Very low	73 Å²	73	109.4 Å²	109.4	34%	0.341	60%	0.603	S	S	.	*	H	α-helix	trans	-74.1	-28.4	174.7	-74	-176.3	158.3	0	0	112.4	R34 T38 N45	R34-E41 IonicContact CZ-OE1 3.71Å; R34-E41 IonicContact CZ-OE2 3.98Å; R34-E41 IonicContact NH1-OE1 3.63Å; R34-E41 PolarHBondContact NH1-OE1 3.09Å; R34-E41 IonicContact NH1-OE2 2.82Å; R34-E41 PolarHBondContact NH1-OE2 3.18Å; T38-E41 PolarHBondContact O-N 3.01Å; E41-N45 PolarHBondContact O-N 3.3Å; E41-N45 VanDerWaalsContact O-N 3.16Å; E41-N45 PolarHBondContact O-ND2 3.05Å
42	M	43.1	Very low	39.5	Very low	73 Å²	73	103.7 Å²	103.7	36%	0.36	59%	0.585	S	S	.	*	H	α-helix	trans	-70.4	-39.8	172.3	-132.6	175.1	-72.8	0	0	110.8	Q37 T38 A39 L46	Q37-M42 HydrophobicContact CB-CE 4.08Å; T38-M42 PolarHBondContact O-N 3.37Å; T38-M42 VanDerWaalsContact O-N 3.13Å; A39-M42 PolarHBondContact O-N 3.14Å; M42-L46 WeakPolarHBondContact O-CD1 3.42Å; M42-L46 VanDerWaalsContact O-CG 3.27Å; M42-L46 WeakPolarHBondContact O-CG 3.3Å; M42-L46 PolarHBondContact O-N 3.41Å; M42-L46 VanDerWaalsContact O-N 3.1Å
43	A	43	Very low	39.4	Very low	52 Å²	52	103.8 Å²	103.8	43%	0.43	59%	0.586	S	S	.	*	H	α-helix	trans	-67.5	-39.3	175.2	0	0	0	0	0	112.8	A39 E40 L46 T47	A39-A43 WeakPolarHBondContact O-CB 3.4Å; A39-A43 PolarHBondContact O-N 2.95Å; E40-A43 PolarHBondContact O-N 3.3Å; A43-L46 PolarHBondContact O-N 3.14Å; A43-T47 PolarHBondContact O-N 2.9Å; A43-T47 PolarHBondContact O-OG1 3.02Å
44	A	39.9	Very low	39.6	Very low	52 Å²	52	100 Å²	100	43%	0.43	57%	0.572	S	S	.	*	H	α-helix	trans	-70	-31.3	177.1	0	0	0	0	0	113.2	E40 T47 V48	E40-A44 WeakPolarHBondContact O-CB 3.36Å; E40-A44 PolarHBondContact O-N 2.98Å; A44-T47 PolarHBondContact O-OG1 2.84Å; A44-V48 VanDerWaalsContact O-CG2 3.28Å; A44-V48 WeakPolarHBondContact O-CG2 3.36Å; A44-V48 PolarHBondContact O-N 3.04Å
45	N	39.5	Very low	39.6	Very low	84 Å²	84	96.8 Å²	96.8	45%	0.449	58%	0.579	S	S	.	*	H	α-helix	trans	-77.6	-27.8	173.7	-75.4	-46.3	0	0	0	112.8	E41 Q49	E41-N45 PolarHBondContact O-N 3.3Å; E41-N45 VanDerWaalsContact O-N 3.16Å; E41-N45 PolarHBondContact O-ND2 3.05Å; N45-Q49 WeakPolarHBondContact O-CG 3.48Å; N45-Q49 PolarHBondContact O-N 3.39Å
46	L	40.3	Very low	39.5	Very low	120 Å²	120	95.7 Å²	95.7	63%	0.628	57%	0.574	S	S	*	*	H	α-helix	trans	-66.1	-36.4	172.7	-79.6	161.9	0	0	0	111.9	M42 A43 S50	M42-L46 WeakPolarHBondContact O-CD1 3.42Å; M42-L46 VanDerWaalsContact O-CG 3.27Å; M42-L46 WeakPolarHBondContact O-CG 3.3Å; M42-L46 PolarHBondContact O-N 3.41Å; M42-L46 VanDerWaalsContact O-N 3.1Å; A43-L46 PolarHBondContact O-N 3.14Å; L46-S50 PolarHBondContact O-N 2.96Å
47	T	39.3	Very low	39.4	Very low	88 Å²	88	96.8 Å²	96.8	54%	0.54	57%	0.572	S	S	.	*	H	α-helix	trans	-76.6	-33.2	177.2	53.2	0	0	0	0	112.8	A43 A44 Q49 S50	A43-T47 PolarHBondContact O-N 2.9Å; A43-T47 PolarHBondContact O-OG1 3.02Å; A44-T47 PolarHBondContact O-OG1 2.84Å; T47-Q49 VanDerWaalsContact C-N 3.3Å; T47-Q49 PolarHBondContact O-N 3.28Å; T47-S50 WeakPolarHBondContact CA-OG 3.24Å; T47-S50 PolarHBondContact O-N 3.15Å; T47-S50 PolarHBondContact O-OG 2.89Å
48	V	34.9	Very low	39.4	Very low	106 Å²	106	95.3 Å²	95.3	64%	0.642	57%	0.571	S	S	*	*	H	α-helix	trans	-72	-23.5	176.4	174.5	0	0	0	0	112.3	A44	A44-V48 VanDerWaalsContact O-CG2 3.28Å; A44-V48 WeakPolarHBondContact O-CG2 3.36Å; A44-V48 PolarHBondContact O-N 3.04Å
49	Q	35.6	Very low	38.8	Very low	148 Å²	148	98.5 Å²	98.5	69%	0.692	60%	0.596	S	S	*	*	H	α-helix	trans	-84	-14.4	172.3	-71.6	-173.1	-5.5	0	0	114.1	N45 T47 E51 S52	N45-Q49 WeakPolarHBondContact O-CG 3.48Å; N45-Q49 PolarHBondContact O-N 3.39Å; T47-Q49 VanDerWaalsContact C-N 3.3Å; T47-Q49 PolarHBondContact O-N 3.28Å; Q49-E51 VanDerWaalsContact C-N 3.31Å; Q49-S52 PolarHBondContact O-OG 3.27Å
50	S	38.2	Very low	38.4	Very low	93 Å²	93	98 Å²	98	65%	0.65	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-6.9	175	52	0	0	0	0	114.5	L46 T47	L46-S50 PolarHBondContact O-N 2.96Å; T47-S50 WeakPolarHBondContact CA-OG 3.24Å; T47-S50 PolarHBondContact O-N 3.15Å; T47-S50 PolarHBondContact O-OG 2.89Å
51	E	36.2	Very low	37.8	Very low	174 Å²	174	94 Å²	94	81%	0.813	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	13.3	178.2	-71.7	-168	164	0	0	114.5	Q49 G53	Q49-E51 VanDerWaalsContact C-N 3.31Å; E51-G53 PolarHBondContact O-N 3.42Å
52	S	36.9	Very low	37.5	Very low	81 Å²	81	96.8 Å²	96.8	57%	0.566	61%	0.61	S	S	*	*			trans	-86.5	88.9	167.2	60.1	0	0	0	0	109.9	Q49	Q49-S52 PolarHBondContact O-OG 3.27Å
53	G	34.5	Very low	37.4	Very low	55 Å²	55	98.3 Å²	98.3	57%	0.567	63%	0.627	S	S	*	*			trans	-57	178.4	171.7	0	0	0	0	0	113.4	E51 A55	E51-G53 PolarHBondContact O-N 3.42Å; G53-A55 PolarHBondContact O-N 2.96Å
54	C	37.3	Very low	37.8	Very low	74 Å²	74	104.3 Å²	104.3	50%	0.5	65%	0.646	S	S	.	*	G	3₁₀ helix	trans	-52.7	9.9	-170.6	-63.5	0	0	0	0	118.1	Y172	C54-Y172 PolarHBondContact SG-OH 3.11Å; C54-Y172 VanDerWaalsContact SG-OH 3.4Å
55	A	35.7	Very low	38.5	Very low	92 Å²	92	102.7 Å²	102.7	76%	0.76	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-82.5	-5.3	-179.1	0	0	0	0	0	115.2	G53	G53-A55 PolarHBondContact O-N 2.96Å
56	N	37.8	Very low	39.7	Very low	145 Å²	145	104.3 Å²	104.3	78%	0.775	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-113	18	-178.6	-85.4	-13.3	0	0	0	115.8
57	I	39.8	Very low	41	Very low	108 Å²	108	100.5 Å²	100.5	55%	0.554	62%	0.62	S	S	*	*			trans	-115.1	98.8	166.2	-59.6	176	0	0	0	108	Q180	I57-Q180 HydrophobicContact CD1-CG 4.11Å
58	V	38.2	Very low	42.5	Very low	80 Å²	80	103 Å²	103	49%	0.485	63%	0.626	S	S	.	*			trans	170.5	74.5	131.1	179.9	0	0	0	0	105	A60	V58-A60 VanDerWaalsContact C-N 3.28Å; V58-A60 HydrophobicContact CG1-CB 4.09Å
59	S	34	Very low	44.7	Very low	127 Å²	127	100.7 Å²	100.7	89%	0.888	61%	0.608	S	S	*	*			trans	-102.3	58.8	151.8	168.8	0	0	0	0	106.9	A61	S59-A61 PolarHBondContact O-N 3.43Å
60	A	36.3	Very low	47	Very low	73 Å²	73	94.4 Å²	94.4	60%	0.603	58%	0.578	S	S	*	*			trans	-75.2	120.8	164.6	0	0	0	0	0	107	V58	V58-A60 VanDerWaalsContact C-N 3.28Å; V58-A60 HydrophobicContact CG1-CB 4.09Å
61	A	31	Very low	49.2	Very low	76 Å²	76	91.6 Å²	91.6	63%	0.628	55%	0.554	S	S	*	*			trans	-51.1	147.1	158.3	0	0	0	0	0	108.4	S59 C63	S59-A61 PolarHBondContact O-N 3.43Å; A61-C63 PolarHBondContact O-N 2.99Å
62	P	36.3	Very low	51.6	Low	132 Å²	132	87.5 Å²	87.5	86%	0.857	54%	0.541	S	S	*	.			trans	-72.7	73	-179.5	31.1	-33.5	0	0	0	109.8	Q64	P62-Q64 PolarHBondContact O-N 2.98Å
63	C	40.8	Very low	54.1	Low	105 Å²	105	83.9 Å²	83.9	71%	0.709	52%	0.515	S	S	*	.			trans	-72.3	120.7	160.4	-95.4	0	0	0	0	107	A61 A65	A61-C63 PolarHBondContact O-N 2.99Å; C63-A65 PolarHBondContact O-N 2.85Å
64	Q	51.4	Low	56.8	Low	178 Å²	178	81.2 Å²	81.2	83%	0.832	49%	0.488	S	S	*	.			trans	-62.4	106.6	162.9	-69.8	179.4	-18.3	0	0	106.2	P62 E66	P62-Q64 PolarHBondContact O-N 2.98Å; Q64-E66 PolarHBondContact O-N 3.44Å
65	A	54.8	Low	59.2	Low	18 Å²	18	78.2 Å²	78.2	15%	0.149	47%	0.47	C	S	.	.			trans	-60.4	130.7	176.2	0	0	0	0	0	108.6	C63 Y70 A186	C63-A65 PolarHBondContact O-N 2.85Å; A65-Y70 HydrophobicContact CB-CE1 3.7Å; A65-A186 HydrophobicContact CB-CB 4.24Å
66	E	64.9	Low	61.9	Low	117 Å²	117	77.9 Å²	77.9	55%	0.547	45%	0.449	S	S	.	.			trans	-62.5	137.1	179.4	-72.7	-179.8	158.4	0	0	109.9	Q64 Q68 Q69	Q64-E66 PolarHBondContact O-N 3.44Å; E66-Q68 PolarHBondContact O-N 3.37Å; E66-Q69 HydrophobicContact CB-CG 4.21Å; E66-Q69 WeakPolarHBondContact O-CB 3.36Å; E66-Q69 PolarHBondContact O-N 2.94Å
67	P	66.8	Low	64.3	Low	41 Å²	41	71 Å²	71	27%	0.266	41%	0.412	S	S	.	.	H	α-helix	trans	-52.5	-29.3	-177.5	-31.1	37	0	0	0	115.2	Q69 Y70 L107 S111 T115	P67-Q69 VanDerWaalsContact C-N 3.28Å; P67-Q69 PolarHBondContact O-N 3.48Å; P67-Y70 PolarHBondContact O-N 2.96Å; P67-L107 HydrophobicContact CB-CD2 3.77Å; P67-S111 VanDerWaalsContact CG-CB 3.49Å; P67-T115 HydrophobicContact CB-CG2 3.96Å
68	Q	71.9	Confident	66.7	Low	140 Å²	140	69.4 Å²	69.4	65%	0.654	40%	0.399	S	S	*	.	H	α-helix	trans	-67.9	-26.2	177.9	-66.1	178	-9.2	0	0	112.9	E66 Y70	E66-Q68 PolarHBondContact O-N 3.37Å; Q68-Y70 VanDerWaalsContact C-N 3.29Å; Q68-Y70 PolarHBondContact O-N 3.38Å
69	Q	80.3	Confident	69.2	Low	57 Å²	57	69.4 Å²	69.4	27%	0.266	40%	0.397	S	S	.	.	H	α-helix	trans	-71.2	-25.2	-179.5	-62.9	179.1	-1.5	0	0	112.3	E66 P67 Q73	E66-Q69 HydrophobicContact CB-CG 4.21Å; E66-Q69 WeakPolarHBondContact O-CB 3.36Å; E66-Q69 PolarHBondContact O-N 2.94Å; P67-Q69 VanDerWaalsContact C-N 3.28Å; P67-Q69 PolarHBondContact O-N 3.48Å; Q69-Q73 VanDerWaalsContact O-CB 3.24Å; Q69-Q73 WeakPolarHBondContact O-CB 3.44Å; Q69-Q73 WeakPolarHBondContact O-CG 3.46Å; Q69-Q73 PolarHBondContact O-N 2.96Å
70	Y	83.3	Confident	71.8	Confident	16 Å²	16	66.6 Å²	66.6	6%	0.063	37%	0.369	C	S	.	.	H	α-helix	trans	-67.6	-40.4	-180	-66.4	0.5	0	0	0	111.6	A65 P67 Q68 F74 L103 N106 L107 A186	A65-Y70 HydrophobicContact CB-CE1 3.7Å; P67-Y70 PolarHBondContact O-N 2.96Å; Q68-Y70 VanDerWaalsContact C-N 3.29Å; Q68-Y70 PolarHBondContact O-N 3.38Å; Y70-F74 WeakPolarHBondContact O-CB 3.29Å; Y70-F74 PolarHBondContact O-N 3.39Å; Y70-L103 HydrophobicContact CD1-CD2 4.07Å; Y70-L103 HydrophobicContact CD2-CB 4.5Å; Y70-L103 HydrophobicContact CD2-CD2 3.88Å; Y70-L103 HydrophobicContact CE1-CD2 4.44Å; Y70-L103 HydrophobicContact CE2-CD2 4.32Å; Y70-L103 HydrophobicContact CG-CD2 3.79Å; Y70-N106 HydrophobicContact CE2-CB 4.03Å; Y70-L107 HydrophobicContact CD2-CD1 4.11Å; Y70-L107 HydrophobicContact CD2-CD2 3.38Å; Y70-L107 HydrophobicContact CD2-CG 3.52Å; Y70-L107 HydrophobicContact CE2-CD2 3.85Å; Y70-L107 HydrophobicContact CE2-CG 4.03Å; Y70-L107 HydrophobicContact CG-CD2 4.22Å; Y70-A186 HydrophobicContact CD1-CB 3.35Å; Y70-A186 HydrophobicContact CE1-CB 3.35Å
71	E	85.2	Confident	74.3	Confident	34 Å²	34	63.3 Å²	63.3	16%	0.159	34%	0.341	C	S	.	.	H	α-helix	trans	-65.6	-47	178.5	-165.6	179.5	150.4	0	0	111.4	G75 S118 F119 R122 F123	E71-G75 PolarHBondContact O-N 3.15Å; E71-S118 PolarHBondContact OE2-OG 2.91Å; E71-F119 HydrophobicContact CB-CD2 4.01Å; E71-F119 HydrophobicContact CG-CD2 4.17Å; E71-R122 WeakPolarHBondContact OE1-CD 3.48Å; E71-R122 IonicContact OE1-CZ 3.94Å; E71-R122 IonicContact OE1-NE 3.62Å; E71-R122 IonicContact OE1-NH1 3.34Å; E71-R122 PolarHBondContact OE1-NH1 2.95Å; E71-F123 HydrophobicContact CG-CE2 3.77Å; E71-F123 HydrophobicContact CG-CZ 4.23Å
72	V	87.1	Confident	76.9	Confident	89 Å²	89	62.9 Å²	62.9	54%	0.539	33%	0.33	S	S	.	.	H	α-helix	trans	-67.8	-45.5	-179.5	178.7	0	0	0	0	111.7	R76	V72-R76 WeakPolarHBondContact O-CG 3.47Å; V72-R76 PolarHBondContact O-N 2.93Å
73	Q	88.8	Confident	79.1	Confident	4 Å²	4	63 Å²	63	2%	0.019	32%	0.324	C	S	.	.	H	α-helix	trans	-66.4	-44.9	-179.9	-70.8	-179.5	21.8	0	0	111.6	Q69 R76 L77 N183 N184 L187	Q69-Q73 VanDerWaalsContact O-CB 3.24Å; Q69-Q73 WeakPolarHBondContact O-CB 3.44Å; Q69-Q73 WeakPolarHBondContact O-CG 3.46Å; Q69-Q73 PolarHBondContact O-N 2.96Å; Q73-R76 PolarHBondContact O-N 2.84Å; Q73-L77 PolarHBondContact O-N 3.41Å; Q73-L77 VanDerWaalsContact O-N 3.09Å; Q73-N183 WeakPolarHBondContact CG-O 3.43Å; Q73-N183 PolarHBondContact NE2-O 3.01Å; Q73-N184 VanDerWaalsContact OE1-C 3.29Å; Q73-L187 HydrophobicContact CB-CD1 3.99Å; Q73-L187 HydrophobicContact CB-CG 4.01Å
74	F	90.5	Very high	80.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-42.9	177.5	-174.2	-94.1	0	0	0	112.1	Y70 R76 L77 R78 L96 L99 F100 L103 F119 F123 F127	Y70-F74 WeakPolarHBondContact O-CB 3.29Å; Y70-F74 PolarHBondContact O-N 3.39Å; F74-R76 PolarHBondContact O-N 3.4Å; F74-L77 PolarHBondContact O-N 3.45Å; F74-R78 WeakPolarHBondContact O-CB 3.45Å; F74-R78 PolarHBondContact O-N 3.48Å; F74-L96 HydrophobicContact CE2-CD2 4.12Å; F74-L96 WeakPolarHBondContact CE2-O 3.44Å; F74-L96 HydrophobicContact CZ-CB 4.39Å; F74-L96 HydrophobicContact CZ-CD2 4.3Å; F74-L99 HydrophobicContact CD2-CB 4.45Å; F74-L99 HydrophobicContact CE2-CB 4.13Å; F74-F100 HydrophobicContact CE1-CD2 4.27Å; F74-F100 HydrophobicContact CE2-CB 3.88Å; F74-F100 HydrophobicContact CZ-CB 3.77Å; F74-F100 HydrophobicContact CZ-CD2 4.21Å; F74-F100 HydrophobicContact CZ-CG 4.41Å; F74-L103 HydrophobicContact CB-CD1 4.05Å; F74-L103 HydrophobicContact CD2-CD1 3.76Å; F74-L103 HydrophobicContact CG-CD1 4.25Å; F74-F119 HydrophobicContact CB-CE2 4.07Å; F74-F119 HydrophobicContact CB-CZ 4.39Å; F74-F119 HydrophobicContact CD1-CE2 4.41Å; F74-F119 HydrophobicContact CD1-CZ 4.42Å; F74-F119 HydrophobicContact CG-CE2 4.31Å; F74-F119 HydrophobicContact CG-CZ 4.25Å; F74-F123 HydrophobicContact CD1-CB 4.38Å; F74-F123 AromaticContact CD1-CD1 3.83Å; F74-F123 HydrophobicContact CD1-CD1 3.83Å; F74-F123 AromaticContact CD1-CD2 3.72Å; F74-F123 HydrophobicContact CD1-CD2 3.72Å; F74-F123 AromaticContact CD1-CE1 3.95Å; F74-F123 HydrophobicContact CD1-CE1 3.95Å; F74-F123 AromaticContact CD1-CE2 3.82Å; F74-F123 HydrophobicContact CD1-CE2 3.82Å; F74-F123 AromaticContact CD1-CG 3.72Å; F74-F123 HydrophobicContact CD1-CG 3.72Å; F74-F123 AromaticContact CD1-CZ 3.96Å; F74-F123 HydrophobicContact CD1-CZ 3.96Å; F74-F123 HydrophobicContact CE1-CB 3.91Å; F74-F123 AromaticContact CE1-CD1 3.81Å; F74-F123 HydrophobicContact CE1-CD1 3.81Å; F74-F123 HydrophobicContact CE1-CD2 4.13Å; F74-F123 HydrophobicContact CE1-CE1 4.36Å; F74-F123 AromaticContact CE1-CG 3.69Å; F74-F123 HydrophobicContact CE1-CG 3.69Å; F74-F127 HydrophobicContact CZ-CE2 4.36Å; F74-F127 HydrophobicContact CZ-CZ 4.06Å
75	G	88.8	Confident	81.7	Confident	11 Å²	11	58.3 Å²	58.3	11%	0.113	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-40.9	176.6	0	0	0	0	0	113.2	E71 R78 N79	E71-G75 PolarHBondContact O-N 3.15Å; G75-R78 PolarHBondContact O-N 2.97Å; G75-N79 VanDerWaalsContact O-CG 3.26Å; G75-N79 PolarHBondContact O-N 3.45Å; G75-N79 PolarHBondContact O-OD1 3.47Å
76	R	91.1	Very high	82.9	Confident	84 Å²	84	58.9 Å²	58.9	32%	0.317	30%	0.302	S	S	.	.	H	α-helix	trans	-65.6	-44.6	176	-74.3	-173.3	-62.6	161.9	3.2	112.5	V72 Q73 F74 R78 N79 F80 Y178 N183	V72-R76 WeakPolarHBondContact O-CG 3.47Å; V72-R76 PolarHBondContact O-N 2.93Å; Q73-R76 PolarHBondContact O-N 2.84Å; F74-R76 PolarHBondContact O-N 3.4Å; R76-R78 VanDerWaalsContact C-N 3.31Å; R76-R78 PolarHBondContact O-N 3.05Å; R76-N79 PolarHBondContact O-N 3.03Å; R76-F80 WeakPolarHBondContact O-CB 3.49Å; R76-F80 PolarHBondContact O-N 3.39Å; R76-Y178 WeakPolarHBondContact CB-OH 2.82Å; R76-Y178 PolarHBondContact O-OH 3.42Å; R76-N183 PolarHBondContact NH2-O 2.84Å
77	L	89.7	Confident	83.6	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-42.8	178	175.7	65.8	0	0	0	110.6	Q73 F74 F80 L81 L96 L99 L175 Y178 L187	Q73-L77 PolarHBondContact O-N 3.41Å; Q73-L77 VanDerWaalsContact O-N 3.09Å; F74-L77 PolarHBondContact O-N 3.45Å; L77-F80 PolarHBondContact O-N 3.37Å; L77-L81 HydrophobicContact CD1-CD1 4Å; L77-L81 HydrophobicContact CD1-CG 4.19Å; L77-L81 HydrophobicContact CG-CD1 4.08Å; L77-L81 WeakPolarHBondContact O-CG 3.41Å; L77-L81 PolarHBondContact O-N 3.43Å; L77-L96 HydrophobicContact CD2-CD2 3.85Å; L77-L96 HydrophobicContact CG-CD2 3.96Å; L77-L99 HydrophobicContact CD2-CD1 3.66Å; L77-L175 HydrophobicContact CD1-CD1 4.48Å; L77-Y178 VanDerWaalsContact CA-OH 3.28Å; L77-Y178 WeakPolarHBondContact CA-OH 3.41Å; L77-Y178 HydrophobicContact CB-CE1 3.89Å; L77-Y178 HydrophobicContact CD1-CD1 3.53Å; L77-Y178 HydrophobicContact CD1-CE1 3.39Å; L77-Y178 HydrophobicContact CD1-CG 4.36Å; L77-Y178 HydrophobicContact CG-CE1 4.21Å; L77-Y178 PolarHBondContact N-OH 3.3Å; L77-L187 HydrophobicContact CB-CD1 4.03Å; L77-L187 HydrophobicContact CD2-CD1 4.08Å
78	R	90.4	Very high	84.4	Confident	73 Å²	73	61 Å²	61	28%	0.275	31%	0.309	S	S	.	.	H	α-helix	trans	-56.4	-55.1	175.3	-179.5	-147.1	167.4	157.9	2.8	111	F74 G75 R76 F80 L81 T82 L96 M126	F74-R78 WeakPolarHBondContact O-CB 3.45Å; F74-R78 PolarHBondContact O-N 3.48Å; G75-R78 PolarHBondContact O-N 2.97Å; R76-R78 VanDerWaalsContact C-N 3.31Å; R76-R78 PolarHBondContact O-N 3.05Å; R78-F80 VanDerWaalsContact C-N 3.3Å; R78-F80 PolarHBondContact O-N 3.02Å; R78-L81 PolarHBondContact O-N 3.03Å; R78-L81 VanDerWaalsContact O-N 3.16Å; R78-T82 HydrophobicContact CG-CG2 4.45Å; R78-T82 WeakPolarHBondContact O-CG2 3.33Å; R78-T82 PolarHBondContact O-N 3.5Å; R78-T82 PolarHBondContact O-OG1 2.71Å; R78-T82 VanDerWaalsContact O-OG1 3.12Å; R78-L96 HydrophobicContact CG-CD1 4.42Å; R78-M126 WeakPolarHBondContact CD-SD 3.32Å; R78-M126 HydrophobicContact CG-CE 3.73Å; R78-M126 HydrophobicContact CG-SD 3.73Å; R78-M126 PolarHBondContact NE-SD 3.04Å
79	N	89.9	Confident	85	Confident	81 Å²	81	54.3 Å²	54.3	43%	0.433	28%	0.277	S	S	.	.	H	α-helix	trans	-61.2	-41.4	-177.2	-68.3	-3.1	0	0	0	111.3	G75 R76 L81 T82 D83	G75-N79 VanDerWaalsContact O-CG 3.26Å; G75-N79 PolarHBondContact O-N 3.45Å; G75-N79 PolarHBondContact O-OD1 3.47Å; R76-N79 PolarHBondContact O-N 3.03Å; N79-L81 VanDerWaalsContact C-N 3.33Å; N79-L81 PolarHBondContact O-N 3Å; N79-T82 WeakPolarHBondContact CA-OG1 3.46Å; N79-T82 PolarHBondContact O-N 2.7Å; N79-T82 PolarHBondContact O-OG1 2.96Å; N79-D83 VanDerWaalsContact O-CB 3.22Å; N79-D83 WeakPolarHBondContact O-CB 3.34Å; N79-D83 PolarHBondContact O-N 3.27Å
80	F	89.3	Confident	85.2	Confident	68 Å²	68	56.4 Å²	56.4	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-57.4	-44	175.1	175.2	-103.9	0	0	0	112.8	R76 L77 R78 S84 Y174 Y178	R76-F80 WeakPolarHBondContact O-CB 3.49Å; R76-F80 PolarHBondContact O-N 3.39Å; L77-F80 PolarHBondContact O-N 3.37Å; R78-F80 VanDerWaalsContact C-N 3.3Å; R78-F80 PolarHBondContact O-N 3.02Å; F80-S84 WeakPolarHBondContact O-CB 3.44Å; F80-S84 PolarHBondContact O-OG 3.44Å; F80-Y174 HydrophobicContact CE1-CD1 4.48Å; F80-Y174 AromaticContact CE1-CE1 3.57Å; F80-Y174 HydrophobicContact CE1-CE1 3.57Å; F80-Y174 AromaticContact CE1-CZ 3.61Å; F80-Y174 WeakPolarHBondContact CE1-OH 3.41Å; F80-Y174 AromaticContact CZ-CE1 3.96Å; F80-Y174 HydrophobicContact CZ-CE1 3.96Å; F80-Y174 HydrophobicContact CZ-CE2 4.09Å; F80-Y174 AromaticContact CZ-CZ 3.49Å; F80-Y174 VanDerWaalsContact CZ-CZ 3.49Å; F80-Y174 WeakPolarHBondContact CZ-OH 3.37Å; F80-Y178 HydrophobicContact CB-CD2 4.12Å; F80-Y178 HydrophobicContact CB-CE2 3.57Å; F80-Y178 AromaticContact CD1-CD2 3.31Å; F80-Y178 HydrophobicContact CD1-CD2 3.31Å; F80-Y178 AromaticContact CD1-CE2 3.68Å; F80-Y178 HydrophobicContact CD1-CE2 3.68Å; F80-Y178 AromaticContact CD1-CG 3.8Å; F80-Y178 HydrophobicContact CD1-CG 3.8Å; F80-Y178 AromaticContact CD2-CD2 3.69Å; F80-Y178 HydrophobicContact CD2-CD2 3.69Å; F80-Y178 AromaticContact CD2-CE2 3.82Å; F80-Y178 HydrophobicContact CD2-CE2 3.82Å; F80-Y178 AromaticContact CE1-CD2 3.47Å; F80-Y178 HydrophobicContact CE1-CD2 3.47Å; F80-Y178 VanDerWaalsContact CE1-CD2 3.47Å; F80-Y178 HydrophobicContact CE1-CE2 4.3Å; F80-Y178 AromaticContact CE1-CG 3.78Å; F80-Y178 HydrophobicContact CE1-CG 3.78Å; F80-Y178 AromaticContact CE2-CD2 3.84Å; F80-Y178 HydrophobicContact CE2-CD2 3.84Å; F80-Y178 HydrophobicContact CE2-CE2 4.42Å; F80-Y178 AromaticContact CG-CD2 3.41Å; F80-Y178 HydrophobicContact CG-CD2 3.41Å; F80-Y178 VanDerWaalsContact CG-CD2 3.41Å; F80-Y178 AromaticContact CG-CE2 3.39Å; F80-Y178 HydrophobicContact CG-CE2 3.39Å; F80-Y178 HydrophobicContact CG-CG 4.34Å; F80-Y178 AromaticContact CZ-CD2 3.73Å; F80-Y178 HydrophobicContact CZ-CD2 3.73Å; F80-Y178 HydrophobicContact CZ-CG 4.31Å
81	L	87.8	Confident	85.3	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-74.4	-30.9	178.9	-65.8	175.2	0	0	0	113.1	L77 R78 N79 S84 V92 L96 Y174	L77-L81 HydrophobicContact CD1-CD1 4Å; L77-L81 HydrophobicContact CD1-CG 4.19Å; L77-L81 HydrophobicContact CG-CD1 4.08Å; L77-L81 WeakPolarHBondContact O-CG 3.41Å; L77-L81 PolarHBondContact O-N 3.43Å; R78-L81 PolarHBondContact O-N 3.03Å; R78-L81 VanDerWaalsContact O-N 3.16Å; N79-L81 VanDerWaalsContact C-N 3.33Å; N79-L81 PolarHBondContact O-N 3Å; L81-S84 PolarHBondContact O-OG 2.92Å; L81-V92 HydrophobicContact CD1-CG1 3.94Å; L81-V92 HydrophobicContact CD2-CB 3.98Å; L81-V92 HydrophobicContact CD2-CG1 3.78Å; L81-L96 HydrophobicContact CD1-CD1 4.14Å; L81-L96 HydrophobicContact CD1-CD2 4.02Å; L81-L96 HydrophobicContact CD1-CG 3.98Å; L81-Y174 HydrophobicContact CD2-CE1 4.28Å
82	T	85.1	Confident	85.5	Confident	66 Å²	66	56.3 Å²	56.3	41%	0.405	29%	0.287	S	S	.	.	H	α-helix	trans	-82.2	-31.6	178.9	53.5	0	0	0	0	113.9	R78 N79 S84	R78-T82 HydrophobicContact CG-CG2 4.45Å; R78-T82 WeakPolarHBondContact O-CG2 3.33Å; R78-T82 PolarHBondContact O-N 3.5Å; R78-T82 PolarHBondContact O-OG1 2.71Å; R78-T82 VanDerWaalsContact O-OG1 3.12Å; N79-T82 WeakPolarHBondContact CA-OG1 3.46Å; N79-T82 PolarHBondContact O-N 2.7Å; N79-T82 PolarHBondContact O-OG1 2.96Å; T82-S84 VanDerWaalsContact C-N 3.3Å
83	D	83.3	Confident	85.6	Confident	135 Å²	135	56 Å²	56	72%	0.722	28%	0.28	S	S	*	.	H	α-helix	trans	-83.7	-10.7	-177	-63.3	-9.6	0	0	0	112.1	N79	N79-D83 VanDerWaalsContact O-CB 3.22Å; N79-D83 WeakPolarHBondContact O-CB 3.34Å; N79-D83 PolarHBondContact O-N 3.27Å
84	S	76.6	Confident	85.6	Confident	26 Å²	26	59.6 Å²	59.6	18%	0.182	30%	0.304	C	S	.	.			trans	-100.7	117.7	179.6	56.8	0	0	0	0	111.6	F80 L81 T82 S86 S89 Y174	F80-S84 WeakPolarHBondContact O-CB 3.44Å; F80-S84 PolarHBondContact O-OG 3.44Å; L81-S84 PolarHBondContact O-OG 2.92Å; T82-S84 VanDerWaalsContact C-N 3.3Å; S84-S86 PolarHBondContact O-N 3.01Å; S84-S86 VanDerWaalsContact O-N 3.09Å; S84-S89 PolarHBondContact O-OG 3.19Å; S84-S89 WeakPolarHBondContact OG-CB 3.41Å; S84-S89 PolarHBondContact OG-OG 3.17Å; S84-Y174 PolarHBondContact OG-OH 3.24Å
85	D	71.1	Confident	85.5	Confident	158 Å²	158	59.7 Å²	59.7	85%	0.845	31%	0.305	S	S	*	.			trans	-86.6	44.4	179.1	-159.7	21.6	0	0	0	112	H90	D85-H90 IonicContact OD1-NE2 3.84Å
86	S	79.8	Confident	85.6	Confident	31 Å²	31	59.3 Å²	59.3	22%	0.217	30%	0.3	C	S	.	.			trans	-103.9	146.1	-173.9	76.5	0	0	0	0	111.5	S84 H88 S89 H90	S84-S86 PolarHBondContact O-N 3.01Å; S84-S86 VanDerWaalsContact O-N 3.09Å; S86-H88 PolarHBondContact O-N 3.35Å; S86-S89 PolarHBondContact N-OG 2.92Å; S86-S89 PolarHBondContact O-N 2.85Å; S86-S89 VanDerWaalsContact O-N 3.13Å; S86-S89 PolarHBondContact O-OG 3.12Å; S86-S89 VanDerWaalsContact OG-CB 3.29Å; S86-S89 WeakPolarHBondContact OG-CB 3.36Å; S86-S89 PolarHBondContact OG-N 3.43Å; S86-S89 PolarHBondContact OG-OG 3.02Å; S86-H90 PolarHBondContact O-CD2 3.33Å; S86-H90 VanDerWaalsContact O-CD2 3.25Å; S86-H90 PolarHBondContact O-N 3.44Å
87	Q	79.3	Confident	85.6	Confident	135 Å²	135	55.7 Å²	55.7	63%	0.631	29%	0.287	S	S	*	.	H	α-helix	trans	-56.3	-38	174.7	-174.9	178.3	-21.9	0	0	112	H90 E91	Q87-H90 PolarHBondContact O-N 2.82Å; Q87-E91 PolarHBondContact O-N 2.97Å
88	H	83.6	Confident	85.6	Confident	67 Å²	67	55.6 Å²	55.6	31%	0.31	29%	0.286	S	S	.	.	H	α-helix	trans	-67	-35.3	179	-48.7	93.3	0	0	0	113	S86 E91 V92 Y174	S86-H88 PolarHBondContact O-N 3.35Å; H88-E91 PolarHBondContact O-N 3.28Å; H88-V92 VanDerWaalsContact O-CG2 3.28Å; H88-V92 WeakPolarHBondContact O-CG2 3.47Å; H88-V92 PolarHBondContact O-N 3.32Å; H88-V92 VanDerWaalsContact O-N 3.07Å; H88-Y174 HydrophobicContact CB-CD1 4.06Å; H88-Y174 HydrophobicContact CB-CD2 4.42Å; H88-Y174 HydrophobicContact CB-CG 3.94Å
89	S	84.9	Confident	85.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.3	-38.3	178.5	55.7	0	0	0	0	111.4	S84 S86 E91 V92 M93	S84-S89 PolarHBondContact O-OG 3.19Å; S84-S89 WeakPolarHBondContact OG-CB 3.41Å; S84-S89 PolarHBondContact OG-OG 3.17Å; S86-S89 PolarHBondContact N-OG 2.92Å; S86-S89 PolarHBondContact O-N 2.85Å; S86-S89 VanDerWaalsContact O-N 3.13Å; S86-S89 PolarHBondContact O-OG 3.12Å; S86-S89 VanDerWaalsContact OG-CB 3.29Å; S86-S89 WeakPolarHBondContact OG-CB 3.36Å; S86-S89 PolarHBondContact OG-N 3.43Å; S86-S89 PolarHBondContact OG-OG 3.02Å; S89-E91 VanDerWaalsContact C-N 3.34Å; S89-E91 PolarHBondContact O-N 3.48Å; S89-V92 PolarHBondContact O-N 2.95Å; S89-M93 WeakPolarHBondContact O-CB 3.45Å; S89-M93 PolarHBondContact O-N 3.2Å
90	H	84.9	Confident	85.7	Confident	101 Å²	101	48.3 Å²	48.3	47%	0.468	25%	0.253	S	S	.	.	H	α-helix	trans	-63.7	-36.9	173.3	-64.3	-54.8	0	0	0	113.2	D85 S86 Q87 P94	D85-H90 IonicContact OD1-NE2 3.84Å; S86-H90 PolarHBondContact O-CD2 3.33Å; S86-H90 VanDerWaalsContact O-CD2 3.25Å; S86-H90 PolarHBondContact O-N 3.44Å; Q87-H90 PolarHBondContact O-N 2.82Å; H90-P94 WeakPolarHBondContact O-CD 3.35Å
91	E	85.2	Confident	85.7	Confident	47 Å²	47	45 Å²	45	22%	0.22	24%	0.238	C	C	.	.	H	α-helix	trans	-71.6	-30.2	176.9	-71.8	-173.8	-172.6	0	0	113	Q87 H88 S89 P94 L167 Q168 S171	Q87-E91 PolarHBondContact O-N 2.97Å; H88-E91 PolarHBondContact O-N 3.28Å; S89-E91 VanDerWaalsContact C-N 3.34Å; S89-E91 PolarHBondContact O-N 3.48Å; E91-P94 WeakPolarHBondContact O-CD 3.22Å; E91-L167 VanDerWaalsContact O-CD2 3.31Å; E91-L167 WeakPolarHBondContact O-CD2 3.47Å; E91-Q168 PolarHBondContact OE1-NE2 3.25Å; E91-Q168 WeakPolarHBondContact OE2-CG 3.45Å; E91-S171 WeakPolarHBondContact OE2-CB 3.12Å; E91-S171 PolarHBondContact OE2-OG 3.25Å
92	V	89.1	Confident	85.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-83	-25.4	177.1	176.2	0	0	0	0	112	L81 H88 S89 P94 L95 L167 S171 Y174 L175	L81-V92 HydrophobicContact CD1-CG1 3.94Å; L81-V92 HydrophobicContact CD2-CB 3.98Å; L81-V92 HydrophobicContact CD2-CG1 3.78Å; H88-V92 VanDerWaalsContact O-CG2 3.28Å; H88-V92 WeakPolarHBondContact O-CG2 3.47Å; H88-V92 PolarHBondContact O-N 3.32Å; H88-V92 VanDerWaalsContact O-N 3.07Å; S89-V92 PolarHBondContact O-N 2.95Å; V92-P94 VanDerWaalsContact C-N 3.35Å; V92-L95 HydrophobicContact CG1-CD2 4.37Å; V92-L95 WeakPolarHBondContact O-CB 3.27Å; V92-L95 PolarHBondContact O-N 3.26Å; V92-L167 HydrophobicContact CG2-CD2 4.28Å; V92-S171 WeakPolarHBondContact CG2-O 3.04Å; V92-Y174 HydrophobicContact CG2-CD1 4.49Å; V92-L175 HydrophobicContact CG1-CB 4.32Å; V92-L175 HydrophobicContact CG1-CD1 3.9Å; V92-L175 HydrophobicContact CG1-CD2 4.47Å; V92-L175 HydrophobicContact CG1-CG 4.45Å; V92-L175 HydrophobicContact CG2-CB 4.22Å
93	M	88.6	Confident	86	Confident	82 Å²	82	41.8 Å²	41.8	40%	0.404	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-52.2	-37.6	-176.5	-158.2	157.4	81.4	0	0	115.5	S89 L95 L96	S89-M93 WeakPolarHBondContact O-CB 3.45Å; S89-M93 PolarHBondContact O-N 3.2Å; M93-L95 PolarHBondContact O-N 3.13Å; M93-L95 VanDerWaalsContact O-N 3.13Å; M93-L96 HydrophobicContact CG-CD1 4.2Å; M93-L96 WeakPolarHBondContact O-CB 3.32Å; M93-L96 PolarHBondContact O-N 3.12Å; M93-L96 VanDerWaalsContact O-N 3.12Å
94	P	88	Confident	86.2	Confident	80 Å²	80	35.5 Å²	35.5	52%	0.519	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-59.6	-19.7	174.2	-26.1	36.2	0	0	0	115.1	H90 E91 V92 L96 P98	H90-P94 WeakPolarHBondContact O-CD 3.35Å; E91-P94 WeakPolarHBondContact O-CD 3.22Å; V92-P94 VanDerWaalsContact C-N 3.35Å; P94-L96 PolarHBondContact O-N 3.32Å; P94-P98 VanDerWaalsContact O-CD 3.27Å; P94-P98 WeakPolarHBondContact O-CD 3.44Å
95	L	90.1	Very high	86.7	Confident	2 Å²	2	34.3 Å²	34.3	1%	0.01	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-67	-23.5	175.9	-174.3	64.2	0	0	0	112.8	V92 M93 Y97 P98 L99 V165 L175 L191 I195 L197	V92-L95 HydrophobicContact CG1-CD2 4.37Å; V92-L95 WeakPolarHBondContact O-CB 3.27Å; V92-L95 PolarHBondContact O-N 3.26Å; M93-L95 PolarHBondContact O-N 3.13Å; M93-L95 VanDerWaalsContact O-N 3.13Å; L95-Y97 VanDerWaalsContact C-N 3.26Å; L95-Y97 PolarHBondContact O-N 3.39Å; L95-P98 HydrophobicContact CD1-CG 4.45Å; L95-P98 VanDerWaalsContact O-CD 3.22Å; L95-P98 WeakPolarHBondContact O-CD 3.29Å; L95-P98 WeakPolarHBondContact O-CG 3.37Å; L95-L99 HydrophobicContact CD2-CD1 4.14Å; L95-L99 HydrophobicContact CG-CD1 3.75Å; L95-L99 HydrophobicContact CG-CG 4.19Å; L95-L99 WeakPolarHBondContact O-CB 3.34Å; L95-L99 WeakPolarHBondContact O-CG 3.24Å; L95-L99 PolarHBondContact O-N 3.38Å; L95-V165 HydrophobicContact CD1-CB 4.21Å; L95-V165 HydrophobicContact CD1-CG1 4.25Å; L95-V165 HydrophobicContact CD1-CG2 3.8Å; L95-L175 HydrophobicContact CD2-CD1 4.01Å; L95-L175 HydrophobicContact CD2-CD2 3.44Å; L95-L175 VanDerWaalsContact CD2-CD2 3.44Å; L95-L175 HydrophobicContact CD2-CG 4.39Å; L95-L191 HydrophobicContact CD1-CD2 3.87Å; L95-L191 HydrophobicContact CD2-CD2 4Å; L95-L191 HydrophobicContact CG-CD2 4.31Å; L95-I195 HydrophobicContact CD1-CD1 4.11Å; L95-I195 HydrophobicContact CD1-CG2 4.03Å; L95-L197 HydrophobicContact CD1-CD2 4.04Å
96	L	90.8	Very high	87.4	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-62.7	-32.7	-179.5	-69.1	178.1	0	0	0	112.7	F74 L77 R78 L81 M93 P94 F100 M126 F127	F74-L96 HydrophobicContact CE2-CD2 4.12Å; F74-L96 WeakPolarHBondContact CE2-O 3.44Å; F74-L96 HydrophobicContact CZ-CB 4.39Å; F74-L96 HydrophobicContact CZ-CD2 4.3Å; L77-L96 HydrophobicContact CD2-CD2 3.85Å; L77-L96 HydrophobicContact CG-CD2 3.96Å; R78-L96 HydrophobicContact CG-CD1 4.42Å; L81-L96 HydrophobicContact CD1-CD1 4.14Å; L81-L96 HydrophobicContact CD1-CD2 4.02Å; L81-L96 HydrophobicContact CD1-CG 3.98Å; M93-L96 HydrophobicContact CG-CD1 4.2Å; M93-L96 WeakPolarHBondContact O-CB 3.32Å; M93-L96 PolarHBondContact O-N 3.12Å; M93-L96 VanDerWaalsContact O-N 3.12Å; P94-L96 PolarHBondContact O-N 3.32Å; L96-F100 VanDerWaalsContact O-CB 3.32Å; L96-F100 WeakPolarHBondContact O-CB 3.36Å; L96-F100 PolarHBondContact O-N 3.08Å; L96-M126 HydrophobicContact CD1-CE 4.44Å; L96-F127 HydrophobicContact CB-CE1 4.24Å; L96-F127 HydrophobicContact CB-CZ 4.17Å
97	Y	90.9	Very high	87.7	Confident	9 Å²	9	26.4 Å²	26.4	4%	0.035	13%	0.132	C	C	.	.	H	α-helix	trans	-64.5	-59.4	179.5	170.9	-108.6	0	0	0	113.2	L95 L99 F100 V101 F127 Q133 V136 I137 F158 Y163	L95-Y97 VanDerWaalsContact C-N 3.26Å; L95-Y97 PolarHBondContact O-N 3.39Å; Y97-L99 VanDerWaalsContact C-N 3.25Å; Y97-L99 PolarHBondContact O-N 3.1Å; Y97-F100 PolarHBondContact O-N 3.43Å; Y97-V101 HydrophobicContact CD2-CG2 4.34Å; Y97-V101 HydrophobicContact CE2-CG2 3.9Å; Y97-V101 WeakPolarHBondContact O-CG2 3.49Å; Y97-V101 PolarHBondContact O-N 3.4Å; Y97-V101 VanDerWaalsContact O-N 3.15Å; Y97-F127 VanDerWaalsContact CA-CE1 3.44Å; Y97-F127 HydrophobicContact CD2-CB 4.4Å; Y97-F127 AromaticContact CD2-CD1 3.86Å; Y97-F127 HydrophobicContact CD2-CD1 3.86Å; Y97-F127 HydrophobicContact CD2-CE1 4.39Å; Y97-F127 HydrophobicContact CD2-CG 4.14Å; Y97-F127 HydrophobicContact CG-CD1 4.39Å; Y97-Q133 HydrophobicContact CD1-CG 4.08Å; Y97-Q133 HydrophobicContact CD2-CB 3.89Å; Y97-Q133 HydrophobicContact CD2-CG 3.68Å; Y97-Q133 HydrophobicContact CE1-CG 3.97Å; Y97-Q133 HydrophobicContact CE2-CB 3.49Å; Y97-Q133 VanDerWaalsContact CE2-CB 3.49Å; Y97-Q133 HydrophobicContact CE2-CG 3.56Å; Y97-Q133 HydrophobicContact CG-CG 3.94Å; Y97-V136 WeakPolarHBondContact OH-CB 3.42Å; Y97-I137 HydrophobicContact CD2-CD1 4.44Å; Y97-I137 HydrophobicContact CE2-CD1 4.06Å; Y97-I137 HydrophobicContact CE2-CG1 4.24Å; Y97-F158 HydrophobicContact CE1-CZ 4.26Å; Y97-Y163 HydrophobicContact CE1-CE2 4.26Å
98	P	89.9	Confident	87.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.7	-34.5	178.7	25.3	-34.5	0	0	0	111.9	P94 L95 V101 Y102 Y163 V165 I195	P94-P98 VanDerWaalsContact O-CD 3.27Å; P94-P98 WeakPolarHBondContact O-CD 3.44Å; L95-P98 HydrophobicContact CD1-CG 4.45Å; L95-P98 VanDerWaalsContact O-CD 3.22Å; L95-P98 WeakPolarHBondContact O-CD 3.29Å; L95-P98 WeakPolarHBondContact O-CG 3.37Å; P98-V101 PolarHBondContact O-N 2.93Å; P98-Y102 HydrophobicContact CB-CD2 4.44Å; P98-Y102 HydrophobicContact CB-CE2 4.31Å; P98-Y102 WeakPolarHBondContact O-CD2 3.22Å; P98-Y102 PolarHBondContact O-N 3.13Å; P98-Y163 HydrophobicContact CB-CD1 3.52Å; P98-Y163 HydrophobicContact CB-CD2 4.11Å; P98-Y163 HydrophobicContact CB-CE1 3.86Å; P98-Y163 HydrophobicContact CB-CE2 4.39Å; P98-Y163 HydrophobicContact CB-CG 3.64Å; P98-Y163 HydrophobicContact CG-CD1 3.69Å; P98-Y163 HydrophobicContact CG-CE1 3.75Å; P98-Y163 HydrophobicContact CG-CG 4.34Å; P98-V165 HydrophobicContact CG-CG2 4.03Å; P98-I195 HydrophobicContact CB-CD1 4.25Å; P98-I195 HydrophobicContact CG-CD1 4.37Å
99	L	90.4	Very high	87.9	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-46.8	174.2	-79.1	174.1	0	0	0	112.3	F74 L77 L95 Y97 V101 Y102 L103 L187 V190 L191 I195	F74-L99 HydrophobicContact CD2-CB 4.45Å; F74-L99 HydrophobicContact CE2-CB 4.13Å; L77-L99 HydrophobicContact CD2-CD1 3.66Å; L95-L99 HydrophobicContact CD2-CD1 4.14Å; L95-L99 HydrophobicContact CG-CD1 3.75Å; L95-L99 HydrophobicContact CG-CG 4.19Å; L95-L99 WeakPolarHBondContact O-CB 3.34Å; L95-L99 WeakPolarHBondContact O-CG 3.24Å; L95-L99 PolarHBondContact O-N 3.38Å; Y97-L99 VanDerWaalsContact C-N 3.25Å; Y97-L99 PolarHBondContact O-N 3.1Å; L99-V101 PolarHBondContact O-N 3.05Å; L99-Y102 PolarHBondContact O-N 2.89Å; L99-L103 WeakPolarHBondContact O-CB 3.33Å; L99-L103 VanDerWaalsContact O-CG 3.22Å; L99-L103 WeakPolarHBondContact O-CG 3.38Å; L99-L103 PolarHBondContact O-N 2.91Å; L99-L187 HydrophobicContact CD1-CD2 4.41Å; L99-L187 HydrophobicContact CD2-CD2 4.28Å; L99-V190 HydrophobicContact CD2-CB 4.34Å; L99-V190 HydrophobicContact CD2-CG1 3.89Å; L99-L191 HydrophobicContact CD2-CD2 4.01Å; L99-L191 HydrophobicContact CD2-CG 3.99Å; L99-I195 HydrophobicContact CD2-CD1 3.67Å; L99-I195 HydrophobicContact CG-CD1 3.88Å
100	F	91.3	Very high	87.5	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.2	-46.7	177.7	176.1	-105.3	0	0	0	111.8	F74 L96 Y97 L103 H104 F119 Y120 F123 H124 F127 I137 L140	F74-F100 HydrophobicContact CE1-CD2 4.27Å; F74-F100 HydrophobicContact CE2-CB 3.88Å; F74-F100 HydrophobicContact CZ-CB 3.77Å; F74-F100 HydrophobicContact CZ-CD2 4.21Å; F74-F100 HydrophobicContact CZ-CG 4.41Å; L96-F100 VanDerWaalsContact O-CB 3.32Å; L96-F100 WeakPolarHBondContact O-CB 3.36Å; L96-F100 PolarHBondContact O-N 3.08Å; Y97-F100 PolarHBondContact O-N 3.43Å; F100-L103 PolarHBondContact O-N 3.49Å; F100-H104 WeakPolarHBondContact O-CB 3.47Å; F100-H104 PolarHBondContact O-N 3Å; F100-F119 HydrophobicContact CD2-CD1 4.43Å; F100-F119 AromaticContact CD2-CE1 3.53Å; F100-F119 HydrophobicContact CD2-CE1 3.53Å; F100-F119 AromaticContact CD2-CZ 3.8Å; F100-F119 HydrophobicContact CD2-CZ 3.8Å; F100-F119 AromaticContact CE2-CD1 3.94Å; F100-F119 HydrophobicContact CE2-CD1 3.94Å; F100-F119 AromaticContact CE2-CE1 3.48Å; F100-F119 HydrophobicContact CE2-CE1 3.48Å; F100-F119 VanDerWaalsContact CE2-CE1 3.48Å; F100-F119 HydrophobicContact CE2-CZ 4.09Å; F100-F119 HydrophobicContact CZ-CE1 4.5Å; F100-Y120 HydrophobicContact CZ-CD2 4.11Å; F100-F123 HydrophobicContact CD2-CB 3.92Å; F100-F123 HydrophobicContact CE2-CB 3.64Å; F100-H124 HydrophobicContact CZ-CB 4.35Å; F100-F127 HydrophobicContact CB-CD2 4.45Å; F100-F127 HydrophobicContact CB-CE2 3.57Å; F100-F127 HydrophobicContact CB-CZ 3.83Å; F100-F127 AromaticContact CD1-CD2 3.75Å; F100-F127 HydrophobicContact CD1-CD2 3.75Å; F100-F127 AromaticContact CD1-CE2 3.64Å; F100-F127 HydrophobicContact CD1-CE2 3.64Å; F100-F127 HydrophobicContact CD2-CE2 4.05Å; F100-F127 HydrophobicContact CE1-CD2 4.19Å; F100-F127 HydrophobicContact CE1-CE2 4.36Å; F100-F127 HydrophobicContact CG-CD2 4.07Å; F100-F127 AromaticContact CG-CE2 3.46Å; F100-F127 HydrophobicContact CG-CE2 3.46Å; F100-F127 VanDerWaalsContact CG-CE2 3.46Å; F100-F127 HydrophobicContact CG-CZ 4.24Å; F100-I137 HydrophobicContact CD1-CD1 3.61Å; F100-I137 HydrophobicContact CE1-CD1 3.52Å; F100-L140 HydrophobicContact CE1-CD1 4.33Å
101	V	89.8	Confident	87.3	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.2	-49.6	179.6	176.4	0	0	0	0	111	Y97 P98 L99 H104 L105 L140 F158	Y97-V101 HydrophobicContact CD2-CG2 4.34Å; Y97-V101 HydrophobicContact CE2-CG2 3.9Å; Y97-V101 WeakPolarHBondContact O-CG2 3.49Å; Y97-V101 PolarHBondContact O-N 3.4Å; Y97-V101 VanDerWaalsContact O-N 3.15Å; P98-V101 PolarHBondContact O-N 2.93Å; L99-V101 PolarHBondContact O-N 3.05Å; V101-H104 PolarHBondContact O-N 2.89Å; V101-L105 HydrophobicContact CG1-CD1 4.02Å; V101-L105 HydrophobicContact CG1-CG 4.49Å; V101-L105 VanDerWaalsContact O-CG 3.3Å; V101-L105 WeakPolarHBondContact O-CG 3.26Å; V101-L105 PolarHBondContact O-N 3.24Å; V101-L140 HydrophobicContact CB-CD1 4.45Å; V101-L140 HydrophobicContact CG1-CD1 4.35Å; V101-L140 HydrophobicContact CG2-CD1 4.1Å; V101-F158 HydrophobicContact CG1-CD1 4.1Å; V101-F158 HydrophobicContact CG1-CE1 4.28Å; V101-F158 HydrophobicContact CG1-CG 4.24Å
102	Y	89.3	Confident	87	Confident	1 Å²	1	24 Å²	24	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-69.4	-35.8	-178.6	-73.3	-59.3	0	0	0	113.5	P98 L99 N106 F158 N161 V190 H194 I195	P98-Y102 HydrophobicContact CB-CD2 4.44Å; P98-Y102 HydrophobicContact CB-CE2 4.31Å; P98-Y102 WeakPolarHBondContact O-CD2 3.22Å; P98-Y102 PolarHBondContact O-N 3.13Å; L99-Y102 PolarHBondContact O-N 2.89Å; Y102-N106 WeakPolarHBondContact O-CB 3.48Å; Y102-N106 PolarHBondContact O-N 3.03Å; Y102-N106 PolarHBondContact O-ND2 2.93Å; Y102-F158 HydrophobicContact CE1-CB 4.11Å; Y102-F158 HydrophobicContact CE1-CD1 4.45Å; Y102-F158 VanDerWaalsContact CE1-O 3.24Å; Y102-F158 WeakPolarHBondContact CE1-O 3.35Å; Y102-F158 HydrophobicContact CE2-CD1 4.48Å; Y102-F158 AromaticContact CZ-CD1 3.99Å; Y102-F158 PolarHBondContact OH-O 3.43Å; Y102-N161 PolarHBondContact OH-O 3.1Å; Y102-V190 VanDerWaalsContact CB-CG1 3.47Å; Y102-V190 HydrophobicContact CD2-CG1 4.3Å; Y102-V190 HydrophobicContact CG-CG1 4.2Å; Y102-H194 HydrophobicContact CD1-CB 3.67Å; Y102-H194 AromaticContact CD1-CG 3.74Å; Y102-H194 HydrophobicContact CD2-CB 3.69Å; Y102-H194 HydrophobicContact CE1-CB 3.7Å; Y102-H194 AromaticContact CE1-CG 3.98Å; Y102-H194 HydrophobicContact CE2-CB 3.72Å; Y102-H194 HydrophobicContact CG-CB 3.69Å; Y102-I195 HydrophobicContact CD2-CD1 4.33Å; Y102-I195 HydrophobicContact CD2-CG1 4.05Å; Y102-I195 HydrophobicContact CE2-CG1 4.02Å
103	L	88.6	Confident	86.6	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-44	174	-72.7	169.1	0	0	0	110.7	Y70 F74 L99 F100 N106 L107 F119 L187 V190	Y70-L103 HydrophobicContact CD1-CD2 4.07Å; Y70-L103 HydrophobicContact CD2-CB 4.5Å; Y70-L103 HydrophobicContact CD2-CD2 3.88Å; Y70-L103 HydrophobicContact CE1-CD2 4.44Å; Y70-L103 HydrophobicContact CE2-CD2 4.32Å; Y70-L103 HydrophobicContact CG-CD2 3.79Å; F74-L103 HydrophobicContact CB-CD1 4.05Å; F74-L103 HydrophobicContact CD2-CD1 3.76Å; F74-L103 HydrophobicContact CG-CD1 4.25Å; L99-L103 WeakPolarHBondContact O-CB 3.33Å; L99-L103 VanDerWaalsContact O-CG 3.22Å; L99-L103 WeakPolarHBondContact O-CG 3.38Å; L99-L103 PolarHBondContact O-N 2.91Å; F100-L103 PolarHBondContact O-N 3.49Å; L103-N106 PolarHBondContact O-N 3.24Å; L103-L107 WeakPolarHBondContact O-CG 3.42Å; L103-L107 PolarHBondContact O-N 3.29Å; L103-F119 HydrophobicContact CB-CE1 4.16Å; L103-F119 HydrophobicContact CB-CZ 3.92Å; L103-F119 HydrophobicContact CD1-CZ 4.23Å; L103-L187 HydrophobicContact CD1-CD2 3.92Å; L103-V190 HydrophobicContact CD2-CG2 3.69Å; L103-V190 HydrophobicContact CG-CG2 4.25Å
104	H	87.9	Confident	86.3	Confident	2 Å²	2	30 Å²	30	1%	0.009	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-46.4	176.2	-172.5	90.3	0	0	0	112.1	F100 V101 N106 L107 V108 V116 F119 Y120 L140	F100-H104 WeakPolarHBondContact O-CB 3.47Å; F100-H104 PolarHBondContact O-N 3Å; V101-H104 PolarHBondContact O-N 2.89Å; H104-N106 VanDerWaalsContact C-N 3.33Å; H104-N106 PolarHBondContact O-N 3.4Å; H104-L107 WeakPolarHBondContact O-CB 3.33Å; H104-L107 PolarHBondContact O-N 2.69Å; H104-L107 VanDerWaalsContact O-N 3.15Å; H104-V108 WeakPolarHBondContact O-CG2 3.32Å; H104-V108 PolarHBondContact O-N 3.28Å; H104-V116 VanDerWaalsContact CE1-CG1 3.44Å; H104-V116 WeakPolarHBondContact CE1-CG1 3.37Å; H104-F119 HydrophobicContact CB-CD1 4.39Å; H104-F119 HydrophobicContact CB-CE1 4.23Å; H104-Y120 AromaticContact CE1-CD2 3.81Å; H104-L140 PolarHBondContact NE2-O 2.89Å
105	L	87.3	Confident	86	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-62.4	-39.2	176.3	-68.1	174.5	0	0	0	112.2	V101 L107 V108 Q109 L140 I149 L155 F158 L159	V101-L105 HydrophobicContact CG1-CD1 4.02Å; V101-L105 HydrophobicContact CG1-CG 4.49Å; V101-L105 VanDerWaalsContact O-CG 3.3Å; V101-L105 WeakPolarHBondContact O-CG 3.26Å; V101-L105 PolarHBondContact O-N 3.24Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-V108 PolarHBondContact O-N 2.84Å; L105-Q109 WeakPolarHBondContact O-CG 3.46Å; L105-Q109 PolarHBondContact O-N 2.87Å; L105-L140 HydrophobicContact CD2-CD2 3.95Å; L105-L140 HydrophobicContact CG-CD2 4.38Å; L105-I149 HydrophobicContact CD2-CD1 3.87Å; L105-I149 HydrophobicContact CD2-CG1 3.94Å; L105-I149 HydrophobicContact CD2-CG2 4.14Å; L105-L155 HydrophobicContact CD2-CB 4.45Å; L105-L155 HydrophobicContact CD2-CD1 4.46Å; L105-L155 HydrophobicContact CD2-CD2 4.45Å; L105-F158 HydrophobicContact CD1-CB 4.47Å; L105-L159 HydrophobicContact CD1-CD2 4.06Å; L105-L159 HydrophobicContact CD1-CG 4.24Å
106	N	85.6	Confident	85.8	Confident	23 Å²	23	28.2 Å²	28.2	12%	0.123	16%	0.157	C	C	.	.	H	α-helix	trans	-67.2	-32.8	174.7	-84.6	-64.3	0	0	0	112.7	Y70 Y102 L103 H104 N110	Y70-N106 HydrophobicContact CE2-CB 4.03Å; Y102-N106 WeakPolarHBondContact O-CB 3.48Å; Y102-N106 PolarHBondContact O-N 3.03Å; Y102-N106 PolarHBondContact O-ND2 2.93Å; L103-N106 PolarHBondContact O-N 3.24Å; H104-N106 VanDerWaalsContact C-N 3.33Å; H104-N106 PolarHBondContact O-N 3.4Å; N106-N110 PolarHBondContact O-N 2.97Å; N106-N110 PolarHBondContact O-ND2 2.65Å
107	L	85.4	Confident	85.5	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-67	-48.4	173.1	-71.6	168.3	0	0	0	110.7	P67 Y70 L103 H104 L105 Q109 N110 S111 V116 F119	P67-L107 HydrophobicContact CB-CD2 3.77Å; Y70-L107 HydrophobicContact CD2-CD1 4.11Å; Y70-L107 HydrophobicContact CD2-CD2 3.38Å; Y70-L107 HydrophobicContact CD2-CG 3.52Å; Y70-L107 HydrophobicContact CE2-CD2 3.85Å; Y70-L107 HydrophobicContact CE2-CG 4.03Å; Y70-L107 HydrophobicContact CG-CD2 4.22Å; L103-L107 WeakPolarHBondContact O-CG 3.42Å; L103-L107 PolarHBondContact O-N 3.29Å; H104-L107 WeakPolarHBondContact O-CB 3.33Å; H104-L107 PolarHBondContact O-N 2.69Å; H104-L107 VanDerWaalsContact O-N 3.15Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L107-Q109 PolarHBondContact O-N 3.18Å; L107-Q109 VanDerWaalsContact O-N 3.09Å; L107-N110 PolarHBondContact O-N 3.02Å; L107-S111 WeakPolarHBondContact O-CB 3.45Å; L107-S111 PolarHBondContact O-N 2.96Å; L107-S111 PolarHBondContact O-OG 3.37Å; L107-V116 HydrophobicContact CB-CG2 3.97Å; L107-F119 HydrophobicContact CD1-CB 3.75Å; L107-F119 HydrophobicContact CD1-CD1 3.63Å; L107-F119 HydrophobicContact CD1-CD2 4.18Å; L107-F119 HydrophobicContact CD1-CE1 4.27Å; L107-F119 HydrophobicContact CD1-CG 3.58Å
108	V	85.2	Confident	85.3	Confident	13 Å²	13	36.4 Å²	36.4	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-57	-29.6	178.5	175.5	0	0	0	0	112.2	H104 L105 V116 I149	H104-V108 WeakPolarHBondContact O-CG2 3.32Å; H104-V108 PolarHBondContact O-N 3.28Å; L105-V108 PolarHBondContact O-N 2.84Å; V108-V116 HydrophobicContact CG2-CG1 3.69Å; V108-V116 HydrophobicContact CG2-CG2 4.31Å; V108-I149 HydrophobicContact CB-CD1 3.96Å; V108-I149 HydrophobicContact CG1-CD1 3.61Å; V108-I149 HydrophobicContact CG1-CG1 4.24Å
109	Q	81.8	Confident	85.1	Confident	75 Å²	75	36.5 Å²	36.5	35%	0.35	20%	0.201	S	C	.	.	H	α-helix	trans	-79.1	-32.1	177.1	-71.4	177.5	6.4	0	0	114.4	L105 L107 I146 I149	L105-Q109 WeakPolarHBondContact O-CG 3.46Å; L105-Q109 PolarHBondContact O-N 2.87Å; L107-Q109 PolarHBondContact O-N 3.18Å; L107-Q109 VanDerWaalsContact O-N 3.09Å; Q109-I146 HydrophobicContact CG-CG1 4.24Å; Q109-I149 HydrophobicContact CG-CD1 4.4Å
110	N	77.9	Confident	85.1	Confident	109 Å²	109	37.5 Å²	37.5	58%	0.583	21%	0.205	S	C	*	.	H	α-helix	trans	-126.7	-5.4	-163.6	-59.7	-64.5	0	0	0	115	N106 L107	N106-N110 PolarHBondContact O-N 2.97Å; N106-N110 PolarHBondContact O-ND2 2.65Å; L107-N110 PolarHBondContact O-N 3.02Å
111	S	80.2	Confident	84.9	Confident	23 Å²	23	40.9 Å²	40.9	16%	0.161	23%	0.229	C	C	.	.	S	Bend	trans	-128.5	162.7	-171	82.1	0	0	0	0	113.8	P67 L107 V116	P67-S111 VanDerWaalsContact CG-CB 3.49Å; L107-S111 WeakPolarHBondContact O-CB 3.45Å; L107-S111 PolarHBondContact O-N 2.96Å; L107-S111 PolarHBondContact O-OG 3.37Å; S111-V116 WeakPolarHBondContact OG-CG2 3.09Å
112	P	79.4	Confident	84.8	Confident	80 Å²	80	48.4 Å²	48.4	52%	0.519	26%	0.257	S	S	.	.			trans	-69.4	151.1	175.5	2.1	10.3	0	0	0	111.6	S114 T115 V116	P112-S114 PolarHBondContact O-N 3.4Å; P112-S114 VanDerWaalsContact O-N 3.14Å; P112-T115 PolarHBondContact O-N 3.18Å; P112-V116 PolarHBondContact O-N 2.85Å
113	K	80.3	Confident	84.8	Confident	123 Å²	123	48.5 Å²	48.5	54%	0.535	26%	0.258	S	S	.	.	H	α-helix	trans	-53.6	-36.8	-177.3	-65.9	-172.4	173.7	-162.1	0	114.2	T115 V116 E117	K113-T115 VanDerWaalsContact C-N 3.31Å; K113-T115 PolarHBondContact O-N 3.42Å; K113-V116 PolarHBondContact O-N 3.3Å; K113-E117 PolarHBondContact O-N 3.2Å
114	S	81.7	Confident	84.8	Confident	85 Å²	85	51.1 Å²	51.1	59%	0.594	27%	0.27	S	S	*	.	H	α-helix	trans	-61.9	-37	179.5	52.1	0	0	0	0	112.9	P112 S118	P112-S114 PolarHBondContact O-N 3.4Å; P112-S114 VanDerWaalsContact O-N 3.14Å; S114-S118 WeakPolarHBondContact O-CB 3.41Å; S114-S118 PolarHBondContact O-N 2.94Å
115	T	83.2	Confident	84.6	Confident	28 Å²	28	53 Å²	53	17%	0.172	29%	0.29	C	S	.	.	H	α-helix	trans	-72.9	-37.3	178.2	-50.5	0	0	0	0	111.6	P67 P112 K113 E117 F119	P67-T115 HydrophobicContact CB-CG2 3.96Å; P112-T115 PolarHBondContact O-N 3.18Å; K113-T115 VanDerWaalsContact C-N 3.31Å; K113-T115 PolarHBondContact O-N 3.42Å; T115-E117 VanDerWaalsContact C-N 3.35Å; T115-F119 WeakPolarHBondContact O-CB 3.26Å; T115-F119 PolarHBondContact O-N 3.18Å
116	V	84.4	Confident	84.5	Confident	16 Å²	16	55.3 Å²	55.3	10%	0.097	30%	0.301	C	S	.	.	H	α-helix	trans	-61.6	-45.5	174.6	-179.6	0	0	0	0	110.5	H104 L107 V108 S111 P112 K113 F119 Y120	H104-V116 VanDerWaalsContact CE1-CG1 3.44Å; H104-V116 WeakPolarHBondContact CE1-CG1 3.37Å; L107-V116 HydrophobicContact CB-CG2 3.97Å; V108-V116 HydrophobicContact CG2-CG1 3.69Å; V108-V116 HydrophobicContact CG2-CG2 4.31Å; S111-V116 WeakPolarHBondContact OG-CG2 3.09Å; P112-V116 PolarHBondContact O-N 2.85Å; K113-V116 PolarHBondContact O-N 3.3Å; V116-F119 PolarHBondContact O-N 3.3Å; V116-Y120 WeakPolarHBondContact O-CB 3.39Å; V116-Y120 PolarHBondContact O-N 3.07Å
117	E	84.1	Confident	84.5	Confident	134 Å²	134	54.7 Å²	54.7	63%	0.626	30%	0.297	S	S	*	.	H	α-helix	trans	-69.7	-39.3	-178.1	-160.8	168.6	-160.1	0	0	112.1	K113 T115 Y120 S121	K113-E117 PolarHBondContact O-N 3.2Å; T115-E117 VanDerWaalsContact C-N 3.35Å; E117-Y120 PolarHBondContact O-N 3.42Å; E117-S121 VanDerWaalsContact O-CB 3.29Å; E117-S121 WeakPolarHBondContact O-CB 3.46Å; E117-S121 PolarHBondContact O-N 3.42Å; E117-S121 PolarHBondContact O-OG 2.6Å
118	S	86.6	Confident	84.4	Confident	50 Å²	50	57.9 Å²	57.9	35%	0.35	31%	0.314	S	S	.	.	H	α-helix	trans	-56.6	-52.6	170.3	-176.3	0	0	0	0	111.7	E71 S114 Y120 S121 R122	E71-S118 PolarHBondContact OE2-OG 2.91Å; S114-S118 WeakPolarHBondContact O-CB 3.41Å; S114-S118 PolarHBondContact O-N 2.94Å; S118-Y120 PolarHBondContact O-N 2.74Å; S118-S121 PolarHBondContact O-N 3.04Å; S118-S121 PolarHBondContact O-OG 2.66Å; S118-R122 WeakPolarHBondContact O-CB 3.34Å; S118-R122 PolarHBondContact O-N 3.32Å
119	F	87.8	Confident	84.2	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	35%	0.349	C	S	.	.	H	α-helix	trans	-61.7	-44.5	-179.4	-178.4	-101.5	0	0	0	112.3	E71 F74 F100 L103 H104 L107 T115 V116 F123	E71-F119 HydrophobicContact CB-CD2 4.01Å; E71-F119 HydrophobicContact CG-CD2 4.17Å; F74-F119 HydrophobicContact CB-CE2 4.07Å; F74-F119 HydrophobicContact CB-CZ 4.39Å; F74-F119 HydrophobicContact CD1-CE2 4.41Å; F74-F119 HydrophobicContact CD1-CZ 4.42Å; F74-F119 HydrophobicContact CG-CE2 4.31Å; F74-F119 HydrophobicContact CG-CZ 4.25Å; F100-F119 HydrophobicContact CD2-CD1 4.43Å; F100-F119 AromaticContact CD2-CE1 3.53Å; F100-F119 HydrophobicContact CD2-CE1 3.53Å; F100-F119 AromaticContact CD2-CZ 3.8Å; F100-F119 HydrophobicContact CD2-CZ 3.8Å; F100-F119 AromaticContact CE2-CD1 3.94Å; F100-F119 HydrophobicContact CE2-CD1 3.94Å; F100-F119 AromaticContact CE2-CE1 3.48Å; F100-F119 HydrophobicContact CE2-CE1 3.48Å; F100-F119 VanDerWaalsContact CE2-CE1 3.48Å; F100-F119 HydrophobicContact CE2-CZ 4.09Å; F100-F119 HydrophobicContact CZ-CE1 4.5Å; L103-F119 HydrophobicContact CB-CE1 4.16Å; L103-F119 HydrophobicContact CB-CZ 3.92Å; L103-F119 HydrophobicContact CD1-CZ 4.23Å; H104-F119 HydrophobicContact CB-CD1 4.39Å; H104-F119 HydrophobicContact CB-CE1 4.23Å; L107-F119 HydrophobicContact CD1-CB 3.75Å; L107-F119 HydrophobicContact CD1-CD1 3.63Å; L107-F119 HydrophobicContact CD1-CD2 4.18Å; L107-F119 HydrophobicContact CD1-CE1 4.27Å; L107-F119 HydrophobicContact CD1-CG 3.58Å; T115-F119 WeakPolarHBondContact O-CB 3.26Å; T115-F119 PolarHBondContact O-N 3.18Å; V116-F119 PolarHBondContact O-N 3.3Å; F119-F123 AromaticContact CD2-CD2 3.83Å; F119-F123 HydrophobicContact CD2-CD2 3.83Å; F119-F123 AromaticContact CD2-CE2 3.81Å; F119-F123 HydrophobicContact CD2-CE2 3.81Å; F119-F123 AromaticContact CE2-CD2 3.71Å; F119-F123 HydrophobicContact CE2-CD2 3.71Å; F119-F123 AromaticContact CE2-CE2 3.72Å; F119-F123 HydrophobicContact CE2-CE2 3.72Å; F119-F123 HydrophobicContact CG-CD2 4.44Å; F119-F123 HydrophobicContact CZ-CD2 4.22Å; F119-F123 WeakPolarHBondContact O-CD2 3.2Å; F119-F123 PolarHBondContact O-N 3.28Å
120	Y	88.8	Confident	84.1	Confident	21 Å²	21	65.9 Å²	65.9	8%	0.082	35%	0.353	C	S	.	.	H	α-helix	trans	-62.3	-53.1	177.8	-178.7	-93.6	0	0	0	111.5	F100 H104 V116 E117 S118 R122 F123 H124 I137 L140 Q141	F100-Y120 HydrophobicContact CZ-CD2 4.11Å; H104-Y120 AromaticContact CE1-CD2 3.81Å; V116-Y120 WeakPolarHBondContact O-CB 3.39Å; V116-Y120 PolarHBondContact O-N 3.07Å; E117-Y120 PolarHBondContact O-N 3.42Å; S118-Y120 PolarHBondContact O-N 2.74Å; Y120-R122 PolarHBondContact O-N 2.91Å; Y120-F123 PolarHBondContact O-N 3.28Å; Y120-H124 HydrophobicContact CD1-CB 4.28Å; Y120-H124 HydrophobicContact CD2-CB 4.17Å; Y120-H124 HydrophobicContact CE1-CB 3.95Å; Y120-H124 AromaticContact CE1-CG 3.83Å; Y120-H124 HydrophobicContact CE2-CB 3.83Å; Y120-H124 HydrophobicContact CG-CB 4.37Å; Y120-H124 VanDerWaalsContact O-CB 3.26Å; Y120-H124 WeakPolarHBondContact O-CB 3.24Å; Y120-H124 PolarHBondContact O-N 3.22Å; Y120-H124 PolarHBondContact O-ND1 3.18Å; Y120-I137 HydrophobicContact CE2-CG2 4.11Å; Y120-I137 WeakPolarHBondContact CE2-O 3.37Å; Y120-I137 PolarHBondContact OH-O 3.36Å; Y120-I137 VanDerWaalsContact OH-O 3.09Å; Y120-L140 HydrophobicContact CD2-CB 4.45Å; Y120-L140 HydrophobicContact CE2-CB 4.11Å; Y120-Q141 HydrophobicContact CE1-CB 3.94Å; Y120-Q141 HydrophobicContact CE1-CG 3.83Å; Y120-Q141 HydrophobicContact CE2-CB 4.31Å
121	S	88	Confident	84.1	Confident	72 Å²	72	65 Å²	65	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-57.7	-34.4	-177.2	64	0	0	0	0	113	E117 S118 H124	E117-S121 VanDerWaalsContact O-CB 3.29Å; E117-S121 WeakPolarHBondContact O-CB 3.46Å; E117-S121 PolarHBondContact O-N 3.42Å; E117-S121 PolarHBondContact O-OG 2.6Å; S118-S121 PolarHBondContact O-N 3.04Å; S118-S121 PolarHBondContact O-OG 2.66Å; S121-H124 WeakPolarHBondContact CA-ND1 3.06Å; S121-H124 PolarHBondContact O-CE1 3.15Å; S121-H124 PolarHBondContact O-ND1 3.1Å
122	R	87.5	Confident	84	Confident	157 Å²	157	68.7 Å²	68.7	59%	0.592	39%	0.386	S	S	*	.	H	α-helix	trans	-74	-33	-178.4	-168.3	171.1	-178	159.4	3.1	114.7	E71 S118 Y120	E71-R122 WeakPolarHBondContact OE1-CD 3.48Å; E71-R122 IonicContact OE1-CZ 3.94Å; E71-R122 IonicContact OE1-NE 3.62Å; E71-R122 IonicContact OE1-NH1 3.34Å; E71-R122 PolarHBondContact OE1-NH1 2.95Å; S118-R122 WeakPolarHBondContact O-CB 3.34Å; S118-R122 PolarHBondContact O-N 3.32Å; Y120-R122 PolarHBondContact O-N 2.91Å
123	F	89.6	Confident	84.3	Confident	4 Å²	4	66.1 Å²	66.1	2%	0.018	37%	0.368	C	S	.	.	H	α-helix	trans	-120.9	-18	-168.6	-58.8	-62.6	0	0	0	115.8	E71 F74 F100 F119 Y120 G125 M126	E71-F123 HydrophobicContact CG-CE2 3.77Å; E71-F123 HydrophobicContact CG-CZ 4.23Å; F74-F123 HydrophobicContact CD1-CB 4.38Å; F74-F123 AromaticContact CD1-CD1 3.83Å; F74-F123 HydrophobicContact CD1-CD1 3.83Å; F74-F123 AromaticContact CD1-CD2 3.72Å; F74-F123 HydrophobicContact CD1-CD2 3.72Å; F74-F123 AromaticContact CD1-CE1 3.95Å; F74-F123 HydrophobicContact CD1-CE1 3.95Å; F74-F123 AromaticContact CD1-CE2 3.82Å; F74-F123 HydrophobicContact CD1-CE2 3.82Å; F74-F123 AromaticContact CD1-CG 3.72Å; F74-F123 HydrophobicContact CD1-CG 3.72Å; F74-F123 AromaticContact CD1-CZ 3.96Å; F74-F123 HydrophobicContact CD1-CZ 3.96Å; F74-F123 HydrophobicContact CE1-CB 3.91Å; F74-F123 AromaticContact CE1-CD1 3.81Å; F74-F123 HydrophobicContact CE1-CD1 3.81Å; F74-F123 HydrophobicContact CE1-CD2 4.13Å; F74-F123 HydrophobicContact CE1-CE1 4.36Å; F74-F123 AromaticContact CE1-CG 3.69Å; F74-F123 HydrophobicContact CE1-CG 3.69Å; F100-F123 HydrophobicContact CD2-CB 3.92Å; F100-F123 HydrophobicContact CE2-CB 3.64Å; F119-F123 AromaticContact CD2-CD2 3.83Å; F119-F123 HydrophobicContact CD2-CD2 3.83Å; F119-F123 AromaticContact CD2-CE2 3.81Å; F119-F123 HydrophobicContact CD2-CE2 3.81Å; F119-F123 AromaticContact CE2-CD2 3.71Å; F119-F123 HydrophobicContact CE2-CD2 3.71Å; F119-F123 AromaticContact CE2-CE2 3.72Å; F119-F123 HydrophobicContact CE2-CE2 3.72Å; F119-F123 HydrophobicContact CG-CD2 4.44Å; F119-F123 HydrophobicContact CZ-CD2 4.22Å; F119-F123 WeakPolarHBondContact O-CD2 3.2Å; F119-F123 PolarHBondContact O-N 3.28Å; Y120-F123 PolarHBondContact O-N 3.28Å; F123-G125 PolarHBondContact O-N 3.03Å; F123-G125 VanDerWaalsContact O-N 3.13Å; F123-M126 PolarHBondContact O-N 2.85Å
124	H	87.3	Confident	84.4	Confident	56 Å²	56	64.7 Å²	64.7	26%	0.259	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-55.3	-35.1	-176	70.4	-72.2	0	0	0	113.8	F100 Y120 S121 M126 F127 I137	F100-H124 HydrophobicContact CZ-CB 4.35Å; Y120-H124 HydrophobicContact CD1-CB 4.28Å; Y120-H124 HydrophobicContact CD2-CB 4.17Å; Y120-H124 HydrophobicContact CE1-CB 3.95Å; Y120-H124 AromaticContact CE1-CG 3.83Å; Y120-H124 HydrophobicContact CE2-CB 3.83Å; Y120-H124 HydrophobicContact CG-CB 4.37Å; Y120-H124 VanDerWaalsContact O-CB 3.26Å; Y120-H124 WeakPolarHBondContact O-CB 3.24Å; Y120-H124 PolarHBondContact O-N 3.22Å; Y120-H124 PolarHBondContact O-ND1 3.18Å; S121-H124 WeakPolarHBondContact CA-ND1 3.06Å; S121-H124 PolarHBondContact O-CE1 3.15Å; S121-H124 PolarHBondContact O-ND1 3.1Å; H124-M126 PolarHBondContact O-N 3.39Å; H124-M126 VanDerWaalsContact O-N 3.08Å; H124-F127 PolarHBondContact O-N 3.46Å; H124-F127 VanDerWaalsContact O-N 3.1Å; H124-I137 HydrophobicContact CB-CG2 3.99Å
125	G	85.4	Confident	84.6	Confident	41 Å²	41	63.6 Å²	63.6	42%	0.423	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-58.2	-24.8	-176.3	0	0	0	0	0	114.8	F123 F127	F123-G125 PolarHBondContact O-N 3.03Å; F123-G125 VanDerWaalsContact O-N 3.13Å; G125-F127 VanDerWaalsContact C-N 3.28Å; G125-F127 PolarHBondContact O-N 3.09Å
126	M	84.6	Confident	84.7	Confident	49 Å²	49	62.8 Å²	62.8	24%	0.241	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-68.3	-26.5	179.2	-63.3	-173.2	69.5	0	0	113.6	R78 L96 F123 H124	R78-M126 WeakPolarHBondContact CD-SD 3.32Å; R78-M126 HydrophobicContact CG-CE 3.73Å; R78-M126 HydrophobicContact CG-SD 3.73Å; R78-M126 PolarHBondContact NE-SD 3.04Å; L96-M126 HydrophobicContact CD1-CE 4.44Å; F123-M126 PolarHBondContact O-N 2.85Å; H124-M126 PolarHBondContact O-N 3.39Å; H124-M126 VanDerWaalsContact O-N 3.08Å
127	F	85.6	Confident	84.8	Confident	11 Å²	11	62 Å²	62	5%	0.048	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-102.4	-4.7	-170.7	-55.5	-65.2	0	0	0	113	F74 L96 Y97 F100 H124 G125 Q129 I137	F74-F127 HydrophobicContact CZ-CE2 4.36Å; F74-F127 HydrophobicContact CZ-CZ 4.06Å; L96-F127 HydrophobicContact CB-CE1 4.24Å; L96-F127 HydrophobicContact CB-CZ 4.17Å; Y97-F127 VanDerWaalsContact CA-CE1 3.44Å; Y97-F127 HydrophobicContact CD2-CB 4.4Å; Y97-F127 AromaticContact CD2-CD1 3.86Å; Y97-F127 HydrophobicContact CD2-CD1 3.86Å; Y97-F127 HydrophobicContact CD2-CE1 4.39Å; Y97-F127 HydrophobicContact CD2-CG 4.14Å; Y97-F127 HydrophobicContact CG-CD1 4.39Å; F100-F127 HydrophobicContact CB-CD2 4.45Å; F100-F127 HydrophobicContact CB-CE2 3.57Å; F100-F127 HydrophobicContact CB-CZ 3.83Å; F100-F127 AromaticContact CD1-CD2 3.75Å; F100-F127 HydrophobicContact CD1-CD2 3.75Å; F100-F127 AromaticContact CD1-CE2 3.64Å; F100-F127 HydrophobicContact CD1-CE2 3.64Å; F100-F127 HydrophobicContact CD2-CE2 4.05Å; F100-F127 HydrophobicContact CE1-CD2 4.19Å; F100-F127 HydrophobicContact CE1-CE2 4.36Å; F100-F127 HydrophobicContact CG-CD2 4.07Å; F100-F127 AromaticContact CG-CE2 3.46Å; F100-F127 HydrophobicContact CG-CE2 3.46Å; F100-F127 VanDerWaalsContact CG-CE2 3.46Å; F100-F127 HydrophobicContact CG-CZ 4.24Å; H124-F127 PolarHBondContact O-N 3.46Å; H124-F127 VanDerWaalsContact O-N 3.1Å; G125-F127 VanDerWaalsContact C-N 3.28Å; G125-F127 PolarHBondContact O-N 3.09Å; F127-Q129 VanDerWaalsContact C-N 3.27Å; F127-Q129 PolarHBondContact O-N 3.44Å; F127-I137 HydrophobicContact CB-CD1 3.82Å; F127-I137 HydrophobicContact CB-CG1 3.76Å; F127-I137 HydrophobicContact CD2-CD1 4.01Å; F127-I137 HydrophobicContact CG-CD1 4.14Å
128	L	83.5	Confident	84.9	Confident	67 Å²	67	60 Å²	60	35%	0.351	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.7	-179.2	-62.5	178	0	0	0	113.6	K134 I137	L128-K134 HydrophobicContact CD2-CG 4.22Å; L128-I137 HydrophobicContact CD2-CG2 4.02Å
129	Q	79.6	Confident	84.7	Confident	174 Å²	174	59.4 Å²	59.4	81%	0.813	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-27.9	179.6	-61.7	-176.1	7.5	0	0	112.3	F127	F127-Q129 VanDerWaalsContact C-N 3.27Å; F127-Q129 PolarHBondContact O-N 3.44Å
130	N	81.2	Confident	84.6	Confident	83 Å²	83	59.4 Å²	59.4	44%	0.444	32%	0.321	S	S	.	.	S	Bend	trans	-92.8	115.7	-179.9	-71.4	-36.9	0	0	0	110.8	S132 Q133 K134	N130-S132 PolarHBondContact O-N 2.99Å; N130-S132 VanDerWaalsContact O-N 3.14Å; N130-Q133 HydrophobicContact CB-CB 4.01Å; N130-Q133 HydrophobicContact CB-CG 3.93Å; N130-Q133 PolarHBondContact ND2-OE1 3.17Å; N130-Q133 PolarHBondContact O-N 3.36Å; N130-K134 WeakPolarHBondContact O-CB 3.15Å; N130-K134 PolarHBondContact O-N 3.38Å
131	A	78	Confident	84.3	Confident	90 Å²	90	64.4 Å²	64.4	74%	0.744	35%	0.346	S	S	*	.	H	α-helix	trans	-57.8	-31.7	-177	0	0	0	0	0	113.9
132	S	78.2	Confident	83.9	Confident	100 Å²	100	65.9 Å²	65.9	70%	0.699	35%	0.352	S	S	*	.	H	α-helix	trans	-74.6	-27.5	177.7	55.7	0	0	0	0	113.8	N130	N130-S132 PolarHBondContact O-N 2.99Å; N130-S132 VanDerWaalsContact O-N 3.14Å
133	Q	84.2	Confident	83.5	Confident	27 Å²	27	58.6 Å²	58.6	13%	0.126	33%	0.325	C	S	.	.	H	α-helix	trans	-89.6	-35.1	-178.3	-64.6	178.6	-15.4	0	0	111	Y97 N130 D135 V136 I137	Y97-Q133 HydrophobicContact CD1-CG 4.08Å; Y97-Q133 HydrophobicContact CD2-CB 3.89Å; Y97-Q133 HydrophobicContact CD2-CG 3.68Å; Y97-Q133 HydrophobicContact CE1-CG 3.97Å; Y97-Q133 HydrophobicContact CE2-CB 3.49Å; Y97-Q133 VanDerWaalsContact CE2-CB 3.49Å; Y97-Q133 HydrophobicContact CE2-CG 3.56Å; Y97-Q133 HydrophobicContact CG-CG 3.94Å; N130-Q133 HydrophobicContact CB-CB 4.01Å; N130-Q133 HydrophobicContact CB-CG 3.93Å; N130-Q133 PolarHBondContact ND2-OE1 3.17Å; N130-Q133 PolarHBondContact O-N 3.36Å; Q133-D135 PolarHBondContact O-N 3.2Å; Q133-V136 PolarHBondContact O-N 2.95Å; Q133-V136 VanDerWaalsContact O-N 3.13Å; Q133-I137 VanDerWaalsContact O-CG1 3.29Å; Q133-I137 WeakPolarHBondContact O-CG1 3.47Å; Q133-I137 PolarHBondContact O-N 3.05Å; Q133-I137 VanDerWaalsContact O-N 3.09Å
134	K	83.9	Confident	82.9	Confident	92 Å²	92	63.3 Å²	63.3	40%	0.4	35%	0.347	S	S	.	.	H	α-helix	trans	-51.2	-47.6	-175.9	-176.8	175.6	173.6	178.4	0	114	L128 N130 V136 I137 E138	L128-K134 HydrophobicContact CD2-CG 4.22Å; N130-K134 WeakPolarHBondContact O-CB 3.15Å; N130-K134 PolarHBondContact O-N 3.38Å; K134-V136 VanDerWaalsContact C-N 3.33Å; K134-V136 PolarHBondContact O-N 3Å; K134-I137 PolarHBondContact O-N 3.34Å; K134-E138 WeakPolarHBondContact CE-OE1 3.47Å; K134-E138 HydrophobicContact CG-CG 4.42Å; K134-E138 IonicContact NZ-OE1 3.59Å; K134-E138 WeakPolarHBondContact O-CG 3.39Å; K134-E138 PolarHBondContact O-N 3Å
135	D	84.1	Confident	82.6	Confident	63 Å²	63	63.2 Å²	63.2	34%	0.337	35%	0.35	S	S	.	.	H	α-helix	trans	-61.9	-38.3	-178.9	177.1	45.3	0	0	0	112.6	Q133 Q139 K154	Q133-D135 PolarHBondContact O-N 3.2Å; D135-Q139 WeakPolarHBondContact O-CG 3.43Å; D135-Q139 PolarHBondContact O-N 3.47Å; D135-Q139 VanDerWaalsContact O-N 3.16Å; D135-Q139 PolarHBondContact OD1-NE2 3.02Å; D135-Q139 PolarHBondContact OD2-NE2 3.48Å; D135-K154 IonicContact OD2-NZ 2.58Å; D135-K154 PolarHBondContact OD2-NZ 3.37Å
136	V	85.2	Confident	82.2	Confident	10 Å²	10	65.3 Å²	65.3	6%	0.061	35%	0.351	C	S	.	.	H	α-helix	trans	-70.7	-39.7	176.6	179.1	0	0	0	0	110.7	Y97 Q133 K134 Q139 L140 L155 F158	Y97-V136 WeakPolarHBondContact OH-CB 3.42Å; Q133-V136 PolarHBondContact O-N 2.95Å; Q133-V136 VanDerWaalsContact O-N 3.13Å; K134-V136 VanDerWaalsContact C-N 3.33Å; K134-V136 PolarHBondContact O-N 3Å; V136-Q139 WeakPolarHBondContact O-CB 3.43Å; V136-Q139 PolarHBondContact O-N 3.19Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.42Å; V136-L155 HydrophobicContact CG1-CD2 3.92Å; V136-F158 HydrophobicContact CG1-CE2 3.98Å; V136-F158 HydrophobicContact CG1-CZ 4.47Å; V136-F158 HydrophobicContact CG2-CE2 4.22Å
137	I	87.4	Confident	82	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-66.4	-43.2	-179.9	-61.1	-73	0	0	0	110.9	Y97 F100 Y120 H124 F127 L128 Q133 K134 Q139 L140 Q141	Y97-I137 HydrophobicContact CD2-CD1 4.44Å; Y97-I137 HydrophobicContact CE2-CD1 4.06Å; Y97-I137 HydrophobicContact CE2-CG1 4.24Å; F100-I137 HydrophobicContact CD1-CD1 3.61Å; F100-I137 HydrophobicContact CE1-CD1 3.52Å; Y120-I137 HydrophobicContact CE2-CG2 4.11Å; Y120-I137 WeakPolarHBondContact CE2-O 3.37Å; Y120-I137 PolarHBondContact OH-O 3.36Å; Y120-I137 VanDerWaalsContact OH-O 3.09Å; H124-I137 HydrophobicContact CB-CG2 3.99Å; F127-I137 HydrophobicContact CB-CD1 3.82Å; F127-I137 HydrophobicContact CB-CG1 3.76Å; F127-I137 HydrophobicContact CD2-CD1 4.01Å; F127-I137 HydrophobicContact CG-CD1 4.14Å; L128-I137 HydrophobicContact CD2-CG2 4.02Å; Q133-I137 VanDerWaalsContact O-CG1 3.29Å; Q133-I137 WeakPolarHBondContact O-CG1 3.47Å; Q133-I137 PolarHBondContact O-N 3.05Å; Q133-I137 VanDerWaalsContact O-N 3.09Å; K134-I137 PolarHBondContact O-N 3.34Å; I137-Q139 VanDerWaalsContact C-N 3.28Å; I137-Q139 PolarHBondContact O-N 3.48Å; I137-L140 HydrophobicContact CD1-CD1 4.32Å; I137-L140 WeakPolarHBondContact O-CB 3.31Å; I137-L140 PolarHBondContact O-N 3.39Å; I137-L140 VanDerWaalsContact O-N 3.14Å; I137-Q141 PolarHBondContact O-N 3.24Å
138	E	85.4	Confident	81.8	Confident	91 Å²	91	72.5 Å²	72.5	43%	0.425	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-36.1	174.5	-72.4	177.2	176.3	0	0	111.6	K134 Q141	K134-E138 WeakPolarHBondContact CE-OE1 3.47Å; K134-E138 HydrophobicContact CG-CG 4.42Å; K134-E138 IonicContact NZ-OE1 3.59Å; K134-E138 WeakPolarHBondContact O-CG 3.39Å; K134-E138 PolarHBondContact O-N 3Å; E138-Q141 WeakPolarHBondContact O-CB 3.28Å; E138-Q141 PolarHBondContact O-N 3.04Å
139	Q	83.6	Confident	81.7	Confident	38 Å²	38	69.4 Å²	69.4	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-67	-37.1	173.5	-71.5	168.9	20.8	0	0	112.6	D135 V136 I137 Q141 T142 T143 N152	D135-Q139 WeakPolarHBondContact O-CG 3.43Å; D135-Q139 PolarHBondContact O-N 3.47Å; D135-Q139 VanDerWaalsContact O-N 3.16Å; D135-Q139 PolarHBondContact OD1-NE2 3.02Å; D135-Q139 PolarHBondContact OD2-NE2 3.48Å; V136-Q139 WeakPolarHBondContact O-CB 3.43Å; V136-Q139 PolarHBondContact O-N 3.19Å; I137-Q139 VanDerWaalsContact C-N 3.28Å; I137-Q139 PolarHBondContact O-N 3.48Å; Q139-Q141 PolarHBondContact O-N 2.95Å; Q139-T142 PolarHBondContact O-N 3.39Å; Q139-T142 VanDerWaalsContact O-N 3.09Å; Q139-T142 PolarHBondContact O-OG1 3.18Å; Q139-T143 WeakPolarHBondContact O-CG2 3.39Å; Q139-T143 PolarHBondContact O-N 2.92Å; Q139-N152 PolarHBondContact OE1-ND2 3.34Å
140	L	84.6	Confident	81.6	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-63.4	-25.5	176.8	-70.7	177.6	0	0	0	113.4	F100 V101 H104 L105 Y120 V136 I137 T142 T143 L155	F100-L140 HydrophobicContact CE1-CD1 4.33Å; V101-L140 HydrophobicContact CB-CD1 4.45Å; V101-L140 HydrophobicContact CG1-CD1 4.35Å; V101-L140 HydrophobicContact CG2-CD1 4.1Å; H104-L140 PolarHBondContact NE2-O 2.89Å; L105-L140 HydrophobicContact CD2-CD2 3.95Å; L105-L140 HydrophobicContact CG-CD2 4.38Å; Y120-L140 HydrophobicContact CD2-CB 4.45Å; Y120-L140 HydrophobicContact CE2-CB 4.11Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.42Å; I137-L140 HydrophobicContact CD1-CD1 4.32Å; I137-L140 WeakPolarHBondContact O-CB 3.31Å; I137-L140 PolarHBondContact O-N 3.39Å; I137-L140 VanDerWaalsContact O-N 3.14Å; L140-T142 VanDerWaalsContact C-N 3.28Å; L140-T142 PolarHBondContact O-N 3.42Å; L140-T143 WeakPolarHBondContact CA-OG1 3.37Å; L140-T143 PolarHBondContact O-N 3.25Å; L140-T143 PolarHBondContact O-OG1 3.16Å; L140-L155 HydrophobicContact CD2-CD1 3.97Å; L140-L155 HydrophobicContact CD2-CD2 3.49Å; L140-L155 VanDerWaalsContact CD2-CD2 3.49Å; L140-L155 HydrophobicContact CD2-CG 4.39Å; L140-L155 HydrophobicContact CG-CD2 4.18Å
141	Q	83.6	Confident	81.6	Confident	126 Å²	126	66.4 Å²	66.4	59%	0.589	37%	0.366	S	S	*	.	H	α-helix	trans	-64.1	-36.5	173.5	-167	176.6	-0.7	0	0	112	Y120 I137 E138 Q139	Y120-Q141 HydrophobicContact CE1-CB 3.94Å; Y120-Q141 HydrophobicContact CE1-CG 3.83Å; Y120-Q141 HydrophobicContact CE2-CB 4.31Å; I137-Q141 PolarHBondContact O-N 3.24Å; E138-Q141 WeakPolarHBondContact O-CB 3.28Å; E138-Q141 PolarHBondContact O-N 3.04Å; Q139-Q141 PolarHBondContact O-N 2.95Å
142	T	80.3	Confident	81.9	Confident	103 Å²	103	63.3 Å²	63.3	63%	0.632	34%	0.337	S	S	*	.	H	α-helix	trans	-85.2	-12.2	-176.4	63.3	0	0	0	0	113.3	Q139 L140 Q144	Q139-T142 PolarHBondContact O-N 3.39Å; Q139-T142 VanDerWaalsContact O-N 3.09Å; Q139-T142 PolarHBondContact O-OG1 3.18Å; L140-T142 VanDerWaalsContact C-N 3.28Å; L140-T142 PolarHBondContact O-N 3.42Å; T142-Q144 PolarHBondContact O-N 3.05Å
143	T	79	Confident	82	Confident	5 Å²	5	66 Å²	66	3%	0.031	34%	0.337	C	S	.	.			trans	-89.5	105.3	-177	55.6	0	0	0	0	111.2	Q139 L140 D148 L155	Q139-T143 WeakPolarHBondContact O-CG2 3.39Å; Q139-T143 PolarHBondContact O-N 2.92Å; L140-T143 WeakPolarHBondContact CA-OG1 3.37Å; L140-T143 PolarHBondContact O-N 3.25Å; L140-T143 PolarHBondContact O-OG1 3.16Å; T143-D148 HydrophobicContact CG2-CB 4.16Å; T143-L155 HydrophobicContact CG2-CD1 3.44Å; T143-L155 VanDerWaalsContact CG2-CD1 3.44Å
144	Q	76.6	Confident	81.7	Confident	103 Å²	103	68 Å²	68	48%	0.481	35%	0.345	S	S	.	.			trans	-112.9	-16.2	-179.8	-63.7	-167.4	2.7	0	0	113.5	T142 D148	T142-Q144 PolarHBondContact O-N 3.05Å; Q144-D148 PolarHBondContact N-OD2 3.37Å
145	T	80.4	Confident	81.6	Confident	53 Å²	53	63.6 Å²	63.6	33%	0.325	33%	0.326	S	S	.	.	S	Bend	trans	-130.1	160.3	-177.6	72.3	0	0	0	0	111.7	Q147 D148 I149	T145-Q147 PolarHBondContact O-N 3.12Å; T145-D148 WeakPolarHBondContact CB-OD2 3.48Å; T145-D148 PolarHBondContact N-OD2 2.94Å; T145-D148 WeakPolarHBondContact O-CB 3.34Å; T145-D148 PolarHBondContact O-N 3.49Å; T145-D148 PolarHBondContact OG1-N 3.29Å; T145-D148 PolarHBondContact OG1-OD1 3.44Å; T145-D148 PolarHBondContact OG1-OD2 2.76Å; T145-I149 PolarHBondContact O-N 3.38Å
146	I	78.3	Confident	81.5	Confident	86 Å²	86	66.6 Å²	66.6	44%	0.441	33%	0.332	S	S	.	.	H	α-helix	trans	-59.4	-32	175.1	-59.5	174.6	0	0	0	111.1	Q109 D148 I149 L150	Q109-I146 HydrophobicContact CG-CG1 4.24Å; I146-D148 VanDerWaalsContact C-N 3.32Å; I146-D148 PolarHBondContact O-N 2.96Å; I146-I149 PolarHBondContact O-N 3.4Å; I146-L150 HydrophobicContact CG2-CD1 4.32Å; I146-L150 WeakPolarHBondContact O-CG 3.48Å; I146-L150 PolarHBondContact O-N 3.44Å; I146-L150 VanDerWaalsContact O-N 3.16Å
147	Q	79.1	Confident	81.2	Confident	157 Å²	157	68.1 Å²	68.1	73%	0.734	35%	0.346	S	S	*	.	H	α-helix	trans	-67.8	-32.1	176.9	-68.6	-177.3	-14	0	0	112.3	T145 I149 L150 S151	T145-Q147 PolarHBondContact O-N 3.12Å; Q147-I149 VanDerWaalsContact C-N 3.34Å; Q147-L150 PolarHBondContact O-N 3.16Å; Q147-S151 WeakPolarHBondContact O-CB 3.39Å; Q147-S151 PolarHBondContact O-N 3.11Å; Q147-S151 PolarHBondContact O-OG 2.89Å
148	D	81.8	Confident	81	Confident	54 Å²	54	69.6 Å²	69.6	29%	0.289	35%	0.352	S	S	.	.	H	α-helix	trans	-70.1	-33.2	175.7	-53.3	-37	0	0	0	111.8	T143 Q144 T145 I146 S151 N152	T143-D148 HydrophobicContact CG2-CB 4.16Å; Q144-D148 PolarHBondContact N-OD2 3.37Å; T145-D148 WeakPolarHBondContact CB-OD2 3.48Å; T145-D148 PolarHBondContact N-OD2 2.94Å; T145-D148 WeakPolarHBondContact O-CB 3.34Å; T145-D148 PolarHBondContact O-N 3.49Å; T145-D148 PolarHBondContact OG1-N 3.29Å; T145-D148 PolarHBondContact OG1-OD1 3.44Å; T145-D148 PolarHBondContact OG1-OD2 2.76Å; I146-D148 VanDerWaalsContact C-N 3.32Å; I146-D148 PolarHBondContact O-N 2.96Å; D148-S151 PolarHBondContact O-OG 2.71Å; D148-S151 VanDerWaalsContact O-OG 3.05Å; D148-N152 PolarHBondContact O-N 3.27Å
149	I	80.9	Confident	80.8	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-67.1	-43.7	174	-61.2	173.5	0	0	0	110.3	L105 V108 Q109 T145 I146 Q147 S151 N152 L155 L159	L105-I149 HydrophobicContact CD2-CD1 3.87Å; L105-I149 HydrophobicContact CD2-CG1 3.94Å; L105-I149 HydrophobicContact CD2-CG2 4.14Å; V108-I149 HydrophobicContact CB-CD1 3.96Å; V108-I149 HydrophobicContact CG1-CD1 3.61Å; V108-I149 HydrophobicContact CG1-CG1 4.24Å; Q109-I149 HydrophobicContact CG-CD1 4.4Å; T145-I149 PolarHBondContact O-N 3.38Å; I146-I149 PolarHBondContact O-N 3.4Å; Q147-I149 VanDerWaalsContact C-N 3.34Å; I149-S151 VanDerWaalsContact C-N 3.35Å; I149-N152 PolarHBondContact O-N 3.46Å; I149-L155 HydrophobicContact CG2-CB 4.45Å; I149-L159 HydrophobicContact CG2-CD1 3.55Å
150	L	77.2	Confident	80.6	Confident	98 Å²	98	71 Å²	71	51%	0.513	36%	0.364	S	S	.	.	H	α-helix	trans	-72.8	-26.3	-177	-67.9	175	0	0	0	113.3	I146 Q147	I146-L150 HydrophobicContact CG2-CD1 4.32Å; I146-L150 WeakPolarHBondContact O-CG 3.48Å; I146-L150 PolarHBondContact O-N 3.44Å; I146-L150 VanDerWaalsContact O-N 3.16Å; Q147-L150 PolarHBondContact O-N 3.16Å
151	S	82.8	Confident	80.4	Confident	95 Å²	95	75.9 Å²	75.9	66%	0.664	39%	0.39	S	S	*	.	H	α-helix	trans	-79.5	-26	176.9	67.3	0	0	0	0	112.9	Q147 D148 I149 F153	Q147-S151 WeakPolarHBondContact O-CB 3.39Å; Q147-S151 PolarHBondContact O-N 3.11Å; Q147-S151 PolarHBondContact O-OG 2.89Å; D148-S151 PolarHBondContact O-OG 2.71Å; D148-S151 VanDerWaalsContact O-OG 3.05Å; I149-S151 VanDerWaalsContact C-N 3.35Å; S151-F153 PolarHBondContact O-N 3.34Å
152	N	83.3	Confident	80.4	Confident	26 Å²	26	76 Å²	76	14%	0.139	39%	0.389	C	S	.	.			trans	-86.1	111.1	177	-172.3	-32.2	0	0	0	111.7	Q139 D148 I149 K154 L155 R156	Q139-N152 PolarHBondContact OE1-ND2 3.34Å; D148-N152 PolarHBondContact O-N 3.27Å; I149-N152 PolarHBondContact O-N 3.46Å; N152-K154 VanDerWaalsContact C-N 3.27Å; N152-K154 PolarHBondContact O-N 3.2Å; N152-K154 WeakPolarHBondContact OD1-CB 3.34Å; N152-K154 PolarHBondContact OD1-N 3.25Å; N152-L155 HydrophobicContact CB-CB 4.22Å; N152-L155 HydrophobicContact CB-CD1 4.06Å; N152-L155 HydrophobicContact CB-CG 4.22Å; N152-L155 PolarHBondContact O-N 3.04Å; N152-L155 PolarHBondContact OD1-N 3.38Å; N152-R156 VanDerWaalsContact O-CB 3.3Å; N152-R156 WeakPolarHBondContact O-CB 3.28Å; N152-R156 PolarHBondContact O-N 3.13Å
153	F	79.6	Confident	80.6	Confident	157 Å²	157	74.8 Å²	74.8	69%	0.689	37%	0.373	S	S	*	.	H	α-helix	trans	-60.3	-31.7	-178.7	78.9	-88.5	0	0	0	113.9	S151 A157	S151-F153 PolarHBondContact O-N 3.34Å; F153-A157 VanDerWaalsContact O-CB 3.31Å; F153-A157 WeakPolarHBondContact O-CB 3.43Å; F153-A157 PolarHBondContact O-N 3.45Å
154	K	79.8	Confident	80.9	Confident	68 Å²	68	78.1 Å²	78.1	30%	0.296	39%	0.393	S	S	.	.	H	α-helix	trans	-73.7	-47	-179.6	-64.8	-171	-178.5	-174.2	0	111.2	D135 N152 R156 A157 F158	D135-K154 IonicContact OD2-NZ 2.58Å; D135-K154 PolarHBondContact OD2-NZ 3.37Å; N152-K154 VanDerWaalsContact C-N 3.27Å; N152-K154 PolarHBondContact O-N 3.2Å; N152-K154 WeakPolarHBondContact OD1-CB 3.34Å; N152-K154 PolarHBondContact OD1-N 3.25Å; K154-R156 VanDerWaalsContact C-N 3.34Å; K154-A157 WeakPolarHBondContact O-CB 3.26Å; K154-A157 PolarHBondContact O-N 3.24Å; K154-A157 VanDerWaalsContact O-N 3.13Å; K154-F158 VanDerWaalsContact O-CD2 3.29Å; K154-F158 WeakPolarHBondContact O-CD2 3.45Å; K154-F158 PolarHBondContact O-N 3.46Å; K154-F158 VanDerWaalsContact O-N 3.09Å
155	L	81.8	Confident	81.4	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-68.2	-36.4	179	-62.2	178.1	0	0	0	112	L105 V136 L140 T143 I149 N152 A157 F158 L159	L105-L155 HydrophobicContact CD2-CB 4.45Å; L105-L155 HydrophobicContact CD2-CD1 4.46Å; L105-L155 HydrophobicContact CD2-CD2 4.45Å; V136-L155 HydrophobicContact CG1-CD2 3.92Å; L140-L155 HydrophobicContact CD2-CD1 3.97Å; L140-L155 HydrophobicContact CD2-CD2 3.49Å; L140-L155 VanDerWaalsContact CD2-CD2 3.49Å; L140-L155 HydrophobicContact CD2-CG 4.39Å; L140-L155 HydrophobicContact CG-CD2 4.18Å; T143-L155 HydrophobicContact CG2-CD1 3.44Å; T143-L155 VanDerWaalsContact CG2-CD1 3.44Å; I149-L155 HydrophobicContact CG2-CB 4.45Å; N152-L155 HydrophobicContact CB-CB 4.22Å; N152-L155 HydrophobicContact CB-CD1 4.06Å; N152-L155 HydrophobicContact CB-CG 4.22Å; N152-L155 PolarHBondContact O-N 3.04Å; N152-L155 PolarHBondContact OD1-N 3.38Å; L155-A157 VanDerWaalsContact C-N 3.33Å; L155-F158 WeakPolarHBondContact O-CB 3.48Å; L155-F158 PolarHBondContact O-N 3.26Å; L155-L159 PolarHBondContact O-N 2.93Å
156	R	80.9	Confident	81.6	Confident	125 Å²	125	80 Å²	80	47%	0.472	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-42.5	168.8	-177.2	174.8	177.4	164.4	2	111.9	N152 K154 F158 L159 D160	N152-R156 VanDerWaalsContact O-CB 3.3Å; N152-R156 WeakPolarHBondContact O-CB 3.28Å; N152-R156 PolarHBondContact O-N 3.13Å; K154-R156 VanDerWaalsContact C-N 3.34Å; R156-F158 VanDerWaalsContact C-N 3.25Å; R156-F158 PolarHBondContact O-N 3.03Å; R156-L159 PolarHBondContact O-N 3.49Å; R156-D160 WeakPolarHBondContact CG-OD2 3.38Å; R156-D160 IonicContact NE-OD2 3.44Å; R156-D160 PolarHBondContact NE-OD2 3.09Å; R156-D160 WeakPolarHBondContact O-CB 3.36Å; R156-D160 PolarHBondContact O-N 3.42Å
157	A	79.1	Confident	82	Confident	43 Å²	43	76.1 Å²	76.1	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-29.2	176.1	0	0	0	0	0	113.3	F153 K154 L155 N161	F153-A157 VanDerWaalsContact O-CB 3.31Å; F153-A157 WeakPolarHBondContact O-CB 3.43Å; F153-A157 PolarHBondContact O-N 3.45Å; K154-A157 WeakPolarHBondContact O-CB 3.26Å; K154-A157 PolarHBondContact O-N 3.24Å; K154-A157 VanDerWaalsContact O-N 3.13Å; L155-A157 VanDerWaalsContact C-N 3.33Å; A157-N161 WeakPolarHBondContact O-CB 3.35Å; A157-N161 PolarHBondContact O-N 3.15Å; A157-N161 VanDerWaalsContact O-N 3.15Å; A157-N161 PolarHBondContact O-ND2 3.24Å
158	F	82.8	Confident	82.3	Confident	30 Å²	30	73.2 Å²	73.2	13%	0.132	36%	0.358	C	S	.	.	H	α-helix	trans	-67.2	-41.2	169	-85.4	-88.9	0	0	0	111.8	Y97 V101 Y102 L105 V136 K154 L155 R156 Y163	Y97-F158 HydrophobicContact CE1-CZ 4.26Å; V101-F158 HydrophobicContact CG1-CD1 4.1Å; V101-F158 HydrophobicContact CG1-CE1 4.28Å; V101-F158 HydrophobicContact CG1-CG 4.24Å; Y102-F158 HydrophobicContact CE1-CB 4.11Å; Y102-F158 HydrophobicContact CE1-CD1 4.45Å; Y102-F158 VanDerWaalsContact CE1-O 3.24Å; Y102-F158 WeakPolarHBondContact CE1-O 3.35Å; Y102-F158 HydrophobicContact CE2-CD1 4.48Å; Y102-F158 AromaticContact CZ-CD1 3.99Å; Y102-F158 PolarHBondContact OH-O 3.43Å; L105-F158 HydrophobicContact CD1-CB 4.47Å; V136-F158 HydrophobicContact CG1-CE2 3.98Å; V136-F158 HydrophobicContact CG1-CZ 4.47Å; V136-F158 HydrophobicContact CG2-CE2 4.22Å; K154-F158 VanDerWaalsContact O-CD2 3.29Å; K154-F158 WeakPolarHBondContact O-CD2 3.45Å; K154-F158 PolarHBondContact O-N 3.46Å; K154-F158 VanDerWaalsContact O-N 3.09Å; L155-F158 WeakPolarHBondContact O-CB 3.48Å; L155-F158 PolarHBondContact O-N 3.26Å; R156-F158 VanDerWaalsContact C-N 3.25Å; R156-F158 PolarHBondContact O-N 3.03Å; F158-Y163 HydrophobicContact CD1-CD2 4.05Å; F158-Y163 AromaticContact CE1-CD2 3.47Å; F158-Y163 HydrophobicContact CE1-CD2 3.47Å; F158-Y163 VanDerWaalsContact CE1-CD2 3.47Å; F158-Y163 AromaticContact CE1-CE2 3.65Å; F158-Y163 HydrophobicContact CE1-CE2 3.65Å; F158-Y163 HydrophobicContact CZ-CD2 4.36Å; F158-Y163 HydrophobicContact CZ-CE2 4.16Å
159	L	81.2	Confident	82.2	Confident	50 Å²	50	74.3 Å²	74.3	26%	0.262	36%	0.361	S	S	.	.	H	α-helix	trans	-70.9	-35.5	178	-67.3	178	0	0	0	113	L105 I149 L155 R156	L105-L159 HydrophobicContact CD1-CD2 4.06Å; L105-L159 HydrophobicContact CD1-CG 4.24Å; I149-L159 HydrophobicContact CG2-CD1 3.55Å; L155-L159 PolarHBondContact O-N 2.93Å; R156-L159 PolarHBondContact O-N 3.49Å
160	D	79.8	Confident	82.2	Confident	108 Å²	108	78.4 Å²	78.4	58%	0.578	38%	0.383	S	S	*	.	H	α-helix	trans	-79.8	-21.3	-176.9	-69.4	-18.2	0	0	0	112.7	R156	R156-D160 WeakPolarHBondContact CG-OD2 3.38Å; R156-D160 IonicContact NE-OD2 3.44Å; R156-D160 PolarHBondContact NE-OD2 3.09Å; R156-D160 WeakPolarHBondContact O-CB 3.36Å; R156-D160 PolarHBondContact O-N 3.42Å
161	N	80.5	Confident	82.5	Confident	105 Å²	105	73.7 Å²	73.7	56%	0.561	36%	0.358	S	S	*	.	S	Bend	trans	-125.5	139.1	-177.2	-57.7	-70.5	0	0	0	112.6	Y102 A157 Y163	Y102-N161 PolarHBondContact OH-O 3.1Å; A157-N161 WeakPolarHBondContact O-CB 3.35Å; A157-N161 PolarHBondContact O-N 3.15Å; A157-N161 VanDerWaalsContact O-N 3.15Å; A157-N161 PolarHBondContact O-ND2 3.24Å; N161-Y163 PolarHBondContact O-N 3.04Å
162	K	83.6	Confident	82.6	Confident	128 Å²	128	71.2 Å²	71.2	56%	0.557	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-70.5	131.5	171.9	-66.1	-169.4	177.5	-166.2	0	110.7	V164 L193 H194 H196	K162-V164 PolarHBondContact O-N 3.16Å; K162-L193 WeakPolarHBondContact CE-O 3.32Å; K162-H194 WeakPolarHBondContact CA-O 3.32Å; K162-H196 HydrophobicContact CB-CB 4.26Å
163	Y	84.6	Confident	82.6	Confident	77 Å²	77	72.9 Å²	72.9	30%	0.302	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	122.2	176.7	-163.7	-82.4	0	0	0	109.7	Y97 P98 F158 N161 V165 H194 I195 H196	Y97-Y163 HydrophobicContact CE1-CE2 4.26Å; P98-Y163 HydrophobicContact CB-CD1 3.52Å; P98-Y163 HydrophobicContact CB-CD2 4.11Å; P98-Y163 HydrophobicContact CB-CE1 3.86Å; P98-Y163 HydrophobicContact CB-CE2 4.39Å; P98-Y163 HydrophobicContact CB-CG 3.64Å; P98-Y163 HydrophobicContact CG-CD1 3.69Å; P98-Y163 HydrophobicContact CG-CE1 3.75Å; P98-Y163 HydrophobicContact CG-CG 4.34Å; F158-Y163 HydrophobicContact CD1-CD2 4.05Å; F158-Y163 AromaticContact CE1-CD2 3.47Å; F158-Y163 HydrophobicContact CE1-CD2 3.47Å; F158-Y163 VanDerWaalsContact CE1-CD2 3.47Å; F158-Y163 AromaticContact CE1-CE2 3.65Å; F158-Y163 HydrophobicContact CE1-CE2 3.65Å; F158-Y163 HydrophobicContact CZ-CD2 4.36Å; F158-Y163 HydrophobicContact CZ-CE2 4.16Å; N161-Y163 PolarHBondContact O-N 3.04Å; Y163-V165 HydrophobicContact CD1-CG2 3.72Å; Y163-V165 HydrophobicContact CE1-CG2 3.95Å; Y163-H194 PolarHBondContact N-O 3.06Å; Y163-I195 CarbonylContact O-C 3.6Å; Y163-I195 WeakPolarHBondContact O-CA 3.37Å; Y163-H196 PolarHBondContact O-N 3.42Å
164	V	85.7	Confident	82.8	Confident	76 Å²	76	67.7 Å²	67.7	46%	0.461	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.5	-178.1	-176.4	0	0	0	0	109.9	K162 H196 D198	K162-V164 PolarHBondContact O-N 3.16Å; V164-H196 WeakPolarHBondContact CA-O 3.35Å; V164-H196 HydrophobicContact CG2-CB 4.33Å; V164-D198 HydrophobicContact CG1-CB 4.02Å
165	V	86.1	Confident	83.1	Confident	10 Å²	10	64.6 Å²	64.6	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.4	171.8	-176.9	0	0	0	0	108.3	L95 P98 Y163 L167 I195 H196 L197 D198	L95-V165 HydrophobicContact CD1-CB 4.21Å; L95-V165 HydrophobicContact CD1-CG1 4.25Å; L95-V165 HydrophobicContact CD1-CG2 3.8Å; P98-V165 HydrophobicContact CG-CG2 4.03Å; Y163-V165 HydrophobicContact CD1-CG2 3.72Å; Y163-V165 HydrophobicContact CE1-CG2 3.95Å; V165-L167 HydrophobicContact CG1-CD2 4.27Å; V165-L167 HydrophobicContact CG1-CG 4.25Å; V165-I195 HydrophobicContact CG2-CG2 4.07Å; V165-H196 PolarHBondContact N-O 3.09Å; V165-L197 HydrophobicContact CB-CD2 4.02Å; V165-L197 WeakPolarHBondContact O-CA 3.34Å; V165-D198 PolarHBondContact O-N 2.79Å
166	R	86	Confident	83.1	Confident	185 Å²	185	66.1 Å²	66.1	70%	0.698	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	124.9	178.5	-65.5	-178.7	178.6	152.8	3.7	109.5	D198	R166-D198 WeakPolarHBondContact CA-O 3.3Å; R166-D198 HydrophobicContact CG-CB 4.12Å; R166-D198 IonicContact NE-OD2 2.92Å
167	L	85.3	Confident	83.1	Confident	5 Å²	5	68.8 Å²	68.8	3%	0.026	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.2	177.2	-64.6	175.8	0	0	0	109.5	E91 V92 V165 L175 L197 D198 V199 Q200	E91-L167 VanDerWaalsContact O-CD2 3.31Å; E91-L167 WeakPolarHBondContact O-CD2 3.47Å; V92-L167 HydrophobicContact CG2-CD2 4.28Å; V165-L167 HydrophobicContact CG1-CD2 4.27Å; V165-L167 HydrophobicContact CG1-CG 4.25Å; L167-L175 HydrophobicContact CD1-CD2 3.96Å; L167-L197 HydrophobicContact CD1-CD2 4.01Å; L167-D198 PolarHBondContact N-O 3.48Å; L167-V199 WeakPolarHBondContact O-CA 2.93Å; L167-Q200 PolarHBondContact O-N 2.8Å
168	Q	85.3	Confident	83.4	Confident	96 Å²	96	67.5 Å²	67.5	45%	0.449	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	156.6	165.7	-61.4	-174	14.7	0	0	110	E91 D170 S171 Y172	E91-Q168 PolarHBondContact OE1-NE2 3.25Å; E91-Q168 WeakPolarHBondContact OE2-CG 3.45Å; Q168-D170 VanDerWaalsContact C-N 3.29Å; Q168-D170 PolarHBondContact O-N 3.07Å; Q168-S171 PolarHBondContact O-N 3.21Å; Q168-Y172 WeakPolarHBondContact O-CB 3.48Å; Q168-Y172 PolarHBondContact O-N 3.39Å
169	E	80.5	Confident	83.4	Confident	76 Å²	76	67.1 Å²	67.1	36%	0.355	31%	0.309	S	S	.	.	H	α-helix	trans	-54.7	-42	-179.6	-168.9	173.4	178.1	0	0	112.8	Y172 N173 V199 Q200	E169-Y172 PolarHBondContact O-N 2.5Å; E169-N173 VanDerWaalsContact O-CG 3.29Å; E169-N173 PolarHBondContact O-N 3.33Å; E169-N173 PolarHBondContact O-ND2 3.21Å; E169-N173 VanDerWaalsContact O-ND2 3.11Å; E169-V199 HydrophobicContact CB-CG1 4.18Å; E169-V199 HydrophobicContact CG-CG1 4.5Å; E169-Q200 PolarHBondContact N-O 2.8Å
170	D	80.1	Confident	83.3	Confident	88 Å²	88	70.2 Å²	70.2	47%	0.471	32%	0.323	S	S	.	.	H	α-helix	trans	-68.9	-40.9	179.2	-65	-35.1	0	0	0	112.6	Q168 N173 Y174	Q168-D170 VanDerWaalsContact C-N 3.29Å; Q168-D170 PolarHBondContact O-N 3.07Å; D170-N173 PolarHBondContact O-N 3.17Å; D170-Y174 WeakPolarHBondContact O-CB 3.29Å; D170-Y174 PolarHBondContact O-N 3.44Å
171	S	85.1	Confident	83	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-68.4	-34.6	176.4	-61.5	0	0	0	0	112	E91 V92 Q168 Y174 L175	E91-S171 WeakPolarHBondContact OE2-CB 3.12Å; E91-S171 PolarHBondContact OE2-OG 3.25Å; V92-S171 WeakPolarHBondContact CG2-O 3.04Å; Q168-S171 PolarHBondContact O-N 3.21Å; S171-Y174 PolarHBondContact O-N 3.22Å; S171-L175 PolarHBondContact O-N 3.28Å
172	Y	84.8	Confident	82.6	Confident	43 Å²	43	67.8 Å²	67.8	17%	0.169	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-45.9	170.6	174.7	-97.9	0	0	0	111.3	C54 Q168 E169 Y174 L175 I176 L197 V199	C54-Y172 PolarHBondContact SG-OH 3.11Å; C54-Y172 VanDerWaalsContact SG-OH 3.4Å; Q168-Y172 WeakPolarHBondContact O-CB 3.48Å; Q168-Y172 PolarHBondContact O-N 3.39Å; E169-Y172 PolarHBondContact O-N 2.5Å; Y172-Y174 VanDerWaalsContact C-N 3.31Å; Y172-Y174 PolarHBondContact O-N 3.19Å; Y172-L175 PolarHBondContact O-N 3.24Å; Y172-I176 HydrophobicContact CD1-CG1 4.17Å; Y172-I176 HydrophobicContact CD2-CG1 4.43Å; Y172-I176 HydrophobicContact CE1-CD1 4.41Å; Y172-I176 HydrophobicContact CE1-CG1 3.72Å; Y172-I176 HydrophobicContact CE2-CD1 4.13Å; Y172-I176 HydrophobicContact CE2-CG1 4.01Å; Y172-I176 WeakPolarHBondContact O-CG1 3.46Å; Y172-I176 PolarHBondContact O-N 2.73Å; Y172-L197 HydrophobicContact CD2-CD1 4.07Å; Y172-L197 HydrophobicContact CE2-CB 4.44Å; Y172-L197 HydrophobicContact CE2-CD1 3.81Å; Y172-V199 HydrophobicContact CD1-CG2 4.15Å; Y172-V199 HydrophobicContact CD2-CG2 3.56Å; Y172-V199 HydrophobicContact CE2-CG2 4Å; Y172-V199 HydrophobicContact CG-CG1 4.41Å; Y172-V199 HydrophobicContact CG-CG2 3.64Å
173	N	81.7	Confident	82.2	Confident	61 Å²	61	65.8 Å²	65.8	33%	0.326	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-38	176.6	-73.6	-36.2	0	0	0	112.2	E169 D170 I176 R177	E169-N173 VanDerWaalsContact O-CG 3.29Å; E169-N173 PolarHBondContact O-N 3.33Å; E169-N173 PolarHBondContact O-ND2 3.21Å; E169-N173 VanDerWaalsContact O-ND2 3.11Å; D170-N173 PolarHBondContact O-N 3.17Å; N173-I176 PolarHBondContact O-N 3.26Å; N173-R177 WeakPolarHBondContact O-CG 3.04Å; N173-R177 PolarHBondContact O-N 2.74Å
174	Y	85	Confident	82	Confident	48 Å²	48	62.3 Å²	62.3	19%	0.188	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-47.4	173.4	-179.2	-101	0	0	0	111.9	F80 L81 S84 H88 V92 D170 S171 Y172 R177 Y178	F80-Y174 HydrophobicContact CE1-CD1 4.48Å; F80-Y174 AromaticContact CE1-CE1 3.57Å; F80-Y174 HydrophobicContact CE1-CE1 3.57Å; F80-Y174 AromaticContact CE1-CZ 3.61Å; F80-Y174 WeakPolarHBondContact CE1-OH 3.41Å; F80-Y174 AromaticContact CZ-CE1 3.96Å; F80-Y174 HydrophobicContact CZ-CE1 3.96Å; F80-Y174 HydrophobicContact CZ-CE2 4.09Å; F80-Y174 AromaticContact CZ-CZ 3.49Å; F80-Y174 VanDerWaalsContact CZ-CZ 3.49Å; F80-Y174 WeakPolarHBondContact CZ-OH 3.37Å; L81-Y174 HydrophobicContact CD2-CE1 4.28Å; S84-Y174 PolarHBondContact OG-OH 3.24Å; H88-Y174 HydrophobicContact CB-CD1 4.06Å; H88-Y174 HydrophobicContact CB-CD2 4.42Å; H88-Y174 HydrophobicContact CB-CG 3.94Å; V92-Y174 HydrophobicContact CG2-CD1 4.49Å; D170-Y174 WeakPolarHBondContact O-CB 3.29Å; D170-Y174 PolarHBondContact O-N 3.44Å; S171-Y174 PolarHBondContact O-N 3.22Å; Y172-Y174 VanDerWaalsContact C-N 3.31Å; Y172-Y174 PolarHBondContact O-N 3.19Å; Y174-R177 PolarHBondContact O-N 3.32Å; Y174-Y178 PolarHBondContact O-N 3.47Å
175	L	84.9	Confident	81.8	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-43.1	175.1	174.7	65.1	0	0	0	112.1	L77 V92 L95 L167 S171 Y172 R177 Y178 L179 L197	L77-L175 HydrophobicContact CD1-CD1 4.48Å; V92-L175 HydrophobicContact CG1-CB 4.32Å; V92-L175 HydrophobicContact CG1-CD1 3.9Å; V92-L175 HydrophobicContact CG1-CD2 4.47Å; V92-L175 HydrophobicContact CG1-CG 4.45Å; V92-L175 HydrophobicContact CG2-CB 4.22Å; L95-L175 HydrophobicContact CD2-CD1 4.01Å; L95-L175 HydrophobicContact CD2-CD2 3.44Å; L95-L175 VanDerWaalsContact CD2-CD2 3.44Å; L95-L175 HydrophobicContact CD2-CG 4.39Å; L167-L175 HydrophobicContact CD1-CD2 3.96Å; S171-L175 PolarHBondContact O-N 3.28Å; Y172-L175 PolarHBondContact O-N 3.24Å; L175-R177 PolarHBondContact O-N 3.09Å; L175-Y178 WeakPolarHBondContact O-CB 3.18Å; L175-Y178 PolarHBondContact O-N 3.32Å; L175-L179 HydrophobicContact CD1-CD1 4.17Å; L175-L179 HydrophobicContact CD1-CG 4.23Å; L175-L179 HydrophobicContact CG-CD1 3.98Å; L175-L179 HydrophobicContact CG-CG 4.44Å; L175-L179 WeakPolarHBondContact O-CG 3.22Å; L175-L179 PolarHBondContact O-N 3.04Å; L175-L197 HydrophobicContact CD2-CD1 4.25Å
176	I	81.9	Confident	81.4	Confident	33 Å²	33	62 Å²	62	17%	0.169	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-40.7	179.9	-71.3	-65.7	0	0	0	111.5	Y172 N173 Y178 L179 Q180	Y172-I176 HydrophobicContact CD1-CG1 4.17Å; Y172-I176 HydrophobicContact CD2-CG1 4.43Å; Y172-I176 HydrophobicContact CE1-CD1 4.41Å; Y172-I176 HydrophobicContact CE1-CG1 3.72Å; Y172-I176 HydrophobicContact CE2-CD1 4.13Å; Y172-I176 HydrophobicContact CE2-CG1 4.01Å; Y172-I176 WeakPolarHBondContact O-CG1 3.46Å; Y172-I176 PolarHBondContact O-N 2.73Å; N173-I176 PolarHBondContact O-N 3.26Å; I176-Y178 VanDerWaalsContact C-N 3.28Å; I176-Y178 PolarHBondContact O-N 3.47Å; I176-L179 HydrophobicContact CD1-CD1 4.43Å; I176-L179 PolarHBondContact O-N 2.85Å; I176-Q180 HydrophobicContact CG2-CG 4.32Å; I176-Q180 WeakPolarHBondContact O-CB 3.49Å; I176-Q180 VanDerWaalsContact O-CG 3.26Å; I176-Q180 WeakPolarHBondContact O-CG 3.41Å; I176-Q180 PolarHBondContact O-N 2.94Å
177	R	82.3	Confident	81.3	Confident	181 Å²	181	53.2 Å²	53.2	68%	0.683	26%	0.263	S	S	*	.	H	α-helix	trans	-59.4	-41	175.2	-73.6	177.1	-169.3	168.1	6	111.9	N173 Y174 L175 Q180 S181	N173-R177 WeakPolarHBondContact O-CG 3.04Å; N173-R177 PolarHBondContact O-N 2.74Å; Y174-R177 PolarHBondContact O-N 3.32Å; L175-R177 PolarHBondContact O-N 3.09Å; R177-Q180 PolarHBondContact O-N 3.11Å; R177-S181 PolarHBondContact O-N 3.23Å
178	Y	85.3	Confident	81.2	Confident	16 Å²	16	54.4 Å²	54.4	6%	0.063	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-45.4	174.8	178.6	-92.7	0	0	0	112	R76 L77 F80 Y174 L175 I176 Q180 S181 N184	R76-Y178 WeakPolarHBondContact CB-OH 2.82Å; R76-Y178 PolarHBondContact O-OH 3.42Å; L77-Y178 VanDerWaalsContact CA-OH 3.28Å; L77-Y178 WeakPolarHBondContact CA-OH 3.41Å; L77-Y178 HydrophobicContact CB-CE1 3.89Å; L77-Y178 HydrophobicContact CD1-CD1 3.53Å; L77-Y178 HydrophobicContact CD1-CE1 3.39Å; L77-Y178 HydrophobicContact CD1-CG 4.36Å; L77-Y178 HydrophobicContact CG-CE1 4.21Å; L77-Y178 PolarHBondContact N-OH 3.3Å; F80-Y178 HydrophobicContact CB-CD2 4.12Å; F80-Y178 HydrophobicContact CB-CE2 3.57Å; F80-Y178 AromaticContact CD1-CD2 3.31Å; F80-Y178 HydrophobicContact CD1-CD2 3.31Å; F80-Y178 AromaticContact CD1-CE2 3.68Å; F80-Y178 HydrophobicContact CD1-CE2 3.68Å; F80-Y178 AromaticContact CD1-CG 3.8Å; F80-Y178 HydrophobicContact CD1-CG 3.8Å; F80-Y178 AromaticContact CD2-CD2 3.69Å; F80-Y178 HydrophobicContact CD2-CD2 3.69Å; F80-Y178 AromaticContact CD2-CE2 3.82Å; F80-Y178 HydrophobicContact CD2-CE2 3.82Å; F80-Y178 AromaticContact CE1-CD2 3.47Å; F80-Y178 HydrophobicContact CE1-CD2 3.47Å; F80-Y178 VanDerWaalsContact CE1-CD2 3.47Å; F80-Y178 HydrophobicContact CE1-CE2 4.3Å; F80-Y178 AromaticContact CE1-CG 3.78Å; F80-Y178 HydrophobicContact CE1-CG 3.78Å; F80-Y178 AromaticContact CE2-CD2 3.84Å; F80-Y178 HydrophobicContact CE2-CD2 3.84Å; F80-Y178 HydrophobicContact CE2-CE2 4.42Å; F80-Y178 AromaticContact CG-CD2 3.41Å; F80-Y178 HydrophobicContact CG-CD2 3.41Å; F80-Y178 VanDerWaalsContact CG-CD2 3.41Å; F80-Y178 AromaticContact CG-CE2 3.39Å; F80-Y178 HydrophobicContact CG-CE2 3.39Å; F80-Y178 HydrophobicContact CG-CG 4.34Å; F80-Y178 AromaticContact CZ-CD2 3.73Å; F80-Y178 HydrophobicContact CZ-CD2 3.73Å; F80-Y178 HydrophobicContact CZ-CG 4.31Å; Y174-Y178 PolarHBondContact O-N 3.47Å; L175-Y178 WeakPolarHBondContact O-CB 3.18Å; L175-Y178 PolarHBondContact O-N 3.32Å; I176-Y178 VanDerWaalsContact C-N 3.28Å; I176-Y178 PolarHBondContact O-N 3.47Å; Y178-Q180 PolarHBondContact O-N 3Å; Y178-Q180 VanDerWaalsContact O-N 3.17Å; Y178-S181 PolarHBondContact O-N 3.06Å; Y178-S181 PolarHBondContact O-OG 3.16Å; Y178-N184 PolarHBondContact O-ND2 2.76Å
179	L	82.5	Confident	81	Confident	21 Å²	21	54.1 Å²	54.1	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-23.5	178.6	-68.2	172.6	0	0	0	112.7	L175 I176 N184 L187 L191	L175-L179 HydrophobicContact CD1-CD1 4.17Å; L175-L179 HydrophobicContact CD1-CG 4.23Å; L175-L179 HydrophobicContact CG-CD1 3.98Å; L175-L179 HydrophobicContact CG-CG 4.44Å; L175-L179 WeakPolarHBondContact O-CG 3.22Å; L175-L179 PolarHBondContact O-N 3.04Å; I176-L179 HydrophobicContact CD1-CD1 4.43Å; I176-L179 PolarHBondContact O-N 2.85Å; L179-N184 HydrophobicContact CD2-CB 4.06Å; L179-L187 HydrophobicContact CD2-CB 4.28Å; L179-L191 HydrophobicContact CD1-CD1 3.53Å; L179-L191 HydrophobicContact CD2-CD1 4.04Å; L179-L191 HydrophobicContact CG-CD1 4.45Å
180	Q	78.8	Confident	81.1	Confident	116 Å²	116	50.7 Å²	50.7	54%	0.542	25%	0.253	S	S	.	.	H	α-helix	trans	-88.4	-16.9	177.7	-72	174.4	-8	0	0	114.9	I57 I176 R177 Y178	I57-Q180 HydrophobicContact CD1-CG 4.11Å; I176-Q180 HydrophobicContact CG2-CG 4.32Å; I176-Q180 WeakPolarHBondContact O-CB 3.49Å; I176-Q180 VanDerWaalsContact O-CG 3.26Å; I176-Q180 WeakPolarHBondContact O-CG 3.41Å; I176-Q180 PolarHBondContact O-N 2.94Å; R177-Q180 PolarHBondContact O-N 3.11Å; Y178-Q180 PolarHBondContact O-N 3Å; Y178-Q180 VanDerWaalsContact O-N 3.17Å
181	S	73.6	Confident	81.4	Confident	73 Å²	73	47.2 Å²	47.2	51%	0.51	23%	0.234	S	C	.	.	H	α-helix	trans	-76.5	-37.4	-173.4	66.2	0	0	0	0	113.8	R177 Y178	R177-S181 PolarHBondContact O-N 3.23Å; Y178-S181 PolarHBondContact O-N 3.06Å; Y178-S181 PolarHBondContact O-OG 3.16Å
182	D	70.9	Confident	81.3	Confident	88 Å²	88	50.8 Å²	50.8	47%	0.471	26%	0.256	S	S	.	.	S	Bend	trans	-133.8	174.8	-170.7	-73.8	-56.9	0	0	0	112.6	N184	D182-N184 PolarHBondContact O-N 2.9Å
183	N	75.4	Confident	81	Confident	87 Å²	87	53.1 Å²	53.1	47%	0.465	27%	0.271	S	S	.	.			trans	-66.4	91	171.4	-176.2	8.2	0	0	0	111.2	Q73 R76 T185	Q73-N183 WeakPolarHBondContact CG-O 3.43Å; Q73-N183 PolarHBondContact NE2-O 3.01Å; R76-N183 PolarHBondContact NH2-O 2.84Å; N183-T185 VanDerWaalsContact OD1-CG2 3.26Å; N183-T185 WeakPolarHBondContact OD1-CG2 3.31Å; N183-T185 PolarHBondContact OD1-OG1 3.08Å
184	N	81.8	Confident	81	Confident	3 Å²	3	52 Å²	52	2%	0.016	26%	0.263	C	S	.	.			trans	-112.2	27.5	177.3	-69.6	-43.4	0	0	0	112.3	Q73 Y178 L179 D182 A186 L187 C188	Q73-N184 VanDerWaalsContact OE1-C 3.29Å; Y178-N184 PolarHBondContact O-ND2 2.76Å; L179-N184 HydrophobicContact CD2-CB 4.06Å; D182-N184 PolarHBondContact O-N 2.9Å; N184-A186 VanDerWaalsContact C-N 3.31Å; N184-A186 PolarHBondContact O-N 2.99Å; N184-L187 HydrophobicContact CB-CD1 4.49Å; N184-L187 PolarHBondContact O-N 3.31Å; N184-C188 WeakPolarHBondContact O-CB 3.28Å; N184-C188 PolarHBondContact O-N 2.97Å; N184-C188 PolarHBondContact O-SG 3.33Å
185	T	80.6	Confident	81.1	Confident	77 Å²	77	50 Å²	50	47%	0.472	26%	0.256	S	S	.	.	H	α-helix	trans	-57.4	-36.7	-172.3	47.1	0	0	0	0	114.2	N183 K189	N183-T185 VanDerWaalsContact OD1-CG2 3.26Å; N183-T185 WeakPolarHBondContact OD1-CG2 3.31Å; N183-T185 PolarHBondContact OD1-OG1 3.08Å; T185-K189 WeakPolarHBondContact O-CB 3.46Å; T185-K189 PolarHBondContact O-N 3.4Å
186	A	77.9	Confident	81.1	Confident	2 Å²	2	54.6 Å²	54.6	2%	0.017	28%	0.277	C	S	.	.	H	α-helix	trans	-72.6	-43.1	178	0	0	0	0	0	111.8	A65 Y70 N184 K189 V190	A65-A186 HydrophobicContact CB-CB 4.24Å; Y70-A186 HydrophobicContact CD1-CB 3.35Å; Y70-A186 HydrophobicContact CE1-CB 3.35Å; N184-A186 VanDerWaalsContact C-N 3.31Å; N184-A186 PolarHBondContact O-N 2.99Å; A186-K189 PolarHBondContact O-N 2.84Å; A186-V190 WeakPolarHBondContact O-CG2 3.28Å; A186-V190 PolarHBondContact O-N 3.42Å
187	L	83.8	Confident	81.3	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-60.6	-47.3	174.4	-65.8	175.5	0	0	0	110.9	Q73 L77 L99 L103 L179 N184 K189 V190 L191	Q73-L187 HydrophobicContact CB-CD1 3.99Å; Q73-L187 HydrophobicContact CB-CG 4.01Å; L77-L187 HydrophobicContact CB-CD1 4.03Å; L77-L187 HydrophobicContact CD2-CD1 4.08Å; L99-L187 HydrophobicContact CD1-CD2 4.41Å; L99-L187 HydrophobicContact CD2-CD2 4.28Å; L103-L187 HydrophobicContact CD1-CD2 3.92Å; L179-L187 HydrophobicContact CD2-CB 4.28Å; N184-L187 HydrophobicContact CB-CD1 4.49Å; N184-L187 PolarHBondContact O-N 3.31Å; L187-K189 VanDerWaalsContact C-N 3.29Å; L187-K189 PolarHBondContact O-N 3.19Å; L187-V190 PolarHBondContact O-N 3.09Å; L187-L191 WeakPolarHBondContact O-CB 3.38Å; L187-L191 VanDerWaalsContact O-CG 3.24Å; L187-L191 WeakPolarHBondContact O-CG 3.4Å; L187-L191 PolarHBondContact O-N 2.75Å
188	C	83.5	Confident	81.4	Confident	30 Å²	30	48.4 Å²	48.4	20%	0.203	26%	0.258	C	S	.	.	H	α-helix	trans	-60.1	-38.3	176.8	-68.4	0	0	0	0	112.3	N184 T192	N184-C188 WeakPolarHBondContact O-CB 3.28Å; N184-C188 PolarHBondContact O-N 2.97Å; N184-C188 PolarHBondContact O-SG 3.33Å; C188-T192 WeakPolarHBondContact O-CB 3.19Å; C188-T192 PolarHBondContact O-N 3.28Å; C188-T192 PolarHBondContact O-OG1 2.94Å
189	K	81.1	Confident	81.3	Confident	91 Å²	91	50.1 Å²	50.1	40%	0.396	27%	0.27	S	S	.	.	H	α-helix	trans	-65.4	-47.7	176.6	-176.7	178.4	179.7	-175.7	0	111.6	T185 A186 L187 T192 L193	T185-K189 WeakPolarHBondContact O-CB 3.46Å; T185-K189 PolarHBondContact O-N 3.4Å; A186-K189 PolarHBondContact O-N 2.84Å; L187-K189 VanDerWaalsContact C-N 3.29Å; L187-K189 PolarHBondContact O-N 3.19Å; K189-T192 PolarHBondContact O-N 2.82Å; K189-L193 HydrophobicContact CD-CD1 4.46Å; K189-L193 HydrophobicContact CG-CD1 3.72Å; K189-L193 HydrophobicContact CG-CG 4.48Å; K189-L193 WeakPolarHBondContact O-CB 3.18Å; K189-L193 WeakPolarHBondContact O-CG 3.42Å; K189-L193 PolarHBondContact O-N 2.9Å
190	V	83.1	Confident	81.2	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.024	29%	0.285	C	S	.	.	H	α-helix	trans	-63.3	-43.4	177.5	172.3	0	0	0	0	111.1	L99 Y102 L103 A186 L187 T192 L193 H194 I195	L99-V190 HydrophobicContact CD2-CB 4.34Å; L99-V190 HydrophobicContact CD2-CG1 3.89Å; Y102-V190 VanDerWaalsContact CB-CG1 3.47Å; Y102-V190 HydrophobicContact CD2-CG1 4.3Å; Y102-V190 HydrophobicContact CG-CG1 4.2Å; L103-V190 HydrophobicContact CD2-CG2 3.69Å; L103-V190 HydrophobicContact CG-CG2 4.25Å; A186-V190 WeakPolarHBondContact O-CG2 3.28Å; A186-V190 PolarHBondContact O-N 3.42Å; L187-V190 PolarHBondContact O-N 3.09Å; V190-T192 VanDerWaalsContact C-N 3.31Å; V190-T192 PolarHBondContact O-N 2.95Å; V190-L193 PolarHBondContact O-N 2.87Å; V190-H194 WeakPolarHBondContact O-CB 3.29Å; V190-H194 PolarHBondContact O-N 3.05Å; V190-I195 HydrophobicContact CG1-CD1 4.38Å
191	L	85.3	Confident	80.6	Confident	15 Å²	15	52.7 Å²	52.7	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-59.2	-42.7	176.5	-74.7	166.1	0	0	0	111.7	L95 L99 L179 L187 I195	L95-L191 HydrophobicContact CD1-CD2 3.87Å; L95-L191 HydrophobicContact CD2-CD2 4Å; L95-L191 HydrophobicContact CG-CD2 4.31Å; L99-L191 HydrophobicContact CD2-CD2 4.01Å; L99-L191 HydrophobicContact CD2-CG 3.99Å; L179-L191 HydrophobicContact CD1-CD1 3.53Å; L179-L191 HydrophobicContact CD2-CD1 4.04Å; L179-L191 HydrophobicContact CG-CD1 4.45Å; L187-L191 WeakPolarHBondContact O-CB 3.38Å; L187-L191 VanDerWaalsContact O-CG 3.24Å; L187-L191 WeakPolarHBondContact O-CG 3.4Å; L187-L191 PolarHBondContact O-N 2.75Å; L191-I195 HydrophobicContact CD2-CB 4.25Å; L191-I195 HydrophobicContact CD2-CD1 3.77Å; L191-I195 HydrophobicContact CD2-CG2 4.26Å; L191-I195 PolarHBondContact O-N 3.05Å
192	T	82.8	Confident	79.9	Confident	74 Å²	74	51.8 Å²	51.8	45%	0.454	29%	0.287	S	S	.	.	H	α-helix	trans	-71.2	-41.4	-178.4	-55.4	0	0	0	0	112.6	C188 K189 V190	C188-T192 WeakPolarHBondContact O-CB 3.19Å; C188-T192 PolarHBondContact O-N 3.28Å; C188-T192 PolarHBondContact O-OG1 2.94Å; K189-T192 PolarHBondContact O-N 2.82Å; V190-T192 VanDerWaalsContact C-N 3.31Å; V190-T192 PolarHBondContact O-N 2.95Å
193	L	79	Confident	78.7	Confident	92 Å²	92	57.4 Å²	57.4	48%	0.482	31%	0.307	S	S	.	.	H	α-helix	trans	-82.8	-42.5	-173.6	-69.2	174.1	0	0	0	112.8	K162 K189 V190	K162-L193 WeakPolarHBondContact CE-O 3.32Å; K189-L193 HydrophobicContact CD-CD1 4.46Å; K189-L193 HydrophobicContact CG-CD1 3.72Å; K189-L193 HydrophobicContact CG-CG 4.48Å; K189-L193 WeakPolarHBondContact O-CB 3.18Å; K189-L193 WeakPolarHBondContact O-CG 3.42Å; K189-L193 PolarHBondContact O-N 2.9Å; V190-L193 PolarHBondContact O-N 2.87Å
194	H	81.4	Confident	77	Confident	37 Å²	37	63.7 Å²	63.7	17%	0.171	32%	0.324	C	S	.	.	H	α-helix	trans	-117.1	-14.5	-163.3	-60.7	-64.3	0	0	0	114.9	Y102 K162 Y163 V190	Y102-H194 HydrophobicContact CD1-CB 3.67Å; Y102-H194 AromaticContact CD1-CG 3.74Å; Y102-H194 HydrophobicContact CD2-CB 3.69Å; Y102-H194 HydrophobicContact CE1-CB 3.7Å; Y102-H194 AromaticContact CE1-CG 3.98Å; Y102-H194 HydrophobicContact CE2-CB 3.72Å; Y102-H194 HydrophobicContact CG-CB 3.69Å; K162-H194 WeakPolarHBondContact CA-O 3.32Å; Y163-H194 PolarHBondContact N-O 3.06Å; V190-H194 WeakPolarHBondContact O-CB 3.29Å; V190-H194 PolarHBondContact O-N 3.05Å
195	I	87.4	Confident	74.8	Confident	8 Å²	8	69.5 Å²	69.5	4%	0.041	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.4	-176.2	-60.5	171.6	0	0	0	109.4	L95 P98 L99 Y102 Y163 V165 V190 L191 L197	L95-I195 HydrophobicContact CD1-CD1 4.11Å; L95-I195 HydrophobicContact CD1-CG2 4.03Å; P98-I195 HydrophobicContact CB-CD1 4.25Å; P98-I195 HydrophobicContact CG-CD1 4.37Å; L99-I195 HydrophobicContact CD2-CD1 3.67Å; L99-I195 HydrophobicContact CG-CD1 3.88Å; Y102-I195 HydrophobicContact CD2-CD1 4.33Å; Y102-I195 HydrophobicContact CD2-CG1 4.05Å; Y102-I195 HydrophobicContact CE2-CG1 4.02Å; Y163-I195 CarbonylContact O-C 3.6Å; Y163-I195 WeakPolarHBondContact O-CA 3.37Å; V165-I195 HydrophobicContact CG2-CG2 4.07Å; V190-I195 HydrophobicContact CG1-CD1 4.38Å; L191-I195 HydrophobicContact CD2-CB 4.25Å; L191-I195 HydrophobicContact CD2-CD1 3.77Å; L191-I195 HydrophobicContact CD2-CG2 4.26Å; L191-I195 PolarHBondContact O-N 3.05Å; I195-L197 HydrophobicContact CG2-CD2 3.9Å; I195-L197 HydrophobicContact CG2-CG 4.39Å
196	H	85.6	Confident	72.5	Confident	98 Å²	98	73.3 Å²	73.3	45%	0.454	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	112.9	170.6	-178.6	60.7	0	0	0	108.6	K162 Y163 V164 V165 D198	K162-H196 HydrophobicContact CB-CB 4.26Å; Y163-H196 PolarHBondContact O-N 3.42Å; V164-H196 WeakPolarHBondContact CA-O 3.35Å; V164-H196 HydrophobicContact CG2-CB 4.33Å; V165-H196 PolarHBondContact N-O 3.09Å; H196-D198 PolarHBondContact O-N 2.8Å
197	L	85.8	Confident	70.6	Confident	38 Å²	38	82.5 Å²	82.5	20%	0.199	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	107.2	175.5	-61.6	178.3	0	0	0	108.7	L95 V165 L167 Y172 L175 I195 V199	L95-L197 HydrophobicContact CD1-CD2 4.04Å; V165-L197 HydrophobicContact CB-CD2 4.02Å; V165-L197 WeakPolarHBondContact O-CA 3.34Å; L167-L197 HydrophobicContact CD1-CD2 4.01Å; Y172-L197 HydrophobicContact CD2-CD1 4.07Å; Y172-L197 HydrophobicContact CE2-CB 4.44Å; Y172-L197 HydrophobicContact CE2-CD1 3.81Å; L175-L197 HydrophobicContact CD2-CD1 4.25Å; I195-L197 HydrophobicContact CG2-CD2 3.9Å; I195-L197 HydrophobicContact CG2-CG 4.39Å; L197-V199 PolarHBondContact O-N 2.97Å
198	D	83.4	Confident	68.1	Low	46 Å²	46	91.8 Å²	91.8	25%	0.246	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	97.7	174.9	177.8	24.6	0	0	0	108.2	V164 V165 R166 L167 H196 Q200	V164-D198 HydrophobicContact CG1-CB 4.02Å; V165-D198 PolarHBondContact O-N 2.79Å; R166-D198 WeakPolarHBondContact CA-O 3.3Å; R166-D198 HydrophobicContact CG-CB 4.12Å; R166-D198 IonicContact NE-OD2 2.92Å; L167-D198 PolarHBondContact N-O 3.48Å; H196-D198 PolarHBondContact O-N 2.8Å; D198-Q200 PolarHBondContact O-N 3.32Å; D198-Q200 PolarHBondContact OD1-NE2 3.23Å; D198-Q200 PolarHBondContact OD2-NE2 2.94Å
199	V	84.7	Confident	65.8	Low	51 Å²	51	96.7 Å²	96.7	31%	0.309	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	107.7	-177.9	-175	0	0	0	0	108.6	L167 E169 Y172 L197 P201	L167-V199 WeakPolarHBondContact O-CA 2.93Å; E169-V199 HydrophobicContact CB-CG1 4.18Å; E169-V199 HydrophobicContact CG-CG1 4.5Å; Y172-V199 HydrophobicContact CD1-CG2 4.15Å; Y172-V199 HydrophobicContact CD2-CG2 3.56Å; Y172-V199 HydrophobicContact CE2-CG2 4Å; Y172-V199 HydrophobicContact CG-CG1 4.41Å; Y172-V199 HydrophobicContact CG-CG2 3.64Å; L197-V199 PolarHBondContact O-N 2.97Å; V199-P201 WeakPolarHBondContact O-CD 3.49Å
200	Q	79.9	Confident	63.6	Low	94 Å²	94	102.9 Å²	102.9	44%	0.439	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	119.5	175.4	-66.8	-66	-39.3	0	0	108.2	L167 E169 D198 A202	L167-Q200 PolarHBondContact O-N 2.8Å; E169-Q200 PolarHBondContact N-O 2.8Å; D198-Q200 PolarHBondContact O-N 3.32Å; D198-Q200 PolarHBondContact OD1-NE2 3.23Å; D198-Q200 PolarHBondContact OD2-NE2 2.94Å; Q200-A202 PolarHBondContact O-N 3.29Å
201	P	64.9	Low	61	Low	97 Å²	97	107.2 Å²	107.2	63%	0.63	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-62.1	136.6	179.3	25.6	-32.4	0	0	0	108.8	V199 K203	V199-P201 WeakPolarHBondContact O-CD 3.49Å; P201-K203 PolarHBondContact O-N 2.85Å
202	A	59.8	Low	58.3	Low	54 Å²	54	112 Å²	112	45%	0.446	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-55.8	132.7	169.6	0	0	0	0	0	108.1	Q200 R204	Q200-A202 PolarHBondContact O-N 3.29Å; A202-R204 VanDerWaalsContact C-N 3.29Å; A202-R204 PolarHBondContact O-N 3.07Å
203	K	44.9	Very low	55.8	Low	207 Å²	207	112.1 Å²	112.1	90%	0.9	59%	0.589	S	S	*	*			trans	-60	94.6	175.2	-84.1	-177.6	177.3	178	0	108.5	P201 T205	P201-K203 PolarHBondContact O-N 2.85Å; K203-T205 PolarHBondContact O-N 2.76Å
204	R	39.9	Very low	53.3	Low	219 Å²	219	113.3 Å²	113.3	83%	0.826	61%	0.605	S	S	*	*			trans	-66.2	111.5	166.3	-77.1	-175	175.9	-177.1	-0.8	106.8	A202 D206	A202-R204 VanDerWaalsContact C-N 3.29Å; A202-R204 PolarHBondContact O-N 3.07Å; R204-D206 PolarHBondContact O-N 2.93Å
205	T	36	Very low	50.9	Low	125 Å²	125	116.8 Å²	116.8	77%	0.767	63%	0.633	S	S	*	*			trans	-61.5	117.9	165.5	41.8	0	0	0	0	108	K203 Y207	K203-T205 PolarHBondContact O-N 2.76Å; T205-Y207 PolarHBondContact O-N 2.94Å
206	D	33.5	Very low	48	Very low	156 Å²	156	121.7 Å²	121.7	83%	0.834	67%	0.668	S	S	*	*			trans	-55.1	125.3	-174.3	-70.3	-48	0	0	0	112.5	R204 Q208	R204-D206 PolarHBondContact O-N 2.93Å; D206-Q208 PolarHBondContact O-N 3.32Å
207	Y	36.9	Very low	45.3	Very low	195 Å²	195	128.4 Å²	128.4	77%	0.765	69%	0.69	S	S	*	*			trans	-74	110.6	166.6	-86.5	-97.2	0	0	0	109.5	T205	T205-Y207 PolarHBondContact O-N 2.94Å
208	Q	31.3	Very low	42.4	Very low	196 Å²	196	131.2 Å²	131.2	92%	0.916	71%	0.713	S	S	*	*			trans	-93.3	102	159.7	-76.8	-170.4	-9.8	0	0	109.6	D206	D206-Q208 PolarHBondContact O-N 3.32Å
209	L	35.8	Very low	39.8	Very low	133 Å²	133	137 Å²	137	70%	0.696	74%	0.738	S	S	*	*			trans	-101.7	125.9	164.9	-89.8	155.4	0	0	0	108.6
210	Y	34.8	Very low	37.1	Very low	222 Å²	222	140.7 Å²	140.7	87%	0.871	76%	0.756	S	S	*	*			trans	78.8	98.1	174.7	-63.5	-83.2	0	0	0	118.9
211	A	27.9	Very low	34.6	Very low	95 Å²	95	143.6 Å²	143.6	79%	0.785	78%	0.775	S	S	*	*			trans	-160.8	120.3	130.5	0	0	0	0	0	111.7
212	S	28.3	Very low	32.9	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	78%	0.778	S	S	*	*			trans	11.7	128.1	146.5	52.8	0	0	0	0	119.7
213	G	29.9	Very low	31.6	Very low	75 Å²	75	148 Å²	148	77%	0.773	80%	0.801	S	S	*	*			trans	-68.3	159.4	174.2	0	0	0	0	0	115.6
214	S	27	Very low	31.1	Very low	117 Å²	117	147.2 Å²	147.2	82%	0.818	80%	0.8	S	S	*	*			trans	-176.7	140	143	50.1	0	0	0	0	108.5
215	S	30.7	Very low	30.9	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	80%	0.797	S	S	*	*			trans	-35.3	146.9	169.5	58.1	0	0	0	0	116.5
216	S	27.4	Very low	31	Very low	111 Å²	111	142 Å²	142	78%	0.776	80%	0.797	S	S	*	*				179.1	121.9	113.3	55.5	0	0	0	0	113.7
217	R	28	Very low	31.1	Very low	239 Å²	239	142.1 Å²	142.1	90%	0.902	80%	0.797	S	S	*	*			trans	37	124	130.6	-83.6	-179.4	169.2	178.7	-3.5	121.7
218	S	25	Very low	30.7	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	80%	0.799	S	S	*	*				71.8	121	125.8	67.5	0	0	0	0	121.4
219	E	28.8	Very low	31.1	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	79%	0.79	S	S	*	*			trans	89.1	115.4	132.1	-75.8	-177.9	-167.4	0	0	120.7
220	N	27.7	Very low	31	Very low	129 Å²	129	135.3 Å²	135.3	69%	0.69	79%	0.792	S	S	*	*				102.1	122.3	126.4	-85.9	-11.9	0	0	0	121
221	N	28.5	Very low	31.3	Very low	154 Å²	154	128.9 Å²	128.9	82%	0.824	78%	0.778	S	S	*	*			trans	83.3	111.5	141.5	-67.9	-14	0	0	0	119.6
222	G	28.3	Very low	32.3	Very low	69 Å²	69	130.6 Å²	130.6	71%	0.711	77%	0.772	S	S	*	*			trans	146.5	85.8	132.6	0	0	0	0	0	116.1
223	L	33.1	Very low	32.9	Very low	175 Å²	175	131.2 Å²	131.2	92%	0.916	77%	0.766	S	S	*	*			trans	63	117.9	143.5	-65.3	154	0	0	0	118.9
224	E	33.8	Very low	33.6	Very low	191 Å²	191	135.4 Å²	135.4	89%	0.893	77%	0.766	S	S	*	*			trans	-55.4	150.1	167.8	-67.3	177	153.4	0	0	113.2
225	P	35.5	Very low	35	Very low	116 Å²	116	134.8 Å²	134.8	75%	0.753	75%	0.753	S	S	*	*				-122.3	163.2	126.3	28.6	-14.3	0	0	0	111.8
226	P	38.1	Very low	36.2	Very low	117 Å²	117	135.1 Å²	135.1	76%	0.76	74%	0.742	S	S	*	*			trans	-86.4	154.6	-151.8	25.4	-15.6	0	0	0	113.9
227	D	35.8	Very low	38.1	Very low	159 Å²	159	132.3 Å²	132.3	85%	0.85	73%	0.726	S	S	*	*			trans	35.9	84.3	160.7	-68.4	-21.8	0	0	0	117.2	P229	D227-P229 WeakPolarHBondContact O-CD 3.29Å
228	M	29.2	Very low	39.7	Very low	164 Å²	164	123.4 Å²	123.4	81%	0.808	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-55.6	123.5	153.3	-83.3	-83.4	-75.6	0	0	110.2	S230	M228-S230 PolarHBondContact O-N 3.16Å
229	P	39.3	Very low	41.7	Very low	111 Å²	111	123.1 Å²	123.1	72%	0.721	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-62.7	134.4	157.7	-11.7	26.8	0	0	0	108.1	D227	D227-P229 WeakPolarHBondContact O-CD 3.29Å
230	S	33.5	Very low	43.9	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-47.5	136.4	-178.8	42.7	0	0	0	0	112.6	M228	M228-S230 PolarHBondContact O-N 3.16Å
231	P	42.6	Very low	46.2	Very low	87 Å²	87	119.3 Å²	119.3	57%	0.565	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-70.1	154.3	-169.4	29.4	-34.4	0	0	0	112.4	L233	P231-L233 HydrophobicContact CG-CD1 4.37Å; P231-L233 PolarHBondContact O-N 3.1Å
232	I	47	Very low	47.9	Very low	131 Å²	131	116.6 Å²	116.6	67%	0.672	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	9.8	-177.6	-66.8	154	0	0	0	115.8	Q234 N235	I232-Q234 PolarHBondContact O-N 2.96Å; I232-Q234 VanDerWaalsContact O-N 3.08Å; I232-N235 HydrophobicContact CG2-CB 4.15Å; I232-N235 PolarHBondContact O-N 3.29Å
233	L	42.8	Very low	50	Low	129 Å²	129	119.2 Å²	119.2	68%	0.675	66%	0.656	S	S	*	*	H	α-helix	trans	-58.5	-21.9	176	-92	155.1	0	0	0	114.1	P231 N235	P231-L233 HydrophobicContact CG-CD1 4.37Å; P231-L233 PolarHBondContact O-N 3.1Å; L233-N235 VanDerWaalsContact C-N 3.35Å
234	Q	44.7	Very low	51.9	Low	164 Å²	164	116 Å²	116	77%	0.766	64%	0.636	S	S	*	*	H	α-helix	trans	-72.7	-27	173.1	-79.4	-178.9	-11.8	0	0	112.9	I232 A238	I232-Q234 PolarHBondContact O-N 2.96Å; I232-Q234 VanDerWaalsContact O-N 3.08Å; Q234-A238 WeakPolarHBondContact O-CB 3.4Å; Q234-A238 PolarHBondContact O-N 3.24Å
235	N	54.3	Low	53.4	Low	104 Å²	104	108.8 Å²	108.8	56%	0.556	61%	0.607	S	S	*	*	H	α-helix	trans	-85	-32.5	-174.4	-86.8	-10.1	0	0	0	113.7	I232 L233 L239	I232-N235 HydrophobicContact CG2-CB 4.15Å; I232-N235 PolarHBondContact O-N 3.29Å; L233-N235 VanDerWaalsContact C-N 3.35Å; N235-L239 WeakPolarHBondContact O-CB 3.48Å; N235-L239 WeakPolarHBondContact O-CG 3.5Å; N235-L239 PolarHBondContact O-N 2.92Å
236	E	57.8	Low	54.8	Low	117 Å²	117	107.8 Å²	107.8	55%	0.547	59%	0.594	S	S	.	*	H	α-helix	trans	-70.6	-46.5	174.1	-80.1	-176.1	160.1	0	0	111.2	A238 L239 E240	E236-A238 VanDerWaalsContact C-N 3.3Å; E236-A238 PolarHBondContact O-N 3.36Å; E236-L239 PolarHBondContact O-N 2.75Å; E236-L239 VanDerWaalsContact O-N 3.15Å; E236-E240 WeakPolarHBondContact O-CB 3.47Å; E236-E240 PolarHBondContact O-N 3.44Å
237	A	65.5	Low	56.2	Low	52 Å²	52	108.6 Å²	108.6	43%	0.43	59%	0.585	S	S	.	*	H	α-helix	trans	-62.5	-38.2	172.5	0	0	0	0	0	111.3	V241	A237-V241 WeakPolarHBondContact O-CB 3.29Å; A237-V241 WeakPolarHBondContact O-CG2 3.17Å; A237-V241 PolarHBondContact O-N 3.48Å
238	A	63.3	Low	57.3	Low	51 Å²	51	107.8 Å²	107.8	42%	0.421	57%	0.57	S	S	.	*	H	α-helix	trans	-69.7	-31.9	174	0	0	0	0	0	112.9	Q234 E236 L242	Q234-A238 WeakPolarHBondContact O-CB 3.4Å; Q234-A238 PolarHBondContact O-N 3.24Å; E236-A238 VanDerWaalsContact C-N 3.3Å; E236-A238 PolarHBondContact O-N 3.36Å; A238-L242 WeakPolarHBondContact O-CA 3.28Å; A238-L242 WeakPolarHBondContact O-CB 3.47Å; A238-L242 PolarHBondContact O-N 3.08Å
239	L	65.4	Low	58.8	Low	93 Å²	93	105.2 Å²	105.2	49%	0.487	56%	0.564	S	S	.	*	H	α-helix	trans	-72.4	-41.2	174.7	-97.4	154.8	0	0	0	111.5	N235 E236 L242 Q243	N235-L239 WeakPolarHBondContact O-CB 3.48Å; N235-L239 WeakPolarHBondContact O-CG 3.5Å; N235-L239 PolarHBondContact O-N 2.92Å; E236-L239 PolarHBondContact O-N 2.75Å; E236-L239 VanDerWaalsContact O-N 3.15Å; L239-L242 PolarHBondContact O-N 3.39Å; L239-Q243 VanDerWaalsContact O-CB 3.25Å; L239-Q243 WeakPolarHBondContact O-CB 3.43Å; L239-Q243 VanDerWaalsContact O-CG 3.26Å; L239-Q243 WeakPolarHBondContact O-CG 3.35Å; L239-Q243 PolarHBondContact O-N 2.88Å
240	E	75	Confident	59.5	Low	138 Å²	138	106.9 Å²	106.9	65%	0.645	56%	0.559	S	S	*	*	H	α-helix	trans	-65.7	-44.8	172.3	-75.2	-172.7	166.5	0	0	110.3	E236 L242 Q243 E244	E236-E240 WeakPolarHBondContact O-CB 3.47Å; E236-E240 PolarHBondContact O-N 3.44Å; E240-L242 VanDerWaalsContact C-N 3.31Å; E240-L242 PolarHBondContact O-N 2.91Å; E240-Q243 PolarHBondContact O-N 3.49Å; E240-E244 WeakPolarHBondContact O-CB 3.43Å; E240-E244 PolarHBondContact O-N 3.46Å
241	V	77.6	Confident	60.4	Low	78 Å²	78	107.3 Å²	107.3	47%	0.473	55%	0.553	S	S	.	*	H	α-helix	trans	-63.1	-37.5	173.7	169.3	0	0	0	0	110.9	A237 S245	A237-V241 WeakPolarHBondContact O-CB 3.29Å; A237-V241 WeakPolarHBondContact O-CG2 3.17Å; A237-V241 PolarHBondContact O-N 3.48Å; V241-S245 WeakPolarHBondContact O-CA 3.33Å; V241-S245 WeakPolarHBondContact O-CB 3.11Å; V241-S245 PolarHBondContact O-N 3Å; V241-S245 PolarHBondContact O-OG 3.14Å
242	L	63.2	Low	60.8	Low	97 Å²	97	104.3 Å²	104.3	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-69.7	-45.6	176	-176.9	82.1	0	0	0	110.7	A238 L239 E240 E244 S245 I246	A238-L242 WeakPolarHBondContact O-CA 3.28Å; A238-L242 WeakPolarHBondContact O-CB 3.47Å; A238-L242 PolarHBondContact O-N 3.08Å; L239-L242 PolarHBondContact O-N 3.39Å; E240-L242 VanDerWaalsContact C-N 3.31Å; E240-L242 PolarHBondContact O-N 2.91Å; L242-E244 VanDerWaalsContact C-N 3.32Å; L242-S245 CarbonylContact O-C 3.53Å; L242-S245 PolarHBondContact O-N 2.82Å; L242-I246 HydrophobicContact CD2-CD1 4.15Å; L242-I246 HydrophobicContact CG-CD1 3.82Å; L242-I246 HydrophobicContact CG-CG1 4.38Å; L242-I246 WeakPolarHBondContact O-CB 3.46Å; L242-I246 WeakPolarHBondContact O-CG1 3.39Å; L242-I246 PolarHBondContact O-N 2.64Å
243	Q	72.2	Confident	60.9	Low	124 Å²	124	103.8 Å²	103.8	58%	0.579	54%	0.544	S	S	*	.	H	α-helix	trans	-63.5	-41.1	176.4	-79.5	-179.4	-4.2	0	0	111	L239 E240 S245 I246 K247	L239-Q243 VanDerWaalsContact O-CB 3.25Å; L239-Q243 WeakPolarHBondContact O-CB 3.43Å; L239-Q243 VanDerWaalsContact O-CG 3.26Å; L239-Q243 WeakPolarHBondContact O-CG 3.35Å; L239-Q243 PolarHBondContact O-N 2.88Å; E240-Q243 PolarHBondContact O-N 3.49Å; Q243-S245 VanDerWaalsContact C-N 3.35Å; Q243-I246 PolarHBondContact O-N 2.94Å; Q243-K247 WeakPolarHBondContact O-CB 3.35Å; Q243-K247 PolarHBondContact O-N 3.49Å
244	E	73	Confident	61.4	Low	107 Å²	107	100.2 Å²	100.2	50%	0.5	53%	0.528	S	S	.	.	H	α-helix	trans	-70.3	-33.2	175.1	-161.9	-168.1	-146.7	0	0	111	E240 L242 R248	E240-E244 WeakPolarHBondContact O-CB 3.43Å; E240-E244 PolarHBondContact O-N 3.46Å; L242-E244 VanDerWaalsContact C-N 3.32Å; E244-R248 WeakPolarHBondContact O-CB 3.13Å; E244-R248 VanDerWaalsContact O-CG 3.26Å; E244-R248 WeakPolarHBondContact O-CG 3.46Å; E244-R248 PolarHBondContact O-N 2.92Å; E244-R248 IonicContact OE2-CZ 2.92Å; E244-R248 IonicContact OE2-NE 3.37Å; E244-R248 IonicContact OE2-NH2 2.8Å; E244-R248 PolarHBondContact OE2-NH2 3.28Å
245	S	66	Low	61.9	Low	40 Å²	40	96.3 Å²	96.3	28%	0.28	52%	0.519	S	S	.	.	H	α-helix	trans	-70.5	-41.7	172.4	-63	0	0	0	0	111.4	V241 L242 Q243 K247 R248 V249	V241-S245 WeakPolarHBondContact O-CA 3.33Å; V241-S245 WeakPolarHBondContact O-CB 3.11Å; V241-S245 PolarHBondContact O-N 3Å; V241-S245 PolarHBondContact O-OG 3.14Å; L242-S245 CarbonylContact O-C 3.53Å; L242-S245 PolarHBondContact O-N 2.82Å; Q243-S245 VanDerWaalsContact C-N 3.35Å; S245-K247 VanDerWaalsContact C-N 3.33Å; S245-R248 CarbonylContact O-C 3.57Å; S245-R248 PolarHBondContact O-N 3.39Å; S245-V249 WeakPolarHBondContact O-CB 3.43Å; S245-V249 WeakPolarHBondContact O-CG2 3.26Å; S245-V249 PolarHBondContact O-N 2.76Å
246	I	65.2	Low	62.1	Low	95 Å²	95	97.5 Å²	97.5	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-62.8	-44	173.6	-72.1	164.6	0	0	0	109.2	L242 Q243 V249 K250	L242-I246 HydrophobicContact CD2-CD1 4.15Å; L242-I246 HydrophobicContact CG-CD1 3.82Å; L242-I246 HydrophobicContact CG-CG1 4.38Å; L242-I246 WeakPolarHBondContact O-CB 3.46Å; L242-I246 WeakPolarHBondContact O-CG1 3.39Å; L242-I246 PolarHBondContact O-N 2.64Å; Q243-I246 PolarHBondContact O-N 2.94Å; I246-V249 PolarHBondContact O-N 3.32Å; I246-K250 WeakPolarHBondContact O-CB 3.37Å; I246-K250 PolarHBondContact O-N 3.35Å
247	K	67.8	Low	62.6	Low	133 Å²	133	92.5 Å²	92.5	58%	0.578	50%	0.502	S	S	*	.	H	α-helix	trans	-64.4	-43.6	174.8	-170.6	176.4	-179.1	-177.2	0	110.8	Q243 S245 V249 K250 D251	Q243-K247 WeakPolarHBondContact O-CB 3.35Å; Q243-K247 PolarHBondContact O-N 3.49Å; S245-K247 VanDerWaalsContact C-N 3.33Å; K247-V249 VanDerWaalsContact C-N 3.32Å; K247-V249 PolarHBondContact O-N 3.39Å; K247-K250 PolarHBondContact O-N 2.88Å; K247-D251 WeakPolarHBondContact CE-OD2 3.5Å; K247-D251 WeakPolarHBondContact CG-OD2 3.47Å; K247-D251 WeakPolarHBondContact O-CA 3.31Å; K247-D251 WeakPolarHBondContact O-CB 3.32Å; K247-D251 PolarHBondContact O-N 2.79Å
248	R	59.1	Low	63	Low	143 Å²	143	94.4 Å²	94.4	54%	0.54	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-30.8	173.8	-83.7	-174	-94.3	149.4	-11	113.3	E244 S245 G252	E244-R248 WeakPolarHBondContact O-CB 3.13Å; E244-R248 VanDerWaalsContact O-CG 3.26Å; E244-R248 WeakPolarHBondContact O-CG 3.46Å; E244-R248 PolarHBondContact O-N 2.92Å; E244-R248 IonicContact OE2-CZ 2.92Å; E244-R248 IonicContact OE2-NE 3.37Å; E244-R248 IonicContact OE2-NH2 2.8Å; E244-R248 PolarHBondContact OE2-NH2 3.28Å; S245-R248 CarbonylContact O-C 3.57Å; S245-R248 PolarHBondContact O-N 3.39Å; R248-G252 WeakPolarHBondContact O-CA 3.48Å; R248-G252 PolarHBondContact O-N 2.81Å
249	V	58.8	Low	63.7	Low	110 Å²	110	93.3 Å²	93.3	67%	0.667	50%	0.495	S	S	*	.	H	α-helix	trans	-78.3	-38.5	174.6	168.7	0	0	0	0	110.6	S245 I246 K247	S245-V249 WeakPolarHBondContact O-CB 3.43Å; S245-V249 WeakPolarHBondContact O-CG2 3.26Å; S245-V249 PolarHBondContact O-N 2.76Å; I246-V249 PolarHBondContact O-N 3.32Å; K247-V249 VanDerWaalsContact C-N 3.32Å; K247-V249 PolarHBondContact O-N 3.39Å
250	K	54.9	Low	64.3	Low	145 Å²	145	91.2 Å²	91.2	63%	0.63	49%	0.488	S	S	*	.	H	α-helix	trans	-72.8	-40.2	179.9	-171.4	178.1	-179.2	-179.5	0	112.8	I246 K247	I246-K250 WeakPolarHBondContact O-CB 3.37Å; I246-K250 PolarHBondContact O-N 3.35Å; K247-K250 PolarHBondContact O-N 2.88Å
251	D	53.1	Low	64.4	Low	115 Å²	115	88.3 Å²	88.3	62%	0.615	47%	0.473	S	S	*	.	S	Bend	trans	-96.8	-5.1	179.5	-57.8	-21.7	0	0	0	111.9	K247	K247-D251 WeakPolarHBondContact CE-OD2 3.5Å; K247-D251 WeakPolarHBondContact CG-OD2 3.47Å; K247-D251 WeakPolarHBondContact O-CA 3.31Å; K247-D251 WeakPolarHBondContact O-CB 3.32Å; K247-D251 PolarHBondContact O-N 2.79Å
252	G	49.7	Very low	64.4	Low	24 Å²	24	88.6 Å²	88.6	25%	0.247	47%	0.466	C	S	.	.	S	Bend	trans	-71.3	168.6	176.7	0	0	0	0	0	112.6	R248	R248-G252 WeakPolarHBondContact O-CA 3.48Å; R248-G252 PolarHBondContact O-N 2.81Å
253	P	49.4	Very low	65.1	Low	121 Å²	121	85.4 Å²	85.4	79%	0.786	45%	0.454	S	S	*	.	S	Bend	trans	-55	138.1	172.9	25.3	-32.7	0	0	0	108.7	S255	P253-S255 PolarHBondContact O-N 2.72Å
254	P	54.3	Low	65.3	Low	54 Å²	54	80.4 Å²	80.4	35%	0.351	43%	0.43	S	S	.	.			trans	-51.1	114.9	-175.2	20.4	-32.3	0	0	0	108.8	L256 V556	P254-L256 PolarHBondContact O-N 2.97Å; P254-V556 HydrophobicContact CB-CG1 4.26Å; P254-V556 HydrophobicContact CG-CG1 3.74Å; P254-V556 HydrophobicContact CG-CG2 4.38Å
255	S	54.8	Low	65.3	Low	81 Å²	81	83.6 Å²	83.6	57%	0.566	44%	0.439	S	S	*	.			trans	-58	119.1	174.6	59.4	0	0	0	0	106.3	P253 T257	P253-S255 PolarHBondContact O-N 2.72Å; S255-T257 PolarHBondContact O-N 3.06Å
256	L	59.2	Low	65.3	Low	130 Å²	130	88.1 Å²	88.1	68%	0.681	46%	0.46	S	S	*	.			trans	-49.4	114.2	-178.4	-71.9	165.4	0	0	0	108.2	P254 T258	P254-L256 PolarHBondContact O-N 2.97Å; L256-T258 PolarHBondContact O-N 3.17Å
257	T	66.9	Low	65.2	Low	11 Å²	11	84.5 Å²	84.5	7%	0.067	44%	0.442	C	S	.	.			trans	-53.4	126.2	178.2	-54	0	0	0	0	107.9	S255 I259 F571 N575 L577	S255-T257 PolarHBondContact O-N 3.06Å; T257-I259 WeakPolarHBondContact O-CG1 3.4Å; T257-I259 PolarHBondContact O-N 2.81Å; T257-F571 HydrophobicContact CG2-CD1 4.46Å; T257-F571 HydrophobicContact CG2-CE1 3.66Å; T257-F571 HydrophobicContact CG2-CZ 4.47Å; T257-N575 WeakPolarHBondContact CG2-O 3.45Å; T257-L577 HydrophobicContact CG2-CB 3.81Å
258	T	74.6	Confident	64.9	Low	92 Å²	92	85.9 Å²	85.9	56%	0.564	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	124.1	173.6	-57.7	0	0	0	0	107.6	L256 L576 L577	L256-T258 PolarHBondContact O-N 3.17Å; T258-L576 HydrophobicContact CG2-CD1 3.75Å; T258-L577 PolarHBondContact O-N 2.78Å
259	I	77.1	Confident	64.9	Low	29 Å²	29	86.8 Å²	86.8	15%	0.149	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.9	179.7	-50.4	-172.1	0	0	0	108.8	T257 F261 Y559 L577 V579	T257-I259 WeakPolarHBondContact O-CG1 3.4Å; T257-I259 PolarHBondContact O-N 2.81Å; I259-F261 HydrophobicContact CB-CE2 4.28Å; I259-F261 HydrophobicContact CG2-CD2 4.09Å; I259-F261 HydrophobicContact CG2-CE1 4.46Å; I259-F261 HydrophobicContact CG2-CE2 3.63Å; I259-F261 HydrophobicContact CG2-CZ 3.85Å; I259-Y559 HydrophobicContact CD1-CD1 3.65Å; I259-Y559 HydrophobicContact CD1-CD2 3.2Å; I259-Y559 HydrophobicContact CD1-CE1 3.69Å; I259-Y559 HydrophobicContact CD1-CE2 3.28Å; I259-Y559 HydrophobicContact CD1-CG 3.39Å; I259-Y559 VanDerWaalsContact CD1-CZ 3.49Å; I259-Y559 HydrophobicContact CG1-CE1 4.31Å; I259-Y559 HydrophobicContact CG1-CE2 4.42Å; I259-L577 CarbonylContact C-O 3.59Å; I259-L577 WeakPolarHBondContact CA-O 3.38Å; I259-L577 HydrophobicContact CB-CB 4.45Å; I259-L577 HydrophobicContact CD1-CD2 3.87Å; I259-L577 HydrophobicContact CG1-CB 4.06Å; I259-L577 HydrophobicContact CG1-CD2 4.07Å; I259-L577 HydrophobicContact CG2-CB 4.35Å; I259-L577 HydrophobicContact CG2-CD2 4.36Å; I259-V579 HydrophobicContact CG2-CG2 3.58Å
260	C	77.9	Confident	65.8	Low	48 Å²	48	84.7 Å²	84.7	32%	0.324	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124.4	170.4	-65.5	0	0	0	0	109.4	L577 L578 V579	C260-L577 PolarHBondContact N-O 3.22Å; C260-L578 HydrophobicContact CB-CD2 3.61Å; C260-L578 WeakPolarHBondContact O-CA 3.36Å; C260-V579 PolarHBondContact O-N 2.8Å
261	F	77.1	Confident	67.3	Low	77 Å²	77	78.1 Å²	78.1	34%	0.338	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	122.2	175.9	-69.5	-87.8	0	0	0	109.5	I259 V534 M563 V579	I259-F261 HydrophobicContact CB-CE2 4.28Å; I259-F261 HydrophobicContact CG2-CD2 4.09Å; I259-F261 HydrophobicContact CG2-CE1 4.46Å; I259-F261 HydrophobicContact CG2-CE2 3.63Å; I259-F261 HydrophobicContact CG2-CZ 3.85Å; F261-V534 HydrophobicContact CE1-CG2 4.28Å; F261-M563 HydrophobicContact CB-SD 3.83Å; F261-M563 HydrophobicContact CD1-SD 3.53Å; F261-M563 VanDerWaalsContact CD1-SD 3.53Å; F261-M563 HydrophobicContact CE1-SD 4.48Å; F261-M563 HydrophobicContact CG-SD 4.07Å; F261-V579 HydrophobicContact CD1-CB 3.61Å; F261-V579 HydrophobicContact CD1-CG1 3.62Å; F261-V579 HydrophobicContact CD1-CG2 4.24Å; F261-V579 HydrophobicContact CE1-CB 3.85Å; F261-V579 HydrophobicContact CE1-CG1 3.68Å; F261-V579 HydrophobicContact CE1-CG2 4.04Å; F261-V579 HydrophobicContact CG-CB 4.36Å
262	Y	78.4	Confident	69	Low	84 Å²	84	74.9 Å²	74.9	33%	0.329	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	108.5	166.6	-75.2	-72.8	0	0	0	108.4	I276 L297 M563 L578 V579 T580 G581	Y262-I276 HydrophobicContact CD2-CD1 3.7Å; Y262-I276 HydrophobicContact CE2-CD1 3.85Å; Y262-L297 HydrophobicContact CE1-CD2 4.02Å; Y262-M563 WeakPolarHBondContact O-CE 3.34Å; Y262-L578 HydrophobicContact CD2-CD2 4.19Å; Y262-L578 HydrophobicContact CE2-CD1 4.18Å; Y262-L578 HydrophobicContact CE2-CD2 3.65Å; Y262-L578 HydrophobicContact CE2-CG 4.39Å; Y262-V579 PolarHBondContact N-O 3.33Å; Y262-T580 WeakPolarHBondContact O-CA 3.43Å; Y262-G581 PolarHBondContact O-N 3.32Å
263	A	77.8	Confident	70.8	Confident	31 Å²	31	74.6 Å²	74.6	26%	0.256	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.2	-179	0	0	0	0	0	110.4	Y265 M563 T583	A263-Y265 WeakPolarHBondContact O-CD2 3.44Å; A263-M563 HydrophobicContact CB-CE 3.72Å; A263-M563 HydrophobicContact CB-CG 4.05Å; A263-M563 HydrophobicContact CB-SD 3.93Å; A263-T583 HydrophobicContact CB-CG2 3.33Å
264	F	77.1	Confident	72.8	Confident	19 Å²	19	68.9 Å²	68.9	8%	0.083	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.9	174.3	-67.4	-86.1	0	0	0	109.5	T267 L271 A274 L283 A285 W295 G581 T583	F264-T267 HydrophobicContact CB-CG2 3.82Å; F264-L271 HydrophobicContact CB-CD2 4.07Å; F264-L271 HydrophobicContact CD2-CD2 3.37Å; F264-L271 HydrophobicContact CE2-CD2 3.89Å; F264-L271 HydrophobicContact CG-CD2 3.79Å; F264-A274 HydrophobicContact CE2-CB 3.63Å; F264-A274 HydrophobicContact CZ-CB 3.97Å; F264-L283 HydrophobicContact CE1-CD2 3.84Å; F264-L283 HydrophobicContact CZ-CD1 4.11Å; F264-L283 HydrophobicContact CZ-CD2 3.54Å; F264-L283 HydrophobicContact CZ-CG 3.97Å; F264-A285 HydrophobicContact CE1-CB 4.21Å; F264-A285 HydrophobicContact CZ-CB 4Å; F264-W295 HydrophobicContact CD1-CH2 4.02Å; F264-W295 HydrophobicContact CD1-CZ2 4.31Å; F264-W295 HydrophobicContact CE1-CE3 4.12Å; F264-W295 AromaticContact CE1-CH2 3.41Å; F264-W295 HydrophobicContact CE1-CH2 3.41Å; F264-W295 VanDerWaalsContact CE1-CH2 3.41Å; F264-W295 AromaticContact CE1-CZ2 3.97Å; F264-W295 HydrophobicContact CE1-CZ2 3.97Å; F264-W295 AromaticContact CE1-CZ3 3.52Å; F264-W295 HydrophobicContact CE1-CZ3 3.52Å; F264-W295 HydrophobicContact CZ-CH2 4.34Å; F264-W295 HydrophobicContact CZ-CZ3 4.11Å; F264-G581 PolarHBondContact N-O 3.11Å; F264-T583 PolarHBondContact O-N 3.45Å; F264-T583 PolarHBondContact O-OG1 3.37Å
265	Y	71.9	Confident	74.5	Confident	173 Å²	173	67.2 Å²	67.2	68%	0.678	35%	0.345	S	S	*	.			trans	-96.6	150.3	177.2	-68.4	-90.3	0	0	0	110.5	A263 T267 T583	A263-Y265 WeakPolarHBondContact O-CD2 3.44Å; Y265-T267 PolarHBondContact O-N 3.26Å; Y265-T267 VanDerWaalsContact O-N 3.12Å; Y265-T583 HydrophobicContact CD1-CG2 3.83Å; Y265-T583 HydrophobicContact CD2-CG2 4.37Å; Y265-T583 HydrophobicContact CE1-CG2 3.62Å; Y265-T583 HydrophobicContact CE2-CG2 4.17Å; Y265-T583 HydrophobicContact CG-CG2 4.21Å
266	N	65.6	Low	76.1	Confident	135 Å²	135	63.4 Å²	63.4	72%	0.722	32%	0.318	S	S	*	.	S	Bend	trans	53.7	29.7	177.4	-61.8	9.9	0	0	0	113.9
267	T	64.9	Low	77.6	Confident	19 Å²	19	57.2 Å²	57.2	12%	0.117	29%	0.286	C	S	.	.			trans	-93.4	97	166.6	57.4	0	0	0	0	106.2	F264 Y265 Q269 F287	F264-T267 HydrophobicContact CB-CG2 3.82Å; Y265-T267 PolarHBondContact O-N 3.26Å; Y265-T267 VanDerWaalsContact O-N 3.12Å; T267-Q269 PolarHBondContact O-N 3.23Å; T267-F287 HydrophobicContact CG2-CE1 3.86Å; T267-F287 HydrophobicContact CG2-CZ 4.46Å
268	E	59.4	Low	78.5	Confident	163 Å²	163	59.8 Å²	59.8	76%	0.762	30%	0.302	S	S	*	.			trans	-61.9	58.8	177.5	-63.8	-176.2	171.3	0	0	112	L270	E268-L270 PolarHBondContact O-N 2.77Å; E268-L270 VanDerWaalsContact O-N 3.11Å
269	Q	61.1	Low	78.9	Confident	162 Å²	162	57.7 Å²	57.7	76%	0.757	29%	0.288	S	S	*	.	S	Bend	trans	58.8	18.1	-178.3	-58	179.8	-6.9	0	0	116.2	T267 L271	T267-Q269 PolarHBondContact O-N 3.23Å; Q269-L271 VanDerWaalsContact C-N 3.32Å; Q269-L271 PolarHBondContact O-N 2.75Å
270	L	77.3	Confident	79.3	Confident	65 Å²	65	58.6 Å²	58.6	34%	0.34	30%	0.296	S	S	.	.			trans	-85	2.2	179.3	-61.2	172.7	0	0	0	114.1	E268 F287 D288	E268-L270 PolarHBondContact O-N 2.77Å; E268-L270 VanDerWaalsContact O-N 3.11Å; L270-F287 HydrophobicContact CB-CD1 4.17Å; L270-F287 CarbonylContact O-C 3.6Å; L270-F287 WeakPolarHBondContact O-CA 3.48Å; L270-F287 WeakPolarHBondContact O-CB 3.39Å; L270-F287 WeakPolarHBondContact O-CD1 3.36Å; L270-D288 HydrophobicContact CB-CB 4.27Å; L270-D288 HydrophobicContact CD2-CB 3.81Å; L270-D288 PolarHBondContact O-N 3.46Å
271	L	86	Confident	79.7	Confident	7 Å²	7	60.3 Å²	60.3	4%	0.037	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.1	-171.7	177.6	67.2	0	0	0	110.9	F264 Q269 T273 A285 F287 L567 I582	F264-L271 HydrophobicContact CB-CD2 4.07Å; F264-L271 HydrophobicContact CD2-CD2 3.37Å; F264-L271 HydrophobicContact CE2-CD2 3.89Å; F264-L271 HydrophobicContact CG-CD2 3.79Å; Q269-L271 VanDerWaalsContact C-N 3.32Å; Q269-L271 PolarHBondContact O-N 2.75Å; L271-T273 WeakPolarHBondContact CD1-O 3.32Å; L271-A285 HydrophobicContact CD1-CB 3.57Å; L271-F287 HydrophobicContact CB-CD1 4.44Å; L271-F287 HydrophobicContact CB-CE1 4.24Å; L271-F287 HydrophobicContact CD1-CD1 4.42Å; L271-F287 HydrophobicContact CD1-CE1 4Å; L271-F287 HydrophobicContact CD1-CE2 4.46Å; L271-F287 HydrophobicContact CD1-CZ 4.02Å; L271-L567 HydrophobicContact CB-CD1 4.36Å; L271-L567 HydrophobicContact CD2-CD1 3.33Å; L271-L567 HydrophobicContact CG-CD1 3.46Å; L271-L567 VanDerWaalsContact CG-CD1 3.46Å; L271-I582 HydrophobicContact CB-CD1 4.05Å; L271-I582 HydrophobicContact CB-CG1 4.25Å; L271-I582 HydrophobicContact CD2-CG1 3.93Å
272	N	87.9	Confident	80.3	Confident	48 Å²	48	57.7 Å²	57.7	26%	0.257	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-39.6	-178.8	-71.7	-32.3	0	0	0	113	G286 D288 V345	N272-G286 PolarHBondContact N-O 2.94Å; N272-D288 PolarHBondContact ND2-OD1 3Å; N272-D288 PolarHBondContact OD1-OD1 2.9Å; N272-V345 WeakPolarHBondContact CB-O 3.23Å; N272-V345 PolarHBondContact ND2-O 2.69Å
273	T	89.3	Confident	80.9	Confident	17 Å²	17	54.1 Å²	54.1	10%	0.104	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	146	-172.6	-169.7	0	0	0	0	110.7	L271 A285 G286 Y346 T348	L271-T273 WeakPolarHBondContact CD1-O 3.32Å; T273-A285 CarbonylContact O-C 3.57Å; T273-A285 WeakPolarHBondContact O-CA 3.18Å; T273-G286 PolarHBondContact N-O 2.81Å; T273-G286 PolarHBondContact O-N 2.82Å; T273-Y346 WeakPolarHBondContact CB-O 3.34Å; T273-T348 HydrophobicContact CG2-CG2 3.94Å
274	A	90.5	Very high	81.6	Confident	2 Å²	2	52.7 Å²	52.7	2%	0.017	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	132.2	173.4	0	0	0	0	0	109.9	F264 A284 A285 S568 T580	F264-A274 HydrophobicContact CE2-CB 3.63Å; F264-A274 HydrophobicContact CZ-CB 3.97Å; A274-A284 CarbonylContact C-O 3.59Å; A274-A284 VanDerWaalsContact CA-O 3.3Å; A274-A284 WeakPolarHBondContact CA-O 3.31Å; A274-A285 HydrophobicContact CB-CB 4.33Å; A274-S568 VanDerWaalsContact O-CB 3.29Å; A274-S568 WeakPolarHBondContact O-CB 3.37Å; A274-S568 PolarHBondContact O-OG 3.17Å; A274-T580 HydrophobicContact CB-CG2 4.27Å; A274-T580 WeakPolarHBondContact CB-OG1 3.26Å
275	E	89.8	Confident	82.3	Confident	19 Å²	19	51.8 Å²	51.8	9%	0.089	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146	-179.8	-175.8	171.4	129.4	0	0	110.4	A284 R349 F350	E275-A284 PolarHBondContact N-O 2.94Å; E275-A284 PolarHBondContact O-N 2.93Å; E275-R349 WeakPolarHBondContact OE1-CA 3.31Å; E275-R349 IonicContact OE1-NE 3.79Å; E275-R349 IonicContact OE2-CZ 2.59Å; E275-R349 IonicContact OE2-NE 2.69Å; E275-R349 PolarHBondContact OE2-NE 3.23Å; E275-R349 IonicContact OE2-NH2 2.82Å; E275-R349 PolarHBondContact OE2-NH2 2.93Å; E275-F350 HydrophobicContact CG-CD2 4.1Å; E275-F350 PolarHBondContact OE1-N 3.27Å
276	I	89.6	Confident	83.2	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	138.2	176	-64.1	172.9	0	0	0	108.7	Y262 L282 L283 L297 Q570 L578 T580	Y262-I276 HydrophobicContact CD2-CD1 3.7Å; Y262-I276 HydrophobicContact CE2-CD1 3.85Å; I276-L282 WeakPolarHBondContact CA-O 3.31Å; I276-L283 HydrophobicContact CD1-CD1 4.15Å; I276-L283 HydrophobicContact CG1-CD1 3.42Å; I276-L283 VanDerWaalsContact CG1-CD1 3.42Å; I276-L297 HydrophobicContact CG2-CD1 4.03Å; I276-Q570 PolarHBondContact O-NE2 3.37Å; I276-Q570 PolarHBondContact O-OE1 3.29Å; I276-L578 HydrophobicContact CB-CD1 4.45Å; I276-L578 HydrophobicContact CD1-CB 3.87Å; I276-L578 HydrophobicContact CD1-CD1 3.43Å; I276-L578 VanDerWaalsContact CD1-CD1 3.43Å; I276-L578 HydrophobicContact CD1-CG 4.19Å; I276-L578 HydrophobicContact CG2-CD1 4.07Å; I276-T580 HydrophobicContact CD1-CG2 4.25Å
277	S	89.9	Confident	84.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.			trans	-62	149.5	-179.8	68.9	0	0	0	0	111.5	D279 S280 K281 L282	S277-D279 VanDerWaalsContact CB-OD1 3.29Å; S277-D279 WeakPolarHBondContact CB-OD1 3.45Å; S277-D279 PolarHBondContact O-N 3.09Å; S277-D279 PolarHBondContact OG-OD1 3.4Å; S277-S280 WeakPolarHBondContact O-CA 3.08Å; S277-S280 PolarHBondContact O-N 2.95Å; S277-K281 PolarHBondContact OG-N 2.91Å; S277-K281 VanDerWaalsContact OG-N 3.12Å; S277-L282 PolarHBondContact N-O 2.95Å; S277-L282 PolarHBondContact OG-N 2.83Å; S277-L282 PolarHBondContact OG-O 2.81Å
278	P	84.6	Confident	85.6	Confident	64 Å²	64	39.2 Å²	39.2	42%	0.416	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-29.2	179.7	-30.1	35	0	0	0	115	S354	P278-S354 WeakPolarHBondContact CD-OG 3.08Å
279	D	84	Confident	87	Confident	49 Å²	49	35 Å²	35	26%	0.262	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	7.3	177.8	67.9	-21.4	0	0	0	114.7	S277 K281 S354	S277-D279 VanDerWaalsContact CB-OD1 3.29Å; S277-D279 WeakPolarHBondContact CB-OD1 3.45Å; S277-D279 PolarHBondContact O-N 3.09Å; S277-D279 PolarHBondContact OG-OD1 3.4Å; D279-K281 HydrophobicContact CB-CG 4.23Å; D279-K281 WeakPolarHBondContact O-CG 3.5Å; D279-K281 PolarHBondContact O-N 2.73Å; D279-K281 WeakPolarHBondContact OD2-CD 3.25Å; D279-K281 VanDerWaalsContact OD2-CE 3.23Å; D279-K281 WeakPolarHBondContact OD2-CE 3.09Å; D279-K281 WeakPolarHBondContact OD2-CG 3.39Å; D279-K281 IonicContact OD2-NZ 2.7Å; D279-K281 PolarHBondContact OD2-NZ 2.76Å; D279-S354 VanDerWaalsContact CG-OG 3.27Å; D279-S354 PolarHBondContact OD1-OG 2.69Å
280	S	84.6	Confident	88.3	Confident	47 Å²	47	28.5 Å²	28.5	33%	0.329	16%	0.157	S	C	.	.	S	Bend	trans	55.9	25.2	-178.3	-44.1	0	0	0	0	114.3	S277 M572	S277-S280 WeakPolarHBondContact O-CA 3.08Å; S277-S280 PolarHBondContact O-N 2.95Å; S280-M572 WeakPolarHBondContact OG-CE 3.49Å
281	K	86.2	Confident	88.9	Confident	84 Å²	84	25.6 Å²	25.6	37%	0.365	14%	0.142	S	C	.	.	S	Bend	trans	-97.1	-31.8	-176.7	-62.8	-162.3	-161.1	115	0	113	S277 D279 L297	S277-K281 PolarHBondContact OG-N 2.91Å; S277-K281 VanDerWaalsContact OG-N 3.12Å; D279-K281 HydrophobicContact CB-CG 4.23Å; D279-K281 WeakPolarHBondContact O-CG 3.5Å; D279-K281 PolarHBondContact O-N 2.73Å; D279-K281 WeakPolarHBondContact OD2-CD 3.25Å; D279-K281 VanDerWaalsContact OD2-CE 3.23Å; D279-K281 WeakPolarHBondContact OD2-CE 3.09Å; D279-K281 WeakPolarHBondContact OD2-CG 3.39Å; D279-K281 IonicContact OD2-NZ 2.7Å; D279-K281 PolarHBondContact OD2-NZ 2.76Å; K281-L297 PolarHBondContact O-N 2.93Å
282	L	89.9	Confident	89.1	Confident	22 Å²	22	25.3 Å²	25.3	12%	0.115	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.8	-174.1	-58.3	174.5	0	0	0	109.7	I276 S277 L294 W295 L302 F350 L371	I276-L282 WeakPolarHBondContact CA-O 3.31Å; S277-L282 PolarHBondContact N-O 2.95Å; S277-L282 PolarHBondContact OG-N 2.83Å; S277-L282 PolarHBondContact OG-O 2.81Å; L282-L294 HydrophobicContact CB-CD1 4.09Å; L282-W295 WeakPolarHBondContact CA-O 3.45Å; L282-L302 HydrophobicContact CD2-CD2 3.61Å; L282-F350 HydrophobicContact CB-CE1 4.12Å; L282-F350 HydrophobicContact CB-CZ 3.93Å; L282-F350 HydrophobicContact CD1-CE1 4.22Å; L282-L371 HydrophobicContact CD1-CD1 4.01Å
283	L	91	Very high	89.3	Confident	10 Å²	10	25.9 Å²	25.9	5%	0.052	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.1	169.3	173.5	70.2	0	0	0	106.6	F264 I276 L294 W295 L297 T580	F264-L283 HydrophobicContact CE1-CD2 3.84Å; F264-L283 HydrophobicContact CZ-CD1 4.11Å; F264-L283 HydrophobicContact CZ-CD2 3.54Å; F264-L283 HydrophobicContact CZ-CG 3.97Å; I276-L283 HydrophobicContact CD1-CD1 4.15Å; I276-L283 HydrophobicContact CG1-CD1 3.42Å; I276-L283 VanDerWaalsContact CG1-CD1 3.42Å; L283-L294 CarbonylContact O-C 3.56Å; L283-L294 WeakPolarHBondContact O-CA 3.27Å; L283-W295 HydrophobicContact CB-CB 4.42Å; L283-W295 HydrophobicContact CB-CE3 4.35Å; L283-W295 HydrophobicContact CD2-CE3 4.07Å; L283-W295 HydrophobicContact CG-CE3 4.01Å; L283-W295 HydrophobicContact CG-CZ3 4.49Å; L283-W295 PolarHBondContact N-O 2.8Å; L283-W295 PolarHBondContact O-N 3.06Å; L283-L297 HydrophobicContact CB-CD1 4.21Å; L283-L297 HydrophobicContact CB-CD2 4.05Å; L283-L297 HydrophobicContact CB-CG 4.1Å; L283-L297 HydrophobicContact CD2-CD2 4.36Å; L283-T580 HydrophobicContact CD1-CG2 4.32Å
284	A	92.6	Very high	89.3	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	139.5	172.8	0	0	0	0	0	109.3	A274 E275 K293 L294 F350 L357	A274-A284 CarbonylContact C-O 3.59Å; A274-A284 VanDerWaalsContact CA-O 3.3Å; A274-A284 WeakPolarHBondContact CA-O 3.31Å; E275-A284 PolarHBondContact N-O 2.94Å; E275-A284 PolarHBondContact O-N 2.93Å; A284-K293 CarbonylContact C-O 3.56Å; A284-K293 WeakPolarHBondContact CA-O 3.47Å; A284-L294 HydrophobicContact CB-CD1 3.93Å; A284-F350 HydrophobicContact CB-CE2 3.63Å; A284-F350 HydrophobicContact CB-CZ 3.5Å; A284-F350 VanDerWaalsContact CB-CZ 3.5Å; A284-L357 HydrophobicContact CB-CD1 4.02Å; A284-L357 HydrophobicContact CB-CD2 3.93Å
285	A	91.8	Very high	89.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134.9	172.7	0	0	0	0	0	111.5	F264 L271 T273 A274 F287 I292 K293 W295	F264-A285 HydrophobicContact CE1-CB 4.21Å; F264-A285 HydrophobicContact CZ-CB 4Å; L271-A285 HydrophobicContact CD1-CB 3.57Å; T273-A285 CarbonylContact O-C 3.57Å; T273-A285 WeakPolarHBondContact O-CA 3.18Å; A274-A285 HydrophobicContact CB-CB 4.33Å; A285-F287 HydrophobicContact CB-CE2 3.71Å; A285-F287 HydrophobicContact CB-CZ 4.04Å; A285-F287 WeakPolarHBondContact O-CD2 3.3Å; A285-F287 WeakPolarHBondContact O-CE2 3.44Å; A285-I292 CarbonylContact O-C 3.52Å; A285-I292 VanDerWaalsContact O-CA 3.27Å; A285-I292 WeakPolarHBondContact O-CA 3.19Å; A285-I292 WeakPolarHBondContact O-CG2 3.45Å; A285-K293 PolarHBondContact N-O 2.73Å; A285-K293 PolarHBondContact O-N 2.99Å; A285-W295 HydrophobicContact CB-CH2 3.7Å; A285-W295 HydrophobicContact CB-CZ3 3.42Å; A285-W295 VanDerWaalsContact CB-CZ3 3.42Å
286	G	92.2	Very high	89.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	137.3	175.4	0	0	0	0	0	111.4	N272 T273	N272-G286 PolarHBondContact N-O 2.94Å; T273-G286 PolarHBondContact N-O 2.81Å; T273-G286 PolarHBondContact O-N 2.82Å
287	F	91.5	Very high	88.9	Confident	5 Å²	5	30.8 Å²	30.8	2%	0.022	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	159.4	-174.3	-66	-94	0	0	0	113	T267 L270 L271 A285 N289 S290 C291 K293 W295 V345	T267-F287 HydrophobicContact CG2-CE1 3.86Å; T267-F287 HydrophobicContact CG2-CZ 4.46Å; L270-F287 HydrophobicContact CB-CD1 4.17Å; L270-F287 CarbonylContact O-C 3.6Å; L270-F287 WeakPolarHBondContact O-CA 3.48Å; L270-F287 WeakPolarHBondContact O-CB 3.39Å; L270-F287 WeakPolarHBondContact O-CD1 3.36Å; L271-F287 HydrophobicContact CB-CD1 4.44Å; L271-F287 HydrophobicContact CB-CE1 4.24Å; L271-F287 HydrophobicContact CD1-CD1 4.42Å; L271-F287 HydrophobicContact CD1-CE1 4Å; L271-F287 HydrophobicContact CD1-CE2 4.46Å; L271-F287 HydrophobicContact CD1-CZ 4.02Å; A285-F287 HydrophobicContact CB-CE2 3.71Å; A285-F287 HydrophobicContact CB-CZ 4.04Å; A285-F287 WeakPolarHBondContact O-CD2 3.3Å; A285-F287 WeakPolarHBondContact O-CE2 3.44Å; F287-N289 VanDerWaalsContact C-N 3.25Å; F287-N289 WeakPolarHBondContact CB-OD1 3.48Å; F287-N289 PolarHBondContact O-N 2.76Å; F287-S290 PolarHBondContact O-N 2.69Å; F287-C291 PolarHBondContact N-O 3.04Å; F287-K293 HydrophobicContact CD2-CD 4.37Å; F287-K293 HydrophobicContact CD2-CG 4.07Å; F287-K293 HydrophobicContact CE2-CB 3.76Å; F287-K293 HydrophobicContact CE2-CD 3.62Å; F287-K293 HydrophobicContact CE2-CG 3.55Å; F287-K293 HydrophobicContact CZ-CD 3.84Å; F287-K293 HydrophobicContact CZ-CG 4.29Å; F287-W295 HydrophobicContact CE2-CH2 4.01Å; F287-W295 AromaticContact CZ-CH2 3.92Å; F287-W295 HydrophobicContact CZ-CH2 3.92Å; F287-V345 PolarHBondContact O-N 2.94Å; F287-V345 VanDerWaalsContact O-N 3.11Å
288	D	89.1	Confident	88.4	Confident	58 Å²	58	37.5 Å²	37.5	31%	0.31	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-29.7	173.8	-84.7	-19.6	0	0	0	113.2	L270 N272 S290 P344	L270-D288 HydrophobicContact CB-CB 4.27Å; L270-D288 HydrophobicContact CD2-CB 3.81Å; L270-D288 PolarHBondContact O-N 3.46Å; N272-D288 PolarHBondContact ND2-OD1 3Å; N272-D288 PolarHBondContact OD1-OD1 2.9Å; D288-S290 PolarHBondContact O-N 2.74Å; D288-P344 WeakPolarHBondContact OD1-CB 3.34Å
289	N	88.1	Confident	87.5	Confident	76 Å²	76	40.2 Å²	40.2	41%	0.406	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	21.6	176.8	71.3	-4.5	0	0	0	113.4	F287 C291	F287-N289 VanDerWaalsContact C-N 3.25Å; F287-N289 WeakPolarHBondContact CB-OD1 3.48Å; F287-N289 PolarHBondContact O-N 2.76Å; N289-C291 PolarHBondContact O-N 2.78Å; N289-C291 VanDerWaalsContact O-N 3.1Å; N289-C291 PolarHBondContact O-SG 3.18Å; N289-C291 VanDerWaalsContact O-SG 3.4Å; N289-C291 VanDerWaalsContact OD1-CB 3.29Å; N289-C291 WeakPolarHBondContact OD1-CB 3.15Å; N289-C291 PolarHBondContact OD1-N 3.36Å
290	S	89.3	Confident	87	Confident	25 Å²	25	46 Å²	46	18%	0.175	23%	0.233	C	C	.	.	S	Bend	trans	63.7	11.1	178.4	-40.4	0	0	0	0	115.6	F287 D288 H341 G343	F287-S290 PolarHBondContact O-N 2.69Å; D288-S290 PolarHBondContact O-N 2.74Å; S290-H341 VanDerWaalsContact CB-O 3.23Å; S290-H341 WeakPolarHBondContact CB-O 3.37Å; S290-G343 VanDerWaalsContact CA-O 3.25Å; S290-G343 WeakPolarHBondContact CA-O 3.48Å; S290-G343 VanDerWaalsContact CB-O 3.27Å; S290-G343 WeakPolarHBondContact CB-O 3.15Å; S290-G343 VanDerWaalsContact OG-CA 3.28Å; S290-G343 WeakPolarHBondContact OG-CA 3.4Å; S290-G343 PolarHBondContact OG-N 2.93Å; S290-G343 PolarHBondContact OG-O 3.14Å; S290-G343 VanDerWaalsContact OG-O 3.08Å
291	C	89.2	Confident	86.7	Confident	4 Å²	4	49.3 Å²	49.3	3%	0.027	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	150.4	178.6	-59.6	0	0	0	0	110.9	F287 N289 I337	F287-C291 PolarHBondContact N-O 3.04Å; N289-C291 PolarHBondContact O-N 2.78Å; N289-C291 VanDerWaalsContact O-N 3.1Å; N289-C291 PolarHBondContact O-SG 3.18Å; N289-C291 VanDerWaalsContact O-SG 3.4Å; N289-C291 VanDerWaalsContact OD1-CB 3.29Å; N289-C291 WeakPolarHBondContact OD1-CB 3.15Å; N289-C291 PolarHBondContact OD1-N 3.36Å; C291-I337 HydrophobicContact CB-CG2 4.03Å
292	I	91.3	Very high	86.3	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.9	165.9	-54.7	164.9	0	0	0	106.7	A285 I337 L338 V345 T348 L357 S359 W369	A285-I292 CarbonylContact O-C 3.52Å; A285-I292 VanDerWaalsContact O-CA 3.27Å; A285-I292 WeakPolarHBondContact O-CA 3.19Å; A285-I292 WeakPolarHBondContact O-CG2 3.45Å; I292-I337 CarbonylContact O-C 3.55Å; I292-I337 WeakPolarHBondContact O-CA 3.23Å; I292-L338 HydrophobicContact CB-CB 4.15Å; I292-L338 HydrophobicContact CB-CD1 4.43Å; I292-L338 HydrophobicContact CG2-CD1 4.3Å; I292-L338 PolarHBondContact N-O 2.79Å; I292-L338 PolarHBondContact O-N 3.19Å; I292-V345 HydrophobicContact CD1-CG1 4.43Å; I292-V345 HydrophobicContact CG1-CG1 4.15Å; I292-V345 HydrophobicContact CG1-CG2 3.99Å; I292-T348 HydrophobicContact CG2-CG2 4.38Å; I292-L357 HydrophobicContact CG2-CD2 3.99Å; I292-S359 VanDerWaalsContact CD1-OG 3.3Å; I292-S359 WeakPolarHBondContact CD1-OG 3.45Å; I292-W369 HydrophobicContact CD1-CZ2 4.07Å
293	K	90.9	Very high	85.5	Confident	60 Å²	60	51 Å²	51	26%	0.261	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.2	173.2	-60.2	-177.5	-177.7	177.2	0	109.2	A284 A285 F287 W295 M335 I337	A284-K293 CarbonylContact C-O 3.56Å; A284-K293 WeakPolarHBondContact CA-O 3.47Å; A285-K293 PolarHBondContact N-O 2.73Å; A285-K293 PolarHBondContact O-N 2.99Å; F287-K293 HydrophobicContact CD2-CD 4.37Å; F287-K293 HydrophobicContact CD2-CG 4.07Å; F287-K293 HydrophobicContact CE2-CB 3.76Å; F287-K293 HydrophobicContact CE2-CD 3.62Å; F287-K293 HydrophobicContact CE2-CG 3.55Å; F287-K293 HydrophobicContact CZ-CD 3.84Å; F287-K293 HydrophobicContact CZ-CG 4.29Å; K293-W295 HydrophobicContact CB-CE3 4.34Å; K293-W295 HydrophobicContact CB-CH2 3.32Å; K293-W295 HydrophobicContact CB-CZ2 3.6Å; K293-W295 HydrophobicContact CB-CZ3 3.71Å; K293-W295 HydrophobicContact CD-CH2 4.04Å; K293-W295 HydrophobicContact CD-CZ2 3.8Å; K293-W295 HydrophobicContact CG-CH2 4.26Å; K293-W295 HydrophobicContact CG-CZ2 4.36Å; K293-W295 WeakPolarHBondContact O-CZ3 3.39Å; K293-M335 HydrophobicContact CB-SD 4.42Å; K293-M335 HydrophobicContact CG-SD 4.46Å; K293-I337 HydrophobicContact CG-CG1 4.36Å
294	L	90.4	Very high	84.5	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.7	178.9	-172.8	76.8	0	0	0	108.8	L282 L283 A284 L302 M335 K336 F350 L371 F374	L282-L294 HydrophobicContact CB-CD1 4.09Å; L283-L294 CarbonylContact O-C 3.56Å; L283-L294 WeakPolarHBondContact O-CA 3.27Å; A284-L294 HydrophobicContact CB-CD1 3.93Å; L294-L302 HydrophobicContact CD2-CD1 4.11Å; L294-L302 HydrophobicContact CG-CD1 4.37Å; L294-M335 CarbonylContact O-C 3.57Å; L294-M335 WeakPolarHBondContact O-CA 2.98Å; L294-K336 PolarHBondContact N-O 3.41Å; L294-K336 PolarHBondContact O-N 3.42Å; L294-F350 HydrophobicContact CD1-CE1 4.06Å; L294-F350 HydrophobicContact CD1-CZ 3.77Å; L294-L371 HydrophobicContact CD2-CD2 3.82Å; L294-F374 HydrophobicContact CD2-CD1 3.85Å; L294-F374 HydrophobicContact CD2-CE1 3.53Å
295	W	89.7	Confident	83.4	Confident	63 Å²	63	60.7 Å²	60.7	24%	0.239	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.5	176	-60.7	-97.8	0	0	0	110.8	F264 L282 L283 A285 F287 K293 M335	F264-W295 HydrophobicContact CD1-CH2 4.02Å; F264-W295 HydrophobicContact CD1-CZ2 4.31Å; F264-W295 HydrophobicContact CE1-CE3 4.12Å; F264-W295 AromaticContact CE1-CH2 3.41Å; F264-W295 HydrophobicContact CE1-CH2 3.41Å; F264-W295 VanDerWaalsContact CE1-CH2 3.41Å; F264-W295 AromaticContact CE1-CZ2 3.97Å; F264-W295 HydrophobicContact CE1-CZ2 3.97Å; F264-W295 AromaticContact CE1-CZ3 3.52Å; F264-W295 HydrophobicContact CE1-CZ3 3.52Å; F264-W295 HydrophobicContact CZ-CH2 4.34Å; F264-W295 HydrophobicContact CZ-CZ3 4.11Å; L282-W295 WeakPolarHBondContact CA-O 3.45Å; L283-W295 HydrophobicContact CB-CB 4.42Å; L283-W295 HydrophobicContact CB-CE3 4.35Å; L283-W295 HydrophobicContact CD2-CE3 4.07Å; L283-W295 HydrophobicContact CG-CE3 4.01Å; L283-W295 HydrophobicContact CG-CZ3 4.49Å; L283-W295 PolarHBondContact N-O 2.8Å; L283-W295 PolarHBondContact O-N 3.06Å; A285-W295 HydrophobicContact CB-CH2 3.7Å; A285-W295 HydrophobicContact CB-CZ3 3.42Å; A285-W295 VanDerWaalsContact CB-CZ3 3.42Å; F287-W295 HydrophobicContact CE2-CH2 4.01Å; F287-W295 AromaticContact CZ-CH2 3.92Å; F287-W295 HydrophobicContact CZ-CH2 3.92Å; K293-W295 HydrophobicContact CB-CE3 4.34Å; K293-W295 HydrophobicContact CB-CH2 3.32Å; K293-W295 HydrophobicContact CB-CZ2 3.6Å; K293-W295 HydrophobicContact CB-CZ3 3.71Å; K293-W295 HydrophobicContact CD-CH2 4.04Å; K293-W295 HydrophobicContact CD-CZ2 3.8Å; K293-W295 HydrophobicContact CG-CH2 4.26Å; K293-W295 HydrophobicContact CG-CZ2 4.36Å; K293-W295 WeakPolarHBondContact O-CZ3 3.39Å; W295-M335 HydrophobicContact CD2-CG 4.33Å; W295-M335 HydrophobicContact CG-CB 4.45Å; W295-M335 HydrophobicContact CG-CG 4.16Å
296	S	87.9	Confident	81.7	Confident	25 Å²	25	66.9 Å²	66.9	18%	0.175	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	120.2	163.8	-171.3	0	0	0	0	109.5	R298 K300 E334	S296-R298 PolarHBondContact O-N 2.97Å; S296-R298 PolarHBondContact OG-N 3.05Å; S296-R298 PolarHBondContact OG-O 3.08Å; S296-K300 WeakPolarHBondContact CB-O 3.26Å; S296-K300 PolarHBondContact OG-O 3.22Å; S296-E334 PolarHBondContact N-O 3.14Å
297	L	83.7	Confident	80	Confident	54 Å²	54	71 Å²	71	28%	0.283	36%	0.36	S	S	.	.	S	Bend	trans	-79.7	-3.9	172.9	-63.6	177.2	0	0	0	112.2	Y262 I276 K281 L283	Y262-L297 HydrophobicContact CE1-CD2 4.02Å; I276-L297 HydrophobicContact CG2-CD1 4.03Å; K281-L297 PolarHBondContact O-N 2.93Å; L283-L297 HydrophobicContact CB-CD1 4.21Å; L283-L297 HydrophobicContact CB-CD2 4.05Å; L283-L297 HydrophobicContact CB-CG 4.1Å; L283-L297 HydrophobicContact CD2-CD2 4.36Å
298	R	79.2	Confident	77.9	Confident	141 Å²	141	79.8 Å²	79.8	53%	0.532	40%	0.401	S	S	.	.	S	Bend	trans	-110.7	157	174.8	-63.2	-166.5	-179.3	-159.7	8.7	109.8	S296 K300	S296-R298 PolarHBondContact O-N 2.97Å; S296-R298 PolarHBondContact OG-N 3.05Å; S296-R298 PolarHBondContact OG-O 3.08Å; R298-K300 PolarHBondContact O-N 3.15Å
299	S	65.3	Low	76	Confident	121 Å²	121	81.2 Å²	81.2	85%	0.846	41%	0.412	S	S	*	.	S	Bend	trans	-59.9	-4.3	174.7	178.8	0	0	0	0	114.7
300	K	73.4	Confident	73.9	Confident	172 Å²	172	81.4 Å²	81.4	75%	0.748	41%	0.413	S	S	*	.	S	Bend	trans	-79.8	123	174.2	-70.3	-170.6	177.6	-172.7	0	109.5	S296 R298	S296-K300 WeakPolarHBondContact CB-O 3.26Å; S296-K300 PolarHBondContact OG-O 3.22Å; R298-K300 PolarHBondContact O-N 3.15Å
301	K	78.7	Confident	71.9	Confident	115 Å²	115	86.7 Å²	86.7	50%	0.5	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-71.9	146.2	174.2	-48.8	-162.7	-174.6	-173.3	0	111	K303 G332 T333	K301-K303 PolarHBondContact O-N 2.93Å; K301-G332 WeakPolarHBondContact CB-O 3.07Å; K301-G332 WeakPolarHBondContact CD-O 3.17Å; K301-T333 CarbonylContact C-O 3.53Å
302	L	76.6	Confident	70	Confident	16 Å²	16	90.9 Å²	90.9	8%	0.084	47%	0.473	C	S	.	.	B	Isolated β-bridge	trans	-73.7	117.3	176.4	-59.4	174	0	0	0	109	L282 L294 G332 T333 K336 F374	L282-L302 HydrophobicContact CD2-CD2 3.61Å; L294-L302 HydrophobicContact CD2-CD1 4.11Å; L294-L302 HydrophobicContact CG-CD1 4.37Å; L302-G332 CarbonylContact O-C 3.54Å; L302-G332 WeakPolarHBondContact O-CA 3.16Å; L302-T333 WeakPolarHBondContact CB-O 3.25Å; L302-T333 PolarHBondContact N-O 3.32Å; L302-T333 PolarHBondContact O-N 3.28Å; L302-K336 HydrophobicContact CB-CD 4.25Å; L302-K336 HydrophobicContact CB-CG 4.3Å; L302-K336 HydrophobicContact CD1-CB 4.25Å; L302-K336 HydrophobicContact CD1-CG 4.11Å; L302-F374 HydrophobicContact CB-CE1 4.33Å; L302-F374 HydrophobicContact CB-CE2 4.41Å; L302-F374 HydrophobicContact CB-CZ 3.79Å; L302-F374 HydrophobicContact CD1-CE1 4.28Å; L302-F374 HydrophobicContact CD2-CE1 4.25Å; L302-F374 HydrophobicContact CD2-CZ 4.04Å; L302-F374 HydrophobicContact CG-CZ 4.33Å
303	K	74.5	Confident	67.7	Low	127 Å²	127	98 Å²	98	55%	0.552	50%	0.5	S	S	*	.			trans	-115.2	128.6	177	-66	-169.7	179.8	-147.7	0	108.7	K301 N330	K301-K303 PolarHBondContact O-N 2.93Å; K303-N330 PolarHBondContact NZ-O 3.42Å
304	S	69	Low	65.5	Low	71 Å²	71	102.4 Å²	102.4	50%	0.497	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-69.4	128.4	171.6	12.4	0	0	0	0	109	K336	S304-K336 PolarHBondContact OG-NZ 3.26Å; S304-K336 VanDerWaalsContact OG-NZ 3.15Å
305	E	69.7	Low	63.1	Low	142 Å²	142	108.2 Å²	108.2	66%	0.664	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-76.3	147.5	164.4	-65.9	-169.3	168.4	0	0	109.6	H307 G372	E305-H307 PolarHBondContact O-N 2.8Å; E305-H307 VanDerWaalsContact O-N 3.09Å; E305-G372 PolarHBondContact N-O 2.8Å; E305-G372 VanDerWaalsContact N-O 3.08Å
306	P	56.9	Low	61.1	Low	129 Å²	129	111.5 Å²	111.5	84%	0.838	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-59.3	118.2	179.1	22.4	-31.6	0	0	0	110	Q308	P306-Q308 PolarHBondContact O-N 3.25Å
307	H	54.8	Low	59	Low	88 Å²	88	112.6 Å²	112.6	41%	0.407	58%	0.584	S	S	.	*			trans	-66.1	112.9	-176	-174.8	74.2	0	0	0	110.7	E305 V309	E305-H307 PolarHBondContact O-N 2.8Å; E305-H307 VanDerWaalsContact O-N 3.09Å; H307-V309 PolarHBondContact O-N 3.11Å
308	Q	49.1	Very low	57.2	Low	189 Å²	189	115.7 Å²	115.7	88%	0.883	61%	0.608	S	S	*	*			trans	-85.2	99.9	174.5	-143.6	174.4	24.6	0	0	108.5	P306 D310	P306-Q308 PolarHBondContact O-N 3.25Å; Q308-D310 PolarHBondContact O-N 3.03Å; Q308-D310 VanDerWaalsContact O-N 3.11Å
309	V	47.4	Very low	55.4	Low	88 Å²	88	111.2 Å²	111.2	53%	0.533	60%	0.595	S	S	.	*			trans	-63.2	110.9	-176.4	-179.9	0	0	0	0	110.5	H307 V311	H307-V309 PolarHBondContact O-N 3.11Å; V309-V311 HydrophobicContact CG1-CG2 4.49Å; V309-V311 PolarHBondContact O-N 3.16Å
310	D	44.8	Very low	54.4	Low	80 Å²	80	111.3 Å²	111.3	43%	0.428	59%	0.585	S	S	.	*			trans	-82.6	99.7	168	-174.6	-2.9	0	0	0	109.7	Q308 S312 R313	Q308-D310 PolarHBondContact O-N 3.03Å; Q308-D310 VanDerWaalsContact O-N 3.11Å; D310-S312 PolarHBondContact O-N 2.81Å; D310-S312 WeakPolarHBondContact OD1-CB 3.5Å; D310-S312 PolarHBondContact OD1-N 2.59Å; D310-S312 VanDerWaalsContact OD1-N 3.1Å; D310-S312 PolarHBondContact OD1-OG 2.87Å; D310-S312 PolarHBondContact OD2-OG 2.69Å; D310-R313 PolarHBondContact O-N 2.99Å; D310-R313 VanDerWaalsContact O-N 3.16Å
311	V	47.4	Very low	53.1	Low	135 Å²	135	109.2 Å²	109.2	82%	0.818	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-13.9	-177.7	-167.2	0	0	0	0	112.7	V309 R313	V309-V311 HydrophobicContact CG1-CG2 4.49Å; V309-V311 PolarHBondContact O-N 3.16Å; V311-R313 VanDerWaalsContact C-N 3.32Å
312	S	48.8	Very low	51.3	Low	93 Å²	93	110.1 Å²	110.1	65%	0.65	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-14.5	178.1	72.8	0	0	0	0	114.1	D310	D310-S312 PolarHBondContact O-N 2.81Å; D310-S312 WeakPolarHBondContact OD1-CB 3.5Å; D310-S312 PolarHBondContact OD1-N 2.59Å; D310-S312 VanDerWaalsContact OD1-N 3.1Å; D310-S312 PolarHBondContact OD1-OG 2.87Å; D310-S312 PolarHBondContact OD2-OG 2.69Å
313	R	44.4	Very low	49.7	Very low	150 Å²	150	117.9 Å²	117.9	57%	0.566	62%	0.623	S	S	*	*	S	Bend	trans	-106.6	111.1	177.8	-62.3	-175.7	-174.6	-164	-0.5	109.7	D310 V311 H315	D310-R313 PolarHBondContact O-N 2.99Å; D310-R313 VanDerWaalsContact O-N 3.16Å; V311-R313 VanDerWaalsContact C-N 3.32Å; R313-H315 PolarHBondContact O-N 2.98Å; R313-H315 PolarHBondContact O-ND1 3.43Å; R313-H315 VanDerWaalsContact O-ND1 3.1Å
314	I	43.3	Very low	48.1	Very low	151 Å²	151	119 Å²	119	77%	0.774	63%	0.63	S	S	*	*			trans	-56.6	114.6	174.7	-61.7	172.2	0	0	0	108.2	L316	I314-L316 HydrophobicContact CG2-CD1 4.5Å; I314-L316 HydrophobicContact CG2-CG 4.3Å; I314-L316 PolarHBondContact O-N 3.11Å; I314-L316 VanDerWaalsContact O-N 3.08Å
315	H	40.2	Very low	46.8	Very low	122 Å²	122	122.6 Å²	122.6	57%	0.565	64%	0.644	S	S	*	*			trans	-67.6	104.7	172.8	-72.2	18.9	0	0	0	108.7	R313	R313-H315 PolarHBondContact O-N 2.98Å; R313-H315 PolarHBondContact O-ND1 3.43Å; R313-H315 VanDerWaalsContact O-ND1 3.1Å
316	L	48.7	Very low	45.6	Very low	132 Å²	132	121.1 Å²	121.1	69%	0.691	64%	0.64	S	S	*	*			trans	-109.9	78.5	166.9	-87.3	158.1	0	0	0	108	I314	I314-L316 HydrophobicContact CG2-CD1 4.5Å; I314-L316 HydrophobicContact CG2-CG 4.3Å; I314-L316 PolarHBondContact O-N 3.11Å; I314-L316 VanDerWaalsContact O-N 3.08Å
317	A	43.3	Very low	44.9	Very low	48 Å²	48	124 Å²	124	40%	0.397	64%	0.643	S	S	.	*			trans	173.6	138.9	141.2	0	0	0	0	0	111.4	D319	A317-D319 PolarHBondContact O-N 3.13Å
318	C	45.1	Very low	44.5	Very low	119 Å²	119	125.6 Å²	125.6	80%	0.804	66%	0.655	S	S	*	*			trans	-68.4	105.1	167.6	-53.6	0	0	0	0	109.5
319	D	43	Very low	44.6	Very low	47 Å²	47	124.4 Å²	124.4	25%	0.251	65%	0.654	S	S	.	*			trans	-89.4	105.4	160.3	-70.3	-12.6	0	0	0	106.3	A317 L321 N376	A317-D319 PolarHBondContact O-N 3.13Å; D319-L321 PolarHBondContact O-N 3.4Å; D319-N376 PolarHBondContact OD2-N 2.83Å
320	I	44.3	Very low	44.8	Very low	124 Å²	124	126.7 Å²	126.7	64%	0.636	66%	0.663	S	S	*	*			trans	-71.5	90.8	164.9	-57.8	172	0	0	0	105.1	E322	I320-E322 VanDerWaalsContact C-N 3.25Å; I320-E322 HydrophobicContact CG2-CG 3.94Å; I320-E322 PolarHBondContact O-N 2.97Å
321	L	46.1	Very low	45.4	Very low	128 Å²	128	125.5 Å²	125.5	67%	0.67	67%	0.665	S	S	*	*			trans	-67.7	100.1	147.8	-65.5	170	0	0	0	103.4	D319 E323	D319-L321 PolarHBondContact O-N 3.4Å; L321-E323 PolarHBondContact O-N 2.73Å
322	E	41	Very low	46.1	Very low	133 Å²	133	119.6 Å²	119.6	62%	0.621	63%	0.631	S	S	*	*			trans	-59	109.9	153.1	-84.7	176.9	165.6	0	0	103.4	I320 E324	I320-E322 VanDerWaalsContact C-N 3.25Å; I320-E322 HydrophobicContact CG2-CG 3.94Å; I320-E322 PolarHBondContact O-N 2.97Å; E322-E324 PolarHBondContact O-N 2.8Å
323	E	42.2	Very low	47.3	Very low	179 Å²	179	117.5 Å²	117.5	84%	0.836	62%	0.615	S	S	*	*			trans	-56	74.1	152.1	-65.5	174.5	176.6	0	0	105.3	L321 D325	L321-E323 PolarHBondContact O-N 2.73Å; E323-D325 PolarHBondContact O-N 3.36Å
324	E	40.9	Very low	49	Very low	151 Å²	151	117 Å²	117	71%	0.706	62%	0.618	S	S	*	*			trans	-62.5	102.4	150.9	-78.6	-168.7	178.9	0	0	102.9	E322 D326	E322-E324 PolarHBondContact O-N 2.8Å; E324-D326 PolarHBondContact O-N 3.15Å
325	D	40.9	Very low	51	Low	147 Å²	147	113 Å²	113	79%	0.786	60%	0.597	S	S	*	*			trans	-17.1	69.5	172.7	-61.8	-51.7	0	0	0	115.1	E323 E327	E323-D325 PolarHBondContact O-N 3.36Å; D325-E327 PolarHBondContact O-N 2.75Å
326	D	44.4	Very low	53.2	Low	110 Å²	110	108.9 Å²	108.9	59%	0.588	58%	0.578	S	S	*	*			trans	-82.8	74.2	168.4	-83.2	-29.2	0	0	0	105.3	E324 D328	E324-D326 PolarHBondContact O-N 3.15Å; D326-D328 PolarHBondContact O-N 2.73Å
327	E	43.5	Very low	55	Low	189 Å²	189	106 Å²	106	88%	0.883	56%	0.562	S	S	*	*	S	Bend	trans	-57.3	-1.6	168.2	-73.9	-168.4	154.5	0	0	112.5	D325	D325-E327 PolarHBondContact O-N 2.75Å
328	D	46.3	Very low	57.1	Low	123 Å²	123	104 Å²	104	66%	0.658	55%	0.545	S	S	*	.			trans	-125.1	73.3	172.8	-83.3	-36.8	0	0	0	111.9	D326 N330 A331	D326-D328 PolarHBondContact O-N 2.73Å; D328-N330 PolarHBondContact O-N 2.82Å; D328-A331 HydrophobicContact CB-CB 4.24Å; D328-A331 PolarHBondContact O-N 2.96Å
329	D	50.4	Low	59	Low	163 Å²	163	104.1 Å²	104.1	87%	0.872	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-1.7	171.9	-108.2	-22.4	0	0	0	115.8
330	N	51.7	Low	60.9	Low	136 Å²	136	102.7 Å²	102.7	73%	0.727	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-11.9	178.9	-102.4	-33.7	0	0	0	114.9	K303 D328 G332	K303-N330 PolarHBondContact NZ-O 3.42Å; D328-N330 PolarHBondContact O-N 2.82Å; N330-G332 PolarHBondContact O-N 3.3Å
331	A	56.9	Low	63	Low	55 Å²	55	97.3 Å²	97.3	46%	0.455	50%	0.497	S	S	.	.			trans	-94.6	89.4	-178.4	0	0	0	0	0	110	D328	D328-A331 HydrophobicContact CB-CB 4.24Å; D328-A331 PolarHBondContact O-N 2.96Å
332	G	63.1	Low	65.1	Low	11 Å²	11	96.5 Å²	96.5	11%	0.113	50%	0.501	C	S	.	.			trans	-53.3	159.8	175.2	0	0	0	0	0	112.9	K301 L302 N330	K301-G332 WeakPolarHBondContact CB-O 3.07Å; K301-G332 WeakPolarHBondContact CD-O 3.17Å; L302-G332 CarbonylContact O-C 3.54Å; L302-G332 WeakPolarHBondContact O-CA 3.16Å; N330-G332 PolarHBondContact O-N 3.3Å
333	T	74.5	Confident	67.5	Low	50 Å²	50	90.6 Å²	90.6	31%	0.307	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-103.7	154.1	-179.7	61.5	0	0	0	0	111.6	K301 L302 M335 K336	K301-T333 CarbonylContact C-O 3.53Å; L302-T333 WeakPolarHBondContact CB-O 3.25Å; L302-T333 PolarHBondContact N-O 3.32Å; L302-T333 PolarHBondContact O-N 3.28Å; T333-M335 VanDerWaalsContact C-N 3.26Å; T333-M335 VanDerWaalsContact CB-O 3.32Å; T333-M335 WeakPolarHBondContact CB-O 2.99Å; T333-M335 PolarHBondContact OG1-O 3.45Å; T333-K336 WeakPolarHBondContact OG1-CG 3.45Å
334	E	79.5	Confident	69.9	Low	138 Å²	138	83.1 Å²	83.1	65%	0.645	44%	0.442	S	S	*	.	S	Bend	trans	-75.5	-22.2	173.9	-67	-177.8	170.6	0	0	112.2	S296	S296-E334 PolarHBondContact N-O 3.14Å
335	M	84.8	Confident	72.5	Confident	68 Å²	68	75.9 Å²	75.9	34%	0.335	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	137.6	-178.9	-178.3	-85.3	-65.4	0	0	110.1	K293 L294 W295 T333 I337	K293-M335 HydrophobicContact CB-SD 4.42Å; K293-M335 HydrophobicContact CG-SD 4.46Å; L294-M335 CarbonylContact O-C 3.57Å; L294-M335 WeakPolarHBondContact O-CA 2.98Å; W295-M335 HydrophobicContact CD2-CG 4.33Å; W295-M335 HydrophobicContact CG-CB 4.45Å; W295-M335 HydrophobicContact CG-CG 4.16Å; T333-M335 VanDerWaalsContact C-N 3.26Å; T333-M335 VanDerWaalsContact CB-O 3.32Å; T333-M335 WeakPolarHBondContact CB-O 2.99Å; T333-M335 PolarHBondContact OG1-O 3.45Å; M335-I337 HydrophobicContact CE-CD1 4.19Å; M335-I337 HydrophobicContact CE-CG1 4.05Å; M335-I337 HydrophobicContact SD-CD1 4.21Å; M335-I337 HydrophobicContact SD-CG1 3.43Å; M335-I337 WeakPolarHBondContact SD-CG1 3.48Å
336	K	86.1	Confident	75.1	Confident	35 Å²	35	71.4 Å²	71.4	15%	0.152	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.3	171.8	-77.1	-165.6	167.4	-158.3	0	110.5	L294 L302 S304 T333 F374	L294-K336 PolarHBondContact N-O 3.41Å; L294-K336 PolarHBondContact O-N 3.42Å; L302-K336 HydrophobicContact CB-CD 4.25Å; L302-K336 HydrophobicContact CB-CG 4.3Å; L302-K336 HydrophobicContact CD1-CB 4.25Å; L302-K336 HydrophobicContact CD1-CG 4.11Å; S304-K336 PolarHBondContact OG-NZ 3.26Å; S304-K336 VanDerWaalsContact OG-NZ 3.15Å; T333-K336 WeakPolarHBondContact OG1-CG 3.45Å; K336-F374 HydrophobicContact CB-CD1 4.46Å; K336-F374 HydrophobicContact CD-CB 3.86Å; K336-F374 HydrophobicContact CD-CD1 3.59Å; K336-F374 HydrophobicContact CD-CD2 3.5Å; K336-F374 VanDerWaalsContact CD-CD2 3.5Å; K336-F374 HydrophobicContact CD-CE1 3.94Å; K336-F374 HydrophobicContact CD-CE2 3.83Å; K336-F374 HydrophobicContact CD-CG 3.33Å; K336-F374 HydrophobicContact CD-CZ 4.04Å
337	I	87.1	Confident	77.5	Confident	72 Å²	72	66.3 Å²	66.3	37%	0.369	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.4	176.1	-51.5	-178.9	0	0	0	108.1	C291 I292 K293 M335 R339	C291-I337 HydrophobicContact CB-CG2 4.03Å; I292-I337 CarbonylContact O-C 3.55Å; I292-I337 WeakPolarHBondContact O-CA 3.23Å; K293-I337 HydrophobicContact CG-CG1 4.36Å; M335-I337 HydrophobicContact CE-CD1 4.19Å; M335-I337 HydrophobicContact CE-CG1 4.05Å; M335-I337 HydrophobicContact SD-CD1 4.21Å; M335-I337 HydrophobicContact SD-CG1 3.43Å; M335-I337 WeakPolarHBondContact SD-CG1 3.48Å; I337-R339 HydrophobicContact CG2-CG 3.9Å
338	L	87.7	Confident	80	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118	173.4	-44	174.5	0	0	0	108	I292 L357 W369 F374	I292-L338 HydrophobicContact CB-CB 4.15Å; I292-L338 HydrophobicContact CB-CD1 4.43Å; I292-L338 HydrophobicContact CG2-CD1 4.3Å; I292-L338 PolarHBondContact N-O 2.79Å; I292-L338 PolarHBondContact O-N 3.19Å; L338-L357 HydrophobicContact CD1-CD2 4.19Å; L338-W369 HydrophobicContact CB-CD2 4.13Å; L338-W369 HydrophobicContact CB-CE3 3.8Å; L338-W369 HydrophobicContact CB-CH2 4.03Å; L338-W369 HydrophobicContact CB-CZ2 4.34Å; L338-W369 HydrophobicContact CB-CZ3 3.75Å; L338-W369 HydrophobicContact CD1-CB 4.09Å; L338-W369 HydrophobicContact CD1-CD2 3.91Å; L338-W369 HydrophobicContact CD1-CE3 4.09Å; L338-W369 HydrophobicContact CD1-CG 3.91Å; L338-W369 HydrophobicContact CD2-CE3 4.33Å; L338-W369 HydrophobicContact CG-CE3 4.3Å; L338-F374 HydrophobicContact CD2-CB 3.95Å; L338-F374 WeakPolarHBondContact CD2-O 3.23Å
339	R	84.9	Confident	82.4	Confident	122 Å²	122	53.4 Å²	53.4	46%	0.46	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.9	178.8	-62.7	-172.9	-176.2	-118.9	13.3	109.1	I337	I337-R339 HydrophobicContact CG2-CG 3.9Å
340	G	81.9	Confident	84.5	Confident	16 Å²	16	46 Å²	46	17%	0.165	25%	0.248	C	C	.	.			trans	-178.5	-28.9	177	0	0	0	0	0	113.3	R367	G340-R367 VanDerWaalsContact C-CZ 3.45Å; G340-R367 PolarHBondContact O-NE 2.95Å; G340-R367 PolarHBondContact O-NH2 2.85Å
341	H	89.8	Confident	86.4	Confident	12 Å²	12	40 Å²	40	6%	0.056	22%	0.216	C	C	.	.			trans	-66.8	155.7	172.2	-77.6	-65	0	0	0	112.3	S290 V345 S359 S361 D363 S365 R367	S290-H341 VanDerWaalsContact CB-O 3.23Å; S290-H341 WeakPolarHBondContact CB-O 3.37Å; H341-V345 HydrophobicContact CB-CG2 4.25Å; H341-S359 PolarHBondContact NE2-OG 2.91Å; H341-S361 WeakPolarHBondContact ND1-CB 3.35Å; H341-D363 VanDerWaalsContact CA-OD2 3.28Å; H341-D363 WeakPolarHBondContact CA-OD2 3.4Å; H341-D363 IonicContact CE1-OD1 3.72Å; H341-D363 IonicContact CG-OD2 2.7Å; H341-D363 IonicContact ND1-OD1 2.79Å; H341-D363 PolarHBondContact ND1-OD1 3.2Å; H341-D363 IonicContact ND1-OD2 3.83Å; H341-D363 PolarHBondContact ND1-OD2 2.88Å; H341-S365 PolarHBondContact CE1-OG 2.9Å; H341-S365 PolarHBondContact ND1-OG 2.78Å; H341-R367 VanDerWaalsContact CE1-CD 3.49Å; H341-R367 WeakPolarHBondContact CE1-CD 3.45Å
342	C	89.6	Confident	87.9	Confident	111 Å²	111	40 Å²	40	75%	0.75	22%	0.215	S	C	*	.	S	Bend	trans	-117.7	29.8	176.3	-61	0	0	0	0	112.3	D363	C342-D363 HydrophobicContact CB-CB 4.22Å; C342-D363 PolarHBondContact N-OD2 3.31Å
343	G	90.4	Very high	88.9	Confident	8 Å²	8	44.3 Å²	44.3	8%	0.082	24%	0.236	C	C	.	.	S	Bend	trans	-170	174	173.3	0	0	0	0	0	111.2	S290 V345 S361	S290-G343 VanDerWaalsContact CA-O 3.25Å; S290-G343 WeakPolarHBondContact CA-O 3.48Å; S290-G343 VanDerWaalsContact CB-O 3.27Å; S290-G343 WeakPolarHBondContact CB-O 3.15Å; S290-G343 VanDerWaalsContact OG-CA 3.28Å; S290-G343 WeakPolarHBondContact OG-CA 3.4Å; S290-G343 PolarHBondContact OG-N 2.93Å; S290-G343 PolarHBondContact OG-O 3.14Å; S290-G343 VanDerWaalsContact OG-O 3.08Å; G343-V345 PolarHBondContact O-N 3.36Å; G343-S361 VanDerWaalsContact C-OG 3.3Å; G343-S361 PolarHBondContact O-OG 3.42Å
344	P	94.3	Very high	89.6	Confident	22 Å²	22	42.6 Å²	42.6	14%	0.143	23%	0.226	C	C	.	.			trans	-43.6	135.6	171.9	-32	36.4	0	0	0	113.2	D288 Y346 S361 E362	D288-P344 WeakPolarHBondContact OD1-CB 3.34Å; P344-Y346 HydrophobicContact CB-CD1 4.37Å; P344-Y346 HydrophobicContact CB-CE1 3.75Å; P344-S361 CarbonylContact O-C 3.43Å; P344-S361 WeakPolarHBondContact O-CA 3.15Å; P344-S361 VanDerWaalsContact O-CB 3.29Å; P344-S361 WeakPolarHBondContact O-CB 3.4Å; P344-S361 PolarHBondContact O-OG 2.88Å; P344-E362 WeakPolarHBondContact CD-OE2 3.47Å; P344-E362 WeakPolarHBondContact CG-OE2 3.25Å; P344-E362 PolarHBondContact O-N 3.48Å
345	V	95.4	Very high	90	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	114.9	174	-179.2	0	0	0	0	108.2	N272 F287 I292 H341 G343 T348 C360	N272-V345 WeakPolarHBondContact CB-O 3.23Å; N272-V345 PolarHBondContact ND2-O 2.69Å; F287-V345 PolarHBondContact O-N 2.94Å; F287-V345 VanDerWaalsContact O-N 3.11Å; I292-V345 HydrophobicContact CD1-CG1 4.43Å; I292-V345 HydrophobicContact CG1-CG1 4.15Å; I292-V345 HydrophobicContact CG1-CG2 3.99Å; H341-V345 HydrophobicContact CB-CG2 4.25Å; G343-V345 PolarHBondContact O-N 3.36Å; V345-T348 HydrophobicContact CG1-CG2 3.89Å; V345-C360 CarbonylContact C-O 3.56Å; V345-C360 WeakPolarHBondContact CA-O 3.32Å; V345-C360 WeakPolarHBondContact CG1-O 3.49Å
346	Y	94.9	Very high	90.3	Very high	52 Å²	52	35 Å²	35	20%	0.204	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-32.4	-173.3	-65.2	-49.8	0	0	0	114	T273 P344 C360 E362 P386 V387 W388	T273-Y346 WeakPolarHBondContact CB-O 3.34Å; P344-Y346 HydrophobicContact CB-CD1 4.37Å; P344-Y346 HydrophobicContact CB-CE1 3.75Å; Y346-C360 PolarHBondContact N-O 3.34Å; Y346-E362 HydrophobicContact CE2-CB 3.62Å; Y346-E362 HydrophobicContact CE2-CG 4.08Å; Y346-E362 PolarHBondContact OH-OE2 2.55Å; Y346-P386 HydrophobicContact CE2-CB 4.22Å; Y346-V387 WeakPolarHBondContact CD2-O 3.48Å; Y346-W388 WeakPolarHBondContact CB-O 3.29Å; Y346-W388 HydrophobicContact CD1-CE3 4.48Å; Y346-W388 HydrophobicContact CD1-CZ3 4.43Å; Y346-W388 AromaticContact CD2-CE3 3.57Å; Y346-W388 HydrophobicContact CD2-CE3 3.57Å; Y346-W388 AromaticContact CD2-CZ3 3.76Å; Y346-W388 HydrophobicContact CD2-CZ3 3.76Å; Y346-W388 HydrophobicContact CE1-CZ3 4.07Å; Y346-W388 AromaticContact CE2-CE3 3.63Å; Y346-W388 HydrophobicContact CE2-CE3 3.63Å; Y346-W388 HydrophobicContact CE2-CH2 4.23Å; Y346-W388 AromaticContact CE2-CZ3 3.29Å; Y346-W388 HydrophobicContact CE2-CZ3 3.29Å; Y346-W388 HydrophobicContact CG-CE3 4.02Å; Y346-W388 HydrophobicContact CG-CZ3 4.3Å; Y346-W388 AromaticContact CZ-CZ3 3.47Å; Y346-W388 VanDerWaalsContact CZ-CZ3 3.47Å
347	S	95.4	Very high	90.7	Very high	4 Å²	4	33.3 Å²	33.3	3%	0.028	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	142.2	178.5	-166.2	0	0	0	0	110.6	S359 C360 D389	S347-S359 WeakPolarHBondContact O-CA 3.22Å; S347-C360 VanDerWaalsContact CB-SG 3.53Å; S347-C360 PolarHBondContact O-N 3.46Å; S347-D389 PolarHBondContact OG-OD1 3.04Å
348	T	95.6	Very high	91.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147	172.2	55.6	0	0	0	0	108.5	T273 I292 V345 L358	T273-T348 HydrophobicContact CG2-CG2 3.94Å; I292-T348 HydrophobicContact CG2-CG2 4.38Å; V345-T348 HydrophobicContact CG1-CG2 3.89Å; T348-L358 CarbonylContact C-O 3.54Å; T348-L358 VanDerWaalsContact CA-O 3.25Å; T348-L358 WeakPolarHBondContact CA-O 3.27Å
349	R	95.6	Very high	91.6	Very high	40 Å²	40	29.6 Å²	29.6	15%	0.151	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	127.4	178.5	-163.5	121.7	-72.3	141.6	7.6	111.5	E275 L358 D389 L390 D391 I392	E275-R349 WeakPolarHBondContact OE1-CA 3.31Å; E275-R349 IonicContact OE1-NE 3.79Å; E275-R349 IonicContact OE2-CZ 2.59Å; E275-R349 IonicContact OE2-NE 2.69Å; E275-R349 PolarHBondContact OE2-NE 3.23Å; E275-R349 IonicContact OE2-NH2 2.82Å; E275-R349 PolarHBondContact OE2-NH2 2.93Å; R349-L358 PolarHBondContact N-O 3.04Å; R349-L358 PolarHBondContact O-N 2.59Å; R349-D389 IonicContact NH1-OD1 2.87Å; R349-L390 PolarHBondContact NH1-O 2.85Å; R349-D391 VanDerWaalsContact CD-OD1 3.32Å; R349-D391 WeakPolarHBondContact CD-OD1 3.39Å; R349-D391 IonicContact NE-OD1 2.62Å; R349-D391 IonicContact NH1-OD1 3.28Å; R349-I392 HydrophobicContact CB-CD1 4.02Å; R349-I392 HydrophobicContact CB-CG1 4.3Å; R349-I392 HydrophobicContact CG-CB 4.3Å; R349-I392 HydrophobicContact CG-CD1 3.87Å; R349-I392 HydrophobicContact CG-CG1 3.95Å
350	F	94.5	Very high	92.2	Very high	7 Å²	7	23.8 Å²	23.8	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	148.8	174.5	-74.3	-82.5	0	0	0	111.4	E275 L282 A284 L294 L357 L371 I392	E275-F350 HydrophobicContact CG-CD2 4.1Å; E275-F350 PolarHBondContact OE1-N 3.27Å; L282-F350 HydrophobicContact CB-CE1 4.12Å; L282-F350 HydrophobicContact CB-CZ 3.93Å; L282-F350 HydrophobicContact CD1-CE1 4.22Å; A284-F350 HydrophobicContact CB-CE2 3.63Å; A284-F350 HydrophobicContact CB-CZ 3.5Å; A284-F350 VanDerWaalsContact CB-CZ 3.5Å; L294-F350 HydrophobicContact CD1-CE1 4.06Å; L294-F350 HydrophobicContact CD1-CZ 3.77Å; F350-L357 HydrophobicContact CD1-CB 4.46Å; F350-L357 HydrophobicContact CD1-CD1 3.82Å; F350-L357 HydrophobicContact CD2-CD1 4.03Å; F350-L357 HydrophobicContact CE1-CD1 3.87Å; F350-L357 HydrophobicContact CE2-CD1 4.08Å; F350-L357 HydrophobicContact CG-CD1 3.92Å; F350-L357 HydrophobicContact CZ-CD1 4.01Å; F350-L371 HydrophobicContact CD1-CD1 3.75Å; F350-L371 HydrophobicContact CE1-CD1 3.6Å; F350-I392 WeakPolarHBondContact O-CD1 3.11Å
351	L	91.9	Very high	92.8	Very high	12 Å²	12	23 Å²	23	6%	0.063	14%	0.139	C	C	.	.			trans	-63.6	153.6	162.5	-67.7	179	0	0	0	110.5	D353 S354 G356 Y368 I392 F413	L351-D353 WeakPolarHBondContact CB-OD1 3.38Å; L351-D353 PolarHBondContact O-N 2.82Å; L351-D353 VanDerWaalsContact O-N 3.14Å; L351-S354 PolarHBondContact O-N 3.44Å; L351-G356 PolarHBondContact N-O 3.45Å; L351-Y368 HydrophobicContact CD1-CE2 3.76Å; L351-Y368 HydrophobicContact CG-CE2 4.37Å; L351-I392 HydrophobicContact CD2-CD1 3.82Å; L351-I392 HydrophobicContact CD2-CG2 4.11Å; L351-I392 HydrophobicContact CG-CD1 4.45Å; L351-F413 HydrophobicContact CD2-CE1 3.81Å; L351-F413 HydrophobicContact CD2-CE2 4.22Å; L351-F413 HydrophobicContact CD2-CZ 3.47Å; L351-F413 VanDerWaalsContact CD2-CZ 3.47Å
352	A	88	Confident	93.1	Very high	53 Å²	53	26.7 Å²	26.7	44%	0.438	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.6	-178.6	0	0	0	0	0	113.8	S396	A352-S396 WeakPolarHBondContact CB-OG 3.48Å; A352-S396 PolarHBondContact N-OG 2.54Å
353	D	85.6	Confident	93.3	Very high	103 Å²	103	23.3 Å²	23.3	55%	0.551	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	2.1	177.1	65.6	-12	0	0	0	113.4	L351 S355	L351-D353 WeakPolarHBondContact CB-OD1 3.38Å; L351-D353 PolarHBondContact O-N 2.82Å; L351-D353 VanDerWaalsContact O-N 3.14Å; D353-S355 PolarHBondContact O-N 3.3Å; D353-S355 VanDerWaalsContact O-N 3.16Å; D353-S355 PolarHBondContact OD1-N 3.2Å; D353-S355 VanDerWaalsContact OD1-N 3.07Å; D353-S355 PolarHBondContact OD1-OG 3.13Å; D353-S355 WeakPolarHBondContact OD2-CB 3.35Å; D353-S355 PolarHBondContact OD2-OG 2.92Å
354	S	88.3	Confident	93.4	Very high	14 Å²	14	26.7 Å²	26.7	10%	0.098	15%	0.145	C	C	.	.	S	Bend	trans	57.1	19	-174.1	-55.1	0	0	0	0	114.6	P278 D279 L351 L371	P278-S354 WeakPolarHBondContact CD-OG 3.08Å; D279-S354 VanDerWaalsContact CG-OG 3.27Å; D279-S354 PolarHBondContact OD1-OG 2.69Å; L351-S354 PolarHBondContact O-N 3.44Å; S354-L371 WeakPolarHBondContact O-CD1 3.36Å
355	S	88.7	Confident	93.4	Very high	46 Å²	46	25.8 Å²	25.8	32%	0.322	14%	0.139	S	C	.	.	S	Bend	trans	-80.5	-25.6	-178.4	65.6	0	0	0	0	113.4	D353 L371	D353-S355 PolarHBondContact O-N 3.3Å; D353-S355 VanDerWaalsContact O-N 3.16Å; D353-S355 PolarHBondContact OD1-N 3.2Å; D353-S355 VanDerWaalsContact OD1-N 3.07Å; D353-S355 PolarHBondContact OD1-OG 3.13Å; D353-S355 WeakPolarHBondContact OD2-CB 3.35Å; D353-S355 PolarHBondContact OD2-OG 2.92Å; S355-L371 VanDerWaalsContact O-CB 3.31Å; S355-L371 WeakPolarHBondContact O-CB 3.36Å; S355-L371 PolarHBondContact O-N 3.31Å
356	G	90.8	Very high	93.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	162.8	-175.8	0	0	0	0	0	112.6	L351 W369	L351-G356 PolarHBondContact N-O 3.45Å; G356-W369 VanDerWaalsContact CA-O 3.31Å; G356-W369 WeakPolarHBondContact CA-O 3.31Å
357	L	95.1	Very high	93.3	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	131.4	-179.6	-179.3	73.4	0	0	0	109.6	A284 I292 L338 F350 W369 L371	A284-L357 HydrophobicContact CB-CD1 4.02Å; A284-L357 HydrophobicContact CB-CD2 3.93Å; I292-L357 HydrophobicContact CG2-CD2 3.99Å; L338-L357 HydrophobicContact CD1-CD2 4.19Å; F350-L357 HydrophobicContact CD1-CB 4.46Å; F350-L357 HydrophobicContact CD1-CD1 3.82Å; F350-L357 HydrophobicContact CD2-CD1 4.03Å; F350-L357 HydrophobicContact CE1-CD1 3.87Å; F350-L357 HydrophobicContact CE2-CD1 4.08Å; F350-L357 HydrophobicContact CG-CD1 3.92Å; F350-L357 HydrophobicContact CZ-CD1 4.01Å; L357-W369 HydrophobicContact CB-CB 4.26Å; L357-W369 PolarHBondContact N-O 3.44Å; L357-W369 PolarHBondContact O-N 3.37Å; L357-L371 HydrophobicContact CB-CD1 4.29Å; L357-L371 HydrophobicContact CB-CD2 4.04Å; L357-L371 HydrophobicContact CB-CG 4.34Å
358	L	96.6	Very high	93.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.5	165.6	-71.5	179.6	0	0	0	110.5	T348 R349 I366 R367 Y368 Y380 L390 I392 F399 F413	T348-L358 CarbonylContact C-O 3.54Å; T348-L358 VanDerWaalsContact CA-O 3.25Å; T348-L358 WeakPolarHBondContact CA-O 3.27Å; R349-L358 PolarHBondContact N-O 3.04Å; R349-L358 PolarHBondContact O-N 2.59Å; L358-I366 HydrophobicContact CD2-CG2 4.39Å; L358-R367 CarbonylContact C-O 3.51Å; L358-R367 VanDerWaalsContact CA-O 3.32Å; L358-R367 WeakPolarHBondContact CA-O 3.23Å; L358-Y368 HydrophobicContact CD2-CD2 3.86Å; L358-Y368 HydrophobicContact CD2-CG 4.26Å; L358-Y368 HydrophobicContact CG-CD2 4.43Å; L358-Y380 HydrophobicContact CD2-CE2 4.21Å; L358-L390 HydrophobicContact CB-CD1 4.08Å; L358-I392 HydrophobicContact CB-CD1 4.36Å; L358-I392 HydrophobicContact CD1-CD1 3.73Å; L358-I392 HydrophobicContact CD1-CG1 3.69Å; L358-I392 HydrophobicContact CG-CD1 4.06Å; L358-F399 HydrophobicContact CD1-CB 3.64Å; L358-F399 HydrophobicContact CD1-CD1 3.83Å; L358-F399 HydrophobicContact CD1-CD2 3.76Å; L358-F399 HydrophobicContact CD1-CE1 4.38Å; L358-F399 HydrophobicContact CD1-CE2 4.33Å; L358-F399 HydrophobicContact CD1-CG 3.48Å; L358-F399 VanDerWaalsContact CD1-CG 3.48Å; L358-F413 HydrophobicContact CD1-CE1 3.8Å; L358-F413 HydrophobicContact CD1-CZ 4.08Å; L358-F413 HydrophobicContact CD2-CE1 4.09Å; L358-F413 HydrophobicContact CG-CE1 4.1Å
359	S	96.3	Very high	93	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	145.3	171.3	61.8	0	0	0	0	111.4	I292 H341 S347 I366 R367 W369 L390	I292-S359 VanDerWaalsContact CD1-OG 3.3Å; I292-S359 WeakPolarHBondContact CD1-OG 3.45Å; H341-S359 PolarHBondContact NE2-OG 2.91Å; S347-S359 WeakPolarHBondContact O-CA 3.22Å; S359-I366 CarbonylContact O-C 3.52Å; S359-I366 VanDerWaalsContact O-CA 3.27Å; S359-I366 WeakPolarHBondContact O-CA 3.3Å; S359-R367 PolarHBondContact N-O 2.91Å; S359-R367 PolarHBondContact O-N 2.91Å; S359-W369 PolarHBondContact OG-NE1 2.77Å; S359-L390 VanDerWaalsContact C-CD1 3.46Å
360	C	96.5	Very high	92.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	152.5	171.3	68.5	0	0	0	0	111.4	V345 Y346 S347 I366 V387 L390	V345-C360 CarbonylContact C-O 3.56Å; V345-C360 WeakPolarHBondContact CA-O 3.32Å; V345-C360 WeakPolarHBondContact CG1-O 3.49Å; Y346-C360 PolarHBondContact N-O 3.34Å; S347-C360 VanDerWaalsContact CB-SG 3.53Å; S347-C360 PolarHBondContact O-N 3.46Å; C360-I366 HydrophobicContact CB-CG1 4.1Å; C360-V387 HydrophobicContact CB-CB 3.79Å; C360-V387 HydrophobicContact CB-CG1 3.49Å; C360-V387 VanDerWaalsContact CB-CG1 3.49Å; C360-V387 PolarHBondContact SG-O 2.8Å; C360-L390 HydrophobicContact CB-CD1 3.54Å; C360-L390 HydrophobicContact CB-CD2 4.16Å; C360-L390 HydrophobicContact CB-CG 3.67Å
361	S	96	Very high	92.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	166.6	-172.8	173.3	0	0	0	0	112.5	H341 G343 P344 D363 M364 S365 V387	H341-S361 WeakPolarHBondContact ND1-CB 3.35Å; G343-S361 VanDerWaalsContact C-OG 3.3Å; G343-S361 PolarHBondContact O-OG 3.42Å; P344-S361 CarbonylContact O-C 3.43Å; P344-S361 WeakPolarHBondContact O-CA 3.15Å; P344-S361 VanDerWaalsContact O-CB 3.29Å; P344-S361 WeakPolarHBondContact O-CB 3.4Å; P344-S361 PolarHBondContact O-OG 2.88Å; S361-D363 WeakPolarHBondContact CB-OD1 3.29Å; S361-D363 PolarHBondContact O-N 3.44Å; S361-D363 PolarHBondContact OG-N 3.34Å; S361-M364 PolarHBondContact O-N 3.37Å; S361-S365 PolarHBondContact N-O 3.49Å; S361-V387 PolarHBondContact O-N 2.88Å
362	E	95.7	Very high	91.8	Very high	89 Å²	89	27.4 Å²	27.4	42%	0.416	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-27	167	-161.2	178.9	171.5	0	0	112.8	P344 Y346 M364 P386	P344-E362 WeakPolarHBondContact CD-OE2 3.47Å; P344-E362 WeakPolarHBondContact CG-OE2 3.25Å; P344-E362 PolarHBondContact O-N 3.48Å; Y346-E362 HydrophobicContact CE2-CB 3.62Å; Y346-E362 HydrophobicContact CE2-CG 4.08Å; Y346-E362 PolarHBondContact OH-OE2 2.55Å; E362-M364 PolarHBondContact O-N 2.9Å; E362-P386 HydrophobicContact CG-CB 4.17Å; E362-P386 HydrophobicContact CG-CG 3.75Å
363	D	93.4	Very high	91.4	Very high	39 Å²	39	25.5 Å²	25.5	21%	0.209	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	11.3	178.6	73.8	8	0	0	0	115	H341 C342 S361 S365	H341-D363 VanDerWaalsContact CA-OD2 3.28Å; H341-D363 WeakPolarHBondContact CA-OD2 3.4Å; H341-D363 IonicContact CE1-OD1 3.72Å; H341-D363 IonicContact CG-OD2 2.7Å; H341-D363 IonicContact ND1-OD1 2.79Å; H341-D363 PolarHBondContact ND1-OD1 3.2Å; H341-D363 IonicContact ND1-OD2 3.83Å; H341-D363 PolarHBondContact ND1-OD2 2.88Å; C342-D363 HydrophobicContact CB-CB 4.22Å; C342-D363 PolarHBondContact N-OD2 3.31Å; S361-D363 WeakPolarHBondContact CB-OD1 3.29Å; S361-D363 PolarHBondContact O-N 3.44Å; S361-D363 PolarHBondContact OG-N 3.34Å; D363-S365 PolarHBondContact O-N 2.92Å; D363-S365 VanDerWaalsContact O-N 3.13Å; D363-S365 WeakPolarHBondContact OD1-CA 3.44Å; D363-S365 WeakPolarHBondContact OD1-CB 3.34Å; D363-S365 PolarHBondContact OD1-N 2.77Å; D363-S365 PolarHBondContact OD1-OG 2.88Å; D363-S365 PolarHBondContact OD2-OG 2.88Å
364	M	93.9	Very high	91.3	Very high	80 Å²	80	21.4 Å²	21.4	39%	0.394	12%	0.116	S	C	.	.	S	Bend	trans	67.1	3.4	179.7	-42.8	175	169.8	0	0	114.4	S361 E362 A384	S361-M364 PolarHBondContact O-N 3.37Å; E362-M364 PolarHBondContact O-N 2.9Å; M364-A384 WeakPolarHBondContact CE-O 3.26Å; M364-A384 VanDerWaalsContact SD-O 3.37Å
365	S	92.3	Very high	91	Very high	3 Å²	3	22 Å²	22	2%	0.021	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	152.2	-176.1	80.9	0	0	0	0	112.4	H341 S361 D363	H341-S365 PolarHBondContact CE1-OG 2.9Å; H341-S365 PolarHBondContact ND1-OG 2.78Å; S361-S365 PolarHBondContact N-O 3.49Å; D363-S365 PolarHBondContact O-N 2.92Å; D363-S365 VanDerWaalsContact O-N 3.13Å; D363-S365 WeakPolarHBondContact OD1-CA 3.44Å; D363-S365 WeakPolarHBondContact OD1-CB 3.34Å; D363-S365 PolarHBondContact OD1-N 2.77Å; D363-S365 PolarHBondContact OD1-OG 2.88Å; D363-S365 PolarHBondContact OD2-OG 2.88Å
366	I	95.8	Very high	90.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.7	167.3	-57.1	160.3	0	0	0	106.5	L358 S359 C360 Y380 V387 L390 F399 S401 W411	L358-I366 HydrophobicContact CD2-CG2 4.39Å; S359-I366 CarbonylContact O-C 3.52Å; S359-I366 VanDerWaalsContact O-CA 3.27Å; S359-I366 WeakPolarHBondContact O-CA 3.3Å; C360-I366 HydrophobicContact CB-CG1 4.1Å; I366-Y380 HydrophobicContact CB-CD2 4.4Å; I366-Y380 HydrophobicContact CG2-CD2 4.2Å; I366-Y380 PolarHBondContact N-O 2.93Å; I366-Y380 WeakPolarHBondContact O-CD2 3.39Å; I366-Y380 PolarHBondContact O-N 2.75Å; I366-V387 HydrophobicContact CD1-CG1 4.24Å; I366-V387 HydrophobicContact CG1-CG1 4.15Å; I366-V387 HydrophobicContact CG1-CG2 4.41Å; I366-L390 HydrophobicContact CD1-CD2 3.78Å; I366-L390 HydrophobicContact CG1-CD2 3.99Å; I366-L390 HydrophobicContact CG2-CD1 4.01Å; I366-L390 HydrophobicContact CG2-CD2 3.94Å; I366-F399 HydrophobicContact CD1-CE2 4.14Å; I366-F399 HydrophobicContact CG2-CE2 3.91Å; I366-F399 HydrophobicContact CG2-CZ 4.39Å; I366-S401 VanDerWaalsContact CD1-CB 3.47Å; I366-W411 HydrophobicContact CD1-CZ2 4.17Å
367	R	93.4	Very high	90.5	Very high	21 Å²	21	23.3 Å²	23.3	8%	0.079	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	139.9	-176.3	-73.8	-179.5	-173.5	-103.6	1.5	110.4	G340 H341 L358 S359 W369 N376 L379	G340-R367 VanDerWaalsContact C-CZ 3.45Å; G340-R367 PolarHBondContact O-NE 2.95Å; G340-R367 PolarHBondContact O-NH2 2.85Å; H341-R367 VanDerWaalsContact CE1-CD 3.49Å; H341-R367 WeakPolarHBondContact CE1-CD 3.45Å; L358-R367 CarbonylContact C-O 3.51Å; L358-R367 VanDerWaalsContact CA-O 3.32Å; L358-R367 WeakPolarHBondContact CA-O 3.23Å; S359-R367 PolarHBondContact N-O 2.91Å; S359-R367 PolarHBondContact O-N 2.91Å; R367-W369 HydrophobicContact CB-CZ2 4.24Å; R367-N376 WeakPolarHBondContact CB-ND2 3.25Å; R367-N376 PolarHBondContact NH1-OD1 3Å; R367-L379 HydrophobicContact CG-CD1 3.68Å
368	Y	93.1	Very high	90	Very high	37 Å²	37	24.3 Å²	24.3	15%	0.145	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.4	168.7	176.6	-113.1	0	0	0	109.7	L351 L358 N376 T377 V378 F413	L351-Y368 HydrophobicContact CD1-CE2 3.76Å; L351-Y368 HydrophobicContact CG-CE2 4.37Å; L358-Y368 HydrophobicContact CD2-CD2 3.86Å; L358-Y368 HydrophobicContact CD2-CG 4.26Å; L358-Y368 HydrophobicContact CG-CD2 4.43Å; Y368-N376 PolarHBondContact O-ND2 2.65Å; Y368-T377 WeakPolarHBondContact CD1-OG1 3.49Å; Y368-T377 VanDerWaalsContact CE1-OG1 3.3Å; Y368-T377 WeakPolarHBondContact CE1-OG1 3.35Å; Y368-T377 PolarHBondContact O-N 3.01Å; Y368-T377 PolarHBondContact O-OG1 3.05Å; Y368-V378 HydrophobicContact CD1-CG2 4.3Å; Y368-V378 PolarHBondContact N-O 2.73Å; Y368-F413 HydrophobicContact CD2-CE1 4.48Å
369	W	90.7	Very high	89.7	Confident	3 Å²	3	25.9 Å²	25.9	1%	0.011	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	124	179	-53.7	89.7	0	0	0	108.3	I292 L338 G356 L357 S359 R367 T375 N376	I292-W369 HydrophobicContact CD1-CZ2 4.07Å; L338-W369 HydrophobicContact CB-CD2 4.13Å; L338-W369 HydrophobicContact CB-CE3 3.8Å; L338-W369 HydrophobicContact CB-CH2 4.03Å; L338-W369 HydrophobicContact CB-CZ2 4.34Å; L338-W369 HydrophobicContact CB-CZ3 3.75Å; L338-W369 HydrophobicContact CD1-CB 4.09Å; L338-W369 HydrophobicContact CD1-CD2 3.91Å; L338-W369 HydrophobicContact CD1-CE3 4.09Å; L338-W369 HydrophobicContact CD1-CG 3.91Å; L338-W369 HydrophobicContact CD2-CE3 4.33Å; L338-W369 HydrophobicContact CG-CE3 4.3Å; G356-W369 VanDerWaalsContact CA-O 3.31Å; G356-W369 WeakPolarHBondContact CA-O 3.31Å; L357-W369 HydrophobicContact CB-CB 4.26Å; L357-W369 PolarHBondContact N-O 3.44Å; L357-W369 PolarHBondContact O-N 3.37Å; S359-W369 PolarHBondContact OG-NE1 2.77Å; R367-W369 HydrophobicContact CB-CZ2 4.24Å; W369-T375 WeakPolarHBondContact CA-O 3.35Å; W369-N376 HydrophobicContact CD2-CB 4.37Å; W369-N376 HydrophobicContact CE3-CB 3.79Å; W369-N376 HydrophobicContact CH2-CB 4.02Å; W369-N376 HydrophobicContact CZ3-CB 3.59Å
370	D	87.8	Confident	89.5	Confident	47 Å²	47	26 Å²	26	25%	0.251	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	125.9	170.2	-179.6	56.8	0	0	0	108.9	G372 S373 F374 T375 T377	D370-G372 VanDerWaalsContact C-N 3.32Å; D370-G372 PolarHBondContact OD2-N 2.95Å; D370-S373 PolarHBondContact OD2-N 2.96Å; D370-S373 PolarHBondContact OD2-OG 2.8Å; D370-F374 WeakPolarHBondContact O-CA 3.42Å; D370-F374 PolarHBondContact O-N 2.63Å; D370-T375 PolarHBondContact N-O 2.83Å; D370-T377 HydrophobicContact CB-CG2 3.68Å
371	L	87.4	Confident	89.2	Confident	16 Å²	16	32.1 Å²	32.1	8%	0.084	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-3.2	-177.5	-59.2	173.1	0	0	0	112.7	L282 L294 F350 S354 S355 L357 F374	L282-L371 HydrophobicContact CD1-CD1 4.01Å; L294-L371 HydrophobicContact CD2-CD2 3.82Å; F350-L371 HydrophobicContact CD1-CD1 3.75Å; F350-L371 HydrophobicContact CE1-CD1 3.6Å; S354-L371 WeakPolarHBondContact O-CD1 3.36Å; S355-L371 VanDerWaalsContact O-CB 3.31Å; S355-L371 WeakPolarHBondContact O-CB 3.36Å; S355-L371 PolarHBondContact O-N 3.31Å; L357-L371 HydrophobicContact CB-CD1 4.29Å; L357-L371 HydrophobicContact CB-CD2 4.04Å; L357-L371 HydrophobicContact CB-CG 4.34Å; L371-F374 WeakPolarHBondContact O-CE1 3.32Å; L371-F374 WeakPolarHBondContact O-CE2 3.43Å; L371-F374 WeakPolarHBondContact O-CZ 3.25Å
372	G	82.6	Confident	88.8	Confident	24 Å²	24	33.6 Å²	33.6	25%	0.247	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-50.9	167.5	0	0	0	0	0	111.8	E305 D370	E305-G372 PolarHBondContact N-O 2.8Å; E305-G372 VanDerWaalsContact N-O 3.08Å; D370-G372 VanDerWaalsContact C-N 3.32Å; D370-G372 PolarHBondContact OD2-N 2.95Å
373	S	79.2	Confident	88.7	Confident	12 Å²	12	29.9 Å²	29.9	8%	0.084	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-17.4	177.2	62.8	0	0	0	0	114.6	D370 T375	D370-S373 PolarHBondContact OD2-N 2.96Å; D370-S373 PolarHBondContact OD2-OG 2.8Å; S373-T375 VanDerWaalsContact C-N 3.26Å; S373-T375 PolarHBondContact O-N 2.84Å; S373-T375 PolarHBondContact OG-OG1 2.86Å
374	F	83.8	Confident	88.7	Confident	17 Å²	17	30.8 Å²	30.8	8%	0.075	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	31.8	-172.4	-52.9	-86.3	0	0	0	113.8	L294 L302 K336 L338 D370 L371	L294-F374 HydrophobicContact CD2-CD1 3.85Å; L294-F374 HydrophobicContact CD2-CE1 3.53Å; L302-F374 HydrophobicContact CB-CE1 4.33Å; L302-F374 HydrophobicContact CB-CE2 4.41Å; L302-F374 HydrophobicContact CB-CZ 3.79Å; L302-F374 HydrophobicContact CD1-CE1 4.28Å; L302-F374 HydrophobicContact CD2-CE1 4.25Å; L302-F374 HydrophobicContact CD2-CZ 4.04Å; L302-F374 HydrophobicContact CG-CZ 4.33Å; K336-F374 HydrophobicContact CB-CD1 4.46Å; K336-F374 HydrophobicContact CD-CB 3.86Å; K336-F374 HydrophobicContact CD-CD1 3.59Å; K336-F374 HydrophobicContact CD-CD2 3.5Å; K336-F374 VanDerWaalsContact CD-CD2 3.5Å; K336-F374 HydrophobicContact CD-CE1 3.94Å; K336-F374 HydrophobicContact CD-CE2 3.83Å; K336-F374 HydrophobicContact CD-CG 3.33Å; K336-F374 HydrophobicContact CD-CZ 4.04Å; L338-F374 HydrophobicContact CD2-CB 3.95Å; L338-F374 WeakPolarHBondContact CD2-O 3.23Å; D370-F374 WeakPolarHBondContact O-CA 3.42Å; D370-F374 PolarHBondContact O-N 2.63Å; L371-F374 WeakPolarHBondContact O-CE1 3.32Å; L371-F374 WeakPolarHBondContact O-CE2 3.43Å; L371-F374 WeakPolarHBondContact O-CZ 3.25Å
375	T	82.3	Confident	88.8	Confident	26 Å²	26	32.7 Å²	32.7	16%	0.16	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	155.5	179.8	58.1	0	0	0	0	111.5	W369 D370 S373 T377	W369-T375 WeakPolarHBondContact CA-O 3.35Å; D370-T375 PolarHBondContact N-O 2.83Å; S373-T375 VanDerWaalsContact C-N 3.26Å; S373-T375 PolarHBondContact O-N 2.84Å; S373-T375 PolarHBondContact OG-OG1 2.86Å; T375-T377 PolarHBondContact O-N 2.97Å
376	N	84.6	Confident	89	Confident	21 Å²	21	33.6 Å²	33.6	11%	0.112	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	119.3	171.7	-178.8	-130.9	0	0	0	109.3	D319 R367 Y368 W369 V378	D319-N376 PolarHBondContact OD2-N 2.83Å; R367-N376 WeakPolarHBondContact CB-ND2 3.25Å; R367-N376 PolarHBondContact NH1-OD1 3Å; Y368-N376 PolarHBondContact O-ND2 2.65Å; W369-N376 HydrophobicContact CD2-CB 4.37Å; W369-N376 HydrophobicContact CE3-CB 3.79Å; W369-N376 HydrophobicContact CH2-CB 4.02Å; W369-N376 HydrophobicContact CZ3-CB 3.59Å; N376-V378 PolarHBondContact ND2-O 3Å; N376-V378 VanDerWaalsContact ND2-O 3.09Å
377	T	83.8	Confident	89.1	Confident	53 Å²	53	33.5 Å²	33.5	33%	0.325	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-30.2	-177.5	53	0	0	0	0	112.8	Y368 D370 T375	Y368-T377 WeakPolarHBondContact CD1-OG1 3.49Å; Y368-T377 VanDerWaalsContact CE1-OG1 3.3Å; Y368-T377 WeakPolarHBondContact CE1-OG1 3.35Å; Y368-T377 PolarHBondContact O-N 3.01Å; Y368-T377 PolarHBondContact O-OG1 3.05Å; D370-T377 HydrophobicContact CB-CG2 3.68Å; T375-T377 PolarHBondContact O-N 2.97Å
378	V	85.9	Confident	89.3	Confident	22 Å²	22	35.8 Å²	35.8	13%	0.133	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	140.6	179.6	-171.5	0	0	0	0	110.9	Y368 N376 Y380 T416	Y368-V378 HydrophobicContact CD1-CG2 4.3Å; Y368-V378 PolarHBondContact N-O 2.73Å; N376-V378 PolarHBondContact ND2-O 3Å; N376-V378 VanDerWaalsContact ND2-O 3.09Å; V378-Y380 HydrophobicContact CB-CE2 4.03Å; V378-Y380 HydrophobicContact CG1-CD1 4.32Å; V378-Y380 HydrophobicContact CG1-CD2 4.27Å; V378-Y380 HydrophobicContact CG1-CE1 3.84Å; V378-Y380 HydrophobicContact CG1-CE2 3.77Å; V378-T416 HydrophobicContact CG1-CG2 4.22Å
379	L	89.8	Confident	89.5	Confident	32 Å²	32	34.9 Å²	34.9	17%	0.168	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	120.3	171.2	-176	69.4	0	0	0	109.2	R367 Q381	R367-L379 HydrophobicContact CG-CD1 3.68Å; L379-Q381 HydrophobicContact CD2-CG 4.16Å; L379-Q381 HydrophobicContact CG-CG 4.08Å
380	Y	92.2	Very high	89.8	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.008	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119.4	174	-51.5	-92	0	0	0	109	L358 I366 V378 F399 W411 F413 R415	L358-Y380 HydrophobicContact CD2-CE2 4.21Å; I366-Y380 HydrophobicContact CB-CD2 4.4Å; I366-Y380 HydrophobicContact CG2-CD2 4.2Å; I366-Y380 PolarHBondContact N-O 2.93Å; I366-Y380 WeakPolarHBondContact O-CD2 3.39Å; I366-Y380 PolarHBondContact O-N 2.75Å; V378-Y380 HydrophobicContact CB-CE2 4.03Å; V378-Y380 HydrophobicContact CG1-CD1 4.32Å; V378-Y380 HydrophobicContact CG1-CD2 4.27Å; V378-Y380 HydrophobicContact CG1-CE1 3.84Å; V378-Y380 HydrophobicContact CG1-CE2 3.77Å; Y380-F399 HydrophobicContact CD1-CE1 4.2Å; Y380-F399 AromaticContact CD1-CZ 3.77Å; Y380-F399 HydrophobicContact CD1-CZ 3.77Å; Y380-F399 HydrophobicContact CD2-CE1 4.37Å; Y380-F399 AromaticContact CD2-CZ 3.74Å; Y380-F399 HydrophobicContact CD2-CZ 3.74Å; Y380-F399 AromaticContact CE1-CE1 3.83Å; Y380-F399 HydrophobicContact CE1-CE1 3.83Å; Y380-F399 AromaticContact CE1-CZ 3.89Å; Y380-F399 HydrophobicContact CE1-CZ 3.89Å; Y380-F399 HydrophobicContact CE2-CE1 4.03Å; Y380-F399 AromaticContact CE2-CZ 3.86Å; Y380-F399 HydrophobicContact CE2-CZ 3.86Å; Y380-F399 HydrophobicContact CG-CE1 4.46Å; Y380-F399 AromaticContact CG-CZ 3.71Å; Y380-F399 HydrophobicContact CG-CZ 3.71Å; Y380-F399 AromaticContact CZ-CE1 3.76Å; Y380-F399 AromaticContact CZ-CZ 3.94Å; Y380-W411 HydrophobicContact CD1-CE3 4.15Å; Y380-W411 HydrophobicContact CG-CE3 4.48Å; Y380-F413 WeakPolarHBondContact OH-CA 3.49Å; Y380-F413 PolarHBondContact OH-O 3.29Å; Y380-R415 WeakPolarHBondContact CD1-O 3.17Å; Y380-R415 WeakPolarHBondContact CE1-O 3.46Å
381	Q	89.3	Confident	90.2	Very high	129 Å²	129	33.3 Å²	33.3	60%	0.603	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.4	177.9	-73.4	-176.5	-22.7	0	0	109.2	L379 T416	L379-Q381 HydrophobicContact CD2-CG 4.16Å; L379-Q381 HydrophobicContact CG-CG 4.08Å; Q381-T416 PolarHBondContact N-O 2.88Å
382	G	88.5	Confident	90.6	Very high	31 Å²	31	33.2 Å²	33.2	32%	0.32	19%	0.186	S	C	.	.			trans	-175.3	-32.7	173.6	0	0	0	0	0	112.6	R409	G382-R409 PolarHBondContact O-NH1 3.05Å; G382-R409 PolarHBondContact O-NH2 3.18Å
383	H	93.8	Very high	91.1	Very high	12 Å²	12	32.1 Å²	32.1	6%	0.056	17%	0.174	C	C	.	.			trans	-64.8	143	168.2	-71.7	-71.8	0	0	0	110	V387 S401 S403 D405 R409 W411	H383-V387 HydrophobicContact CB-CG2 3.78Å; H383-S401 PolarHBondContact NE2-OG 2.7Å; H383-S403 WeakPolarHBondContact CE1-CB 3.32Å; H383-S403 WeakPolarHBondContact ND1-CB 3.15Å; H383-S403 PolarHBondContact ND1-OG 2.77Å; H383-D405 IonicContact CE1-OD1 3.89Å; H383-D405 IonicContact CE1-OD2 3.81Å; H383-D405 IonicContact CG-OD2 3.45Å; H383-D405 IonicContact ND1-OD1 3.13Å; H383-D405 PolarHBondContact ND1-OD1 2.7Å; H383-D405 IonicContact ND1-OD2 3.74Å; H383-D405 PolarHBondContact ND1-OD2 3.21Å; H383-R409 WeakPolarHBondContact CE1-CD 3.3Å; H383-R409 VanDerWaalsContact CE1-CG 3.5Å; H383-R409 WeakPolarHBondContact CE1-CG 3.24Å; H383-R409 PolarHBondContact CE1-NE 2.99Å; H383-R409 PolarHBondContact ND1-NE 2.9Å; H383-W411 AromaticContact CD2-CZ2 3.99Å
384	A	91.9	Very high	91.4	Very high	58 Å²	58	34.4 Å²	34.4	48%	0.479	19%	0.189	S	C	.	.	S	Bend	trans	-102	9	176.6	0	0	0	0	0	111.8	M364	M364-A384 WeakPolarHBondContact CE-O 3.26Å; M364-A384 VanDerWaalsContact SD-O 3.37Å
385	Y	96.6	Very high	91.5	Very high	120 Å²	120	40.9 Å²	40.9	47%	0.471	21%	0.214	S	C	.	.	S	Bend	trans	-150.2	165.2	-173.6	-70.2	-84.8	0	0	0	109.3	S403 H404 D405	Y385-S403 PolarHBondContact O-OG 3.3Å; Y385-H404 AromaticContact CD1-CD2 3.52Å; Y385-H404 AromaticContact CG-CD2 3.93Å; Y385-D405 HydrophobicContact CD2-CB 3.59Å; Y385-D405 HydrophobicContact CE2-CB 4.46Å; Y385-D405 HydrophobicContact CG-CB 4.24Å
386	P	97.3	Very high	91.7	Very high	21 Å²	21	41.1 Å²	41.1	14%	0.136	22%	0.217	C	C	.	.			trans	-47.6	142.5	177.6	-34	39.7	0	0	0	113.7	Y346 E362 W388 S403 H404	Y346-P386 HydrophobicContact CE2-CB 4.22Å; E362-P386 HydrophobicContact CG-CB 4.17Å; E362-P386 HydrophobicContact CG-CG 3.75Å; P386-W388 HydrophobicContact CB-CH2 4.15Å; P386-W388 HydrophobicContact CB-CZ2 4.22Å; P386-W388 HydrophobicContact CB-CZ3 4.41Å; P386-S403 WeakPolarHBondContact O-CA 3.3Å; P386-S403 WeakPolarHBondContact O-CB 3.09Å; P386-S403 PolarHBondContact O-OG 2.79Å; P386-H404 HydrophobicContact CB-CB 4.47Å; P386-H404 PolarHBondContact O-N 3.45Å
387	V	97.9	Very high	91.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.3	178.3	-178.1	0	0	0	0	108.4	Y346 C360 S361 I366 H383 L390 G402	Y346-V387 WeakPolarHBondContact CD2-O 3.48Å; C360-V387 HydrophobicContact CB-CB 3.79Å; C360-V387 HydrophobicContact CB-CG1 3.49Å; C360-V387 VanDerWaalsContact CB-CG1 3.49Å; C360-V387 PolarHBondContact SG-O 2.8Å; S361-V387 PolarHBondContact O-N 2.88Å; I366-V387 HydrophobicContact CD1-CG1 4.24Å; I366-V387 HydrophobicContact CG1-CG1 4.15Å; I366-V387 HydrophobicContact CG1-CG2 4.41Å; H383-V387 HydrophobicContact CB-CG2 3.78Å; V387-L390 HydrophobicContact CG1-CD2 4.48Å; V387-G402 CarbonylContact C-O 3.56Å; V387-G402 WeakPolarHBondContact CG1-O 3.17Å
388	W	96.9	Very high	92.2	Very high	68 Å²	68	47 Å²	47	26%	0.258	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-44.3	-171.4	-59.5	130.6	0	0	0	112.9	Y346 P386 G402 H404	Y346-W388 WeakPolarHBondContact CB-O 3.29Å; Y346-W388 HydrophobicContact CD1-CE3 4.48Å; Y346-W388 HydrophobicContact CD1-CZ3 4.43Å; Y346-W388 AromaticContact CD2-CE3 3.57Å; Y346-W388 HydrophobicContact CD2-CE3 3.57Å; Y346-W388 AromaticContact CD2-CZ3 3.76Å; Y346-W388 HydrophobicContact CD2-CZ3 3.76Å; Y346-W388 HydrophobicContact CE1-CZ3 4.07Å; Y346-W388 AromaticContact CE2-CE3 3.63Å; Y346-W388 HydrophobicContact CE2-CE3 3.63Å; Y346-W388 HydrophobicContact CE2-CH2 4.23Å; Y346-W388 AromaticContact CE2-CZ3 3.29Å; Y346-W388 HydrophobicContact CE2-CZ3 3.29Å; Y346-W388 HydrophobicContact CG-CE3 4.02Å; Y346-W388 HydrophobicContact CG-CZ3 4.3Å; Y346-W388 AromaticContact CZ-CZ3 3.47Å; Y346-W388 VanDerWaalsContact CZ-CZ3 3.47Å; P386-W388 HydrophobicContact CB-CH2 4.15Å; P386-W388 HydrophobicContact CB-CZ2 4.22Å; P386-W388 HydrophobicContact CB-CZ3 4.41Å; W388-G402 PolarHBondContact N-O 2.87Å; W388-H404 HydrophobicContact CZ2-CB 3.9Å; W388-H404 AromaticContact CZ2-ND1 3.93Å
389	D	97.4	Very high	92.7	Very high	19 Å²	19	45.9 Å²	45.9	10%	0.102	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	156.3	-172.8	-168	27.6	0	0	0	112.4	S347 R349 S401 G402 D430 C431 V432	S347-D389 PolarHBondContact OG-OD1 3.04Å; R349-D389 IonicContact NH1-OD1 2.87Å; D389-S401 CarbonylContact O-C 3.54Å; D389-S401 WeakPolarHBondContact O-CA 3.16Å; D389-G402 PolarHBondContact N-O 3.17Å; D389-G402 PolarHBondContact O-N 3.45Å; D389-D430 WeakPolarHBondContact CB-O 3.35Å; D389-C431 WeakPolarHBondContact OD2-CA 3.43Å; D389-V432 PolarHBondContact OD2-N 2.94Å
390	L	96.9	Very high	93.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	146.5	179.3	-70.9	173.3	0	0	0	110.2	R349 L358 S359 C360 I366 V387 F399 A400	R349-L390 PolarHBondContact NH1-O 2.85Å; L358-L390 HydrophobicContact CB-CD1 4.08Å; S359-L390 VanDerWaalsContact C-CD1 3.46Å; C360-L390 HydrophobicContact CB-CD1 3.54Å; C360-L390 HydrophobicContact CB-CD2 4.16Å; C360-L390 HydrophobicContact CB-CG 3.67Å; I366-L390 HydrophobicContact CD1-CD2 3.78Å; I366-L390 HydrophobicContact CG1-CD2 3.99Å; I366-L390 HydrophobicContact CG2-CD1 4.01Å; I366-L390 HydrophobicContact CG2-CD2 3.94Å; V387-L390 HydrophobicContact CG1-CD2 4.48Å; L390-F399 HydrophobicContact CD2-CD2 4.37Å; L390-A400 CarbonylContact C-O 3.58Å; L390-A400 VanDerWaalsContact CA-O 3.31Å; L390-A400 WeakPolarHBondContact CA-O 3.45Å
391	D	97.1	Very high	93.4	Very high	16 Å²	16	44.3 Å²	44.3	9%	0.086	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	145.3	165.3	-154.5	50.3	0	0	0	111.4	R349 F399 A400 V432 K433 F434	R349-D391 VanDerWaalsContact CD-OD1 3.32Å; R349-D391 WeakPolarHBondContact CD-OD1 3.39Å; R349-D391 IonicContact NE-OD1 2.62Å; R349-D391 IonicContact NH1-OD1 3.28Å; D391-F399 CarbonylContact O-C 3.58Å; D391-F399 VanDerWaalsContact O-CA 3.23Å; D391-F399 WeakPolarHBondContact O-CA 3.42Å; D391-F399 WeakPolarHBondContact O-CB 3.16Å; D391-A400 PolarHBondContact N-O 2.84Å; D391-A400 PolarHBondContact O-N 2.96Å; D391-V432 WeakPolarHBondContact CB-O 3.43Å; D391-K433 IonicContact OD1-NZ 3.96Å; D391-K433 PolarHBondContact OD1-NZ 3.01Å; D391-K433 VanDerWaalsContact OD2-CA 3.31Å; D391-K433 WeakPolarHBondContact OD2-CA 3.43Å; D391-F434 HydrophobicContact CB-CD2 4.06Å; D391-F434 WeakPolarHBondContact O-CE2 3.5Å; D391-F434 PolarHBondContact OD2-N 3.06Å
392	I	95.4	Very high	93.8	Very high	15 Å²	15	38.1 Å²	38.1	8%	0.077	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	136	177.3	-65.1	170.7	0	0	0	107.9	R349 F350 L351 L358 F399 F413	R349-I392 HydrophobicContact CB-CD1 4.02Å; R349-I392 HydrophobicContact CB-CG1 4.3Å; R349-I392 HydrophobicContact CG-CB 4.3Å; R349-I392 HydrophobicContact CG-CD1 3.87Å; R349-I392 HydrophobicContact CG-CG1 3.95Å; F350-I392 WeakPolarHBondContact O-CD1 3.11Å; L351-I392 HydrophobicContact CD2-CD1 3.82Å; L351-I392 HydrophobicContact CD2-CG2 4.11Å; L351-I392 HydrophobicContact CG-CD1 4.45Å; L358-I392 HydrophobicContact CB-CD1 4.36Å; L358-I392 HydrophobicContact CD1-CD1 3.73Å; L358-I392 HydrophobicContact CD1-CG1 3.69Å; L358-I392 HydrophobicContact CG-CD1 4.06Å; I392-F399 HydrophobicContact CG1-CB 4.05Å; I392-F413 HydrophobicContact CG2-CZ 4.33Å
393	S	92.1	Very high	94.2	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	18%	0.18	C	C	.	.			trans	-58.9	141.5	173.9	66.7	0	0	0	0	109.9	Y395 S396 L397 Y398	S393-Y395 PolarHBondContact O-N 3.38Å; S393-S396 WeakPolarHBondContact O-CA 3.38Å; S393-S396 PolarHBondContact O-N 3.12Å; S393-S396 PolarHBondContact OG-N 2.95Å; S393-L397 PolarHBondContact OG-N 2.87Å; S393-Y398 VanDerWaalsContact CB-O 3.29Å; S393-Y398 WeakPolarHBondContact CB-O 3.45Å; S393-Y398 PolarHBondContact N-O 3.07Å; S393-Y398 PolarHBondContact OG-N 3.45Å; S393-Y398 PolarHBondContact OG-O 3.44Å
394	P	87	Confident	94.4	Very high	60 Å²	60	39.5 Å²	39.5	39%	0.39	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-23.9	178.4	-31.3	33.3	0	0	0	115.7	S438	P394-S438 WeakPolarHBondContact CD-OG 3.44Å
395	Y	84.1	Confident	94.6	Very high	152 Å²	152	38.1 Å²	38.1	60%	0.596	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	6.4	176.8	-55.8	-63.4	0	0	0	114.1	S393 L397 S438	S393-Y395 PolarHBondContact O-N 3.38Å; Y395-L397 PolarHBondContact O-N 2.76Å; Y395-S438 WeakPolarHBondContact CD2-OG 3.49Å
396	S	87.1	Confident	94.6	Very high	32 Å²	32	39 Å²	39	22%	0.224	18%	0.18	C	C	.	.	S	Bend	trans	52.9	25.3	-176.7	-60.1	0	0	0	0	114.7	A352 S393 F413	A352-S396 WeakPolarHBondContact CB-OG 3.48Å; A352-S396 PolarHBondContact N-OG 2.54Å; S393-S396 WeakPolarHBondContact O-CA 3.38Å; S393-S396 PolarHBondContact O-N 3.12Å; S393-S396 PolarHBondContact OG-N 2.95Å; S396-F413 VanDerWaalsContact O-CE2 3.29Å; S396-F413 WeakPolarHBondContact O-CE2 3.19Å
397	L	86.2	Confident	94.6	Very high	104 Å²	104	39 Å²	39	55%	0.545	18%	0.18	S	C	.	.	S	Bend	trans	-84.3	-40.8	178.9	-66.8	175.9	0	0	0	111.8	S393 Y395	S393-L397 PolarHBondContact OG-N 2.87Å; Y395-L397 PolarHBondContact O-N 2.76Å
398	Y	92.5	Very high	94.5	Very high	92 Å²	92	39 Å²	39	36%	0.361	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	160.7	-178.2	-54.7	-62.2	0	0	0	110.2	S393 L410 W411 L419	S393-Y398 VanDerWaalsContact CB-O 3.29Å; S393-Y398 WeakPolarHBondContact CB-O 3.45Å; S393-Y398 PolarHBondContact N-O 3.07Å; S393-Y398 PolarHBondContact OG-N 3.45Å; S393-Y398 PolarHBondContact OG-O 3.44Å; Y398-L410 HydrophobicContact CG-CD1 4.43Å; Y398-W411 WeakPolarHBondContact CA-O 3.48Å; Y398-W411 WeakPolarHBondContact CB-O 3.32Å; Y398-W411 WeakPolarHBondContact CD1-O 2.96Å; Y398-L419 HydrophobicContact CD1-CD1 3.85Å; Y398-L419 HydrophobicContact CE1-CD1 3.72Å
399	F	96.8	Very high	94.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	160.4	164.2	70.3	-89.1	0	0	0	109.6	L358 I366 Y380 L390 D391 I392 W411 F413	L358-F399 HydrophobicContact CD1-CB 3.64Å; L358-F399 HydrophobicContact CD1-CD1 3.83Å; L358-F399 HydrophobicContact CD1-CD2 3.76Å; L358-F399 HydrophobicContact CD1-CE1 4.38Å; L358-F399 HydrophobicContact CD1-CE2 4.33Å; L358-F399 HydrophobicContact CD1-CG 3.48Å; L358-F399 VanDerWaalsContact CD1-CG 3.48Å; I366-F399 HydrophobicContact CD1-CE2 4.14Å; I366-F399 HydrophobicContact CG2-CE2 3.91Å; I366-F399 HydrophobicContact CG2-CZ 4.39Å; Y380-F399 HydrophobicContact CD1-CE1 4.2Å; Y380-F399 AromaticContact CD1-CZ 3.77Å; Y380-F399 HydrophobicContact CD1-CZ 3.77Å; Y380-F399 HydrophobicContact CD2-CE1 4.37Å; Y380-F399 AromaticContact CD2-CZ 3.74Å; Y380-F399 HydrophobicContact CD2-CZ 3.74Å; Y380-F399 AromaticContact CE1-CE1 3.83Å; Y380-F399 HydrophobicContact CE1-CE1 3.83Å; Y380-F399 AromaticContact CE1-CZ 3.89Å; Y380-F399 HydrophobicContact CE1-CZ 3.89Å; Y380-F399 HydrophobicContact CE2-CE1 4.03Å; Y380-F399 AromaticContact CE2-CZ 3.86Å; Y380-F399 HydrophobicContact CE2-CZ 3.86Å; Y380-F399 HydrophobicContact CG-CE1 4.46Å; Y380-F399 AromaticContact CG-CZ 3.71Å; Y380-F399 HydrophobicContact CG-CZ 3.71Å; Y380-F399 AromaticContact CZ-CE1 3.76Å; Y380-F399 AromaticContact CZ-CZ 3.94Å; L390-F399 HydrophobicContact CD2-CD2 4.37Å; D391-F399 CarbonylContact O-C 3.58Å; D391-F399 VanDerWaalsContact O-CA 3.23Å; D391-F399 WeakPolarHBondContact O-CA 3.42Å; D391-F399 WeakPolarHBondContact O-CB 3.16Å; I392-F399 HydrophobicContact CG1-CB 4.05Å; F399-W411 HydrophobicContact CD1-CB 3.75Å; F399-W411 HydrophobicContact CD2-CB 3.84Å; F399-W411 AromaticContact CD2-CD1 3.7Å; F399-W411 AromaticContact CD2-CG 3.96Å; F399-W411 HydrophobicContact CD2-CG 3.96Å; F399-W411 HydrophobicContact CE1-CB 3.33Å; F399-W411 HydrophobicContact CE1-CG 4.16Å; F399-W411 HydrophobicContact CE2-CB 3.42Å; F399-W411 VanDerWaalsContact CE2-CB 3.42Å; F399-W411 AromaticContact CE2-CD1 3.35Å; F399-W411 HydrophobicContact CE2-CD2 4.08Å; F399-W411 AromaticContact CE2-CG 3.35Å; F399-W411 HydrophobicContact CE2-CG 3.35Å; F399-W411 HydrophobicContact CG-CB 3.99Å; F399-W411 HydrophobicContact CZ-CB 3.15Å; F399-W411 AromaticContact CZ-CD1 3.99Å; F399-W411 HydrophobicContact CZ-CD2 4.09Å; F399-W411 AromaticContact CZ-CG 3.47Å; F399-W411 HydrophobicContact CZ-CG 3.47Å; F399-W411 VanDerWaalsContact CZ-CG 3.47Å; F399-W411 PolarHBondContact N-O 3.39Å; F399-W411 PolarHBondContact O-N 2.87Å; F399-F413 HydrophobicContact CB-CZ 4.15Å; F399-F413 HydrophobicContact CD1-CD1 4.06Å; F399-F413 HydrophobicContact CD1-CD2 4.4Å; F399-F413 AromaticContact CD1-CE1 3.74Å; F399-F413 HydrophobicContact CD1-CE1 3.74Å; F399-F413 HydrophobicContact CD1-CE2 4.08Å; F399-F413 HydrophobicContact CD1-CG 4.39Å; F399-F413 AromaticContact CD1-CZ 3.74Å; F399-F413 HydrophobicContact CD1-CZ 3.74Å; F399-F413 HydrophobicContact CE1-CD1 4.21Å; F399-F413 HydrophobicContact CE1-CE1 4.24Å; F399-F413 HydrophobicContact CG-CZ 4.36Å
400	A	97.9	Very high	94.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.2	179.3	0	0	0	0	0	110.1	L390 D391 R409 V432 F434 L441	L390-A400 CarbonylContact C-O 3.58Å; L390-A400 VanDerWaalsContact CA-O 3.31Å; L390-A400 WeakPolarHBondContact CA-O 3.45Å; D391-A400 PolarHBondContact N-O 2.84Å; D391-A400 PolarHBondContact O-N 2.96Å; A400-R409 CarbonylContact C-O 3.44Å; A400-R409 WeakPolarHBondContact CA-O 3.39Å; A400-R409 WeakPolarHBondContact CB-O 3.45Å; A400-V432 HydrophobicContact CB-CG1 3.69Å; A400-F434 HydrophobicContact CB-CE2 3.56Å; A400-F434 HydrophobicContact CB-CZ 3.7Å; A400-L441 HydrophobicContact CB-CD1 3.6Å; A400-L441 HydrophobicContact CB-CD2 3.75Å; A400-L441 HydrophobicContact CB-CG 4.33Å
401	S	98.1	Very high	94.5	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	145.9	179.3	59.5	0	0	0	0	111	I366 H383 D389 A408 R409 W411	I366-S401 VanDerWaalsContact CD1-CB 3.47Å; H383-S401 PolarHBondContact NE2-OG 2.7Å; D389-S401 CarbonylContact O-C 3.54Å; D389-S401 WeakPolarHBondContact O-CA 3.16Å; S401-A408 CarbonylContact O-C 3.59Å; S401-A408 WeakPolarHBondContact O-CA 3.26Å; S401-A408 WeakPolarHBondContact O-CB 3.34Å; S401-R409 PolarHBondContact N-O 3.27Å; S401-R409 PolarHBondContact O-N 3.42Å; S401-W411 PolarHBondContact OG-NE1 3.28Å
402	G	97.8	Very high	94.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	139.4	170.8	0	0	0	0	0	110.3	V387 W388 D389 V429	V387-G402 CarbonylContact C-O 3.56Å; V387-G402 WeakPolarHBondContact CG1-O 3.17Å; W388-G402 PolarHBondContact N-O 2.87Å; D389-G402 PolarHBondContact N-O 3.17Å; D389-G402 PolarHBondContact O-N 3.45Å; G402-V429 CarbonylContact C-O 3.58Å
403	S	97.9	Very high	93.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	160.7	-173.8	175	0	0	0	0	112.5	H383 Y385 P386 D405 R406 T407 V429	H383-S403 WeakPolarHBondContact CE1-CB 3.32Å; H383-S403 WeakPolarHBondContact ND1-CB 3.15Å; H383-S403 PolarHBondContact ND1-OG 2.77Å; Y385-S403 PolarHBondContact O-OG 3.3Å; P386-S403 WeakPolarHBondContact O-CA 3.3Å; P386-S403 WeakPolarHBondContact O-CB 3.09Å; P386-S403 PolarHBondContact O-OG 2.79Å; S403-D405 WeakPolarHBondContact CB-OD1 3.04Å; S403-D405 PolarHBondContact O-N 3.17Å; S403-D405 PolarHBondContact OG-N 2.74Å; S403-R406 PolarHBondContact O-N 2.74Å; S403-T407 PolarHBondContact N-O 3.04Å; S403-V429 PolarHBondContact N-O 3.13Å; S403-V429 PolarHBondContact O-N 2.73Å
404	H	97.3	Very high	93.5	Very high	72 Å²	72	43.6 Å²	43.6	33%	0.333	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.8	166.9	-176.5	82.2	0	0	0	113.1	Y385 P386 W388 R406 D428	Y385-H404 AromaticContact CD1-CD2 3.52Å; Y385-H404 AromaticContact CG-CD2 3.93Å; P386-H404 HydrophobicContact CB-CB 4.47Å; P386-H404 PolarHBondContact O-N 3.45Å; W388-H404 HydrophobicContact CZ2-CB 3.9Å; W388-H404 AromaticContact CZ2-ND1 3.93Å; H404-R406 PolarHBondContact O-N 3.35Å; H404-D428 IonicContact CE1-OD1 2.78Å; H404-D428 IonicContact CE1-OD2 3.84Å; H404-D428 PolarHBondContact CE1-OD2 2.92Å; H404-D428 VanDerWaalsContact CE1-OD2 3.28Å; H404-D428 IonicContact CG-OD2 3.45Å; H404-D428 VanDerWaalsContact ND1-CG 3.28Å; H404-D428 IonicContact ND1-OD1 2.87Å; H404-D428 IonicContact ND1-OD2 3.15Å; H404-D428 PolarHBondContact ND1-OD2 3.27Å
405	D	95.9	Very high	93.4	Very high	28 Å²	28	45.6 Å²	45.6	15%	0.15	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	6.1	174.4	78.3	2.5	0	0	0	114.6	H383 Y385 S403 T407 R409	H383-D405 IonicContact CE1-OD1 3.89Å; H383-D405 IonicContact CE1-OD2 3.81Å; H383-D405 IonicContact CG-OD2 3.45Å; H383-D405 IonicContact ND1-OD1 3.13Å; H383-D405 PolarHBondContact ND1-OD1 2.7Å; H383-D405 IonicContact ND1-OD2 3.74Å; H383-D405 PolarHBondContact ND1-OD2 3.21Å; Y385-D405 HydrophobicContact CD2-CB 3.59Å; Y385-D405 HydrophobicContact CE2-CB 4.46Å; Y385-D405 HydrophobicContact CG-CB 4.24Å; S403-D405 WeakPolarHBondContact CB-OD1 3.04Å; S403-D405 PolarHBondContact O-N 3.17Å; S403-D405 PolarHBondContact OG-N 2.74Å; D405-T407 PolarHBondContact O-N 2.59Å; D405-T407 WeakPolarHBondContact OD1-CA 3.1Å; D405-T407 WeakPolarHBondContact OD1-CB 3.46Å; D405-T407 PolarHBondContact OD1-N 3.42Å; D405-T407 PolarHBondContact OD1-OG1 3.48Å; D405-T407 PolarHBondContact OD2-OG1 3.29Å; D405-R409 IonicContact OD2-CZ 3.64Å; D405-R409 IonicContact OD2-NE 2.69Å; D405-R409 IonicContact OD2-NH2 3.57Å; D405-R409 PolarHBondContact OD2-NH2 3.01Å
406	R	96.6	Very high	93.5	Very high	139 Å²	139	42.3 Å²	42.3	53%	0.525	20%	0.202	S	C	.	.	S	Bend	trans	67.6	12.4	179.7	-42.9	-179.3	-175	165.3	4.6	113.9	S403 H404 A427	S403-R406 PolarHBondContact O-N 2.74Å; H404-R406 PolarHBondContact O-N 3.35Å; R406-A427 WeakPolarHBondContact CA-O 3.45Å; R406-A427 VanDerWaalsContact CB-O 3.26Å; R406-A427 WeakPolarHBondContact CB-O 3.4Å
407	T	96.7	Very high	93.5	Very high	20 Å²	20	46.7 Å²	46.7	12%	0.123	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	146.6	177.9	75.6	0	0	0	0	110.5	S403 D405 R409 I421 A423	S403-T407 PolarHBondContact N-O 3.04Å; D405-T407 PolarHBondContact O-N 2.59Å; D405-T407 WeakPolarHBondContact OD1-CA 3.1Å; D405-T407 WeakPolarHBondContact OD1-CB 3.46Å; D405-T407 PolarHBondContact OD1-N 3.42Å; D405-T407 PolarHBondContact OD1-OG1 3.48Å; D405-T407 PolarHBondContact OD2-OG1 3.29Å; T407-R409 PolarHBondContact OG1-NE 3.22Å; T407-I421 HydrophobicContact CG2-CG2 3.96Å; T407-A423 HydrophobicContact CG2-CB 4.3Å
408	A	97.8	Very high	93.9	Very high	1 Å²	1	43 Å²	43	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	152.2	157.9	0	0	0	0	0	109.2	S401 Y422 V429 V432 T443	S401-A408 CarbonylContact O-C 3.59Å; S401-A408 WeakPolarHBondContact O-CA 3.26Å; S401-A408 WeakPolarHBondContact O-CB 3.34Å; A408-Y422 HydrophobicContact CB-CD2 4.03Å; A408-Y422 PolarHBondContact N-O 3.37Å; A408-Y422 WeakPolarHBondContact O-CD2 3.16Å; A408-Y422 PolarHBondContact O-N 2.92Å; A408-V429 HydrophobicContact CB-CG1 4.32Å; A408-V432 HydrophobicContact CB-CG2 4.28Å; A408-T443 HydrophobicContact CB-CG2 3.53Å
409	R	97.7	Very high	93.9	Very high	29 Å²	29	41.6 Å²	41.6	11%	0.109	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.6	179	-62.8	-175.6	-170.7	-163.7	15.4	111.2	G382 H383 A400 S401 D405 T407 W411 P418 R420 I421	G382-R409 PolarHBondContact O-NH1 3.05Å; G382-R409 PolarHBondContact O-NH2 3.18Å; H383-R409 WeakPolarHBondContact CE1-CD 3.3Å; H383-R409 VanDerWaalsContact CE1-CG 3.5Å; H383-R409 WeakPolarHBondContact CE1-CG 3.24Å; H383-R409 PolarHBondContact CE1-NE 2.99Å; H383-R409 PolarHBondContact ND1-NE 2.9Å; A400-R409 CarbonylContact C-O 3.44Å; A400-R409 WeakPolarHBondContact CA-O 3.39Å; A400-R409 WeakPolarHBondContact CB-O 3.45Å; S401-R409 PolarHBondContact N-O 3.27Å; S401-R409 PolarHBondContact O-N 3.42Å; D405-R409 IonicContact OD2-CZ 3.64Å; D405-R409 IonicContact OD2-NE 2.69Å; D405-R409 IonicContact OD2-NH2 3.57Å; D405-R409 PolarHBondContact OD2-NH2 3.01Å; T407-R409 PolarHBondContact OG1-NE 3.22Å; R409-W411 HydrophobicContact CB-CZ2 4.1Å; R409-P418 HydrophobicContact CB-CB 4.04Å; R409-P418 HydrophobicContact CG-CB 4.43Å; R409-R420 CarbonylContact C-O 3.59Å; R409-R420 VanDerWaalsContact CA-O 3.28Å; R409-R420 WeakPolarHBondContact CA-O 3.29Å; R409-I421 HydrophobicContact CG-CG1 4.27Å
410	L	97.1	Very high	93.7	Very high	9 Å²	9	46 Å²	46	5%	0.047	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.5	172.1	-171.4	69.3	0	0	0	108.8	Y398 P418 L419 R420 Y422 F434	Y398-L410 HydrophobicContact CG-CD1 4.43Å; L410-P418 CarbonylContact O-C 3.59Å; L410-P418 WeakPolarHBondContact O-CA 3.28Å; L410-L419 PolarHBondContact O-N 3.37Å; L410-R420 HydrophobicContact CB-CB 3.92Å; L410-R420 PolarHBondContact N-O 3.47Å; L410-R420 PolarHBondContact O-N 2.58Å; L410-Y422 HydrophobicContact CB-CE2 3.86Å; L410-F434 HydrophobicContact CD1-CE1 3.92Å; L410-F434 HydrophobicContact CD1-CZ 3.56Å
411	W	95.8	Very high	93.6	Very high	1 Å²	1	50.2 Å²	50.2	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160.8	-178.6	-53.4	86.8	0	0	0	110.2	I366 Y380 H383 Y398 F399 S401 R409 Y417 P418	I366-W411 HydrophobicContact CD1-CZ2 4.17Å; Y380-W411 HydrophobicContact CD1-CE3 4.15Å; Y380-W411 HydrophobicContact CG-CE3 4.48Å; H383-W411 AromaticContact CD2-CZ2 3.99Å; Y398-W411 WeakPolarHBondContact CA-O 3.48Å; Y398-W411 WeakPolarHBondContact CB-O 3.32Å; Y398-W411 WeakPolarHBondContact CD1-O 2.96Å; F399-W411 HydrophobicContact CD1-CB 3.75Å; F399-W411 HydrophobicContact CD2-CB 3.84Å; F399-W411 AromaticContact CD2-CD1 3.7Å; F399-W411 AromaticContact CD2-CG 3.96Å; F399-W411 HydrophobicContact CD2-CG 3.96Å; F399-W411 HydrophobicContact CE1-CB 3.33Å; F399-W411 HydrophobicContact CE1-CG 4.16Å; F399-W411 HydrophobicContact CE2-CB 3.42Å; F399-W411 VanDerWaalsContact CE2-CB 3.42Å; F399-W411 AromaticContact CE2-CD1 3.35Å; F399-W411 HydrophobicContact CE2-CD2 4.08Å; F399-W411 AromaticContact CE2-CG 3.35Å; F399-W411 HydrophobicContact CE2-CG 3.35Å; F399-W411 HydrophobicContact CG-CB 3.99Å; F399-W411 HydrophobicContact CZ-CB 3.15Å; F399-W411 AromaticContact CZ-CD1 3.99Å; F399-W411 HydrophobicContact CZ-CD2 4.09Å; F399-W411 AromaticContact CZ-CG 3.47Å; F399-W411 HydrophobicContact CZ-CG 3.47Å; F399-W411 VanDerWaalsContact CZ-CG 3.47Å; F399-W411 PolarHBondContact N-O 3.39Å; F399-W411 PolarHBondContact O-N 2.87Å; S401-W411 PolarHBondContact OG-NE1 3.28Å; R409-W411 HydrophobicContact CB-CZ2 4.1Å; W411-Y417 VanDerWaalsContact CZ3-C 3.45Å; W411-P418 HydrophobicContact CD2-CB 4.07Å; W411-P418 HydrophobicContact CE3-CB 4.02Å; W411-P418 HydrophobicContact CH2-CB 4.03Å; W411-P418 HydrophobicContact CH2-CG 4.16Å; W411-P418 HydrophobicContact CZ2-CB 4.05Å; W411-P418 HydrophobicContact CZ3-CB 4.02Å; W411-P418 VanDerWaalsContact CZ3-CD 3.45Å; W411-P418 HydrophobicContact CZ3-CG 4.28Å; W411-P418 VanDerWaalsContact CZ3-N 3.28Å
412	S	91.8	Very high	93.5	Very high	17 Å²	17	50.2 Å²	50.2	12%	0.119	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	146.8	169.5	176.8	0	0	0	0	107.9	D414 R415	S412-D414 WeakPolarHBondContact CB-OD1 3.13Å; S412-D414 PolarHBondContact O-N 3.34Å; S412-D414 PolarHBondContact OG-OD1 2.93Å; S412-R415 PolarHBondContact O-N 3.49Å; S412-R415 VanDerWaalsContact O-N 3.15Å; S412-R415 VanDerWaalsContact O-O 3.09Å
413	F	87.1	Confident	93.4	Very high	45 Å²	45	53.5 Å²	53.5	20%	0.197	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.6	-174.4	-65.4	-84.9	0	0	0	113.4	L351 L358 Y368 Y380 I392 S396 F399	L351-F413 HydrophobicContact CD2-CE1 3.81Å; L351-F413 HydrophobicContact CD2-CE2 4.22Å; L351-F413 HydrophobicContact CD2-CZ 3.47Å; L351-F413 VanDerWaalsContact CD2-CZ 3.47Å; L358-F413 HydrophobicContact CD1-CE1 3.8Å; L358-F413 HydrophobicContact CD1-CZ 4.08Å; L358-F413 HydrophobicContact CD2-CE1 4.09Å; L358-F413 HydrophobicContact CG-CE1 4.1Å; Y368-F413 HydrophobicContact CD2-CE1 4.48Å; Y380-F413 WeakPolarHBondContact OH-CA 3.49Å; Y380-F413 PolarHBondContact OH-O 3.29Å; I392-F413 HydrophobicContact CG2-CZ 4.33Å; S396-F413 VanDerWaalsContact O-CE2 3.29Å; S396-F413 WeakPolarHBondContact O-CE2 3.19Å; F399-F413 HydrophobicContact CB-CZ 4.15Å; F399-F413 HydrophobicContact CD1-CD1 4.06Å; F399-F413 HydrophobicContact CD1-CD2 4.4Å; F399-F413 AromaticContact CD1-CE1 3.74Å; F399-F413 HydrophobicContact CD1-CE1 3.74Å; F399-F413 HydrophobicContact CD1-CE2 4.08Å; F399-F413 HydrophobicContact CD1-CG 4.39Å; F399-F413 AromaticContact CD1-CZ 3.74Å; F399-F413 HydrophobicContact CD1-CZ 3.74Å; F399-F413 HydrophobicContact CE1-CD1 4.21Å; F399-F413 HydrophobicContact CE1-CE1 4.24Å; F399-F413 HydrophobicContact CG-CZ 4.36Å
414	D	84.9	Confident	93.1	Very high	115 Å²	115	54.9 Å²	54.9	62%	0.615	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-12.3	177.1	70.1	-29.8	0	0	0	113.8	S412	S412-D414 WeakPolarHBondContact CB-OD1 3.13Å; S412-D414 PolarHBondContact O-N 3.34Å; S412-D414 PolarHBondContact OG-OD1 2.93Å
415	R	85.3	Confident	93.1	Very high	101 Å²	101	52 Å²	52	38%	0.381	26%	0.262	S	S	.	.			trans	-130.2	132.2	-170.4	-69.8	167.1	-164.5	-132	5.1	111.8	Y380 S412 Y417	Y380-R415 WeakPolarHBondContact CD1-O 3.17Å; Y380-R415 WeakPolarHBondContact CE1-O 3.46Å; S412-R415 PolarHBondContact O-N 3.49Å; S412-R415 VanDerWaalsContact O-N 3.15Å; S412-R415 VanDerWaalsContact O-O 3.09Å; R415-Y417 VanDerWaalsContact C-N 3.29Å; R415-Y417 PolarHBondContact NH1-OH 3.02Å; R415-Y417 PolarHBondContact O-N 3.07Å
416	T	86.1	Confident	93.1	Very high	83 Å²	83	57.1 Å²	57.1	51%	0.509	29%	0.289	S	S	.	.	S	Bend	trans	-79.3	-7.9	179.1	54.6	0	0	0	0	114.5	V378 Q381	V378-T416 HydrophobicContact CG1-CG2 4.22Å; Q381-T416 PolarHBondContact N-O 2.88Å
417	Y	86.5	Confident	93.1	Very high	125 Å²	125	51.6 Å²	51.6	49%	0.49	27%	0.273	S	S	.	.	S	Bend	trans	-117.9	155	179	61.6	-94.4	0	0	0	110.8	W411 R415	W411-Y417 VanDerWaalsContact CZ3-C 3.45Å; R415-Y417 VanDerWaalsContact C-N 3.29Å; R415-Y417 PolarHBondContact NH1-OH 3.02Å; R415-Y417 PolarHBondContact O-N 3.07Å
418	P	93.6	Very high	93.2	Very high	27 Å²	27	52 Å²	52	18%	0.175	27%	0.274	C	S	.	.			trans	-70.3	138.7	-173.5	29.3	-35.7	0	0	0	111.1	R409 L410 W411 R420	R409-P418 HydrophobicContact CB-CB 4.04Å; R409-P418 HydrophobicContact CG-CB 4.43Å; L410-P418 CarbonylContact O-C 3.59Å; L410-P418 WeakPolarHBondContact O-CA 3.28Å; W411-P418 HydrophobicContact CD2-CB 4.07Å; W411-P418 HydrophobicContact CE3-CB 4.02Å; W411-P418 HydrophobicContact CH2-CB 4.03Å; W411-P418 HydrophobicContact CH2-CG 4.16Å; W411-P418 HydrophobicContact CZ2-CB 4.05Å; W411-P418 HydrophobicContact CZ3-CB 4.02Å; W411-P418 VanDerWaalsContact CZ3-CD 3.45Å; W411-P418 HydrophobicContact CZ3-CG 4.28Å; W411-P418 VanDerWaalsContact CZ3-N 3.28Å; P418-R420 VanDerWaalsContact C-N 3.3Å
419	L	92.5	Very high	93.2	Very high	62 Å²	62	52 Å²	52	33%	0.325	27%	0.274	S	S	.	.	S	Bend	trans	-67.8	-35.2	170.3	-71.5	-180	0	0	0	111.6	Y398 L410	Y398-L419 HydrophobicContact CD1-CD1 3.85Å; Y398-L419 HydrophobicContact CE1-CD1 3.72Å; L410-L419 PolarHBondContact O-N 3.37Å
420	R	93.5	Very high	93.2	Very high	92 Å²	92	52.1 Å²	52.1	35%	0.347	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	150.5	-172.6	-161.3	166.5	-71.1	-83.3	-5.1	112	R409 L410 P418 Y422 A455 Q456 Q457 G458	R409-R420 CarbonylContact C-O 3.59Å; R409-R420 VanDerWaalsContact CA-O 3.28Å; R409-R420 WeakPolarHBondContact CA-O 3.29Å; L410-R420 HydrophobicContact CB-CB 3.92Å; L410-R420 PolarHBondContact N-O 3.47Å; L410-R420 PolarHBondContact O-N 2.58Å; P418-R420 VanDerWaalsContact C-N 3.3Å; R420-Y422 HydrophobicContact CG-CE1 4.35Å; R420-A455 PolarHBondContact NE-O 3.42Å; R420-Q456 PolarHBondContact NE-O 2.93Å; R420-Q456 PolarHBondContact NH2-O 3.4Å; R420-Q457 PolarHBondContact NH1-O 2.91Å; R420-G458 VanDerWaalsContact CD-CA 3.46Å
421	I	95.5	Very high	93.2	Very high	89 Å²	89	51.8 Å²	51.8	46%	0.456	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.4	175.5	-55.4	175	0	0	0	107.9	T407 R409 A423	T407-I421 HydrophobicContact CG2-CG2 3.96Å; R409-I421 HydrophobicContact CG-CG1 4.27Å; I421-A423 HydrophobicContact CG2-CB 4.42Å
422	Y	96.6	Very high	93.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	88	173.1	-55	-74	0	0	0	108.5	A408 L410 R420 L441 W453 A455	A408-Y422 HydrophobicContact CB-CD2 4.03Å; A408-Y422 PolarHBondContact N-O 3.37Å; A408-Y422 WeakPolarHBondContact O-CD2 3.16Å; A408-Y422 PolarHBondContact O-N 2.92Å; L410-Y422 HydrophobicContact CB-CE2 3.86Å; R420-Y422 HydrophobicContact CG-CE1 4.35Å; Y422-L441 HydrophobicContact CD2-CD2 3.76Å; Y422-L441 HydrophobicContact CE2-CD2 3.48Å; Y422-L441 VanDerWaalsContact CE2-CD2 3.48Å; Y422-W453 HydrophobicContact CD1-CB 3.58Å; Y422-W453 AromaticContact CD1-CD2 3.79Å; Y422-W453 HydrophobicContact CD1-CD2 3.79Å; Y422-W453 AromaticContact CD1-CE3 3.83Å; Y422-W453 HydrophobicContact CD1-CE3 3.83Å; Y422-W453 AromaticContact CD1-CG 3.69Å; Y422-W453 HydrophobicContact CD1-CG 3.69Å; Y422-W453 HydrophobicContact CE1-CB 3.7Å; Y422-W453 HydrophobicContact CE1-CG 4.3Å; Y422-W453 HydrophobicContact CG-CB 4.32Å; Y422-W453 HydrophobicContact CG-CD2 4.1Å; Y422-W453 HydrophobicContact CG-CE3 4.38Å; Y422-W453 HydrophobicContact CG-CG 4.05Å; Y422-A455 VanDerWaalsContact OH-CA 3.32Å; Y422-A455 WeakPolarHBondContact OH-CA 3.29Å; Y422-A455 PolarHBondContact OH-O 3.15Å
423	A	94.6	Very high	93.6	Very high	68 Å²	68	53 Å²	53	56%	0.562	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.6	177.8	0	0	0	0	0	110.4	T407 I421 W453	T407-A423 HydrophobicContact CG2-CB 4.3Å; I421-A423 HydrophobicContact CG2-CB 4.42Å; A423-W453 WeakPolarHBondContact O-CH2 3.23Å
424	G	92.9	Very high	94.1	Very high	30 Å²	30	51.3 Å²	51.3	31%	0.309	27%	0.271	S	S	.	.			trans	162.5	-16.2	167.4	0	0	0	0	0	115.3	R451	G424-R451 VanDerWaalsContact CA-NH1 3.26Å; G424-R451 PolarHBondContact O-NH1 3.34Å; G424-R451 PolarHBondContact O-NH2 3.23Å
425	H	96.4	Very high	94.6	Very high	11 Å²	11	46.6 Å²	46.6	5%	0.051	25%	0.245	C	C	.	.			trans	-59.9	151.2	167.5	-80.1	-69	0	0	0	111	V429 T443 S445 D447 T449	H425-V429 HydrophobicContact CB-CG2 4.32Å; H425-T443 PolarHBondContact CD2-OG1 3.09Å; H425-T443 PolarHBondContact NE2-OG1 2.61Å; H425-S445 VanDerWaalsContact CE1-CB 3.49Å; H425-S445 WeakPolarHBondContact CE1-CB 3.23Å; H425-S445 WeakPolarHBondContact ND1-CB 3.32Å; H425-D447 WeakPolarHBondContact CA-OD2 3.42Å; H425-D447 IonicContact CE1-OD1 3.52Å; H425-D447 IonicContact CG-OD2 3.67Å; H425-D447 IonicContact ND1-OD1 3.48Å; H425-D447 PolarHBondContact ND1-OD1 2.84Å; H425-D447 IonicContact ND1-OD2 3.72Å; H425-D447 PolarHBondContact ND1-OD2 2.98Å; H425-T449 PolarHBondContact CE1-OG1 2.81Å; H425-T449 PolarHBondContact ND1-OG1 2.89Å
426	L	95.8	Very high	94.9	Very high	135 Å²	135	43.7 Å²	43.7	71%	0.707	24%	0.239	S	C	*	.	S	Bend	trans	-92.3	-13.5	-177.4	-60.4	178.2	0	0	0	112.8	D447	L426-D447 HydrophobicContact CB-CB 4.01Å; L426-D447 PolarHBondContact N-OD2 3Å
427	A	97.3	Very high	95	Very high	23 Å²	23	42.3 Å²	42.3	19%	0.19	23%	0.229	C	C	.	.	S	Bend	trans	-144.2	-172	177.6	0	0	0	0	0	109.2	R406 S445 D447	R406-A427 WeakPolarHBondContact CA-O 3.45Å; R406-A427 VanDerWaalsContact CB-O 3.26Å; R406-A427 WeakPolarHBondContact CB-O 3.4Å; A427-S445 PolarHBondContact O-OG 3.14Å; A427-D447 HydrophobicContact CB-CB 4.06Å
428	D	97.5	Very high	95.2	Very high	30 Å²	30	36.9 Å²	36.9	16%	0.16	21%	0.21	C	C	.	.			trans	-56.5	150.6	-172.7	-50.1	1.2	0	0	0	112.2	H404 S445 T446	H404-D428 IonicContact CE1-OD1 2.78Å; H404-D428 IonicContact CE1-OD2 3.84Å; H404-D428 PolarHBondContact CE1-OD2 2.92Å; H404-D428 VanDerWaalsContact CE1-OD2 3.28Å; H404-D428 IonicContact CG-OD2 3.45Å; H404-D428 VanDerWaalsContact ND1-CG 3.28Å; H404-D428 IonicContact ND1-OD1 2.87Å; H404-D428 IonicContact ND1-OD2 3.15Å; H404-D428 PolarHBondContact ND1-OD2 3.27Å; D428-S445 WeakPolarHBondContact O-CA 3.2Å; D428-S445 WeakPolarHBondContact O-CB 3.46Å; D428-S445 PolarHBondContact O-OG 2.62Å; D428-T446 PolarHBondContact O-N 3.22Å; D428-T446 VanDerWaalsContact O-N 3.14Å
429	V	98.3	Very high	95	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	101.3	174	-179.2	0	0	0	0	108.3	G402 S403 A408 H425 V432 T443	G402-V429 CarbonylContact C-O 3.58Å; S403-V429 PolarHBondContact N-O 3.13Å; S403-V429 PolarHBondContact O-N 2.73Å; A408-V429 HydrophobicContact CB-CG1 4.32Å; H425-V429 HydrophobicContact CB-CG2 4.32Å; V429-V432 HydrophobicContact CG1-CG2 3.76Å; V429-T443 HydrophobicContact CG1-CG2 4.29Å
430	D	97.6	Very high	95.1	Very high	31 Å²	31	41.2 Å²	41.2	17%	0.166	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-31	-171.9	-61.6	-45.2	0	0	0	112.6	D389 G444 T446 L472	D389-D430 WeakPolarHBondContact CB-O 3.35Å; D430-G444 PolarHBondContact N-O 3Å; D430-T446 PolarHBondContact OD1-OG1 2.77Å; D430-T446 WeakPolarHBondContact OD2-CA 3.41Å; D430-T446 PolarHBondContact OD2-N 3.27Å; D430-T446 PolarHBondContact OD2-OG1 2.79Å; D430-L472 HydrophobicContact CB-CD2 4.41Å
431	C	97.5	Very high	95.3	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.02	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	147.7	-178.7	56.5	0	0	0	0	112.9	D389 T443 G444 V471 L472	D389-C431 WeakPolarHBondContact OD2-CA 3.43Å; C431-T443 WeakPolarHBondContact O-CA 3.33Å; C431-G444 PolarHBondContact N-O 2.87Å; C431-G444 PolarHBondContact O-N 2.7Å; C431-V471 PolarHBondContact SG-O 2.83Å; C431-L472 WeakPolarHBondContact CB-O 3.44Å; C431-L472 VanDerWaalsContact SG-C 3.59Å
432	V	98.1	Very high	95.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.4	-176.5	179.4	0	0	0	0	109.7	D389 D391 A400 A408 V429 L441 A442 T443	D389-V432 PolarHBondContact OD2-N 2.94Å; D391-V432 WeakPolarHBondContact CB-O 3.43Å; A400-V432 HydrophobicContact CB-CG1 3.69Å; A408-V432 HydrophobicContact CB-CG2 4.28Å; V429-V432 HydrophobicContact CG1-CG2 3.76Å; V432-L441 HydrophobicContact CG1-CD1 3.59Å; V432-L441 HydrophobicContact CG1-CD2 3.91Å; V432-L441 HydrophobicContact CG1-CG 3.91Å; V432-A442 WeakPolarHBondContact CA-O 3.4Å; V432-T443 HydrophobicContact CG2-CG2 4.19Å
433	K	97.8	Very high	95.5	Very high	42 Å²	42	32.6 Å²	32.6	18%	0.183	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	139.9	175.3	-70.8	-68.9	152.2	-168.9	0	112.8	D391 L441 A442 L474 F476	D391-K433 IonicContact OD1-NZ 3.96Å; D391-K433 PolarHBondContact OD1-NZ 3.01Å; D391-K433 VanDerWaalsContact OD2-CA 3.31Å; D391-K433 WeakPolarHBondContact OD2-CA 3.43Å; K433-L441 WeakPolarHBondContact O-CD1 3.3Å; K433-A442 PolarHBondContact N-O 2.87Å; K433-A442 PolarHBondContact O-N 2.69Å; K433-L474 HydrophobicContact CB-CB 4.25Å; K433-L474 HydrophobicContact CG-CB 3.76Å; K433-L474 WeakPolarHBondContact CG-O 3.36Å; K433-F476 HydrophobicContact CB-CD2 4.04Å; K433-F476 HydrophobicContact CB-CE2 4.1Å; K433-F476 WeakPolarHBondContact O-CE2 3.4Å
434	F	96.8	Very high	95.7	Very high	10 Å²	10	29.4 Å²	29.4	4%	0.044	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	140.7	168.4	-81.5	-81.1	0	0	0	111.4	D391 A400 L410 L441 F476	D391-F434 HydrophobicContact CB-CD2 4.06Å; D391-F434 WeakPolarHBondContact O-CE2 3.5Å; D391-F434 PolarHBondContact OD2-N 3.06Å; A400-F434 HydrophobicContact CB-CE2 3.56Å; A400-F434 HydrophobicContact CB-CZ 3.7Å; L410-F434 HydrophobicContact CD1-CE1 3.92Å; L410-F434 HydrophobicContact CD1-CZ 3.56Å; F434-L441 HydrophobicContact CD1-CD1 3.78Å; F434-L441 HydrophobicContact CD2-CD1 3.89Å; F434-L441 HydrophobicContact CE1-CD1 3.81Å; F434-L441 HydrophobicContact CE2-CD1 3.91Å; F434-L441 HydrophobicContact CG-CD1 3.84Å; F434-L441 HydrophobicContact CZ-CD1 3.88Å; F434-F476 VanDerWaalsContact C-CD2 3.5Å; F434-F476 WeakPolarHBondContact O-CD2 3.5Å
435	H	95.6	Very high	95.9	Very high	16 Å²	16	28 Å²	28	7%	0.074	15%	0.146	C	C	.	.			trans	-67.9	147.9	165.2	-176.1	-85.9	0	0	0	109.8	N437 S438 Y440 F476 G480	H435-N437 PolarHBondContact CE1-ND2 3.28Å; H435-N437 PolarHBondContact ND1-N 3.37Å; H435-N437 PolarHBondContact ND1-ND2 2.89Å; H435-N437 PolarHBondContact ND1-OD1 2.99Å; H435-N437 PolarHBondContact O-N 3.26Å; H435-S438 WeakPolarHBondContact O-CA 3.39Å; H435-S438 PolarHBondContact O-N 2.93Å; H435-Y440 WeakPolarHBondContact CB-O 3.36Å; H435-Y440 PolarHBondContact N-O 2.8Å; H435-F476 HydrophobicContact CB-CD1 4.4Å; H435-F476 HydrophobicContact CB-CD2 4.43Å; H435-F476 HydrophobicContact CB-CE1 4.11Å; H435-F476 HydrophobicContact CB-CE2 4.12Å; H435-F476 HydrophobicContact CB-CZ 3.93Å; H435-F476 AromaticContact CD2-CD1 3.57Å; H435-F476 AromaticContact CD2-CE1 3.56Å; H435-G480 VanDerWaalsContact NE2-CA 3.25Å; H435-G480 WeakPolarHBondContact NE2-CA 3.27Å; H435-G480 PolarHBondContact NE2-O 2.62Å
436	P	91.4	Very high	96	Very high	40 Å²	40	29.8 Å²	29.8	26%	0.26	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-28	-178.5	-32	36	0	0	0	115.7	S438 F476	P436-S438 VanDerWaalsContact C-N 3.34Å; P436-F476 HydrophobicContact CG-CB 4.3Å
437	N	88.6	Confident	96.1	Very high	55 Å²	55	24.8 Å²	24.8	29%	0.294	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	1.7	176.3	73.6	5.6	0	0	0	115	H435 N439	H435-N437 PolarHBondContact CE1-ND2 3.28Å; H435-N437 PolarHBondContact ND1-N 3.37Å; H435-N437 PolarHBondContact ND1-ND2 2.89Å; H435-N437 PolarHBondContact ND1-OD1 2.99Å; H435-N437 PolarHBondContact O-N 3.26Å; N437-N439 PolarHBondContact O-N 3.19Å; N437-N439 WeakPolarHBondContact OD1-CB 3.36Å; N437-N439 PolarHBondContact OD1-N 3Å
438	S	90.6	Very high	96.1	Very high	11 Å²	11	28.3 Å²	28.3	8%	0.077	14%	0.143	C	C	.	.	S	Bend	trans	58.7	1.5	-176.6	-54.5	0	0	0	0	117.1	P394 Y395 H435 P436	P394-S438 WeakPolarHBondContact CD-OG 3.44Å; Y395-S438 WeakPolarHBondContact CD2-OG 3.49Å; H435-S438 WeakPolarHBondContact O-CA 3.39Å; H435-S438 PolarHBondContact O-N 2.93Å; P436-S438 VanDerWaalsContact C-N 3.34Å
439	N	89.8	Confident	96.1	Very high	94 Å²	94	27.9 Å²	27.9	50%	0.503	14%	0.142	S	C	.	.	S	Bend	trans	-87.9	-16.6	-177.8	-69.8	-34.4	0	0	0	113.4	N437 A455	N437-N439 PolarHBondContact O-N 3.19Å; N437-N439 WeakPolarHBondContact OD1-CB 3.36Å; N437-N439 PolarHBondContact OD1-N 3Å; N439-A455 VanDerWaalsContact O-CB 3.29Å; N439-A455 WeakPolarHBondContact O-CB 3.25Å; N439-A455 PolarHBondContact O-N 3.38Å
440	Y	94.7	Very high	96.1	Very high	86 Å²	86	27.9 Å²	27.9	34%	0.337	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.9	179.2	-60.2	-78.3	0	0	0	111.1	H435 L452 W453 V461	H435-Y440 WeakPolarHBondContact CB-O 3.36Å; H435-Y440 PolarHBondContact N-O 2.8Å; Y440-L452 HydrophobicContact CD1-CD2 4.3Å; Y440-L452 HydrophobicContact CD1-CG 4.36Å; Y440-L452 HydrophobicContact CG-CD2 4.5Å; Y440-W453 VanDerWaalsContact CA-O 3.26Å; Y440-W453 WeakPolarHBondContact CA-O 3.26Å; Y440-V461 HydrophobicContact CE1-CG2 4.21Å
441	L	97.2	Very high	96.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	129.2	175.3	-171.2	76.2	0	0	0	109.1	A400 Y422 V432 K433 F434 T443 L452 W453	A400-L441 HydrophobicContact CB-CD1 3.6Å; A400-L441 HydrophobicContact CB-CD2 3.75Å; A400-L441 HydrophobicContact CB-CG 4.33Å; Y422-L441 HydrophobicContact CD2-CD2 3.76Å; Y422-L441 HydrophobicContact CE2-CD2 3.48Å; Y422-L441 VanDerWaalsContact CE2-CD2 3.48Å; V432-L441 HydrophobicContact CG1-CD1 3.59Å; V432-L441 HydrophobicContact CG1-CD2 3.91Å; V432-L441 HydrophobicContact CG1-CG 3.91Å; K433-L441 WeakPolarHBondContact O-CD1 3.3Å; F434-L441 HydrophobicContact CD1-CD1 3.78Å; F434-L441 HydrophobicContact CD2-CD1 3.89Å; F434-L441 HydrophobicContact CE1-CD1 3.81Å; F434-L441 HydrophobicContact CE2-CD1 3.91Å; F434-L441 HydrophobicContact CG-CD1 3.84Å; F434-L441 HydrophobicContact CZ-CD1 3.88Å; L441-T443 HydrophobicContact CD2-CG2 4.2Å; L441-T443 HydrophobicContact CG-CG2 4.47Å; L441-L452 CarbonylContact O-C 3.55Å; L441-L452 WeakPolarHBondContact O-CA 3.22Å; L441-W453 HydrophobicContact CB-CB 4.49Å; L441-W453 PolarHBondContact N-O 3Å; L441-W453 PolarHBondContact O-N 2.95Å
442	A	98.3	Very high	96.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141	169.2	0	0	0	0	0	110.5	V432 K433 R451 L452 L474 F476 L483	V432-A442 WeakPolarHBondContact CA-O 3.4Å; K433-A442 PolarHBondContact N-O 2.87Å; K433-A442 PolarHBondContact O-N 2.69Å; A442-R451 CarbonylContact C-O 3.44Å; A442-R451 VanDerWaalsContact CA-O 3.25Å; A442-R451 WeakPolarHBondContact CA-O 3.4Å; A442-L452 HydrophobicContact CB-CD1 4.16Å; A442-L474 HydrophobicContact CB-CD1 3.92Å; A442-F476 HydrophobicContact CB-CE2 3.59Å; A442-F476 HydrophobicContact CB-CZ 3.49Å; A442-F476 VanDerWaalsContact CB-CZ 3.49Å; A442-L483 HydrophobicContact CB-CD1 4.03Å; A442-L483 HydrophobicContact CB-CD2 3.86Å
443	T	98.6	Very high	96	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	130.8	176.3	60.1	0	0	0	0	109.5	A408 H425 V429 C431 V432 L441 V450 R451 W453	A408-T443 HydrophobicContact CB-CG2 3.53Å; H425-T443 PolarHBondContact CD2-OG1 3.09Å; H425-T443 PolarHBondContact NE2-OG1 2.61Å; V429-T443 HydrophobicContact CG1-CG2 4.29Å; C431-T443 WeakPolarHBondContact O-CA 3.33Å; V432-T443 HydrophobicContact CG2-CG2 4.19Å; L441-T443 HydrophobicContact CD2-CG2 4.2Å; L441-T443 HydrophobicContact CG-CG2 4.47Å; T443-V450 CarbonylContact O-C 3.52Å; T443-V450 VanDerWaalsContact O-CA 3.29Å; T443-V450 WeakPolarHBondContact O-CA 3.21Å; T443-V450 WeakPolarHBondContact O-CG1 3.36Å; T443-R451 PolarHBondContact N-O 3.31Å; T443-R451 PolarHBondContact O-N 3.01Å; T443-W453 PolarHBondContact OG1-NE1 2.8Å
444	G	98.3	Very high	95.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	143.3	173.2	0	0	0	0	0	109.4	D430 C431	D430-G444 PolarHBondContact N-O 3Å; C431-G444 PolarHBondContact N-O 2.87Å; C431-G444 PolarHBondContact O-N 2.7Å
445	S	98.3	Very high	95.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	156.2	-172.3	172.4	0	0	0	0	112.4	H425 A427 D428 D447 K448 T449 V471	H425-S445 VanDerWaalsContact CE1-CB 3.49Å; H425-S445 WeakPolarHBondContact CE1-CB 3.23Å; H425-S445 WeakPolarHBondContact ND1-CB 3.32Å; A427-S445 PolarHBondContact O-OG 3.14Å; D428-S445 WeakPolarHBondContact O-CA 3.2Å; D428-S445 WeakPolarHBondContact O-CB 3.46Å; D428-S445 PolarHBondContact O-OG 2.62Å; S445-D447 VanDerWaalsContact CB-OD1 3.32Å; S445-D447 WeakPolarHBondContact CB-OD1 3.48Å; S445-D447 PolarHBondContact O-N 3.19Å; S445-D447 VanDerWaalsContact O-N 3.11Å; S445-D447 VanDerWaalsContact OG-CG 3.24Å; S445-D447 PolarHBondContact OG-N 2.75Å; S445-D447 VanDerWaalsContact OG-N 3.09Å; S445-D447 PolarHBondContact OG-OD1 2.81Å; S445-K448 PolarHBondContact O-N 2.9Å; S445-T449 PolarHBondContact N-O 2.84Å; S445-V471 PolarHBondContact O-N 2.77Å
446	T	97.9	Very high	94.9	Very high	50 Å²	50	34.3 Å²	34.3	31%	0.307	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-20.1	168.7	-36.5	0	0	0	0	112	D428 D430 K448 P470	D428-T446 PolarHBondContact O-N 3.22Å; D428-T446 VanDerWaalsContact O-N 3.14Å; D430-T446 PolarHBondContact OD1-OG1 2.77Å; D430-T446 WeakPolarHBondContact OD2-CA 3.41Å; D430-T446 PolarHBondContact OD2-N 3.27Å; D430-T446 PolarHBondContact OD2-OG1 2.79Å; T446-K448 PolarHBondContact O-N 2.86Å; T446-K448 VanDerWaalsContact O-N 3.09Å; T446-P470 HydrophobicContact CG2-CB 4.17Å; T446-P470 HydrophobicContact CG2-CG 3.72Å
447	D	97.3	Very high	94.6	Very high	30 Å²	30	38.3 Å²	38.3	16%	0.16	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	2.5	173.2	77.8	10	0	0	0	114.3	H425 L426 A427 S445 T449	H425-D447 WeakPolarHBondContact CA-OD2 3.42Å; H425-D447 IonicContact CE1-OD1 3.52Å; H425-D447 IonicContact CG-OD2 3.67Å; H425-D447 IonicContact ND1-OD1 3.48Å; H425-D447 PolarHBondContact ND1-OD1 2.84Å; H425-D447 IonicContact ND1-OD2 3.72Å; H425-D447 PolarHBondContact ND1-OD2 2.98Å; L426-D447 HydrophobicContact CB-CB 4.01Å; L426-D447 PolarHBondContact N-OD2 3Å; A427-D447 HydrophobicContact CB-CB 4.06Å; S445-D447 VanDerWaalsContact CB-OD1 3.32Å; S445-D447 WeakPolarHBondContact CB-OD1 3.48Å; S445-D447 PolarHBondContact O-N 3.19Å; S445-D447 VanDerWaalsContact O-N 3.11Å; S445-D447 VanDerWaalsContact OG-CG 3.24Å; S445-D447 PolarHBondContact OG-N 2.75Å; S445-D447 VanDerWaalsContact OG-N 3.09Å; S445-D447 PolarHBondContact OG-OD1 2.81Å; D447-T449 VanDerWaalsContact CG-OG1 3.32Å; D447-T449 PolarHBondContact O-N 2.87Å; D447-T449 WeakPolarHBondContact OD1-CA 2.88Å; D447-T449 VanDerWaalsContact OD1-CB 3.3Å; D447-T449 WeakPolarHBondContact OD1-CB 3.43Å; D447-T449 PolarHBondContact OD1-N 2.83Å; D447-T449 PolarHBondContact OD1-OG1 3.01Å; D447-T449 PolarHBondContact OD2-OG1 2.89Å
448	K	97.5	Very high	94.4	Very high	96 Å²	96	36.4 Å²	36.4	42%	0.417	18%	0.181	S	C	.	.	S	Bend	trans	71.1	17.6	175.5	-40.9	175.4	176	-165.4	0	113	S445 T446 H467 R468 G469	S445-K448 PolarHBondContact O-N 2.9Å; T446-K448 PolarHBondContact O-N 2.86Å; T446-K448 VanDerWaalsContact O-N 3.09Å; K448-H467 HydrophobicContact CB-CB 4.42Å; K448-R468 WeakPolarHBondContact CD-O 3.25Å; K448-R468 WeakPolarHBondContact CE-O 3.14Å; K448-R468 PolarHBondContact NZ-O 2.77Å; K448-G469 WeakPolarHBondContact CB-O 3.35Å; K448-G469 WeakPolarHBondContact CG-O 3.33Å
449	T	97.4	Very high	94.2	Very high	22 Å²	22	40.4 Å²	40.4	14%	0.135	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	154.1	177.5	76	0	0	0	0	111.3	H425 S445 D447 L463 T465	H425-T449 PolarHBondContact CE1-OG1 2.81Å; H425-T449 PolarHBondContact ND1-OG1 2.89Å; S445-T449 PolarHBondContact N-O 2.84Å; D447-T449 VanDerWaalsContact CG-OG1 3.32Å; D447-T449 PolarHBondContact O-N 2.87Å; D447-T449 WeakPolarHBondContact OD1-CA 2.88Å; D447-T449 VanDerWaalsContact OD1-CB 3.3Å; D447-T449 WeakPolarHBondContact OD1-CB 3.43Å; D447-T449 PolarHBondContact OD1-N 2.83Å; D447-T449 PolarHBondContact OD1-OG1 3.01Å; D447-T449 PolarHBondContact OD2-OG1 2.89Å; T449-L463 HydrophobicContact CG2-CD1 4.24Å; T449-T465 HydrophobicContact CG2-CG2 4.31Å
450	V	98.3	Very high	94.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.2	169	-177.2	0	0	0	0	107.9	T443 F464 V471 L474 L483	T443-V450 CarbonylContact O-C 3.52Å; T443-V450 VanDerWaalsContact O-CA 3.29Å; T443-V450 WeakPolarHBondContact O-CA 3.21Å; T443-V450 WeakPolarHBondContact O-CG1 3.36Å; V450-F464 HydrophobicContact CB-CB 4.14Å; V450-F464 HydrophobicContact CB-CD2 4.11Å; V450-F464 HydrophobicContact CG1-CD2 4.08Å; V450-F464 PolarHBondContact N-O 3.22Å; V450-F464 PolarHBondContact O-N 3.45Å; V450-V471 HydrophobicContact CG2-CB 4.29Å; V450-V471 HydrophobicContact CG2-CG1 3.82Å; V450-V471 HydrophobicContact CG2-CG2 3.91Å; V450-L474 HydrophobicContact CG1-CD1 4.2Å; V450-L474 HydrophobicContact CG1-CD2 3.74Å; V450-L474 HydrophobicContact CG2-CD2 3.98Å; V450-L483 HydrophobicContact CG1-CD2 3.84Å
451	R	98	Very high	94.3	Very high	41 Å²	41	37.8 Å²	37.8	16%	0.155	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.2	176.9	-70.5	-179.8	-178.2	-150.1	4.2	110.6	G424 A442 T443 W453 R462 L463	G424-R451 VanDerWaalsContact CA-NH1 3.26Å; G424-R451 PolarHBondContact O-NH1 3.34Å; G424-R451 PolarHBondContact O-NH2 3.23Å; A442-R451 CarbonylContact C-O 3.44Å; A442-R451 VanDerWaalsContact CA-O 3.25Å; A442-R451 WeakPolarHBondContact CA-O 3.4Å; T443-R451 PolarHBondContact N-O 3.31Å; T443-R451 PolarHBondContact O-N 3.01Å; R451-W453 HydrophobicContact CB-CZ2 3.87Å; R451-W453 HydrophobicContact CG-CZ2 4.27Å; R451-R462 WeakPolarHBondContact CA-O 3.03Å; R451-L463 HydrophobicContact CG-CD1 3.6Å
452	L	97.6	Very high	94.1	Very high	7 Å²	7	41.3 Å²	41.3	4%	0.037	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.1	169.2	-167.9	73	0	0	0	108.5	Y440 L441 A442 S460 V461 R462 F464 F476 L497	Y440-L452 HydrophobicContact CD1-CD2 4.3Å; Y440-L452 HydrophobicContact CD1-CG 4.36Å; Y440-L452 HydrophobicContact CG-CD2 4.5Å; L441-L452 CarbonylContact O-C 3.55Å; L441-L452 WeakPolarHBondContact O-CA 3.22Å; A442-L452 HydrophobicContact CB-CD1 4.16Å; L452-S460 CarbonylContact O-C 3.6Å; L452-V461 PolarHBondContact O-N 3.45Å; L452-R462 HydrophobicContact CB-CB 3.96Å; L452-R462 HydrophobicContact CD2-CG 4.36Å; L452-R462 PolarHBondContact N-O 2.81Å; L452-R462 PolarHBondContact O-N 3.49Å; L452-F464 HydrophobicContact CB-CE2 4.22Å; L452-F476 HydrophobicContact CD1-CE1 4.16Å; L452-F476 HydrophobicContact CD1-CZ 3.71Å; L452-L497 HydrophobicContact CD2-CD2 4.18Å
453	W	96.2	Very high	94	Very high	8 Å²	8	45.5 Å²	45.5	3%	0.03	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	145.7	-177.4	-52.5	91.2	0	0	0	110.2	Y422 A423 Y440 L441 T443 R451 N459	Y422-W453 HydrophobicContact CD1-CB 3.58Å; Y422-W453 AromaticContact CD1-CD2 3.79Å; Y422-W453 HydrophobicContact CD1-CD2 3.79Å; Y422-W453 AromaticContact CD1-CE3 3.83Å; Y422-W453 HydrophobicContact CD1-CE3 3.83Å; Y422-W453 AromaticContact CD1-CG 3.69Å; Y422-W453 HydrophobicContact CD1-CG 3.69Å; Y422-W453 HydrophobicContact CE1-CB 3.7Å; Y422-W453 HydrophobicContact CE1-CG 4.3Å; Y422-W453 HydrophobicContact CG-CB 4.32Å; Y422-W453 HydrophobicContact CG-CD2 4.1Å; Y422-W453 HydrophobicContact CG-CE3 4.38Å; Y422-W453 HydrophobicContact CG-CG 4.05Å; A423-W453 WeakPolarHBondContact O-CH2 3.23Å; Y440-W453 VanDerWaalsContact CA-O 3.26Å; Y440-W453 WeakPolarHBondContact CA-O 3.26Å; L441-W453 HydrophobicContact CB-CB 4.49Å; L441-W453 PolarHBondContact N-O 3Å; L441-W453 PolarHBondContact O-N 2.95Å; T443-W453 PolarHBondContact OG1-NE1 2.8Å; R451-W453 HydrophobicContact CB-CZ2 3.87Å; R451-W453 HydrophobicContact CG-CZ2 4.27Å; W453-N459 WeakPolarHBondContact CA-O 3.2Å
454	S	93.7	Very high	93.9	Very high	14 Å²	14	45.7 Å²	45.7	10%	0.098	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.3	164.6	173.1	0	0	0	0	108.8	Q456 Q457 G458 N459	S454-Q456 VanDerWaalsContact C-N 3.29Å; S454-Q456 PolarHBondContact O-N 3.23Å; S454-Q457 PolarHBondContact OG-N 2.98Å; S454-G458 WeakPolarHBondContact O-CA 3.5Å; S454-G458 PolarHBondContact O-N 2.98Å; S454-N459 PolarHBondContact N-O 2.5Å
455	A	88.7	Confident	93.6	Very high	9 Å²	9	50.1 Å²	50.1	7%	0.074	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-39.9	-179.5	0	0	0	0	0	111.9	R420 Y422 N439	R420-A455 PolarHBondContact NE-O 3.42Å; Y422-A455 VanDerWaalsContact OH-CA 3.32Å; Y422-A455 WeakPolarHBondContact OH-CA 3.29Å; Y422-A455 PolarHBondContact OH-O 3.15Å; N439-A455 VanDerWaalsContact O-CB 3.29Å; N439-A455 WeakPolarHBondContact O-CB 3.25Å; N439-A455 PolarHBondContact O-N 3.38Å
456	Q	84.4	Confident	93.3	Very high	158 Å²	158	52 Å²	52	74%	0.738	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-44.5	-179.6	-169.3	-177.9	5.8	0	0	112.7	R420 S454	R420-Q456 PolarHBondContact NE-O 2.93Å; R420-Q456 PolarHBondContact NH2-O 3.4Å; S454-Q456 VanDerWaalsContact C-N 3.29Å; S454-Q456 PolarHBondContact O-N 3.23Å
457	Q	84.9	Confident	93.2	Very high	124 Å²	124	50.2 Å²	50.2	58%	0.579	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-25.6	-172	-61.1	-177.2	4.1	0	0	113.5	R420 S454 N459	R420-Q457 PolarHBondContact NH1-O 2.91Å; S454-Q457 PolarHBondContact OG-N 2.98Å; Q457-N459 PolarHBondContact O-N 3.35Å
458	G	84.7	Confident	93.1	Very high	14 Å²	14	58.3 Å²	58.3	14%	0.144	30%	0.299	C	S	.	.			trans	81.3	-4.6	-175.2	0	0	0	0	0	115.8	R420 S454	R420-G458 VanDerWaalsContact CD-CA 3.46Å; S454-G458 WeakPolarHBondContact O-CA 3.5Å; S454-G458 PolarHBondContact O-N 2.98Å
459	N	87.4	Confident	93.1	Very high	96 Å²	96	54.1 Å²	54.1	51%	0.513	28%	0.282	S	S	.	.			trans	-79.1	142.4	-178.3	-63.4	-31.1	0	0	0	110.7	W453 S454 Q457 V461	W453-N459 WeakPolarHBondContact CA-O 3.2Å; S454-N459 PolarHBondContact N-O 2.5Å; Q457-N459 PolarHBondContact O-N 3.35Å; N459-V461 PolarHBondContact O-N 2.81Å
460	S	92.4	Very high	93.1	Very high	51 Å²	51	53.7 Å²	53.7	36%	0.357	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	116.3	166.9	-174.5	0	0	0	0	108.5	L452 R462	L452-S460 CarbonylContact O-C 3.6Å; S460-R462 PolarHBondContact OG-O 2.86Å
461	V	93.4	Very high	93.1	Very high	74 Å²	74	53.7 Å²	53.7	45%	0.448	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-36.5	-179.2	-175.9	0	0	0	0	110.4	Y440 L452 N459	Y440-V461 HydrophobicContact CE1-CG2 4.21Å; L452-V461 PolarHBondContact O-N 3.45Å; N459-V461 PolarHBondContact O-N 2.81Å
462	R	93.6	Very high	93	Very high	73 Å²	73	54.1 Å²	54.1	28%	0.275	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.2	176.9	-58.9	-171.4	178.9	-82.3	5.3	111.7	R451 L452 S460 F464 L497 A498 G500	R451-R462 WeakPolarHBondContact CA-O 3.03Å; L452-R462 HydrophobicContact CB-CB 3.96Å; L452-R462 HydrophobicContact CD2-CG 4.36Å; L452-R462 PolarHBondContact N-O 2.81Å; L452-R462 PolarHBondContact O-N 3.49Å; S460-R462 PolarHBondContact OG-O 2.86Å; R462-F464 HydrophobicContact CB-CE1 4.36Å; R462-F464 HydrophobicContact CB-CE2 4.09Å; R462-F464 HydrophobicContact CB-CZ 3.89Å; R462-F464 HydrophobicContact CG-CZ 4.43Å; R462-L497 PolarHBondContact NE-O 2.85Å; R462-L497 PolarHBondContact NH2-O 2.94Å; R462-A498 PolarHBondContact NH2-O 3.13Å; R462-G500 VanDerWaalsContact NH1-CA 3.27Å
463	L	94.7	Very high	92.9	Very high	89 Å²	89	54.4 Å²	54.4	47%	0.466	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	116.1	170.1	175.9	67.7	0	0	0	108	T449 R451 T465	T449-L463 HydrophobicContact CG2-CD1 4.24Å; R451-L463 HydrophobicContact CG-CD1 3.6Å; L463-T465 HydrophobicContact CD2-CG2 4.08Å; L463-T465 HydrophobicContact CG-CG2 3.95Å
464	F	96.3	Very high	93	Very high	3 Å²	3	54.1 Å²	54.1	1%	0.013	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	116.6	175.8	-54.1	-72.4	0	0	0	109.3	V450 L452 R462 L483 W495 L497	V450-F464 HydrophobicContact CB-CB 4.14Å; V450-F464 HydrophobicContact CB-CD2 4.11Å; V450-F464 HydrophobicContact CG1-CD2 4.08Å; V450-F464 PolarHBondContact N-O 3.22Å; V450-F464 PolarHBondContact O-N 3.45Å; L452-F464 HydrophobicContact CB-CE2 4.22Å; R462-F464 HydrophobicContact CB-CE1 4.36Å; R462-F464 HydrophobicContact CB-CE2 4.09Å; R462-F464 HydrophobicContact CB-CZ 3.89Å; R462-F464 HydrophobicContact CG-CZ 4.43Å; F464-L483 HydrophobicContact CD2-CD2 4.19Å; F464-L483 HydrophobicContact CE2-CD2 3.83Å; F464-W495 HydrophobicContact CB-CD2 3.86Å; F464-W495 HydrophobicContact CB-CE3 3.96Å; F464-W495 HydrophobicContact CB-CG 4.47Å; F464-W495 HydrophobicContact CB-CH2 4.07Å; F464-W495 HydrophobicContact CB-CZ2 3.97Å; F464-W495 HydrophobicContact CB-CZ3 4.05Å; F464-W495 HydrophobicContact CD1-CB 4.04Å; F464-W495 AromaticContact CD1-CD2 3.71Å; F464-W495 HydrophobicContact CD1-CD2 3.71Å; F464-W495 AromaticContact CD1-CE3 3.52Å; F464-W495 HydrophobicContact CD1-CE3 3.52Å; F464-W495 AromaticContact CD1-CG 3.93Å; F464-W495 HydrophobicContact CD1-CG 3.93Å; F464-W495 HydrophobicContact CD1-CZ3 4.23Å; F464-W495 HydrophobicContact CE1-CB 3.89Å; F464-W495 HydrophobicContact CE1-CD2 4.46Å; F464-W495 HydrophobicContact CE1-CE3 4.36Å; F464-W495 HydrophobicContact CE1-CG 4.28Å; F464-W495 AromaticContact CG-CD2 3.91Å; F464-W495 HydrophobicContact CG-CD2 3.91Å; F464-W495 HydrophobicContact CG-CE3 4.06Å; F464-W495 HydrophobicContact CG-CG 4.11Å; F464-W495 HydrophobicContact CZ-CB 4.3Å; F464-L497 HydrophobicContact CE2-CD2 4.37Å; F464-L497 HydrophobicContact CZ-CD2 3.89Å
465	T	93.9	Very high	93.2	Very high	94 Å²	94	53.8 Å²	53.8	58%	0.577	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	138	178.5	62	0	0	0	0	109.9	T449 L463 W495	T449-T465 HydrophobicContact CG2-CG2 4.31Å; L463-T465 HydrophobicContact CD2-CG2 4.08Å; L463-T465 HydrophobicContact CG-CG2 3.95Å; T465-W495 WeakPolarHBondContact O-CH2 3.2Å
466	G	91.4	Very high	93.6	Very high	38 Å²	38	54.4 Å²	54.4	39%	0.392	29%	0.286	S	S	.	.			trans	156.8	-16.2	174.7	0	0	0	0	0	114.7	K493	G466-K493 VanDerWaalsContact O-CE 3.3Å; G466-K493 WeakPolarHBondContact O-CE 3.38Å
467	H	95.8	Very high	94	Very high	14 Å²	14	46.9 Å²	46.9	7%	0.065	25%	0.251	C	S	.	.			trans	-66.9	150.4	171.4	-78	-75.8	0	0	0	111.4	K448 V471 S485 D489	K448-H467 HydrophobicContact CB-CB 4.42Å; H467-V471 HydrophobicContact CB-CG2 4.13Å; H467-S485 PolarHBondContact CE1-O 3.25Å; H467-S485 PolarHBondContact NE2-OG 3Å; H467-D489 WeakPolarHBondContact CA-OD2 3.26Å; H467-D489 WeakPolarHBondContact CB-OD2 3.18Å; H467-D489 IonicContact CE1-OD1 3.13Å; H467-D489 IonicContact CG-OD2 3.67Å; H467-D489 VanDerWaalsContact ND1-CG 3.34Å; H467-D489 IonicContact ND1-OD1 3.52Å; H467-D489 PolarHBondContact ND1-OD1 3.41Å; H467-D489 VanDerWaalsContact ND1-OD1 3.15Å; H467-D489 IonicContact ND1-OD2 3.31Å; H467-D489 PolarHBondContact ND1-OD2 3.44Å
468	R	95.7	Very high	94.3	Very high	200 Å²	200	43.9 Å²	43.9	76%	0.755	24%	0.242	S	C	*	.	S	Bend	trans	-105.5	-10.8	179.2	-62.2	-172.6	-177.6	-174.2	5.2	113.8	K448 D489	K448-R468 WeakPolarHBondContact CD-O 3.25Å; K448-R468 WeakPolarHBondContact CE-O 3.14Å; K448-R468 PolarHBondContact NZ-O 2.77Å; R468-D489 HydrophobicContact CB-CB 3.95Å; R468-D489 PolarHBondContact N-OD2 3.08Å
469	G	96	Very high	94.5	Very high	7 Å²	7	47.7 Å²	47.7	7%	0.072	26%	0.259	C	S	.	.	S	Bend	trans	-135.5	175.4	175.3	0	0	0	0	0	110.9	K448	K448-G469 WeakPolarHBondContact CB-O 3.35Å; K448-G469 WeakPolarHBondContact CG-O 3.33Å
470	P	97.5	Very high	94.7	Very high	14 Å²	14	43.9 Å²	43.9	9%	0.091	24%	0.243	C	C	.	.			trans	-45.7	142.7	170.9	-30.9	36.7	0	0	0	113.1	T446 L472 G487 E488	T446-P470 HydrophobicContact CG2-CB 4.17Å; T446-P470 HydrophobicContact CG2-CG 3.72Å; P470-L472 HydrophobicContact CB-CD2 4.18Å; P470-G487 WeakPolarHBondContact O-CA 3.35Å; P470-E488 HydrophobicContact CB-CG 4.04Å; P470-E488 WeakPolarHBondContact CD-OE2 3.34Å; P470-E488 HydrophobicContact CG-CG 4.12Å; P470-E488 WeakPolarHBondContact CG-OE2 3.33Å; P470-E488 PolarHBondContact O-N 3.28Å
471	V	98.1	Very high	94.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	107.4	175.7	-175.6	0	0	0	0	108.4	C431 S445 V450 H467 L474 A486	C431-V471 PolarHBondContact SG-O 2.83Å; S445-V471 PolarHBondContact O-N 2.77Å; V450-V471 HydrophobicContact CG2-CB 4.29Å; V450-V471 HydrophobicContact CG2-CG1 3.82Å; V450-V471 HydrophobicContact CG2-CG2 3.91Å; H467-V471 HydrophobicContact CB-CG2 4.13Å; V471-L474 HydrophobicContact CG1-CD2 4.14Å; V471-A486 WeakPolarHBondContact CG1-O 3.41Å
472	L	96.3	Very high	94.7	Very high	50 Å²	50	42.8 Å²	42.8	26%	0.262	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-20.8	-173.2	-57.1	179	0	0	0	113	D430 C431 P470 A486 E488 N512	D430-L472 HydrophobicContact CB-CD2 4.41Å; C431-L472 WeakPolarHBondContact CB-O 3.44Å; C431-L472 VanDerWaalsContact SG-C 3.59Å; P470-L472 HydrophobicContact CB-CD2 4.18Å; L472-A486 PolarHBondContact N-O 2.89Å; L472-E488 HydrophobicContact CD1-CG 3.84Å; L472-E488 HydrophobicContact CG-CG 4.27Å; L472-N512 HydrophobicContact CD1-CB 4.32Å
473	S	96.1	Very high	94.9	Very high	13 Å²	13	39.3 Å²	39.3	9%	0.091	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	143.5	-176.4	-161.8	0	0	0	0	113	S485 A486 T514 S515 L516	S473-S485 WeakPolarHBondContact O-CA 3.14Å; S473-A486 PolarHBondContact N-O 2.88Å; S473-A486 PolarHBondContact O-N 3.11Å; S473-T514 WeakPolarHBondContact CB-O 3.29Å; S473-S515 WeakPolarHBondContact OG-CA 3.33Å; S473-L516 PolarHBondContact OG-N 2.74Å
474	L	98.1	Very high	95	Very high	2 Å²	2	35 Å²	35	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.9	176.9	-68.2	175.4	0	0	0	109.8	K433 A442 V450 V471 L483 A484	K433-L474 HydrophobicContact CB-CB 4.25Å; K433-L474 HydrophobicContact CG-CB 3.76Å; K433-L474 WeakPolarHBondContact CG-O 3.36Å; A442-L474 HydrophobicContact CB-CD1 3.92Å; V450-L474 HydrophobicContact CG1-CD1 4.2Å; V450-L474 HydrophobicContact CG1-CD2 3.74Å; V450-L474 HydrophobicContact CG2-CD2 3.98Å; V471-L474 HydrophobicContact CG1-CD2 4.14Å; L474-L483 HydrophobicContact CB-CD1 4.46Å; L474-L483 HydrophobicContact CD2-CD1 4.28Å; L474-A484 WeakPolarHBondContact CA-O 3.49Å
475	A	97.3	Very high	95.1	Very high	7 Å²	7	34.9 Å²	34.9	6%	0.058	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	135.2	168.6	0	0	0	0	0	110.3	A484 L516 F518	A475-A484 PolarHBondContact N-O 2.73Å; A475-A484 PolarHBondContact O-N 3.4Å; A475-L516 HydrophobicContact CB-CB 3.94Å; A475-F518 HydrophobicContact CB-CD2 3.82Å; A475-F518 HydrophobicContact CB-CE2 4.2Å; A475-F518 WeakPolarHBondContact O-CE2 3.48Å
476	F	96.4	Very high	95.3	Very high	21 Å²	21	30.4 Å²	30.4	9%	0.092	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	142.9	169	-77.8	-79.8	0	0	0	110.5	K433 F434 H435 P436 A442 L452 L483 L497 F518	K433-F476 HydrophobicContact CB-CD2 4.04Å; K433-F476 HydrophobicContact CB-CE2 4.1Å; K433-F476 WeakPolarHBondContact O-CE2 3.4Å; F434-F476 VanDerWaalsContact C-CD2 3.5Å; F434-F476 WeakPolarHBondContact O-CD2 3.5Å; H435-F476 HydrophobicContact CB-CD1 4.4Å; H435-F476 HydrophobicContact CB-CD2 4.43Å; H435-F476 HydrophobicContact CB-CE1 4.11Å; H435-F476 HydrophobicContact CB-CE2 4.12Å; H435-F476 HydrophobicContact CB-CZ 3.93Å; H435-F476 AromaticContact CD2-CD1 3.57Å; H435-F476 AromaticContact CD2-CE1 3.56Å; P436-F476 HydrophobicContact CG-CB 4.3Å; A442-F476 HydrophobicContact CB-CE2 3.59Å; A442-F476 HydrophobicContact CB-CZ 3.49Å; A442-F476 VanDerWaalsContact CB-CZ 3.49Å; L452-F476 HydrophobicContact CD1-CE1 4.16Å; L452-F476 HydrophobicContact CD1-CZ 3.71Å; F476-L483 HydrophobicContact CD1-CB 4.19Å; F476-L483 HydrophobicContact CD1-CD1 3.93Å; F476-L483 HydrophobicContact CD2-CD1 4.12Å; F476-L483 HydrophobicContact CE1-CB 4.08Å; F476-L483 HydrophobicContact CE1-CD1 3.82Å; F476-L483 HydrophobicContact CE1-CD2 4.45Å; F476-L483 HydrophobicContact CE1-CG 4.34Å; F476-L483 HydrophobicContact CE2-CD1 4.03Å; F476-L483 HydrophobicContact CG-CD1 4.11Å; F476-L483 HydrophobicContact CZ-CD1 3.91Å; F476-L497 HydrophobicContact CD1-CD1 3.84Å; F476-L497 HydrophobicContact CE1-CD1 3.63Å; F476-L497 HydrophobicContact CE1-CD2 4.25Å; F476-F518 VanDerWaalsContact C-CD2 3.41Å; F476-F518 VanDerWaalsContact O-CD2 3.3Å; F476-F518 WeakPolarHBondContact O-CD2 3.38Å
477	S	94.4	Very high	95.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.143	C	C	.	.			trans	-65.6	135.6	165.9	56.8	0	0	0	0	109.6	N479 G480 K481 Y482	S477-N479 WeakPolarHBondContact CB-OD1 3.25Å; S477-N479 PolarHBondContact O-N 3.28Å; S477-N479 VanDerWaalsContact O-N 3.11Å; S477-N479 PolarHBondContact OG-OD1 2.76Å; S477-G480 WeakPolarHBondContact O-CA 3.28Å; S477-G480 PolarHBondContact O-N 2.79Å; S477-K481 PolarHBondContact OG-N 3.26Å; S477-Y482 PolarHBondContact N-O 3.3Å; S477-Y482 PolarHBondContact OG-N 3.34Å; S477-Y482 PolarHBondContact OG-O 3.17Å; S477-Y482 VanDerWaalsContact OG-O 3.05Å
478	P	90.6	Very high	95.4	Very high	62 Å²	62	32.2 Å²	32.2	40%	0.403	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31	176.9	-31.3	35.1	0	0	0	114.8	G480 F518 S519 S522	P478-G480 PolarHBondContact O-N 3.28Å; P478-F518 HydrophobicContact CG-CB 4.39Å; P478-S519 WeakPolarHBondContact CG-O 3.39Å; P478-S522 VanDerWaalsContact CD-OG 3.26Å; P478-S522 WeakPolarHBondContact CD-OG 3.47Å
479	N	89.1	Confident	95.3	Very high	93 Å²	93	23.8 Å²	23.8	50%	0.497	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-3.7	173.9	69.9	17.3	0	0	0	114.7	S477 K481 S522	S477-N479 WeakPolarHBondContact CB-OD1 3.25Å; S477-N479 PolarHBondContact O-N 3.28Å; S477-N479 VanDerWaalsContact O-N 3.11Å; S477-N479 PolarHBondContact OG-OD1 2.76Å; N479-K481 VanDerWaalsContact C-N 3.26Å; N479-K481 PolarHBondContact O-N 3.2Å; N479-K481 VanDerWaalsContact OD1-CB 3.3Å; N479-K481 WeakPolarHBondContact OD1-CB 3.3Å; N479-K481 PolarHBondContact OD1-N 3.1Å; N479-S522 PolarHBondContact N-OG 3.41Å; N479-S522 WeakPolarHBondContact ND2-CB 3.27Å
480	G	90.8	Very high	95.3	Very high	17 Å²	17	26.5 Å²	26.5	18%	0.175	14%	0.141	C	C	.	.	S	Bend	trans	69.5	11.6	178.7	0	0	0	0	0	115.8	H435 S477 P478	H435-G480 VanDerWaalsContact NE2-CA 3.25Å; H435-G480 WeakPolarHBondContact NE2-CA 3.27Å; H435-G480 PolarHBondContact NE2-O 2.62Å; S477-G480 WeakPolarHBondContact O-CA 3.28Å; S477-G480 PolarHBondContact O-N 2.79Å; P478-G480 PolarHBondContact O-N 3.28Å
481	K	91.8	Very high	95.1	Very high	76 Å²	76	29.3 Å²	29.3	33%	0.33	15%	0.149	S	C	.	.	S	Bend	trans	-88.6	-35.9	-176.7	-171.4	176.1	177	-170.1	0	113.1	S477 N479 L497	S477-K481 PolarHBondContact OG-N 3.26Å; N479-K481 VanDerWaalsContact C-N 3.26Å; N479-K481 PolarHBondContact O-N 3.2Å; N479-K481 VanDerWaalsContact OD1-CB 3.3Å; N479-K481 WeakPolarHBondContact OD1-CB 3.3Å; N479-K481 PolarHBondContact OD1-N 3.1Å; K481-L497 WeakPolarHBondContact O-CB 3.13Å; K481-L497 WeakPolarHBondContact O-CG 3.42Å; K481-L497 PolarHBondContact O-N 2.7Å
482	Y	95	Very high	95	Very high	25 Å²	25	29.3 Å²	29.3	10%	0.098	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	152.3	-171.7	-52.7	-69.3	0	0	0	112.8	S477 L494 W495 D496 Y503 I539	S477-Y482 PolarHBondContact N-O 3.3Å; S477-Y482 PolarHBondContact OG-N 3.34Å; S477-Y482 PolarHBondContact OG-O 3.17Å; S477-Y482 VanDerWaalsContact OG-O 3.05Å; Y482-L494 HydrophobicContact CD1-CG 4.48Å; Y482-L494 HydrophobicContact CG-CD1 4.26Å; Y482-L494 HydrophobicContact CG-CG 4.43Å; Y482-W495 VanDerWaalsContact CA-O 3.25Å; Y482-W495 WeakPolarHBondContact CA-O 3.29Å; Y482-D496 HydrophobicContact CD1-CB 4.22Å; Y482-D496 HydrophobicContact CE1-CB 4.22Å; Y482-Y503 HydrophobicContact CD1-CD1 4.43Å; Y482-Y503 HydrophobicContact CE1-CD1 4.05Å; Y482-Y503 HydrophobicContact CE1-CE1 4.35Å; Y482-Y503 HydrophobicContact CE1-CG 4.2Å; Y482-I539 HydrophobicContact CD2-CD1 4.37Å
483	L	97.6	Very high	95	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.4	168.2	174.1	65.1	0	0	0	108.2	A442 V450 F464 L474 F476 W495 L497	A442-L483 HydrophobicContact CB-CD1 4.03Å; A442-L483 HydrophobicContact CB-CD2 3.86Å; V450-L483 HydrophobicContact CG1-CD2 3.84Å; F464-L483 HydrophobicContact CD2-CD2 4.19Å; F464-L483 HydrophobicContact CE2-CD2 3.83Å; L474-L483 HydrophobicContact CB-CD1 4.46Å; L474-L483 HydrophobicContact CD2-CD1 4.28Å; F476-L483 HydrophobicContact CD1-CB 4.19Å; F476-L483 HydrophobicContact CD1-CD1 3.93Å; F476-L483 HydrophobicContact CD2-CD1 4.12Å; F476-L483 HydrophobicContact CE1-CB 4.08Å; F476-L483 HydrophobicContact CE1-CD1 3.82Å; F476-L483 HydrophobicContact CE1-CD2 4.45Å; F476-L483 HydrophobicContact CE1-CG 4.34Å; F476-L483 HydrophobicContact CE2-CD1 4.03Å; F476-L483 HydrophobicContact CG-CD1 4.11Å; F476-L483 HydrophobicContact CZ-CD1 3.91Å; L483-W495 HydrophobicContact CB-CB 4.46Å; L483-W495 PolarHBondContact N-O 2.97Å; L483-W495 VanDerWaalsContact O-CD1 3.27Å; L483-W495 PolarHBondContact O-N 3.39Å; L483-L497 HydrophobicContact CB-CD2 3.82Å; L483-L497 HydrophobicContact CB-CG 4.34Å; L483-L497 HydrophobicContact CD2-CD2 4.46Å
484	A	97.8	Very high	95	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	140	169.2	0	0	0	0	0	109.7	L474 A475 L492 K493 L494 L516 F518 I525	L474-A484 WeakPolarHBondContact CA-O 3.49Å; A475-A484 PolarHBondContact N-O 2.73Å; A475-A484 PolarHBondContact O-N 3.4Å; A484-L492 HydrophobicContact CB-CD2 4.15Å; A484-K493 CarbonylContact C-O 3.49Å; A484-K493 WeakPolarHBondContact CA-O 3.1Å; A484-L494 HydrophobicContact CB-CD1 4.16Å; A484-L516 HydrophobicContact CB-CD1 4.08Å; A484-F518 HydrophobicContact CB-CE2 3.54Å; A484-F518 HydrophobicContact CB-CZ 3.94Å; A484-I525 HydrophobicContact CB-CD1 4.19Å
485	S	97.9	Very high	94.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.3	174.3	64.1	0	0	0	0	111.4	H467 S473 K493 W495	H467-S485 PolarHBondContact CE1-O 3.25Å; H467-S485 PolarHBondContact NE2-OG 3Å; S473-S485 WeakPolarHBondContact O-CA 3.14Å; S485-K493 PolarHBondContact N-O 3.23Å; S485-K493 PolarHBondContact O-N 3.09Å; S485-W495 PolarHBondContact OG-NE1 2.71Å
486	A	97.2	Very high	94.7	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	166.6	177.3	0	0	0	0	0	111.4	V471 L472 S473 L492 I513 L516	V471-A486 WeakPolarHBondContact CG1-O 3.41Å; L472-A486 PolarHBondContact N-O 2.89Å; S473-A486 PolarHBondContact N-O 2.88Å; S473-A486 PolarHBondContact O-N 3.11Å; A486-L492 HydrophobicContact CB-CB 4.46Å; A486-L492 HydrophobicContact CB-CG 4.37Å; A486-I513 HydrophobicContact CB-CB 3.68Å; A486-I513 HydrophobicContact CB-CD1 3.81Å; A486-I513 HydrophobicContact CB-CG1 4.34Å; A486-I513 HydrophobicContact CB-CG2 3.49Å; A486-I513 VanDerWaalsContact CB-CG2 3.49Å; A486-L516 HydrophobicContact CB-CD1 3.66Å; A486-L516 HydrophobicContact CB-CD2 4.09Å; A486-L516 HydrophobicContact CB-CG 4.06Å
487	G	94.3	Very high	94.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.5	-137.4	176.5	0	0	0	0	0	111.9	P470 D489 Q490 I513	P470-G487 WeakPolarHBondContact O-CA 3.35Å; G487-D489 VanDerWaalsContact C-N 3.26Å; G487-D489 PolarHBondContact O-N 3.26Å; G487-Q490 PolarHBondContact O-N 3Å; G487-I513 PolarHBondContact O-N 3.23Å; G487-I513 VanDerWaalsContact O-N 3.13Å
488	E	95.9	Very high	94	Very high	89 Å²	89	31.8 Å²	31.8	42%	0.416	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-12.1	-170.2	-56.5	-171	170.9	0	0	114.7	P470 L472 Q490 N512	P470-E488 HydrophobicContact CB-CG 4.04Å; P470-E488 WeakPolarHBondContact CD-OE2 3.34Å; P470-E488 HydrophobicContact CG-CG 4.12Å; P470-E488 WeakPolarHBondContact CG-OE2 3.33Å; P470-E488 PolarHBondContact O-N 3.28Å; L472-E488 HydrophobicContact CD1-CG 3.84Å; L472-E488 HydrophobicContact CG-CG 4.27Å; E488-Q490 PolarHBondContact O-N 2.73Å; E488-N512 VanDerWaalsContact CA-OD1 3.27Å; E488-N512 WeakPolarHBondContact CA-OD1 3.5Å
489	D	94.1	Very high	93.8	Very high	24 Å²	24	31.1 Å²	31.1	13%	0.128	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	2.1	173.2	69.1	-0.7	0	0	0	113.5	H467 R468 G487 R491	H467-D489 WeakPolarHBondContact CA-OD2 3.26Å; H467-D489 WeakPolarHBondContact CB-OD2 3.18Å; H467-D489 IonicContact CE1-OD1 3.13Å; H467-D489 IonicContact CG-OD2 3.67Å; H467-D489 VanDerWaalsContact ND1-CG 3.34Å; H467-D489 IonicContact ND1-OD1 3.52Å; H467-D489 PolarHBondContact ND1-OD1 3.41Å; H467-D489 VanDerWaalsContact ND1-OD1 3.15Å; H467-D489 IonicContact ND1-OD2 3.31Å; H467-D489 PolarHBondContact ND1-OD2 3.44Å; R468-D489 HydrophobicContact CB-CB 3.95Å; R468-D489 PolarHBondContact N-OD2 3.08Å; G487-D489 VanDerWaalsContact C-N 3.26Å; G487-D489 PolarHBondContact O-N 3.26Å; D489-R491 WeakPolarHBondContact O-CG 3.12Å; D489-R491 PolarHBondContact O-N 3.4Å; D489-R491 PolarHBondContact OD1-N 2.92Å
490	Q	94.3	Very high	93.6	Very high	64 Å²	64	27.7 Å²	27.7	30%	0.299	16%	0.155	S	C	.	.	S	Bend	trans	61.1	16.8	175.3	-40	175.3	-15.2	0	0	112.1	G487 E488 T510 D511	G487-Q490 PolarHBondContact O-N 3Å; E488-Q490 PolarHBondContact O-N 2.73Å; Q490-T510 VanDerWaalsContact CD-C 3.47Å; Q490-T510 VanDerWaalsContact CD-O 3.31Å; Q490-T510 PolarHBondContact NE2-O 3.28Å; Q490-T510 PolarHBondContact OE1-O 3.1Å; Q490-D511 WeakPolarHBondContact CG-O 3.29Å
491	R	93.8	Very high	93.4	Very high	73 Å²	73	30.7 Å²	30.7	28%	0.275	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.1	179.6	-60.6	-47.2	-175.3	-163.9	-2.1	109.6	D489 E505 R507	D489-R491 WeakPolarHBondContact O-CG 3.12Å; D489-R491 PolarHBondContact O-N 3.4Å; D489-R491 PolarHBondContact OD1-N 2.92Å; R491-E505 HydrophobicContact CB-CG 4.35Å; R491-R507 VanDerWaalsContact NH1-CG 3.29Å
492	L	95.8	Very high	93.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.5	169	-162.3	158.1	0	0	0	107.9	A484 A486 E505 L506 I513 L516 I525	A484-L492 HydrophobicContact CB-CD2 4.15Å; A486-L492 HydrophobicContact CB-CB 4.46Å; A486-L492 HydrophobicContact CB-CG 4.37Å; L492-E505 CarbonylContact O-C 3.55Å; L492-E505 WeakPolarHBondContact O-CA 3.43Å; L492-L506 HydrophobicContact CB-CB 4.15Å; L492-L506 HydrophobicContact CD2-CD1 3.9Å; L492-L506 HydrophobicContact CD2-CG 4.29Å; L492-L506 PolarHBondContact N-O 3.1Å; L492-L506 PolarHBondContact O-N 3.04Å; L492-I513 HydrophobicContact CB-CD1 4.41Å; L492-L516 HydrophobicContact CD1-CD1 4.48Å; L492-L516 HydrophobicContact CD1-CD2 3.32Å; L492-L516 HydrophobicContact CG-CD1 4.31Å; L492-L516 HydrophobicContact CG-CD2 3.98Å; L492-I525 HydrophobicContact CD1-CG2 3.86Å; L492-I525 HydrophobicContact CD2-CD1 4.12Å; L492-I525 HydrophobicContact CD2-CG2 4.47Å
493	K	96.4	Very high	93.3	Very high	9 Å²	9	33.8 Å²	33.8	4%	0.039	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.2	179.5	-72	-177.6	179.2	-75.9	0	109.2	G466 A484 S485 W495 L502 E505	G466-K493 VanDerWaalsContact O-CE 3.3Å; G466-K493 WeakPolarHBondContact O-CE 3.38Å; A484-K493 CarbonylContact C-O 3.49Å; A484-K493 WeakPolarHBondContact CA-O 3.1Å; S485-K493 PolarHBondContact N-O 3.23Å; S485-K493 PolarHBondContact O-N 3.09Å; K493-W495 HydrophobicContact CB-CZ2 3.88Å; K493-W495 HydrophobicContact CD-CH2 4.25Å; K493-W495 HydrophobicContact CD-CZ2 3.7Å; K493-W495 HydrophobicContact CG-CZ2 4.38Å; K493-L502 HydrophobicContact CB-CD1 3.65Å; K493-L502 HydrophobicContact CD-CD1 4.19Å; K493-L502 HydrophobicContact CG-CD1 3.89Å; K493-E505 HydrophobicContact CG-CG 4.42Å; K493-E505 IonicContact NZ-OE2 3.91Å; K493-E505 PolarHBondContact NZ-OE2 3.11Å
494	L	96.5	Very high	93	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.9	176.6	-172.1	60.6	0	0	0	108.6	Y482 A484 Y503 K504 F518 I525 I539	Y482-L494 HydrophobicContact CD1-CG 4.48Å; Y482-L494 HydrophobicContact CG-CD1 4.26Å; Y482-L494 HydrophobicContact CG-CG 4.43Å; A484-L494 HydrophobicContact CB-CD1 4.16Å; L494-Y503 HydrophobicContact CD2-CD1 3.63Å; L494-Y503 HydrophobicContact CD2-CE1 4.1Å; L494-Y503 HydrophobicContact CG-CD1 4.06Å; L494-Y503 WeakPolarHBondContact O-CA 3.45Å; L494-Y503 WeakPolarHBondContact O-CB 3.47Å; L494-Y503 PolarHBondContact O-N 3.05Å; L494-K504 HydrophobicContact CB-CB 4.24Å; L494-K504 PolarHBondContact N-O 2.85Å; L494-K504 PolarHBondContact O-N 2.82Å; L494-F518 HydrophobicContact CD1-CE1 4.5Å; L494-F518 HydrophobicContact CD1-CZ 3.69Å; L494-I525 HydrophobicContact CD1-CD1 4.09Å; L494-I525 HydrophobicContact CD2-CD1 4.4Å; L494-I539 HydrophobicContact CD2-CB 4.05Å; L494-I539 HydrophobicContact CD2-CD1 3.83Å; L494-I539 HydrophobicContact CD2-CG2 3.85Å
495	W	96.1	Very high	92.8	Very high	10 Å²	10	38 Å²	38	4%	0.038	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	134.7	-177.7	-51.5	94.3	0	0	0	109.8	F464 T465 Y482 L483 S485 K493 T501 L502	F464-W495 HydrophobicContact CB-CD2 3.86Å; F464-W495 HydrophobicContact CB-CE3 3.96Å; F464-W495 HydrophobicContact CB-CG 4.47Å; F464-W495 HydrophobicContact CB-CH2 4.07Å; F464-W495 HydrophobicContact CB-CZ2 3.97Å; F464-W495 HydrophobicContact CB-CZ3 4.05Å; F464-W495 HydrophobicContact CD1-CB 4.04Å; F464-W495 AromaticContact CD1-CD2 3.71Å; F464-W495 HydrophobicContact CD1-CD2 3.71Å; F464-W495 AromaticContact CD1-CE3 3.52Å; F464-W495 HydrophobicContact CD1-CE3 3.52Å; F464-W495 AromaticContact CD1-CG 3.93Å; F464-W495 HydrophobicContact CD1-CG 3.93Å; F464-W495 HydrophobicContact CD1-CZ3 4.23Å; F464-W495 HydrophobicContact CE1-CB 3.89Å; F464-W495 HydrophobicContact CE1-CD2 4.46Å; F464-W495 HydrophobicContact CE1-CE3 4.36Å; F464-W495 HydrophobicContact CE1-CG 4.28Å; F464-W495 AromaticContact CG-CD2 3.91Å; F464-W495 HydrophobicContact CG-CD2 3.91Å; F464-W495 HydrophobicContact CG-CE3 4.06Å; F464-W495 HydrophobicContact CG-CG 4.11Å; F464-W495 HydrophobicContact CZ-CB 4.3Å; T465-W495 WeakPolarHBondContact O-CH2 3.2Å; Y482-W495 VanDerWaalsContact CA-O 3.25Å; Y482-W495 WeakPolarHBondContact CA-O 3.29Å; L483-W495 HydrophobicContact CB-CB 4.46Å; L483-W495 PolarHBondContact N-O 2.97Å; L483-W495 VanDerWaalsContact O-CD1 3.27Å; L483-W495 PolarHBondContact O-N 3.39Å; S485-W495 PolarHBondContact OG-NE1 2.71Å; K493-W495 HydrophobicContact CB-CZ2 3.88Å; K493-W495 HydrophobicContact CD-CH2 4.25Å; K493-W495 HydrophobicContact CD-CZ2 3.7Å; K493-W495 HydrophobicContact CG-CZ2 4.38Å; W495-T501 WeakPolarHBondContact CA-O 3.19Å; W495-L502 HydrophobicContact CD2-CD1 4.12Å; W495-L502 HydrophobicContact CE3-CB 3.89Å; W495-L502 HydrophobicContact CE3-CD1 4.02Å; W495-L502 HydrophobicContact CH2-CB 4.3Å; W495-L502 HydrophobicContact CH2-CD1 3.98Å; W495-L502 HydrophobicContact CZ2-CD1 4.08Å; W495-L502 HydrophobicContact CZ3-CB 3.62Å; W495-L502 HydrophobicContact CZ3-CD1 3.96Å; W495-L502 HydrophobicContact CZ3-CG 4.36Å
496	D	92.6	Very high	92.5	Very high	26 Å²	26	38 Å²	38	14%	0.139	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120	168.4	168.2	26.8	0	0	0	109.5	Y482 A498 S499 G500 T501	Y482-D496 HydrophobicContact CD1-CB 4.22Å; Y482-D496 HydrophobicContact CE1-CB 4.22Å; D496-A498 VanDerWaalsContact C-N 3.27Å; D496-A498 PolarHBondContact O-N 3.46Å; D496-A498 WeakPolarHBondContact OD1-CB 3.46Å; D496-A498 PolarHBondContact OD1-N 2.81Å; D496-S499 WeakPolarHBondContact CB-OG 3.48Å; D496-S499 VanDerWaalsContact CG-OG 3.3Å; D496-S499 VanDerWaalsContact OD2-CB 3.23Å; D496-S499 WeakPolarHBondContact OD2-CB 3.4Å; D496-S499 PolarHBondContact OD2-N 3.15Å; D496-S499 PolarHBondContact OD2-OG 2.98Å; D496-G500 VanDerWaalsContact O-CA 3.23Å; D496-G500 WeakPolarHBondContact O-CA 3.41Å; D496-G500 PolarHBondContact O-N 2.98Å; D496-T501 PolarHBondContact N-O 3.28Å
497	L	89.6	Confident	92.3	Very high	20 Å²	20	43.3 Å²	43.3	11%	0.105	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-20.4	-176.8	-64.1	176.1	0	0	0	112.8	L452 R462 F464 F476 K481 L483	L452-L497 HydrophobicContact CD2-CD2 4.18Å; R462-L497 PolarHBondContact NE-O 2.85Å; R462-L497 PolarHBondContact NH2-O 2.94Å; F464-L497 HydrophobicContact CE2-CD2 4.37Å; F464-L497 HydrophobicContact CZ-CD2 3.89Å; F476-L497 HydrophobicContact CD1-CD1 3.84Å; F476-L497 HydrophobicContact CE1-CD1 3.63Å; F476-L497 HydrophobicContact CE1-CD2 4.25Å; K481-L497 WeakPolarHBondContact O-CB 3.13Å; K481-L497 WeakPolarHBondContact O-CG 3.42Å; K481-L497 PolarHBondContact O-N 2.7Å; L483-L497 HydrophobicContact CB-CD2 3.82Å; L483-L497 HydrophobicContact CB-CG 4.34Å; L483-L497 HydrophobicContact CD2-CD2 4.46Å
498	A	87.6	Confident	92	Very high	80 Å²	80	44 Å²	44	66%	0.661	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-51.1	177.9	0	0	0	0	0	111.3	R462 D496	R462-A498 PolarHBondContact NH2-O 3.13Å; D496-A498 VanDerWaalsContact C-N 3.27Å; D496-A498 PolarHBondContact O-N 3.46Å; D496-A498 WeakPolarHBondContact OD1-CB 3.46Å; D496-A498 PolarHBondContact OD1-N 2.81Å
499	S	86.4	Confident	91.9	Very high	47 Å²	47	40.1 Å²	40.1	33%	0.329	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-28.5	176.2	62.5	0	0	0	0	113.1	D496 T501	D496-S499 WeakPolarHBondContact CB-OG 3.48Å; D496-S499 VanDerWaalsContact CG-OG 3.3Å; D496-S499 VanDerWaalsContact OD2-CB 3.23Å; D496-S499 WeakPolarHBondContact OD2-CB 3.4Å; D496-S499 PolarHBondContact OD2-N 3.15Å; D496-S499 PolarHBondContact OD2-OG 2.98Å; S499-T501 VanDerWaalsContact C-N 3.29Å; S499-T501 PolarHBondContact OG-N 3.03Å; S499-T501 PolarHBondContact OG-OG1 3.45Å
500	G	84.1	Confident	91.8	Very high	22 Å²	22	43.6 Å²	43.6	23%	0.227	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	19.6	-171.1	0	0	0	0	0	113.7	R462 D496	R462-G500 VanDerWaalsContact NH1-CA 3.27Å; D496-G500 VanDerWaalsContact O-CA 3.23Å; D496-G500 WeakPolarHBondContact O-CA 3.41Å; D496-G500 PolarHBondContact O-N 2.98Å
501	T	87.8	Confident	91.7	Very high	80 Å²	80	43.6 Å²	43.6	49%	0.491	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	161.2	-174.8	66.3	0	0	0	0	111.9	W495 D496 S499 Y503	W495-T501 WeakPolarHBondContact CA-O 3.19Å; D496-T501 PolarHBondContact N-O 3.28Å; S499-T501 VanDerWaalsContact C-N 3.29Å; S499-T501 PolarHBondContact OG-N 3.03Å; S499-T501 PolarHBondContact OG-OG1 3.45Å; T501-Y503 PolarHBondContact O-N 2.91Å
502	L	92.5	Very high	91.7	Very high	68 Å²	68	42.1 Å²	42.1	36%	0.356	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	115.7	173.3	-177.1	68.5	0	0	0	108.7	K493 W495 K504 E505	K493-L502 HydrophobicContact CB-CD1 3.65Å; K493-L502 HydrophobicContact CD-CD1 4.19Å; K493-L502 HydrophobicContact CG-CD1 3.89Å; W495-L502 HydrophobicContact CD2-CD1 4.12Å; W495-L502 HydrophobicContact CE3-CB 3.89Å; W495-L502 HydrophobicContact CE3-CD1 4.02Å; W495-L502 HydrophobicContact CH2-CB 4.3Å; W495-L502 HydrophobicContact CH2-CD1 3.98Å; W495-L502 HydrophobicContact CZ2-CD1 4.08Å; W495-L502 HydrophobicContact CZ3-CB 3.62Å; W495-L502 HydrophobicContact CZ3-CD1 3.96Å; W495-L502 HydrophobicContact CZ3-CG 4.36Å; L502-K504 WeakPolarHBondContact CD1-O 3.42Å; L502-E505 HydrophobicContact CD2-CB 4.44Å
503	Y	91.6	Very high	91.6	Very high	98 Å²	98	42.1 Å²	42.1	38%	0.384	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-50.7	177.6	175.4	-114.1	0	0	0	111.4	Y482 L494 T501	Y482-Y503 HydrophobicContact CD1-CD1 4.43Å; Y482-Y503 HydrophobicContact CE1-CD1 4.05Å; Y482-Y503 HydrophobicContact CE1-CE1 4.35Å; Y482-Y503 HydrophobicContact CE1-CG 4.2Å; L494-Y503 HydrophobicContact CD2-CD1 3.63Å; L494-Y503 HydrophobicContact CD2-CE1 4.1Å; L494-Y503 HydrophobicContact CG-CD1 4.06Å; L494-Y503 WeakPolarHBondContact O-CA 3.45Å; L494-Y503 WeakPolarHBondContact O-CB 3.47Å; L494-Y503 PolarHBondContact O-N 3.05Å; T501-Y503 PolarHBondContact O-N 2.91Å
504	K	91.3	Very high	91.4	Very high	28 Å²	28	43.7 Å²	43.7	12%	0.122	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	151	177	-72	-171.5	174.7	-158.4	0	112	L494 L502 L506 I539 N541 E554	L494-K504 HydrophobicContact CB-CB 4.24Å; L494-K504 PolarHBondContact N-O 2.85Å; L494-K504 PolarHBondContact O-N 2.82Å; L502-K504 WeakPolarHBondContact CD1-O 3.42Å; K504-L506 HydrophobicContact CB-CD2 4.12Å; K504-L506 HydrophobicContact CD-CD2 4.38Å; K504-I539 PolarHBondContact NZ-O 3.47Å; K504-N541 PolarHBondContact NZ-O 3.01Å; K504-E554 HydrophobicContact CD-CG 4.28Å; K504-E554 WeakPolarHBondContact CE-OE1 3.15Å; K504-E554 IonicContact NZ-OE1 2.79Å; K504-E554 PolarHBondContact NZ-OE1 2.65Å
505	E	93	Very high	91.2	Very high	60 Å²	60	44.4 Å²	44.4	28%	0.28	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	111.5	168	-178.7	-177.6	130.4	0	0	108.3	R491 L492 K493 L502 R507	R491-E505 HydrophobicContact CB-CG 4.35Å; L492-E505 CarbonylContact O-C 3.55Å; L492-E505 WeakPolarHBondContact O-CA 3.43Å; K493-E505 HydrophobicContact CG-CG 4.42Å; K493-E505 IonicContact NZ-OE2 3.91Å; K493-E505 PolarHBondContact NZ-OE2 3.11Å; L502-E505 HydrophobicContact CD2-CB 4.44Å; E505-R507 IonicContact OE1-CZ 2.9Å; E505-R507 VanDerWaalsContact OE1-CZ 3.31Å; E505-R507 IonicContact OE1-NE 3.65Å; E505-R507 PolarHBondContact OE1-NE 2.77Å; E505-R507 IonicContact OE1-NH2 2.95Å; E505-R507 PolarHBondContact OE1-NH2 2.96Å
506	L	92.7	Very high	91.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	134.9	-179.4	-42.1	-178.4	0	0	0	110.1	L492 K504 W537 I539 E554	L492-L506 HydrophobicContact CB-CB 4.15Å; L492-L506 HydrophobicContact CD2-CD1 3.9Å; L492-L506 HydrophobicContact CD2-CG 4.29Å; L492-L506 PolarHBondContact N-O 3.1Å; L492-L506 PolarHBondContact O-N 3.04Å; K504-L506 HydrophobicContact CB-CD2 4.12Å; K504-L506 HydrophobicContact CD-CD2 4.38Å; L506-W537 HydrophobicContact CB-CD2 4.2Å; L506-W537 HydrophobicContact CB-CE3 3.87Å; L506-W537 HydrophobicContact CB-CH2 4.44Å; L506-W537 HydrophobicContact CB-CZ3 3.99Å; L506-W537 HydrophobicContact CD1-CB 3.65Å; L506-W537 HydrophobicContact CD1-CD2 3.78Å; L506-W537 HydrophobicContact CD1-CE3 3.99Å; L506-W537 HydrophobicContact CD1-CG 3.64Å; L506-W537 HydrophobicContact CG-CE3 4.44Å; L506-I539 HydrophobicContact CD1-CG2 4.44Å; L506-E554 HydrophobicContact CD2-CB 3.94Å; L506-E554 HydrophobicContact CD2-CG 3.86Å
507	R	92.4	Very high	91.3	Very high	110 Å²	110	44.4 Å²	44.4	42%	0.415	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	134.6	-174.4	-62.2	-165.6	170.5	172.8	5.5	110.2	R491 E505 W537 S551 S552	R491-R507 VanDerWaalsContact NH1-CG 3.29Å; E505-R507 IonicContact OE1-CZ 2.9Å; E505-R507 VanDerWaalsContact OE1-CZ 3.31Å; E505-R507 IonicContact OE1-NE 3.65Å; E505-R507 PolarHBondContact OE1-NE 2.77Å; E505-R507 IonicContact OE1-NH2 2.95Å; E505-R507 PolarHBondContact OE1-NH2 2.96Å; R507-W537 WeakPolarHBondContact O-CH2 3.41Å; R507-W537 WeakPolarHBondContact O-CZ3 3.33Å; R507-S551 CarbonylContact O-C 3.47Å; R507-S551 VanDerWaalsContact O-CA 3.26Å; R507-S551 WeakPolarHBondContact O-CA 3.29Å; R507-S551 WeakPolarHBondContact O-CB 3.45Å; R507-S552 PolarHBondContact O-N 3.12Å
508	G	88.4	Confident	91.4	Very high	16 Å²	16	44 Å²	44	17%	0.165	25%	0.25	C	S	.	.			trans	169.2	-37.2	168.6	0	0	0	0	0	114.1	R535	G508-R535 PolarHBondContact O-NH1 3.37Å; G508-R535 PolarHBondContact O-NH2 3.49Å
509	H	92.4	Very high	91.5	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.028	22%	0.219	C	C	.	.			trans	-59.4	146.8	174.3	-78.4	-65.1	0	0	0	111.7	I513 S527 S529 D531 S533 R535	H509-I513 HydrophobicContact CB-CD1 4.19Å; H509-I513 HydrophobicContact CB-CG1 4.02Å; H509-S527 PolarHBondContact CD2-OG 2.67Å; H509-S527 PolarHBondContact NE2-OG 2.92Å; H509-S529 VanDerWaalsContact CE1-CB 3.44Å; H509-S529 WeakPolarHBondContact CE1-CB 3.49Å; H509-S529 WeakPolarHBondContact ND1-CB 3.46Å; H509-D531 WeakPolarHBondContact CA-OD2 3.35Å; H509-D531 IonicContact CE1-OD1 2.75Å; H509-D531 IonicContact CG-OD2 3.9Å; H509-D531 IonicContact ND1-OD1 3.81Å; H509-D531 PolarHBondContact ND1-OD1 2.67Å; H509-D531 IonicContact ND1-OD2 3.55Å; H509-D531 PolarHBondContact ND1-OD2 2.74Å; H509-S533 PolarHBondContact CE1-OG 2.88Å; H509-S533 PolarHBondContact ND1-OG 2.78Å; H509-R535 PolarHBondContact ND1-NE 2.79Å
510	T	91.8	Very high	91.5	Very high	98 Å²	98	41.3 Å²	41.3	60%	0.601	23%	0.225	S	C	*	.	S	Bend	trans	-108.6	-4.2	-178.9	52.8	0	0	0	0	113.2	Q490 D531	Q490-T510 VanDerWaalsContact CD-C 3.47Å; Q490-T510 VanDerWaalsContact CD-O 3.31Å; Q490-T510 PolarHBondContact NE2-O 3.28Å; Q490-T510 PolarHBondContact OE1-O 3.1Å; T510-D531 PolarHBondContact N-OD2 3.46Å; T510-D531 VanDerWaalsContact OG1-CB 3.25Å; T510-D531 WeakPolarHBondContact OG1-CB 3.38Å; T510-D531 PolarHBondContact OG1-OD2 3.26Å
511	D	92.7	Very high	91.4	Very high	64 Å²	64	44.2 Å²	44.2	34%	0.342	24%	0.235	S	C	.	.	S	Bend	trans	-142.9	-179.8	176.9	-147.1	-26.8	0	0	0	110.8	Q490 I513 S529 M530 D531	Q490-D511 WeakPolarHBondContact CG-O 3.29Å; D511-I513 PolarHBondContact O-N 2.78Å; D511-S529 VanDerWaalsContact C-OG 3.32Å; D511-S529 PolarHBondContact O-OG 2.93Å; D511-M530 HydrophobicContact CB-CB 4.11Å; D511-D531 HydrophobicContact CB-CB 3.85Å
512	N	93.4	Very high	91.4	Very high	41 Å²	41	40.9 Å²	40.9	22%	0.219	22%	0.215	C	C	.	.			trans	-52.7	135.1	-177.5	-65.6	-5.3	0	0	0	111.2	L472 E488 S529 M530	L472-N512 HydrophobicContact CD1-CB 4.32Å; E488-N512 VanDerWaalsContact CA-OD1 3.27Å; E488-N512 WeakPolarHBondContact CA-OD1 3.5Å; N512-S529 CarbonylContact O-C 3.55Å; N512-S529 WeakPolarHBondContact O-CA 3.5Å; N512-S529 VanDerWaalsContact O-CB 3.27Å; N512-S529 WeakPolarHBondContact O-CB 3.46Å; N512-S529 PolarHBondContact O-OG 2.96Å; N512-M530 HydrophobicContact CB-CG 4.2Å; N512-M530 PolarHBondContact O-N 3.03Å
513	I	94.8	Very high	91.1	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.5	176	-59.9	169	0	0	0	107.8	A486 G487 L492 H509 D511 L516 A528	A486-I513 HydrophobicContact CB-CB 3.68Å; A486-I513 HydrophobicContact CB-CD1 3.81Å; A486-I513 HydrophobicContact CB-CG1 4.34Å; A486-I513 HydrophobicContact CB-CG2 3.49Å; A486-I513 VanDerWaalsContact CB-CG2 3.49Å; G487-I513 PolarHBondContact O-N 3.23Å; G487-I513 VanDerWaalsContact O-N 3.13Å; L492-I513 HydrophobicContact CB-CD1 4.41Å; H509-I513 HydrophobicContact CB-CD1 4.19Å; H509-I513 HydrophobicContact CB-CG1 4.02Å; D511-I513 PolarHBondContact O-N 2.78Å; I513-L516 HydrophobicContact CG2-CD2 3.81Å; I513-L516 HydrophobicContact CG2-CG 4.38Å; I513-A528 CarbonylContact C-O 3.43Å; I513-A528 WeakPolarHBondContact CA-O 3.4Å; I513-A528 WeakPolarHBondContact CG2-O 3.31Å
514	T	91.8	Very high	91	Very high	41 Å²	41	33.6 Å²	33.6	25%	0.252	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-32.2	-170.7	49.7	0	0	0	0	112.8	S473 A528 M530 V566	S473-T514 WeakPolarHBondContact CB-O 3.29Å; T514-A528 PolarHBondContact N-O 2.83Å; T514-A528 PolarHBondContact OG1-O 2.88Å; T514-M530 HydrophobicContact CG2-CG 3.73Å; T514-M530 HydrophobicContact CG2-SD 3.77Å; T514-V566 PolarHBondContact OG1-O 2.84Å; T514-V566 VanDerWaalsContact OG1-O 3.11Å
515	S	93	Very high	91	Very high	16 Å²	16	32.2 Å²	32.2	11%	0.112	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	141.7	-177.3	-176.3	0	0	0	0	112.2	S473 S527 A528 V569	S473-S515 WeakPolarHBondContact OG-CA 3.33Å; S515-S527 WeakPolarHBondContact O-CA 3.39Å; S515-A528 PolarHBondContact O-N 2.85Å; S515-V569 PolarHBondContact OG-N 3.16Å; S515-V569 VanDerWaalsContact OG-N 3.1Å
516	L	95.3	Very high	91	Very high	12 Å²	12	29.4 Å²	29.4	6%	0.063	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	142.6	175.8	-66.6	-176	0	0	0	110.8	S473 A475 A484 A486 L492 I513 A526	S473-L516 PolarHBondContact OG-N 2.74Å; A475-L516 HydrophobicContact CB-CB 3.94Å; A484-L516 HydrophobicContact CB-CD1 4.08Å; A486-L516 HydrophobicContact CB-CD1 3.66Å; A486-L516 HydrophobicContact CB-CD2 4.09Å; A486-L516 HydrophobicContact CB-CG 4.06Å; L492-L516 HydrophobicContact CD1-CD1 4.48Å; L492-L516 HydrophobicContact CD1-CD2 3.32Å; L492-L516 HydrophobicContact CG-CD1 4.31Å; L492-L516 HydrophobicContact CG-CD2 3.98Å; I513-L516 HydrophobicContact CG2-CD2 3.81Å; I513-L516 HydrophobicContact CG2-CG 4.38Å; L516-A526 WeakPolarHBondContact CA-O 3.38Å
517	T	94.5	Very high	91.1	Very high	24 Å²	24	29.3 Å²	29.3	15%	0.147	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	148.8	171.1	-174.3	0	0	0	0	111.1	I525 A526 V569 F571 L577	T517-I525 WeakPolarHBondContact O-CA 3.25Å; T517-A526 HydrophobicContact CG2-CB 3.91Å; T517-A526 PolarHBondContact N-O 2.98Å; T517-A526 PolarHBondContact O-N 3.21Å; T517-V569 WeakPolarHBondContact CB-O 3.38Å; T517-V569 HydrophobicContact CG2-CB 4.19Å; T517-V569 HydrophobicContact CG2-CG1 3.68Å; T517-V569 VanDerWaalsContact CG2-O 3.29Å; T517-V569 WeakPolarHBondContact CG2-O 3.35Å; T517-F571 HydrophobicContact CG2-CD2 3.47Å; T517-F571 VanDerWaalsContact CG2-CD2 3.47Å; T517-F571 HydrophobicContact CG2-CE2 3.93Å; T517-F571 HydrophobicContact CG2-CG 4.41Å; T517-L577 HydrophobicContact CG2-CD1 4.13Å
518	F	92.8	Very high	91.1	Very high	11 Å²	11	24.1 Å²	24.1	5%	0.048	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	145.2	174.2	-89	-89.1	0	0	0	110.4	A475 F476 P478 A484 L494 I525 I539 F571	A475-F518 HydrophobicContact CB-CD2 3.82Å; A475-F518 HydrophobicContact CB-CE2 4.2Å; A475-F518 WeakPolarHBondContact O-CE2 3.48Å; F476-F518 VanDerWaalsContact C-CD2 3.41Å; F476-F518 VanDerWaalsContact O-CD2 3.3Å; F476-F518 WeakPolarHBondContact O-CD2 3.38Å; P478-F518 HydrophobicContact CG-CB 4.39Å; A484-F518 HydrophobicContact CB-CE2 3.54Å; A484-F518 HydrophobicContact CB-CZ 3.94Å; L494-F518 HydrophobicContact CD1-CE1 4.5Å; L494-F518 HydrophobicContact CD1-CZ 3.69Å; F518-I525 HydrophobicContact CD1-CD1 4.44Å; F518-I525 HydrophobicContact CD1-CG1 3.75Å; F518-I525 HydrophobicContact CE1-CD1 3.63Å; F518-I525 HydrophobicContact CE1-CG1 3.42Å; F518-I525 VanDerWaalsContact CE1-CG1 3.42Å; F518-I525 HydrophobicContact CE2-CD1 4.25Å; F518-I525 HydrophobicContact CE2-CG1 4.33Å; F518-I525 HydrophobicContact CG-CG1 4.35Å; F518-I525 HydrophobicContact CZ-CD1 3.52Å; F518-I525 HydrophobicContact CZ-CG1 3.74Å; F518-I539 HydrophobicContact CE1-CD1 3.93Å; F518-F571 VanDerWaalsContact O-CD2 3.23Å; F518-F571 WeakPolarHBondContact O-CD2 3.48Å
519	S	89.8	Confident	91.2	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.136	C	C	.	.			trans	-64.2	153.2	166.5	57.7	0	0	0	0	110.7	P478 D521 S522 G523 L524 F571	P478-S519 WeakPolarHBondContact CG-O 3.39Å; S519-D521 VanDerWaalsContact CB-OD1 3.29Å; S519-D521 WeakPolarHBondContact CB-OD1 3.09Å; S519-D521 PolarHBondContact O-N 3.2Å; S519-D521 VanDerWaalsContact O-N 3.13Å; S519-D521 PolarHBondContact OG-OD1 3.02Å; S519-S522 WeakPolarHBondContact O-CA 3.43Å; S519-S522 PolarHBondContact O-N 3.26Å; S519-G523 PolarHBondContact OG-N 3.46Å; S519-L524 PolarHBondContact N-O 3.27Å; S519-L524 PolarHBondContact OG-N 2.87Å; S519-L524 PolarHBondContact OG-O 3.2Å; S519-F571 VanDerWaalsContact N-CD2 3.33Å
520	P	85.1	Confident	91.1	Very high	71 Å²	71	26.1 Å²	26.1	46%	0.461	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-30	-179.8	-26.8	36.1	0	0	0	113.9	S522	P520-S522 VanDerWaalsContact C-N 3.27Å; P520-S522 PolarHBondContact O-N 2.93Å
521	D	82.9	Confident	91	Very high	83 Å²	83	23 Å²	23	44%	0.444	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-0.6	176.8	72.9	-13.4	0	0	0	114	S519 G523	S519-D521 VanDerWaalsContact CB-OD1 3.29Å; S519-D521 WeakPolarHBondContact CB-OD1 3.09Å; S519-D521 PolarHBondContact O-N 3.2Å; S519-D521 VanDerWaalsContact O-N 3.13Å; S519-D521 PolarHBondContact OG-OD1 3.02Å; D521-G523 PolarHBondContact O-N 2.92Å; D521-G523 VanDerWaalsContact O-N 3.17Å; D521-G523 PolarHBondContact OD1-N 2.94Å
522	S	87.7	Confident	90.7	Very high	9 Å²	9	22.6 Å²	22.6	6%	0.063	13%	0.128	C	C	.	.	S	Bend	trans	59.8	14.6	-175.4	-48	0	0	0	0	115	P478 N479 S519 P520	P478-S522 VanDerWaalsContact CD-OG 3.26Å; P478-S522 WeakPolarHBondContact CD-OG 3.47Å; N479-S522 PolarHBondContact N-OG 3.41Å; N479-S522 WeakPolarHBondContact ND2-CB 3.27Å; S519-S522 WeakPolarHBondContact O-CA 3.43Å; S519-S522 PolarHBondContact O-N 3.26Å; P520-S522 VanDerWaalsContact C-N 3.27Å; P520-S522 PolarHBondContact O-N 2.93Å
523	G	85.3	Confident	90.5	Very high	2 Å²	2	20.8 Å²	20.8	2%	0.021	12%	0.118	C	C	.	.	S	Bend	trans	-88.7	-29.9	-178.3	0	0	0	0	0	114.1	S519 D521 I539	S519-G523 PolarHBondContact OG-N 3.46Å; D521-G523 PolarHBondContact O-N 2.92Å; D521-G523 VanDerWaalsContact O-N 3.17Å; D521-G523 PolarHBondContact OD1-N 2.94Å; G523-I539 VanDerWaalsContact O-CG1 3.22Å; G523-I539 WeakPolarHBondContact O-CG1 3.32Å; G523-I539 PolarHBondContact O-N 2.9Å; G523-I539 VanDerWaalsContact O-N 3.15Å
524	L	89.5	Confident	90.3	Very high	11 Å²	11	20.7 Å²	20.7	6%	0.058	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	150.9	-177.1	-55.8	176.1	0	0	0	111.2	S519 V536 W537 D538 F571	S519-L524 PolarHBondContact N-O 3.27Å; S519-L524 PolarHBondContact OG-N 2.87Å; S519-L524 PolarHBondContact OG-O 3.2Å; L524-V536 HydrophobicContact CB-CG1 4.34Å; L524-V536 HydrophobicContact CD1-CG1 4.23Å; L524-V536 HydrophobicContact CD2-CG1 4.42Å; L524-W537 CarbonylContact C-O 3.48Å; L524-W537 VanDerWaalsContact CA-O 3.26Å; L524-W537 WeakPolarHBondContact CA-O 3.18Å; L524-D538 HydrophobicContact CD2-CB 3.73Å; L524-F571 HydrophobicContact CB-CZ 4.34Å
525	I	92.8	Very high	90.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	135	167.4	-60.7	177.6	0	0	0	107.5	A484 L492 L494 T517 F518 V536 W537 I539	A484-I525 HydrophobicContact CB-CD1 4.19Å; L492-I525 HydrophobicContact CD1-CG2 3.86Å; L492-I525 HydrophobicContact CD2-CD1 4.12Å; L492-I525 HydrophobicContact CD2-CG2 4.47Å; L494-I525 HydrophobicContact CD1-CD1 4.09Å; L494-I525 HydrophobicContact CD2-CD1 4.4Å; T517-I525 WeakPolarHBondContact O-CA 3.25Å; F518-I525 HydrophobicContact CD1-CD1 4.44Å; F518-I525 HydrophobicContact CD1-CG1 3.75Å; F518-I525 HydrophobicContact CE1-CD1 3.63Å; F518-I525 HydrophobicContact CE1-CG1 3.42Å; F518-I525 VanDerWaalsContact CE1-CG1 3.42Å; F518-I525 HydrophobicContact CE2-CD1 4.25Å; F518-I525 HydrophobicContact CE2-CG1 4.33Å; F518-I525 HydrophobicContact CG-CG1 4.35Å; F518-I525 HydrophobicContact CZ-CD1 3.52Å; F518-I525 HydrophobicContact CZ-CG1 3.74Å; I525-V536 CarbonylContact O-C 3.39Å; I525-V536 WeakPolarHBondContact O-CA 3.42Å; I525-W537 HydrophobicContact CB-CB 4.39Å; I525-W537 PolarHBondContact N-O 2.86Å; I525-W537 PolarHBondContact O-N 2.79Å; I525-I539 HydrophobicContact CD1-CG2 3.61Å; I525-I539 HydrophobicContact CG1-CG2 4Å
526	A	93.1	Very high	90.2	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139.1	166.3	0	0	0	0	0	109.7	L516 T517 R535 V569 F571 L577	L516-A526 WeakPolarHBondContact CA-O 3.38Å; T517-A526 HydrophobicContact CG2-CB 3.91Å; T517-A526 PolarHBondContact N-O 2.98Å; T517-A526 PolarHBondContact O-N 3.21Å; A526-R535 CarbonylContact C-O 3.57Å; A526-R535 VanDerWaalsContact CA-O 3.31Å; A526-R535 WeakPolarHBondContact CA-O 3.27Å; A526-V569 HydrophobicContact CB-CG1 3.81Å; A526-F571 HydrophobicContact CB-CD2 4.38Å; A526-F571 HydrophobicContact CB-CE2 3.5Å; A526-F571 HydrophobicContact CB-CZ 3.87Å; A526-L577 HydrophobicContact CB-CD1 3.69Å; A526-L577 HydrophobicContact CB-CD2 3.73Å; A526-L577 HydrophobicContact CB-CG 4.37Å
527	S	93.6	Very high	90	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.8	177.3	58.9	0	0	0	0	111	H509 S515 V534 R535 W537	H509-S527 PolarHBondContact CD2-OG 2.67Å; H509-S527 PolarHBondContact NE2-OG 2.92Å; S515-S527 WeakPolarHBondContact O-CA 3.39Å; S527-V534 CarbonylContact O-C 3.42Å; S527-V534 WeakPolarHBondContact O-CA 3.33Å; S527-R535 PolarHBondContact N-O 2.95Å; S527-R535 PolarHBondContact O-N 3Å; S527-W537 PolarHBondContact OG-NE1 2.79Å
528	A	91.9	Very high	89.7	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	149	169.1	0	0	0	0	0	111	I513 T514 S515 V534 V566 V569	I513-A528 CarbonylContact C-O 3.43Å; I513-A528 WeakPolarHBondContact CA-O 3.4Å; I513-A528 WeakPolarHBondContact CG2-O 3.31Å; T514-A528 PolarHBondContact N-O 2.83Å; T514-A528 PolarHBondContact OG1-O 2.88Å; S515-A528 PolarHBondContact O-N 2.85Å; A528-V534 HydrophobicContact CB-CG2 4.41Å; A528-V566 HydrophobicContact CB-CB 3.88Å; A528-V566 HydrophobicContact CB-CG1 3.36Å; A528-V569 HydrophobicContact CB-CG2 3.32Å
529	S	92.1	Very high	89.4	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	158.2	-178.9	172.3	0	0	0	0	111.7	H509 D511 N512 D531 N532 S533	H509-S529 VanDerWaalsContact CE1-CB 3.44Å; H509-S529 WeakPolarHBondContact CE1-CB 3.49Å; H509-S529 WeakPolarHBondContact ND1-CB 3.46Å; D511-S529 VanDerWaalsContact C-OG 3.32Å; D511-S529 PolarHBondContact O-OG 2.93Å; N512-S529 CarbonylContact O-C 3.55Å; N512-S529 WeakPolarHBondContact O-CA 3.5Å; N512-S529 VanDerWaalsContact O-CB 3.27Å; N512-S529 WeakPolarHBondContact O-CB 3.46Å; N512-S529 PolarHBondContact O-OG 2.96Å; S529-D531 VanDerWaalsContact CB-OD1 3.25Å; S529-D531 WeakPolarHBondContact CB-OD1 3.46Å; S529-D531 PolarHBondContact O-N 3.13Å; S529-D531 VanDerWaalsContact O-N 3.16Å; S529-D531 VanDerWaalsContact OG-CG 3.31Å; S529-D531 PolarHBondContact OG-N 2.98Å; S529-D531 VanDerWaalsContact OG-N 3.17Å; S529-D531 PolarHBondContact OG-OD1 3.11Å; S529-N532 PolarHBondContact O-N 2.88Å; S529-S533 PolarHBondContact N-O 3.22Å
530	M	89.3	Confident	89	Confident	64 Å²	64	23.6 Å²	23.6	32%	0.315	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-8.2	169.4	-61	-60.3	-75.3	0	0	112.9	D511 N512 T514 N532 N565	D511-M530 HydrophobicContact CB-CB 4.11Å; N512-M530 HydrophobicContact CB-CG 4.2Å; N512-M530 PolarHBondContact O-N 3.03Å; T514-M530 HydrophobicContact CG2-CG 3.73Å; T514-M530 HydrophobicContact CG2-SD 3.77Å; M530-N532 PolarHBondContact O-N 3.21Å; M530-N532 VanDerWaalsContact O-N 3.12Å; M530-N565 HydrophobicContact CE-CB 4.33Å; M530-N565 WeakPolarHBondContact CE-OD1 3.23Å; M530-N565 HydrophobicContact SD-CB 4.42Å
531	D	89.1	Confident	88.2	Confident	32 Å²	32	23.1 Å²	23.1	17%	0.171	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	10	168.4	71.2	9.5	0	0	0	113.7	H509 T510 D511 S529 S533 R535	H509-D531 WeakPolarHBondContact CA-OD2 3.35Å; H509-D531 IonicContact CE1-OD1 2.75Å; H509-D531 IonicContact CG-OD2 3.9Å; H509-D531 IonicContact ND1-OD1 3.81Å; H509-D531 PolarHBondContact ND1-OD1 2.67Å; H509-D531 IonicContact ND1-OD2 3.55Å; H509-D531 PolarHBondContact ND1-OD2 2.74Å; T510-D531 PolarHBondContact N-OD2 3.46Å; T510-D531 VanDerWaalsContact OG1-CB 3.25Å; T510-D531 WeakPolarHBondContact OG1-CB 3.38Å; T510-D531 PolarHBondContact OG1-OD2 3.26Å; D511-D531 HydrophobicContact CB-CB 3.85Å; S529-D531 VanDerWaalsContact CB-OD1 3.25Å; S529-D531 WeakPolarHBondContact CB-OD1 3.46Å; S529-D531 PolarHBondContact O-N 3.13Å; S529-D531 VanDerWaalsContact O-N 3.16Å; S529-D531 VanDerWaalsContact OG-CG 3.31Å; S529-D531 PolarHBondContact OG-N 2.98Å; S529-D531 VanDerWaalsContact OG-N 3.17Å; S529-D531 PolarHBondContact OG-OD1 3.11Å; D531-S533 PolarHBondContact O-N 3.47Å; D531-S533 WeakPolarHBondContact OD1-CA 3.4Å; D531-S533 WeakPolarHBondContact OD1-CB 3.41Å; D531-S533 PolarHBondContact OD1-N 3.46Å; D531-S533 PolarHBondContact OD1-OG 3.2Å; D531-S533 PolarHBondContact OD2-OG 3.45Å; D531-R535 IonicContact OD2-NH2 3.36Å
532	N	87.2	Confident	87	Confident	56 Å²	56	23.4 Å²	23.4	30%	0.299	12%	0.118	S	C	.	.	S	Bend	trans	58.1	23.4	-176.6	-57.7	-37.1	0	0	0	113.8	S529 M530 N565	S529-N532 PolarHBondContact O-N 2.88Å; M530-N532 PolarHBondContact O-N 3.21Å; M530-N532 VanDerWaalsContact O-N 3.12Å; N532-N565 PolarHBondContact OD1-N 2.83Å
533	S	88.8	Confident	85.2	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.021	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.1	176.2	80.6	0	0	0	0	112.9	H509 S529 D531 R535 Y559	H509-S533 PolarHBondContact CE1-OG 2.88Å; H509-S533 PolarHBondContact ND1-OG 2.78Å; S529-S533 PolarHBondContact N-O 3.22Å; D531-S533 PolarHBondContact O-N 3.47Å; D531-S533 WeakPolarHBondContact OD1-CA 3.4Å; D531-S533 WeakPolarHBondContact OD1-CB 3.41Å; D531-S533 PolarHBondContact OD1-N 3.46Å; D531-S533 PolarHBondContact OD1-OG 3.2Å; D531-S533 PolarHBondContact OD2-OG 3.45Å; S533-R535 PolarHBondContact OG-NE 2.55Å; S533-Y559 WeakPolarHBondContact CA-O 3.22Å
534	V	91.3	Very high	83.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.8	163.5	179.8	0	0	0	0	108.2	F261 S527 A528 Y559 V566 V569 L577 V579	F261-V534 HydrophobicContact CE1-CG2 4.28Å; S527-V534 CarbonylContact O-C 3.42Å; S527-V534 WeakPolarHBondContact O-CA 3.33Å; A528-V534 HydrophobicContact CB-CG2 4.41Å; V534-Y559 PolarHBondContact N-O 3.37Å; V534-Y559 PolarHBondContact O-N 3.35Å; V534-V566 HydrophobicContact CG2-CG1 3.95Å; V534-V566 HydrophobicContact CG2-CG2 4.22Å; V534-V569 HydrophobicContact CG1-CG2 4.36Å; V534-V569 HydrophobicContact CG2-CG2 4.27Å; V534-L577 HydrophobicContact CG1-CD2 3.89Å; V534-V579 HydrophobicContact CG1-CG2 4.27Å; V534-V579 HydrophobicContact CG2-CG1 3.75Å; V534-V579 HydrophobicContact CG2-CG2 3.95Å
535	R	91.1	Very high	81.8	Confident	28 Å²	28	39.4 Å²	39.4	11%	0.106	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	139.2	-178.2	-62.2	-173	-172.1	-145.4	13.2	110.8	G508 H509 A526 S527 D531 S533 W537 L555 G557 V558	G508-R535 PolarHBondContact O-NH1 3.37Å; G508-R535 PolarHBondContact O-NH2 3.49Å; H509-R535 PolarHBondContact ND1-NE 2.79Å; A526-R535 CarbonylContact C-O 3.57Å; A526-R535 VanDerWaalsContact CA-O 3.31Å; A526-R535 WeakPolarHBondContact CA-O 3.27Å; S527-R535 PolarHBondContact N-O 2.95Å; S527-R535 PolarHBondContact O-N 3Å; D531-R535 IonicContact OD2-NH2 3.36Å; S533-R535 PolarHBondContact OG-NE 2.55Å; R535-W537 HydrophobicContact CB-CZ2 3.85Å; R535-W537 HydrophobicContact CG-CZ2 4.46Å; R535-L555 HydrophobicContact CB-CD1 3.84Å; R535-L555 HydrophobicContact CG-CD1 4.21Å; R535-G557 WeakPolarHBondContact CA-O 3.32Å; R535-V558 HydrophobicContact CG-CB 4.47Å; R535-V558 HydrophobicContact CG-CG1 4.17Å; R535-V558 HydrophobicContact CG-CG2 4.1Å
536	V	91.3	Very high	80.1	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	129.9	176.3	-177.8	0	0	0	0	108.9	L524 I525 V556 G557 Y559 L577	L524-V536 HydrophobicContact CB-CG1 4.34Å; L524-V536 HydrophobicContact CD1-CG1 4.23Å; L524-V536 HydrophobicContact CD2-CG1 4.42Å; I525-V536 CarbonylContact O-C 3.39Å; I525-V536 WeakPolarHBondContact O-CA 3.42Å; V536-V556 PolarHBondContact O-N 2.9Å; V536-G557 PolarHBondContact N-O 2.81Å; V536-G557 PolarHBondContact O-N 3.26Å; V536-Y559 HydrophobicContact CG2-CD2 4.48Å; V536-Y559 HydrophobicContact CG2-CE2 4Å; V536-L577 HydrophobicContact CG2-CD2 4.34Å
537	W	90.5	Very high	78.6	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.1	-175.4	-45.5	86.1	0	0	0	110.4	L506 R507 L524 I525 S527 R535 E554 L555	L506-W537 HydrophobicContact CB-CD2 4.2Å; L506-W537 HydrophobicContact CB-CE3 3.87Å; L506-W537 HydrophobicContact CB-CH2 4.44Å; L506-W537 HydrophobicContact CB-CZ3 3.99Å; L506-W537 HydrophobicContact CD1-CB 3.65Å; L506-W537 HydrophobicContact CD1-CD2 3.78Å; L506-W537 HydrophobicContact CD1-CE3 3.99Å; L506-W537 HydrophobicContact CD1-CG 3.64Å; L506-W537 HydrophobicContact CG-CE3 4.44Å; R507-W537 WeakPolarHBondContact O-CH2 3.41Å; R507-W537 WeakPolarHBondContact O-CZ3 3.33Å; L524-W537 CarbonylContact C-O 3.48Å; L524-W537 VanDerWaalsContact CA-O 3.26Å; L524-W537 WeakPolarHBondContact CA-O 3.18Å; I525-W537 HydrophobicContact CB-CB 4.39Å; I525-W537 PolarHBondContact N-O 2.86Å; I525-W537 PolarHBondContact O-N 2.79Å; S527-W537 PolarHBondContact OG-NE1 2.79Å; R535-W537 HydrophobicContact CB-CZ2 3.85Å; R535-W537 HydrophobicContact CG-CZ2 4.46Å; W537-E554 CarbonylContact C-O 3.58Å; W537-E554 VanDerWaalsContact CA-O 3.25Å; W537-E554 WeakPolarHBondContact CA-O 3.23Å; W537-E554 HydrophobicContact CE3-CB 4.48Å; W537-L555 HydrophobicContact CD2-CD1 4.17Å; W537-L555 HydrophobicContact CE3-CB 3.85Å; W537-L555 HydrophobicContact CE3-CD1 3.96Å; W537-L555 HydrophobicContact CH2-CD1 3.97Å; W537-L555 HydrophobicContact CZ2-CD1 4.18Å; W537-L555 HydrophobicContact CZ3-CB 3.69Å; W537-L555 HydrophobicContact CZ3-CD1 3.87Å; W537-L555 HydrophobicContact CZ3-CG 4.24Å
538	D	88.8	Confident	77	Confident	13 Å²	13	50 Å²	50	7%	0.07	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	112.7	170.2	-168.6	-31.2	0	0	0	109.8	L524 R540 N541 E554 V556	L524-D538 HydrophobicContact CD2-CB 3.73Å; D538-R540 WeakPolarHBondContact OD1-CA 3.37Å; D538-R540 VanDerWaalsContact OD1-CB 3.25Å; D538-R540 WeakPolarHBondContact OD1-CB 3.46Å; D538-R540 PolarHBondContact OD1-N 3.22Å; D538-R540 IonicContact OD1-NE 3.98Å; D538-R540 PolarHBondContact OD1-NE 2.85Å; D538-R540 IonicContact OD2-CZ 3.8Å; D538-R540 IonicContact OD2-NE 3.61Å; D538-R540 IonicContact OD2-NH2 3.73Å; D538-R540 PolarHBondContact OD2-NH2 3.04Å; D538-R540 VanDerWaalsContact OD2-NH2 3.13Å; D538-N541 HydrophobicContact CB-CB 4.26Å; D538-N541 PolarHBondContact OD1-N 3.44Å; D538-E554 PolarHBondContact N-O 3.14Å; D538-E554 WeakPolarHBondContact O-CB 3.41Å; D538-E554 WeakPolarHBondContact O-CG 3.44Å; D538-V556 HydrophobicContact CB-CG2 3.56Å
539	I	86.2	Confident	75.6	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	33%	0.33	C	S	.	.	S	Bend	trans	-86.8	-12.3	-177.1	58.5	156.2	0	0	0	113.4	Y482 L494 K504 L506 F518 G523 I525	Y482-I539 HydrophobicContact CD2-CD1 4.37Å; L494-I539 HydrophobicContact CD2-CB 4.05Å; L494-I539 HydrophobicContact CD2-CD1 3.83Å; L494-I539 HydrophobicContact CD2-CG2 3.85Å; K504-I539 PolarHBondContact NZ-O 3.47Å; L506-I539 HydrophobicContact CD1-CG2 4.44Å; F518-I539 HydrophobicContact CE1-CD1 3.93Å; G523-I539 VanDerWaalsContact O-CG1 3.22Å; G523-I539 WeakPolarHBondContact O-CG1 3.32Å; G523-I539 PolarHBondContact O-N 2.9Å; G523-I539 VanDerWaalsContact O-N 3.15Å; I525-I539 HydrophobicContact CD1-CG2 3.61Å; I525-I539 HydrophobicContact CG1-CG2 4Å
540	R	80.9	Confident	74.3	Confident	114 Å²	114	60 Å²	60	43%	0.43	36%	0.358	S	S	.	.	S	Bend	trans	-79	-28	172.5	-54.8	170.9	-64.8	175.3	7.1	110.7	D538 T542	D538-R540 WeakPolarHBondContact OD1-CA 3.37Å; D538-R540 VanDerWaalsContact OD1-CB 3.25Å; D538-R540 WeakPolarHBondContact OD1-CB 3.46Å; D538-R540 PolarHBondContact OD1-N 3.22Å; D538-R540 IonicContact OD1-NE 3.98Å; D538-R540 PolarHBondContact OD1-NE 2.85Å; D538-R540 IonicContact OD2-CZ 3.8Å; D538-R540 IonicContact OD2-NE 3.61Å; D538-R540 IonicContact OD2-NH2 3.73Å; D538-R540 PolarHBondContact OD2-NH2 3.04Å; D538-R540 VanDerWaalsContact OD2-NH2 3.13Å; R540-T542 PolarHBondContact O-N 3.31Å
541	N	69.1	Low	73.8	Confident	61 Å²	61	57.7 Å²	57.7	33%	0.326	35%	0.348	S	S	.	.			trans	-63.4	123.4	177.9	-164.5	3.9	0	0	0	110.3	K504 D538 Y543	K504-N541 PolarHBondContact NZ-O 3.01Å; D538-N541 HydrophobicContact CB-CB 4.26Å; D538-N541 PolarHBondContact OD1-N 3.44Å; N541-Y543 PolarHBondContact ND2-O 3.33Å; N541-Y543 PolarHBondContact OD1-N 3.06Å; N541-Y543 PolarHBondContact OD1-O 3.43Å
542	T	57.2	Low	73.4	Confident	89 Å²	89	57 Å²	57	55%	0.546	35%	0.345	S	S	.	.			trans	-114.8	-4.6	177.7	43.8	0	0	0	0	111.9	R540	R540-T542 PolarHBondContact O-N 3.31Å
543	Y	50.4	Low	73.1	Confident	199 Å²	199	56.1 Å²	56.1	78%	0.78	34%	0.344	S	S	*	.			trans	-133.1	102.2	-176.1	-58	-75.9	0	0	0	110.2	N541	N541-Y543 PolarHBondContact ND2-O 3.33Å; N541-Y543 PolarHBondContact OD1-N 3.06Å; N541-Y543 PolarHBondContact OD1-O 3.43Å
544	G	51.8	Low	72.9	Confident	39 Å²	39	57 Å²	57	40%	0.402	35%	0.348	S	S	.	.			trans	-151.9	137.7	166.6	0	0	0	0	0	109.7	A546 S553	G544-A546 PolarHBondContact O-N 3.11Å; G544-S553 VanDerWaalsContact O-CB 3.29Å; G544-S553 WeakPolarHBondContact O-CB 3.36Å
545	S	52.1	Low	72.6	Confident	119 Å²	119	58.7 Å²	58.7	83%	0.832	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-58.3	129	164.1	179.3	0	0	0	0	107.5	P547	S545-P547 WeakPolarHBondContact O-CD 3.49Å
546	A	57.5	Low	72.3	Confident	66 Å²	66	60 Å²	60	55%	0.545	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-54.6	128.7	170.9	0	0	0	0	0	108.1	G544	G544-A546 PolarHBondContact O-N 3.11Å
547	P	61.4	Low	72	Confident	47 Å²	47	60.5 Å²	60.5	31%	0.305	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-54.8	149.2	173.9	-25.7	34.9	0	0	0	110.7	S545 D549 G550 S551	S545-P547 WeakPolarHBondContact O-CD 3.49Å; P547-D549 PolarHBondContact O-N 3.46Å; P547-G550 PolarHBondContact O-N 3.03Å; P547-S551 WeakPolarHBondContact CB-OG 3.27Å; P547-S551 WeakPolarHBondContact CD-O 3.46Å; P547-S551 VanDerWaalsContact CG-OG 3.28Å; P547-S551 WeakPolarHBondContact CG-OG 3.15Å
548	A	59.5	Low	71.8	Confident	110 Å²	110	63.8 Å²	63.8	91%	0.909	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-23.4	-179.3	0	0	0	0	0	113	G550	A548-G550 VanDerWaalsContact C-N 3.27Å; A548-G550 PolarHBondContact O-N 3.33Å
549	D	61.6	Low	71.7	Confident	154 Å²	154	66 Å²	66	82%	0.824	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	1.2	-178	-52.9	-23.3	0	0	0	113.5	P547 S551	P547-D549 PolarHBondContact O-N 3.46Å; D549-S551 VanDerWaalsContact C-N 3.33Å; D549-S551 PolarHBondContact O-N 2.99Å
550	G	66.6	Low	71.4	Confident	57 Å²	57	70.9 Å²	70.9	59%	0.588	43%	0.432	S	S	*	.	S	Bend	trans	77.5	12.9	177.3	0	0	0	0	0	115.1	P547 A548	P547-G550 PolarHBondContact O-N 3.03Å; A548-G550 VanDerWaalsContact C-N 3.27Å; A548-G550 PolarHBondContact O-N 3.33Å
551	S	77.6	Confident	70.7	Confident	14 Å²	14	67 Å²	67	10%	0.098	43%	0.426	C	S	.	.			trans	-74.1	166.6	170.7	52.9	0	0	0	0	112.1	R507 P547 D549	R507-S551 CarbonylContact O-C 3.47Å; R507-S551 VanDerWaalsContact O-CA 3.26Å; R507-S551 WeakPolarHBondContact O-CA 3.29Å; R507-S551 WeakPolarHBondContact O-CB 3.45Å; P547-S551 WeakPolarHBondContact CB-OG 3.27Å; P547-S551 WeakPolarHBondContact CD-O 3.46Å; P547-S551 VanDerWaalsContact CG-OG 3.28Å; P547-S551 WeakPolarHBondContact CG-OG 3.15Å; D549-S551 VanDerWaalsContact C-N 3.33Å; D549-S551 PolarHBondContact O-N 2.99Å
552	S	80.2	Confident	70.6	Confident	17 Å²	17	72.7 Å²	72.7	12%	0.119	45%	0.451	C	S	.	.			trans	-68.8	142	177.7	-134.8	0	0	0	0	110.6	R507 E554 L555	R507-S552 PolarHBondContact O-N 3.12Å; S552-E554 VanDerWaalsContact CB-OE2 3.23Å; S552-E554 WeakPolarHBondContact CB-OE2 3.25Å; S552-E554 PolarHBondContact O-N 2.78Å; S552-E554 VanDerWaalsContact O-N 3.14Å; S552-E554 PolarHBondContact OG-OE2 3.12Å; S552-L555 VanDerWaalsContact O-CB 3.28Å; S552-L555 WeakPolarHBondContact O-CB 3.38Å; S552-L555 PolarHBondContact O-N 3.04Å
553	S	80.6	Confident	71.1	Confident	39 Å²	39	69 Å²	69	27%	0.273	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-18.7	173	44.9	0	0	0	0	113.9	G544 L555	G544-S553 VanDerWaalsContact O-CB 3.29Å; G544-S553 WeakPolarHBondContact O-CB 3.36Å; S553-L555 PolarHBondContact O-N 2.96Å
554	E	84.7	Confident	71.8	Confident	22 Å²	22	60.9 Å²	60.9	10%	0.103	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-13.9	175.1	-67.5	80.5	178.9	0	0	113.2	K504 L506 W537 D538 S552 V556	K504-E554 HydrophobicContact CD-CG 4.28Å; K504-E554 WeakPolarHBondContact CE-OE1 3.15Å; K504-E554 IonicContact NZ-OE1 2.79Å; K504-E554 PolarHBondContact NZ-OE1 2.65Å; L506-E554 HydrophobicContact CD2-CB 3.94Å; L506-E554 HydrophobicContact CD2-CG 3.86Å; W537-E554 CarbonylContact C-O 3.58Å; W537-E554 VanDerWaalsContact CA-O 3.25Å; W537-E554 WeakPolarHBondContact CA-O 3.23Å; W537-E554 HydrophobicContact CE3-CB 4.48Å; D538-E554 PolarHBondContact N-O 3.14Å; D538-E554 WeakPolarHBondContact O-CB 3.41Å; D538-E554 WeakPolarHBondContact O-CG 3.44Å; S552-E554 VanDerWaalsContact CB-OE2 3.23Å; S552-E554 WeakPolarHBondContact CB-OE2 3.25Å; S552-E554 PolarHBondContact O-N 2.78Å; S552-E554 VanDerWaalsContact O-N 3.14Å; S552-E554 PolarHBondContact OG-OE2 3.12Å; E554-V556 PolarHBondContact O-N 3.47Å
555	L	86.4	Confident	72.7	Confident	35 Å²	35	61.7 Å²	61.7	18%	0.183	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	115.6	179.8	-176.9	61.2	0	0	0	110.1	R535 W537 S552 S553 V558	R535-L555 HydrophobicContact CB-CD1 3.84Å; R535-L555 HydrophobicContact CG-CD1 4.21Å; W537-L555 HydrophobicContact CD2-CD1 4.17Å; W537-L555 HydrophobicContact CE3-CB 3.85Å; W537-L555 HydrophobicContact CE3-CD1 3.96Å; W537-L555 HydrophobicContact CH2-CD1 3.97Å; W537-L555 HydrophobicContact CZ2-CD1 4.18Å; W537-L555 HydrophobicContact CZ3-CB 3.69Å; W537-L555 HydrophobicContact CZ3-CD1 3.87Å; W537-L555 HydrophobicContact CZ3-CG 4.24Å; S552-L555 VanDerWaalsContact O-CB 3.28Å; S552-L555 WeakPolarHBondContact O-CB 3.38Å; S552-L555 PolarHBondContact O-N 3.04Å; S553-L555 PolarHBondContact O-N 2.96Å; L555-V558 HydrophobicContact CD1-CG2 4.05Å; L555-V558 HydrophobicContact CD2-CG2 3.76Å; L555-V558 HydrophobicContact CG-CG2 4.22Å
556	V	85.1	Confident	74	Confident	55 Å²	55	56.2 Å²	56.2	33%	0.333	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-41.8	179.2	-178.8	0	0	0	0	110.9	P254 V536 D538 E554	P254-V556 HydrophobicContact CB-CG1 4.26Å; P254-V556 HydrophobicContact CG-CG1 3.74Å; P254-V556 HydrophobicContact CG-CG2 4.38Å; V536-V556 PolarHBondContact O-N 2.9Å; D538-V556 HydrophobicContact CB-CG2 3.56Å; E554-V556 PolarHBondContact O-N 3.47Å
557	G	83.3	Confident	74.8	Confident	14 Å²	14	54.9 Å²	54.9	14%	0.144	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	149.5	-175.3	0	0	0	0	0	112.7	R535 V536	R535-G557 WeakPolarHBondContact CA-O 3.32Å; V536-G557 PolarHBondContact N-O 2.81Å; V536-G557 PolarHBondContact O-N 3.26Å
558	V	87.8	Confident	75.9	Confident	69 Å²	69	53.6 Å²	53.6	42%	0.418	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128	172.2	-175.8	0	0	0	0	107.2	R535 L555 T560	R535-V558 HydrophobicContact CG-CB 4.47Å; R535-V558 HydrophobicContact CG-CG1 4.17Å; R535-V558 HydrophobicContact CG-CG2 4.1Å; L555-V558 HydrophobicContact CD1-CG2 4.05Å; L555-V558 HydrophobicContact CD2-CG2 3.76Å; L555-V558 HydrophobicContact CG-CG2 4.22Å; V558-T560 HydrophobicContact CG1-CG2 4.3Å
559	Y	85.8	Confident	77.1	Confident	60 Å²	60	48.7 Å²	48.7	24%	0.235	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.9	-179.9	-59.4	-95.3	0	0	0	108.4	I259 S533 V534 V536	I259-Y559 HydrophobicContact CD1-CD1 3.65Å; I259-Y559 HydrophobicContact CD1-CD2 3.2Å; I259-Y559 HydrophobicContact CD1-CE1 3.69Å; I259-Y559 HydrophobicContact CD1-CE2 3.28Å; I259-Y559 HydrophobicContact CD1-CG 3.39Å; I259-Y559 VanDerWaalsContact CD1-CZ 3.49Å; I259-Y559 HydrophobicContact CG1-CE1 4.31Å; I259-Y559 HydrophobicContact CG1-CE2 4.42Å; S533-Y559 WeakPolarHBondContact CA-O 3.22Å; V534-Y559 PolarHBondContact N-O 3.37Å; V534-Y559 PolarHBondContact O-N 3.35Å; V536-Y559 HydrophobicContact CG2-CD2 4.48Å; V536-Y559 HydrophobicContact CG2-CE2 4Å
560	T	81.1	Confident	78.3	Confident	109 Å²	109	43.5 Å²	43.5	67%	0.669	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	113.5	176.8	53.5	0	0	0	0	107.5	V558	V558-T560 HydrophobicContact CG1-CG2 4.3Å
561	G	65.6	Low	79.1	Confident	31 Å²	31	41.6 Å²	41.6	32%	0.32	24%	0.238	S	C	.	.			trans	-92.9	172.9	174.5	0	0	0	0	0	111.8	M563	G561-M563 PolarHBondContact O-N 3.44Å
562	Q	65.8	Low	79.1	Confident	182 Å²	182	41.5 Å²	41.5	85%	0.85	24%	0.236	S	C	*	.	S	Bend	trans	-74.4	23.5	168	-66.7	-170.9	-23.6	0	0	112.9	Q584	Q562-Q584 PolarHBondContact O-N 3.03Å
563	M	67.9	Low	78.5	Confident	11 Å²	11	44.4 Å²	44.4	5%	0.054	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	137.2	-176.7	-66.7	177.8	69.9	0	0	109.5	F261 Y262 A263 G561 G581 I582	F261-M563 HydrophobicContact CB-SD 3.83Å; F261-M563 HydrophobicContact CD1-SD 3.53Å; F261-M563 VanDerWaalsContact CD1-SD 3.53Å; F261-M563 HydrophobicContact CE1-SD 4.48Å; F261-M563 HydrophobicContact CG-SD 4.07Å; Y262-M563 WeakPolarHBondContact O-CE 3.34Å; A263-M563 HydrophobicContact CB-CE 3.72Å; A263-M563 HydrophobicContact CB-CG 4.05Å; A263-M563 HydrophobicContact CB-SD 3.93Å; G561-M563 PolarHBondContact O-N 3.44Å; M563-G581 VanDerWaalsContact CE-O 3.32Å; M563-G581 WeakPolarHBondContact CE-O 3.28Å; M563-I582 CarbonylContact C-O 3.52Å; M563-I582 VanDerWaalsContact CA-O 3.23Å; M563-I582 WeakPolarHBondContact CA-O 3.46Å; M563-I582 VanDerWaalsContact CB-O 3.3Å; M563-I582 WeakPolarHBondContact CB-O 3.25Å
564	S	64.9	Low	77.8	Confident	29 Å²	29	48.8 Å²	48.8	20%	0.203	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.8	165.7	50.1	0	0	0	0	108.1	I582 T583 Q584	S564-I582 CarbonylContact C-O 3.54Å; S564-I582 PolarHBondContact N-O 3.35Å; S564-I582 CarbonylContact O-C 3.52Å; S564-I582 WeakPolarHBondContact O-CA 3.46Å; S564-I582 WeakPolarHBondContact O-CB 3.3Å; S564-I582 PolarHBondContact O-N 3.18Å; S564-T583 PolarHBondContact OG-O 3.35Å; S564-T583 VanDerWaalsContact OG-O 3.11Å; S564-Q584 PolarHBondContact OG-N 3.36Å
565	N	71.4	Confident	77.1	Confident	56 Å²	56	50.2 Å²	50.2	30%	0.299	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	60.6	97.8	178.7	-57.9	-18.2	0	0	0	114.1	M530 N532 L567 G581 I582	M530-N565 HydrophobicContact CE-CB 4.33Å; M530-N565 WeakPolarHBondContact CE-OD1 3.23Å; M530-N565 HydrophobicContact SD-CB 4.42Å; N532-N565 PolarHBondContact OD1-N 2.83Å; N565-L567 PolarHBondContact O-N 2.93Å; N565-G581 WeakPolarHBondContact O-CA 3.46Å; N565-I582 PolarHBondContact O-N 3.21Å
566	V	78.4	Confident	76.7	Confident	3 Å²	3	51 Å²	51	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	119.9	168.7	-174.6	0	0	0	0	109.2	T514 A528 V534 V569 V579	T514-V566 PolarHBondContact OG1-O 2.84Å; T514-V566 VanDerWaalsContact OG1-O 3.11Å; A528-V566 HydrophobicContact CB-CB 3.88Å; A528-V566 HydrophobicContact CB-CG1 3.36Å; V534-V566 HydrophobicContact CG2-CG1 3.95Å; V534-V566 HydrophobicContact CG2-CG2 4.22Å; V566-V569 HydrophobicContact CG1-CG2 4.17Å; V566-V579 HydrophobicContact CG1-CG1 3.34Å; V566-V579 HydrophobicContact CG2-CG1 4.44Å
567	L	76.2	Confident	76.6	Confident	38 Å²	38	48.4 Å²	48.4	20%	0.199	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-53.8	-173	-66.2	173.5	0	0	0	111.8	L271 N565 T580 I582	L271-L567 HydrophobicContact CB-CD1 4.36Å; L271-L567 HydrophobicContact CD2-CD1 3.33Å; L271-L567 HydrophobicContact CG-CD1 3.46Å; L271-L567 VanDerWaalsContact CG-CD1 3.46Å; N565-L567 PolarHBondContact O-N 2.93Å; L567-T580 PolarHBondContact N-O 3.19Å; L567-I582 HydrophobicContact CD1-CG1 4.37Å
568	S	82.8	Confident	76.6	Confident	21 Å²	21	48 Å²	48	15%	0.147	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150.2	-177	81.5	0	0	0	0	112.5	A274 T580	A274-S568 VanDerWaalsContact O-CB 3.29Å; A274-S568 WeakPolarHBondContact O-CB 3.37Å; A274-S568 PolarHBondContact O-OG 3.17Å; S568-T580 PolarHBondContact N-O 3.38Å; S568-T580 PolarHBondContact N-OG1 2.55Å; S568-T580 PolarHBondContact O-N 2.95Å; S568-T580 PolarHBondContact OG-OG1 3.21Å
569	V	85.7	Confident	76.4	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.042	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.8	175.4	-178.3	0	0	0	0	108.6	S515 T517 A526 A528 V534 V566 L577 L578 V579	S515-V569 PolarHBondContact OG-N 3.16Å; S515-V569 VanDerWaalsContact OG-N 3.1Å; T517-V569 WeakPolarHBondContact CB-O 3.38Å; T517-V569 HydrophobicContact CG2-CB 4.19Å; T517-V569 HydrophobicContact CG2-CG1 3.68Å; T517-V569 VanDerWaalsContact CG2-O 3.29Å; T517-V569 WeakPolarHBondContact CG2-O 3.35Å; A526-V569 HydrophobicContact CB-CG1 3.81Å; A528-V569 HydrophobicContact CB-CG2 3.32Å; V534-V569 HydrophobicContact CG1-CG2 4.36Å; V534-V569 HydrophobicContact CG2-CG2 4.27Å; V566-V569 HydrophobicContact CG1-CG2 4.17Å; V569-L577 HydrophobicContact CG1-CD1 3.33Å; V569-L577 HydrophobicContact CG1-CD2 3.91Å; V569-L577 HydrophobicContact CG1-CG 3.7Å; V569-L578 WeakPolarHBondContact CA-O 3.28Å; V569-V579 HydrophobicContact CG1-CG2 4.44Å; V569-V579 HydrophobicContact CG2-CG1 4.36Å; V569-V579 HydrophobicContact CG2-CG2 4.28Å
570	Q	86.2	Confident	76.3	Confident	44 Å²	44	42 Å²	42	21%	0.206	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	124.9	-176.3	-173.8	175.5	-4.3	0	0	110.4	I276 M572 L578	I276-Q570 PolarHBondContact O-NE2 3.37Å; I276-Q570 PolarHBondContact O-OE1 3.29Å; Q570-M572 HydrophobicContact CG-SD 3.92Å; Q570-L578 PolarHBondContact N-O 2.86Å; Q570-L578 PolarHBondContact O-N 2.82Å
571	F	82.9	Confident	76.3	Confident	18 Å²	18	36.8 Å²	36.8	8%	0.079	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	132.2	165.9	-81.9	-79.4	0	0	0	110	T257 T517 F518 S519 L524 A526 L577	T257-F571 HydrophobicContact CG2-CD1 4.46Å; T257-F571 HydrophobicContact CG2-CE1 3.66Å; T257-F571 HydrophobicContact CG2-CZ 4.47Å; T517-F571 HydrophobicContact CG2-CD2 3.47Å; T517-F571 VanDerWaalsContact CG2-CD2 3.47Å; T517-F571 HydrophobicContact CG2-CE2 3.93Å; T517-F571 HydrophobicContact CG2-CG 4.41Å; F518-F571 VanDerWaalsContact O-CD2 3.23Å; F518-F571 WeakPolarHBondContact O-CD2 3.48Å; S519-F571 VanDerWaalsContact N-CD2 3.33Å; L524-F571 HydrophobicContact CB-CZ 4.34Å; A526-F571 HydrophobicContact CB-CD2 4.38Å; A526-F571 HydrophobicContact CB-CE2 3.5Å; A526-F571 HydrophobicContact CB-CZ 3.87Å; F571-L577 HydrophobicContact CD1-CD1 3.84Å; F571-L577 HydrophobicContact CD2-CD1 3.82Å; F571-L577 HydrophobicContact CE1-CB 4.47Å; F571-L577 HydrophobicContact CE1-CD1 3.88Å; F571-L577 HydrophobicContact CE2-CD1 3.85Å; F571-L577 HydrophobicContact CG-CD1 3.81Å; F571-L577 HydrophobicContact CZ-CD1 3.88Å
572	M	78.4	Confident	76.9	Confident	12 Å²	12	36 Å²	36	6%	0.059	21%	0.207	C	C	.	.			trans	-103.1	178.9	170.4	-58.1	-52.8	-71.6	0	0	110.5	S280 Q570 L576 L578	S280-M572 WeakPolarHBondContact OG-CE 3.49Å; Q570-M572 HydrophobicContact CG-SD 3.92Å; M572-L576 HydrophobicContact CB-CB 4.31Å; M572-L576 PolarHBondContact N-O 3.31Å; M572-L578 HydrophobicContact CG-CD1 3.41Å; M572-L578 VanDerWaalsContact CG-CD1 3.41Å; M572-L578 HydrophobicContact CG-CG 3.73Å; M572-L578 HydrophobicContact SD-CD1 4.08Å
573	A	67.3	Low	77.2	Confident	78 Å²	78	28.2 Å²	28.2	65%	0.645	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	-51.7	150.9	168.3	0	0	0	0	0	111.2	N575	A573-N575 VanDerWaalsContact C-N 3.34Å; A573-N575 PolarHBondContact O-N 2.88Å
574	C	65.7	Low	77.1	Confident	130 Å²	130	33.4 Å²	33.4	88%	0.878	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	64.6	28	178.2	-51.1	0	0	0	0	115.5	L576	C574-L576 PolarHBondContact O-N 3.36Å
575	N	70.4	Confident	76.7	Confident	53 Å²	53	37.6 Å²	37.6	28%	0.283	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	56.4	33	179.6	-63	-23.9	0	0	0	113.2	T257 A573	T257-N575 WeakPolarHBondContact CG2-O 3.45Å; A573-N575 VanDerWaalsContact C-N 3.34Å; A573-N575 PolarHBondContact O-N 2.88Å
576	L	78.5	Confident	75.7	Confident	51 Å²	51	41.5 Å²	41.5	27%	0.267	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.9	169.4	-176	73.1	0	0	0	108.6	T258 M572 C574 L578	T258-L576 HydrophobicContact CG2-CD1 3.75Å; M572-L576 HydrophobicContact CB-CB 4.31Å; M572-L576 PolarHBondContact N-O 3.31Å; C574-L576 PolarHBondContact O-N 3.36Å; L576-L578 HydrophobicContact CD2-CD2 3.96Å; L576-L578 HydrophobicContact CD2-CG 4.46Å; L576-L578 HydrophobicContact CG-CD2 4.21Å
577	L	83.2	Confident	73.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	118.1	175.5	-167.7	66	0	0	0	109.5	T257 T258 I259 C260 T517 A526 V534 V536 V569 F571 V579	T257-L577 HydrophobicContact CG2-CB 3.81Å; T258-L577 PolarHBondContact O-N 2.78Å; I259-L577 CarbonylContact C-O 3.59Å; I259-L577 WeakPolarHBondContact CA-O 3.38Å; I259-L577 HydrophobicContact CB-CB 4.45Å; I259-L577 HydrophobicContact CD1-CD2 3.87Å; I259-L577 HydrophobicContact CG1-CB 4.06Å; I259-L577 HydrophobicContact CG1-CD2 4.07Å; I259-L577 HydrophobicContact CG2-CB 4.35Å; I259-L577 HydrophobicContact CG2-CD2 4.36Å; C260-L577 PolarHBondContact N-O 3.22Å; T517-L577 HydrophobicContact CG2-CD1 4.13Å; A526-L577 HydrophobicContact CB-CD1 3.69Å; A526-L577 HydrophobicContact CB-CD2 3.73Å; A526-L577 HydrophobicContact CB-CG 4.37Å; V534-L577 HydrophobicContact CG1-CD2 3.89Å; V536-L577 HydrophobicContact CG2-CD2 4.34Å; V569-L577 HydrophobicContact CG1-CD1 3.33Å; V569-L577 HydrophobicContact CG1-CD2 3.91Å; V569-L577 HydrophobicContact CG1-CG 3.7Å; F571-L577 HydrophobicContact CD1-CD1 3.84Å; F571-L577 HydrophobicContact CD2-CD1 3.82Å; F571-L577 HydrophobicContact CE1-CB 4.47Å; F571-L577 HydrophobicContact CE1-CD1 3.88Å; F571-L577 HydrophobicContact CE2-CD1 3.85Å; F571-L577 HydrophobicContact CG-CD1 3.81Å; F571-L577 HydrophobicContact CZ-CD1 3.88Å; L577-V579 HydrophobicContact CD2-CG2 4.43Å; L577-V579 HydrophobicContact CG-CG2 4.34Å
578	L	83.1	Confident	72	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	131.7	172.5	-62.1	-177.7	0	0	0	109.3	C260 Y262 I276 V569 Q570 M572 L576	C260-L578 HydrophobicContact CB-CD2 3.61Å; C260-L578 WeakPolarHBondContact O-CA 3.36Å; Y262-L578 HydrophobicContact CD2-CD2 4.19Å; Y262-L578 HydrophobicContact CE2-CD1 4.18Å; Y262-L578 HydrophobicContact CE2-CD2 3.65Å; Y262-L578 HydrophobicContact CE2-CG 4.39Å; I276-L578 HydrophobicContact CB-CD1 4.45Å; I276-L578 HydrophobicContact CD1-CB 3.87Å; I276-L578 HydrophobicContact CD1-CD1 3.43Å; I276-L578 VanDerWaalsContact CD1-CD1 3.43Å; I276-L578 HydrophobicContact CD1-CG 4.19Å; I276-L578 HydrophobicContact CG2-CD1 4.07Å; V569-L578 WeakPolarHBondContact CA-O 3.28Å; Q570-L578 PolarHBondContact N-O 2.86Å; Q570-L578 PolarHBondContact O-N 2.82Å; M572-L578 HydrophobicContact CG-CD1 3.41Å; M572-L578 VanDerWaalsContact CG-CD1 3.41Å; M572-L578 HydrophobicContact CG-CG 3.73Å; M572-L578 HydrophobicContact SD-CD1 4.08Å; L576-L578 HydrophobicContact CD2-CD2 3.96Å; L576-L578 HydrophobicContact CD2-CG 4.46Å; L576-L578 HydrophobicContact CG-CD2 4.21Å
579	V	83.5	Confident	69.8	Low	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.2	179.9	-178.9	0	0	0	0	108	I259 C260 F261 Y262 V534 V566 V569 L577	I259-V579 HydrophobicContact CG2-CG2 3.58Å; C260-V579 PolarHBondContact O-N 2.8Å; F261-V579 HydrophobicContact CD1-CB 3.61Å; F261-V579 HydrophobicContact CD1-CG1 3.62Å; F261-V579 HydrophobicContact CD1-CG2 4.24Å; F261-V579 HydrophobicContact CE1-CB 3.85Å; F261-V579 HydrophobicContact CE1-CG1 3.68Å; F261-V579 HydrophobicContact CE1-CG2 4.04Å; F261-V579 HydrophobicContact CG-CB 4.36Å; Y262-V579 PolarHBondContact N-O 3.33Å; V534-V579 HydrophobicContact CG1-CG2 4.27Å; V534-V579 HydrophobicContact CG2-CG1 3.75Å; V534-V579 HydrophobicContact CG2-CG2 3.95Å; V566-V579 HydrophobicContact CG1-CG1 3.34Å; V566-V579 HydrophobicContact CG2-CG1 4.44Å; V569-V579 HydrophobicContact CG1-CG2 4.44Å; V569-V579 HydrophobicContact CG2-CG1 4.36Å; V569-V579 HydrophobicContact CG2-CG2 4.28Å; L577-V579 HydrophobicContact CD2-CG2 4.43Å; L577-V579 HydrophobicContact CG-CG2 4.34Å
580	T	82.3	Confident	69	Low	2 Å²	2	69.9 Å²	69.9	1%	0.012	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	147.3	175.3	74	0	0	0	0	111	Y262 A274 I276 L283 L567 S568	Y262-T580 WeakPolarHBondContact O-CA 3.43Å; A274-T580 HydrophobicContact CB-CG2 4.27Å; A274-T580 WeakPolarHBondContact CB-OG1 3.26Å; I276-T580 HydrophobicContact CD1-CG2 4.25Å; L283-T580 HydrophobicContact CD1-CG2 4.32Å; L567-T580 PolarHBondContact N-O 3.19Å; S568-T580 PolarHBondContact N-O 3.38Å; S568-T580 PolarHBondContact N-OG1 2.55Å; S568-T580 PolarHBondContact O-N 2.95Å; S568-T580 PolarHBondContact OG-OG1 3.21Å
581	G	81.2	Confident	68.1	Low	0 Å²	0	71.2 Å²	71.2	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.2	-173.5	178.9	0	0	0	0	0	112.1	Y262 F264 M563 N565	Y262-G581 PolarHBondContact O-N 3.32Å; F264-G581 PolarHBondContact N-O 3.11Å; M563-G581 VanDerWaalsContact CE-O 3.32Å; M563-G581 WeakPolarHBondContact CE-O 3.28Å; N565-G581 WeakPolarHBondContact O-CA 3.46Å
582	I	79.4	Confident	67.3	Low	14 Å²	14	74.2 Å²	74.2	7%	0.072	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	149.7	-175.1	-54.5	168.8	0	0	0	109.1	L271 M563 S564 N565 L567	L271-I582 HydrophobicContact CB-CD1 4.05Å; L271-I582 HydrophobicContact CB-CG1 4.25Å; L271-I582 HydrophobicContact CD2-CG1 3.93Å; M563-I582 CarbonylContact C-O 3.52Å; M563-I582 VanDerWaalsContact CA-O 3.23Å; M563-I582 WeakPolarHBondContact CA-O 3.46Å; M563-I582 VanDerWaalsContact CB-O 3.3Å; M563-I582 WeakPolarHBondContact CB-O 3.25Å; S564-I582 CarbonylContact C-O 3.54Å; S564-I582 PolarHBondContact N-O 3.35Å; S564-I582 CarbonylContact O-C 3.52Å; S564-I582 WeakPolarHBondContact O-CA 3.46Å; S564-I582 WeakPolarHBondContact O-CB 3.3Å; S564-I582 PolarHBondContact O-N 3.18Å; N565-I582 PolarHBondContact O-N 3.21Å; L567-I582 HydrophobicContact CD1-CG1 4.37Å
583	T	71.9	Confident	66.6	Low	19 Å²	19	77.8 Å²	77.8	12%	0.117	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	142.9	173.5	54	0	0	0	0	111.6	A263 F264 Y265 S564 E585	A263-T583 HydrophobicContact CB-CG2 3.33Å; F264-T583 PolarHBondContact O-N 3.45Å; F264-T583 PolarHBondContact O-OG1 3.37Å; Y265-T583 HydrophobicContact CD1-CG2 3.83Å; Y265-T583 HydrophobicContact CD2-CG2 4.37Å; Y265-T583 HydrophobicContact CE1-CG2 3.62Å; Y265-T583 HydrophobicContact CE2-CG2 4.17Å; Y265-T583 HydrophobicContact CG-CG2 4.21Å; S564-T583 PolarHBondContact OG-O 3.35Å; S564-T583 VanDerWaalsContact OG-O 3.11Å; T583-E585 PolarHBondContact O-N 3.04Å
584	Q	65.2	Low	66.6	Low	121 Å²	121	77.8 Å²	77.8	57%	0.565	39%	0.392	S	S	*	.			trans	-72.5	109.3	170.2	-169.6	169.7	9.8	0	0	109.2	Q562 S564 N586	Q562-Q584 PolarHBondContact O-N 3.03Å; S564-Q584 PolarHBondContact OG-N 3.36Å; Q584-N586 PolarHBondContact O-N 3Å
585	E	57.5	Low	66.6	Low	117 Å²	117	74.3 Å²	74.3	55%	0.547	36%	0.36	S	S	.	.			trans	-70.4	111.4	169.5	-75.2	-178.2	-179.2	0	0	108.5	T583 Q587	T583-E585 PolarHBondContact O-N 3.04Å; E585-Q587 PolarHBondContact O-N 2.9Å
586	N	49.5	Very low	66.4	Low	137 Å²	137	75.9 Å²	75.9	73%	0.733	37%	0.365	S	S	*	.			trans	-66.8	106	164.8	-74.3	-22.8	0	0	0	106.9	Q584 E588	Q584-N586 PolarHBondContact O-N 3Å; N586-E588 VanDerWaalsContact C-N 3.31Å; N586-E588 PolarHBondContact O-N 3.07Å
587	Q	39.9	Very low	65.5	Low	163 Å²	163	77.8 Å²	77.8	76%	0.762	37%	0.373	S	S	*	.			trans	-63.9	96.9	165.6	-71.2	-177.8	-7.9	0	0	107.5	E585 H589	E585-Q587 PolarHBondContact O-N 2.9Å; Q587-H589 PolarHBondContact O-N 3.25Å
588	E	37.8	Very low	64	Low	190 Å²	190	84.3 Å²	84.3	89%	0.888	40%	0.404	S	S	*	.			trans	-67.3	112.6	162.5	-70.5	-171.7	164.2	0	0	107	N586	N586-E588 VanDerWaalsContact C-N 3.31Å; N586-E588 PolarHBondContact O-N 3.07Å
589	H	36.3	Very low	62.2	Low	242 Å²	242	91.4 Å²	91.4	100%	1.12	44%	0.438	S	S	*	.			trans	-75.7	0	177	-84.1	-40.3	0	0	0	113	Q587	Q587-H589 PolarHBondContact O-N 3.25Å

Retrieved 589 of 589 residues in 4066.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).