A0A087YKC8_POEFO Loading...

tRNA N(3)-cytidine methyltransferase

S-adenosyl-L-methionine-dependent methyltransferase that mediates N(3)-methylcytidine modification of residue 32 of the tRNA anticodon loop of tRNA(Ser), including tRNA(Ser)(UGA) and tRNA(Ser)(GCU). Interaction with SARS1/SerRS is required for N(3)-methylcytidine methylation.

AlphaFold DB , UniProt , Accession A0A087YKC8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 315 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.4	Very low	32.8	Very low	250 Å²	250	151.2 Å²	151.2	100%	1.232	84%	0.838	S	S	*	*				0	129.1	0	-76.4	-175.6	-141.9	0	0	108
2	S	30.3	Very low	32.8	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	83%	0.828	S	S	*	*			trans	-67.3	147.9	-177.1	-166	0	0	0	0	112
3	L	29.4	Very low	32.8	Very low	148 Å²	148	149.6 Å²	149.6	78%	0.775	82%	0.824	S	S	*	*				177.6	110.3	111.3	-90.9	160.7	0	0	0	112.3
4	T	31.2	Very low	32.9	Very low	112 Å²	112	147.2 Å²	147.2	69%	0.687	82%	0.816	S	S	*	*			trans	48.2	118.3	134.9	53.2	0	0	0	0	121.9
5	A	32.8	Very low	32.8	Very low	104 Å²	104	149.1 Å²	149.1	86%	0.86	82%	0.816	S	S	*	*			trans	-138.2	121	130.3	0	0	0	0	0	108.2
6	V	33.5	Very low	32.9	Very low	130 Å²	130	146.3 Å²	146.3	79%	0.788	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-96.4	118.7	178	172.7	0	0	0	0	107.4
7	E	32.6	Very low	32.8	Very low	190 Å²	190	144.9 Å²	144.9	89%	0.888	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-68.5	129.3	169.3	-77.7	176.6	145.7	0	0	109.9
8	K	33.3	Very low	32.6	Very low	205 Å²	205	147.3 Å²	147.3	89%	0.891	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-86	128.3	174.4	-83.4	-179.8	174.2	178.6	0	109.8
9	S	31.6	Very low	32.5	Very low	107 Å²	107	147.9 Å²	147.9	75%	0.748	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-65.1	130.7	169.8	52.2	0	0	0	0	112.7
10	E	32.8	Very low	32.4	Very low	197 Å²	197	149.4 Å²	149.4	92%	0.921	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80	120.6	156.5	-87.9	178.2	151.1	0	0	109.3
11	V	34.5	Very low	32.4	Very low	116 Å²	116	147.7 Å²	147.7	70%	0.703	81%	0.809	S	S	*	*			trans	-128.2	111.7	157.3	-179.9	0	0	0	0	105.9	L13	V11-L13 PolarHBondContact O-N 3.14Å
12	D	32.9	Very low	32.4	Very low	135 Å²	135	144.9 Å²	144.9	72%	0.722	79%	0.79	S	S	*	*			trans	-66.6	119	176.3	-169.5	11.8	0	0	0	109.7
13	L	32.5	Very low	32.7	Very low	147 Å²	147	146.7 Å²	146.7	77%	0.77	79%	0.791	S	S	*	*			trans	-130.1	60	177.5	-91.3	164.1	0	0	0	109	V11 Q15	V11-L13 PolarHBondContact O-N 3.14Å; L13-Q15 VanDerWaalsContact C-N 3.33Å; L13-Q15 PolarHBondContact O-N 3.07Å
14	T	34.3	Very low	33.5	Very low	116 Å²	116	147.9 Å²	147.9	71%	0.712	80%	0.798	S	S	*	*			trans	-83.9	78.5	159.9	57.4	0	0	0	0	110.2
15	Q	31.7	Very low	35	Very low	175 Å²	175	147.4 Å²	147.4	82%	0.818	80%	0.796	S	S	*	*			trans	-94.5	87.3	150.5	-92.6	-175.1	-2	0	0	107.9	L13 V17	L13-Q15 VanDerWaalsContact C-N 3.33Å; L13-Q15 PolarHBondContact O-N 3.07Å; Q15-V17 PolarHBondContact O-N 3.08Å
16	S	33.9	Very low	36.6	Very low	104 Å²	104	144.4 Å²	144.4	73%	0.727	76%	0.763	S	S	*	*			trans	-59.5	100.8	160.6	43.5	0	0	0	0	108.6	K18	S16-K18 VanDerWaalsContact C-N 3.33Å; S16-K18 PolarHBondContact O-N 3.25Å
17	V	31.4	Very low	38.4	Very low	123 Å²	123	140.7 Å²	140.7	75%	0.745	74%	0.742	S	S	*	*			trans	-62.8	100.4	161.9	-179.3	0	0	0	0	105.9	Q15 L19	Q15-V17 PolarHBondContact O-N 3.08Å; V17-L19 VanDerWaalsContact C-N 3.34Å; V17-L19 PolarHBondContact O-N 3.29Å
18	K	28.9	Very low	40.2	Very low	188 Å²	188	134.6 Å²	134.6	82%	0.817	72%	0.72	S	S	*	*			trans	-59.9	103.4	161.7	-85.2	179	173.5	178.5	0	106.1	S16 E20	S16-K18 VanDerWaalsContact C-N 3.33Å; S16-K18 PolarHBondContact O-N 3.25Å; K18-E20 VanDerWaalsContact C-N 3.29Å; K18-E20 PolarHBondContact O-N 3.46Å
19	L	32	Very low	42	Very low	160 Å²	160	126.9 Å²	126.9	84%	0.838	70%	0.698	S	S	*	*			trans	-60.3	104.9	153.4	-102.1	89	0	0	0	105.4	V17 S21	V17-L19 VanDerWaalsContact C-N 3.34Å; V17-L19 PolarHBondContact O-N 3.29Å; L19-S21 PolarHBondContact O-N 3.18Å; L19-S21 VanDerWaalsContact O-N 3.08Å
20	E	29.9	Very low	44.3	Very low	177 Å²	177	127.3 Å²	127.3	83%	0.827	69%	0.688	S	S	*	*			trans	-57.5	113.1	164.2	-70	179.8	154.7	0	0	107	K18 K22	K18-E20 VanDerWaalsContact C-N 3.29Å; K18-E20 PolarHBondContact O-N 3.46Å; E20-K22 PolarHBondContact O-N 3.23Å
21	S	33.4	Very low	46.8	Very low	114 Å²	114	121.8 Å²	121.8	80%	0.797	67%	0.668	S	S	*	*			trans	-59.2	103.4	164.3	53.5	0	0	0	0	106.8	L19 D23	L19-S21 PolarHBondContact O-N 3.18Å; L19-S21 VanDerWaalsContact O-N 3.08Å; S21-D23 PolarHBondContact O-N 2.85Å; S21-D23 VanDerWaalsContact O-N 3.14Å
22	K	36.8	Very low	49.4	Very low	191 Å²	191	118 Å²	118	83%	0.83	65%	0.645	S	S	*	*			trans	-56.1	121.6	163	-79.8	-176.6	175	179.7	0	106.2	E20 D24	E20-K22 PolarHBondContact O-N 3.23Å; K22-D24 PolarHBondContact O-N 3.09Å
23	D	36.7	Very low	51.9	Low	141 Å²	141	115 Å²	115	75%	0.754	64%	0.635	S	S	*	*			trans	-50.2	113.2	174.2	-129.3	-22	0	0	0	108.2	S21 T25	S21-D23 PolarHBondContact O-N 2.85Å; S21-D23 VanDerWaalsContact O-N 3.14Å; D23-T25 PolarHBondContact O-N 3.07Å
24	D	47.4	Very low	54.6	Low	173 Å²	173	112.1 Å²	112.1	93%	0.925	62%	0.623	S	S	*	*			trans	-72.8	40.8	177.6	-85.3	-34.8	0	0	0	110.8	K22	K22-D24 PolarHBondContact O-N 3.09Å
25	T	62	Low	57.2	Low	102 Å²	102	108 Å²	108	63%	0.626	60%	0.601	S	S	*	*			trans	-80.5	125.1	178.3	15.7	0	0	0	0	109.7	D23 P27	D23-T25 PolarHBondContact O-N 3.07Å; T25-P27 WeakPolarHBondContact O-CD 3.42Å
26	F	66.8	Low	60	Low	42 Å²	42	101.1 Å²	101.1	18%	0.184	57%	0.568	C	S	.	*			trans	-60.6	123.2	176.2	-174.8	-97	0	0	0	109.6	C28 L269 R270 E271 P282 V284	F26-C28 VanDerWaalsContact C-N 3.31Å; F26-C28 PolarHBondContact O-N 3.48Å; F26-L269 HydrophobicContact CE1-CB 3.74Å; F26-L269 HydrophobicContact CE2-CD2 4.31Å; F26-L269 HydrophobicContact CZ-CB 3.73Å; F26-L269 HydrophobicContact CZ-CD1 4.46Å; F26-L269 HydrophobicContact CZ-CD2 3.81Å; F26-L269 HydrophobicContact CZ-CG 4.19Å; F26-R270 WeakPolarHBondContact CE1-O 3.42Å; F26-E271 HydrophobicContact CD1-CG 3.88Å; F26-E271 HydrophobicContact CE1-CG 4.45Å; F26-P282 HydrophobicContact CD1-CB 3.93Å; F26-P282 HydrophobicContact CD2-CB 3.46Å; F26-P282 VanDerWaalsContact CD2-CB 3.46Å; F26-P282 HydrophobicContact CD2-CG 4.49Å; F26-P282 HydrophobicContact CE1-CB 3.8Å; F26-P282 HydrophobicContact CE2-CB 3.31Å; F26-P282 HydrophobicContact CE2-CG 4.49Å; F26-P282 HydrophobicContact CG-CB 3.76Å; F26-P282 HydrophobicContact CZ-CB 3.47Å; F26-P282 VanDerWaalsContact CZ-CB 3.47Å; F26-V284 HydrophobicContact CZ-CG2 4.28Å
27	P	71.8	Confident	62.7	Low	52 Å²	52	104.4 Å²	104.4	34%	0.338	57%	0.571	S	S	.	*			trans	-76.1	82.1	-172.9	20.6	-21.8	0	0	0	111.7	T25 Q30 L269	T25-P27 WeakPolarHBondContact O-CD 3.42Å; P27-Q30 HydrophobicContact CB-CB 4.39Å; P27-Q30 HydrophobicContact CB-CG 4.19Å; P27-L269 HydrophobicContact CG-CD1 3.72Å; P27-L269 VanDerWaalsContact O-CB 3.31Å; P27-L269 WeakPolarHBondContact O-CB 3.5Å
28	C	70.3	Confident	65.5	Low	62 Å²	62	99.9 Å²	99.9	42%	0.419	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	131.4	-179.4	-170.7	0	0	0	0	111.7	F26 E271	F26-C28 VanDerWaalsContact C-N 3.31Å; F26-C28 PolarHBondContact O-N 3.48Å; C28-E271 HydrophobicContact CB-CG 3.89Å; C28-E271 WeakPolarHBondContact CB-OE2 3.48Å; C28-E271 PolarHBondContact SG-N 2.89Å; C28-E271 VanDerWaalsContact SG-N 3.35Å
29	G	69.7	Low	68.5	Low	42 Å²	42	93.6 Å²	93.6	43%	0.433	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	6.5	177.8	0	0	0	0	0	115	L269	G29-L269 WeakPolarHBondContact CA-O 3.35Å; G29-L269 PolarHBondContact N-O 3.33Å
30	Q	79.9	Confident	71.3	Confident	117 Å²	117	92 Å²	92	55%	0.547	51%	0.51	S	S	.	.			trans	-96.4	150.3	176.6	-63.5	-172.6	-8.7	0	0	111.7	P27 L269	P27-Q30 HydrophobicContact CB-CB 4.39Å; P27-Q30 HydrophobicContact CB-CG 4.19Å; Q30-L269 PolarHBondContact O-N 2.99Å
31	T	85.1	Confident	74.3	Confident	81 Å²	81	88.9 Å²	88.9	50%	0.497	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	147.8	163	69.3	0	0	0	0	110.2	E266 Y267 V268	T31-E266 WeakPolarHBondContact CB-OE2 3.18Å; T31-E266 PolarHBondContact OG1-OE2 2.89Å; T31-Y267 CarbonylContact C-O 3.53Å; T31-Y267 WeakPolarHBondContact CA-O 3.45Å; T31-V268 HydrophobicContact CG2-CG2 4.13Å
32	T	89.6	Confident	77.1	Confident	36 Å²	36	85 Å²	85	22%	0.221	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	147.1	179.3	176.4	0	0	0	0	111.6	T34 Y267 L269	T32-T34 VanDerWaalsContact CG2-O 3.23Å; T32-T34 WeakPolarHBondContact CG2-O 3.4Å; T32-T34 PolarHBondContact OG1-N 3.11Å; T32-T34 PolarHBondContact OG1-O 2.75Å; T32-Y267 PolarHBondContact N-O 2.77Å; T32-Y267 PolarHBondContact O-N 2.86Å; T32-L269 HydrophobicContact CG2-CD1 3.91Å; T32-L269 HydrophobicContact CG2-CD2 4.43Å; T32-L269 HydrophobicContact CG2-CG 4.11Å
33	S	85.9	Confident	79.7	Confident	73 Å²	73	79.6 Å²	79.6	51%	0.51	45%	0.445	S	S	.	.	S	Bend	trans	-82.6	-13.2	177	65.8	0	0	0	0	113.1	K248	S33-K248 WeakPolarHBondContact O-CD 3.49Å; S33-K248 VanDerWaalsContact O-CE 3.29Å; S33-K248 WeakPolarHBondContact O-CE 3.33Å; S33-K248 PolarHBondContact O-NZ 2.68Å
34	T	88.4	Confident	82.2	Confident	85 Å²	85	76.9 Å²	76.9	52%	0.521	43%	0.43	S	S	.	.	S	Bend	trans	-120.3	151.5	-178.9	56.8	0	0	0	0	111.4	T32 Y267	T32-T34 VanDerWaalsContact CG2-O 3.23Å; T32-T34 WeakPolarHBondContact CG2-O 3.4Å; T32-T34 PolarHBondContact OG1-N 3.11Å; T32-T34 PolarHBondContact OG1-O 2.75Å; T34-Y267 WeakPolarHBondContact O-CD2 3.34Å
35	A	89.5	Confident	84.1	Confident	29 Å²	29	74.9 Å²	74.9	24%	0.24	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-62.9	146.4	173.3	0	0	0	0	0	109.7	Y217 Y267	A35-Y217 HydrophobicContact CB-CD2 3.9Å; A35-Y217 HydrophobicContact CB-CE2 3.72Å; A35-Y267 HydrophobicContact CB-CE2 3.95Å
36	R	91.3	Very high	85.3	Confident	32 Å²	32	71.5 Å²	71.5	12%	0.121	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-60.7	154.8	178.6	71.9	173.5	-172	94.3	-11.9	111.4	E42 Y217 V284	R36-E42 IonicContact CZ-OE1 3.43Å; R36-E42 IonicContact CZ-OE2 2.75Å; R36-E42 IonicContact NH1-OE1 2.77Å; R36-E42 PolarHBondContact NH1-OE1 3.2Å; R36-E42 IonicContact NH1-OE2 3.2Å; R36-E42 PolarHBondContact NH1-OE2 3.16Å; R36-E42 IonicContact NH2-OE1 3.99Å; R36-E42 PolarHBondContact NH2-OE1 3.04Å; R36-E42 IonicContact NH2-OE2 3.35Å; R36-Y217 HydrophobicContact CG-CD2 4.28Å; R36-Y217 VanDerWaalsContact CZ-O 3.3Å; R36-Y217 PolarHBondContact NE-O 3.06Å; R36-Y217 PolarHBondContact NH2-O 3.39Å; R36-Y217 WeakPolarHBondContact O-CD2 3.42Å; R36-V284 HydrophobicContact CG-CG2 4.37Å
37	H	89.1	Confident	86.1	Confident	172 Å²	172	72.2 Å²	72.2	80%	0.796	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-69.7	143.1	168.3	-63	-72.6	0	0	0	110.6
38	L	91	Very high	86.6	Confident	29 Å²	29	74 Å²	74	15%	0.152	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-99.5	145	173.7	-70	-178.2	0	0	0	109.3	E42 L43 L46 Y217 L222	L38-E42 WeakPolarHBondContact CA-OE2 3.38Å; L38-E42 HydrophobicContact CB-CB 4.1Å; L38-E42 HydrophobicContact CD2-CB 3.96Å; L38-E42 WeakPolarHBondContact CD2-OE2 3.25Å; L38-E42 HydrophobicContact CG-CB 4.47Å; L38-L43 HydrophobicContact CB-CD2 4.05Å; L38-L43 HydrophobicContact CB-CG 3.84Å; L38-L43 HydrophobicContact CD1-CD2 3.7Å; L38-L43 HydrophobicContact CD1-CG 4.22Å; L38-L43 HydrophobicContact CG-CD2 4.5Å; L38-L46 HydrophobicContact CD1-CD1 3.57Å; L38-Y217 HydrophobicContact CD1-CD1 3.69Å; L38-Y217 HydrophobicContact CD1-CD2 4.36Å; L38-Y217 HydrophobicContact CD1-CE1 3.72Å; L38-Y217 HydrophobicContact CD1-CE2 4.38Å; L38-Y217 HydrophobicContact CD1-CG 4.03Å; L38-Y217 HydrophobicContact CD2-CD1 4.04Å; L38-Y217 HydrophobicContact CD2-CD2 4.17Å; L38-Y217 HydrophobicContact CD2-CG 3.67Å; L38-Y217 HydrophobicContact CG-CD1 4.11Å; L38-Y217 HydrophobicContact CG-CD2 4.03Å; L38-Y217 HydrophobicContact CG-CE1 4.43Å; L38-Y217 HydrophobicContact CG-CE2 4.35Å; L38-Y217 HydrophobicContact CG-CG 3.91Å; L38-L222 HydrophobicContact CD2-CD1 4.34Å; L38-L222 HydrophobicContact CD2-CD2 4.46Å
39	S	91.5	Very high	86.9	Confident	55 Å²	55	71.8 Å²	71.8	39%	0.385	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-69.7	162.7	166	80.7	0	0	0	0	110.7	E41 E42 L43	S39-E41 PolarHBondContact O-N 2.89Å; S39-E41 PolarHBondContact OG-N 3.41Å; S39-E42 PolarHBondContact N-OE2 2.99Å; S39-E42 PolarHBondContact O-N 3.27Å; S39-E42 VanDerWaalsContact O-N 3.12Å; S39-E42 WeakPolarHBondContact OG-CG 3.35Å; S39-E42 PolarHBondContact OG-N 3.3Å; S39-L43 PolarHBondContact O-N 2.88Å
40	Q	92	Very high	87.2	Confident	126 Å²	126	79.3 Å²	79.3	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-58.5	-37.9	175.4	-170.4	60.6	52.2	0	0	111.8	E42 L43 D44	Q40-E42 PolarHBondContact O-N 3.14Å; Q40-L43 PolarHBondContact O-N 3.37Å; Q40-D44 PolarHBondContact NE2-OD1 2.76Å; Q40-D44 WeakPolarHBondContact O-CB 3.48Å; Q40-D44 PolarHBondContact O-N 2.63Å
41	E	91.5	Very high	87.6	Confident	112 Å²	112	76.8 Å²	76.8	52%	0.523	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-41.7	175.8	-172.2	-165.5	151.6	0	0	111.9	S39 D44 R45	S39-E41 PolarHBondContact O-N 2.89Å; S39-E41 PolarHBondContact OG-N 3.41Å; E41-D44 PolarHBondContact O-N 3.16Å; E41-R45 WeakPolarHBondContact O-CB 3.4Å; E41-R45 WeakPolarHBondContact O-CG 3.43Å; E41-R45 PolarHBondContact O-N 3.46Å; E41-R45 IonicContact OE1-CZ 3Å; E41-R45 IonicContact OE1-NE 3.34Å; E41-R45 IonicContact OE1-NH1 3.75Å; E41-R45 PolarHBondContact OE1-NH1 3.07Å; E41-R45 IonicContact OE1-NH2 2.69Å; E41-R45 PolarHBondContact OE1-NH2 3.17Å
42	E	92.6	Very high	88.1	Confident	32 Å²	32	77.4 Å²	77.4	15%	0.15	41%	0.406	C	S	.	.	H	α-helix	trans	-67.6	-38.3	178.2	-65.6	178.3	129.2	0	0	111.7	R36 L38 S39 Q40 L46 L222	R36-E42 IonicContact CZ-OE1 3.43Å; R36-E42 IonicContact CZ-OE2 2.75Å; R36-E42 IonicContact NH1-OE1 2.77Å; R36-E42 PolarHBondContact NH1-OE1 3.2Å; R36-E42 IonicContact NH1-OE2 3.2Å; R36-E42 PolarHBondContact NH1-OE2 3.16Å; R36-E42 IonicContact NH2-OE1 3.99Å; R36-E42 PolarHBondContact NH2-OE1 3.04Å; R36-E42 IonicContact NH2-OE2 3.35Å; L38-E42 WeakPolarHBondContact CA-OE2 3.38Å; L38-E42 HydrophobicContact CB-CB 4.1Å; L38-E42 HydrophobicContact CD2-CB 3.96Å; L38-E42 WeakPolarHBondContact CD2-OE2 3.25Å; L38-E42 HydrophobicContact CG-CB 4.47Å; S39-E42 PolarHBondContact N-OE2 2.99Å; S39-E42 PolarHBondContact O-N 3.27Å; S39-E42 VanDerWaalsContact O-N 3.12Å; S39-E42 WeakPolarHBondContact OG-CG 3.35Å; S39-E42 PolarHBondContact OG-N 3.3Å; Q40-E42 PolarHBondContact O-N 3.14Å; E42-L46 WeakPolarHBondContact O-CG 3.4Å; E42-L46 PolarHBondContact O-N 3.07Å; E42-L222 HydrophobicContact CB-CD1 4.11Å; E42-L222 HydrophobicContact CB-CD2 4.33Å; E42-L222 HydrophobicContact CG-CD1 3.75Å; E42-L222 WeakPolarHBondContact OE1-CD1 3.39Å
43	L	91.1	Very high	88.4	Confident	78 Å²	78	76.1 Å²	76.1	41%	0.408	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-47.5	173.3	-72.9	168.8	0	0	0	111.7	L38 S39 Q40 R45 L46 S47	L38-L43 HydrophobicContact CB-CD2 4.05Å; L38-L43 HydrophobicContact CB-CG 3.84Å; L38-L43 HydrophobicContact CD1-CD2 3.7Å; L38-L43 HydrophobicContact CD1-CG 4.22Å; L38-L43 HydrophobicContact CG-CD2 4.5Å; S39-L43 PolarHBondContact O-N 2.88Å; Q40-L43 PolarHBondContact O-N 3.37Å; L43-R45 VanDerWaalsContact C-N 3.31Å; L43-R45 PolarHBondContact O-N 3.34Å; L43-L46 PolarHBondContact O-N 3.46Å; L43-S47 WeakPolarHBondContact O-CB 3.5Å; L43-S47 PolarHBondContact O-N 2.98Å; L43-S47 PolarHBondContact O-OG 3.2Å
44	D	89.5	Confident	88.9	Confident	85 Å²	85	76.1 Å²	76.1	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-42.6	179.3	-67.9	-13.1	0	0	0	110.5	Q40 E41 S47 S48	Q40-D44 PolarHBondContact NE2-OD1 2.76Å; Q40-D44 WeakPolarHBondContact O-CB 3.48Å; Q40-D44 PolarHBondContact O-N 2.63Å; E41-D44 PolarHBondContact O-N 3.16Å; D44-S47 PolarHBondContact O-N 2.66Å; D44-S47 PolarHBondContact O-OG 2.7Å; D44-S48 WeakPolarHBondContact O-CB 3.34Å; D44-S48 PolarHBondContact O-N 2.99Å
45	R	88.3	Confident	89.3	Confident	131 Å²	131	77.9 Å²	77.9	49%	0.494	40%	0.404	S	S	.	.	H	α-helix	trans	-57.6	-53.6	173.6	-83.7	-179.1	157.4	142.7	6.5	112.6	E41 L43 S47 S48 E49	E41-R45 WeakPolarHBondContact O-CB 3.4Å; E41-R45 WeakPolarHBondContact O-CG 3.43Å; E41-R45 PolarHBondContact O-N 3.46Å; E41-R45 IonicContact OE1-CZ 3Å; E41-R45 IonicContact OE1-NE 3.34Å; E41-R45 IonicContact OE1-NH1 3.75Å; E41-R45 PolarHBondContact OE1-NH1 3.07Å; E41-R45 IonicContact OE1-NH2 2.69Å; E41-R45 PolarHBondContact OE1-NH2 3.17Å; L43-R45 VanDerWaalsContact C-N 3.31Å; L43-R45 PolarHBondContact O-N 3.34Å; R45-S47 VanDerWaalsContact C-N 3.29Å; R45-S47 PolarHBondContact O-N 2.9Å; R45-S48 PolarHBondContact O-N 3.35Å; R45-S48 PolarHBondContact O-OG 3.29Å; R45-E49 PolarHBondContact O-N 3.5Å
46	L	87.1	Confident	89.7	Confident	31 Å²	31	84.2 Å²	84.2	16%	0.162	43%	0.426	C	S	.	.	H	α-helix	trans	-61.3	-39.6	179.6	-76.6	178.9	0	0	0	112.1	L38 E42 L43 S48 E49 Y217 M221 L222	L38-L46 HydrophobicContact CD1-CD1 3.57Å; E42-L46 WeakPolarHBondContact O-CG 3.4Å; E42-L46 PolarHBondContact O-N 3.07Å; L43-L46 PolarHBondContact O-N 3.46Å; L46-S48 VanDerWaalsContact C-N 3.3Å; L46-S48 PolarHBondContact O-N 3.06Å; L46-E49 PolarHBondContact O-N 2.91Å; L46-Y217 HydrophobicContact CD1-CD1 4.02Å; L46-Y217 HydrophobicContact CD1-CE1 4.07Å; L46-M221 HydrophobicContact CD2-CE 4.05Å; L46-M221 HydrophobicContact CD2-CG 4.4Å; L46-L222 HydrophobicContact CD1-CD2 3.66Å; L46-L222 HydrophobicContact CD2-CD2 3.76Å; L46-L222 HydrophobicContact CG-CD2 3.53Å
47	S	84.3	Confident	89.9	Confident	57 Å²	57	87 Å²	87	40%	0.399	44%	0.439	S	S	.	.	H	α-helix	trans	-72.1	-24.3	-179	77.7	0	0	0	0	113.6	L43 D44 R45 E49 R50	L43-S47 WeakPolarHBondContact O-CB 3.5Å; L43-S47 PolarHBondContact O-N 2.98Å; L43-S47 PolarHBondContact O-OG 3.2Å; D44-S47 PolarHBondContact O-N 2.66Å; D44-S47 PolarHBondContact O-OG 2.7Å; R45-S47 VanDerWaalsContact C-N 3.29Å; R45-S47 PolarHBondContact O-N 2.9Å; S47-E49 VanDerWaalsContact C-N 3.33Å; S47-R50 VanDerWaalsContact O-CG 3.28Å; S47-R50 WeakPolarHBondContact O-CG 3.26Å; S47-R50 PolarHBondContact O-NE 3.48Å
48	S	82	Confident	90.3	Very high	89 Å²	89	80.9 Å²	80.9	62%	0.622	41%	0.411	S	S	*	.	H	α-helix	trans	-73.5	-23.4	175.3	76.8	0	0	0	0	112.8	D44 R45 L46 R50	D44-S48 WeakPolarHBondContact O-CB 3.34Å; D44-S48 PolarHBondContact O-N 2.99Å; R45-S48 PolarHBondContact O-N 3.35Å; R45-S48 PolarHBondContact O-OG 3.29Å; L46-S48 VanDerWaalsContact C-N 3.3Å; L46-S48 PolarHBondContact O-N 3.06Å; S48-R50 PolarHBondContact O-N 3.33Å; S48-R50 VanDerWaalsContact O-N 3.11Å
49	E	76.8	Confident	90.7	Very high	16 Å²	16	86.1 Å²	86.1	8%	0.075	44%	0.436	C	S	.	.			trans	-85.8	76.9	178.1	-72.4	-159.9	141.5	0	0	112.7	R45 L46 S47 K225 S226 K229 Y235	R45-E49 PolarHBondContact O-N 3.5Å; L46-E49 PolarHBondContact O-N 2.91Å; S47-E49 VanDerWaalsContact C-N 3.33Å; E49-K225 WeakPolarHBondContact OE1-CA 3.36Å; E49-K225 PolarHBondContact OE1-N 3.34Å; E49-S226 PolarHBondContact OE1-N 3.24Å; E49-K229 VanDerWaalsContact O-CD 3.29Å; E49-K229 WeakPolarHBondContact O-CD 3.45Å; E49-K229 PolarHBondContact O-NZ 3.37Å; E49-Y235 WeakPolarHBondContact OE2-CE1 3.06Å
50	R	75.2	Confident	91	Very high	200 Å²	200	88.6 Å²	88.6	76%	0.755	44%	0.44	S	S	*	.			trans	-100.3	-27.7	179.7	-58.2	-172.1	-176.9	-166.4	-0.4	114.4	S47 S48 L52	S47-R50 VanDerWaalsContact O-CG 3.28Å; S47-R50 WeakPolarHBondContact O-CG 3.26Å; S47-R50 PolarHBondContact O-NE 3.48Å; S48-R50 PolarHBondContact O-N 3.33Å; S48-R50 VanDerWaalsContact O-N 3.11Å; R50-L52 PolarHBondContact O-N 3.09Å
51	S	88.9	Confident	91.2	Very high	63 Å²	63	83.4 Å²	83.4	44%	0.441	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-79.1	117.9	-173.4	59.8	0	0	0	0	111.4
52	L	95.1	Very high	91.5	Very high	95 Å²	95	80.4 Å²	80.4	50%	0.497	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68.1	150.8	168.7	-59.5	-177.8	0	0	0	110.7	R50 K229	R50-L52 PolarHBondContact O-N 3.09Å; L52-K229 CarbonylContact C-O 3.51Å; L52-K229 WeakPolarHBondContact CA-O 3.1Å; L52-K229 HydrophobicContact CD2-CB 4.48Å; L52-K229 HydrophobicContact CD2-CD 4.36Å; L52-K229 HydrophobicContact CD2-CG 3.97Å
53	V	95.6	Very high	91.8	Very high	8 Å²	8	88.1 Å²	88.1	5%	0.048	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-58.3	142.4	163.9	170.7	0	0	0	0	109.3	K57 Q58 G227 K229 L230 V236	V53-K57 HydrophobicContact CG1-CB 3.52Å; V53-K57 HydrophobicContact CG1-CD 3.53Å; V53-K57 HydrophobicContact CG1-CG 3.47Å; V53-K57 VanDerWaalsContact CG1-CG 3.47Å; V53-Q58 HydrophobicContact CB-CG 4.08Å; V53-Q58 HydrophobicContact CG1-CG 4Å; V53-Q58 PolarHBondContact O-NE2 3.36Å; V53-G227 WeakPolarHBondContact CG2-O 3.43Å; V53-K229 WeakPolarHBondContact CG2-O 3.39Å; V53-K229 PolarHBondContact N-O 3.06Å; V53-L230 HydrophobicContact CB-CD2 4.02Å; V53-L230 HydrophobicContact CG1-CD2 4.33Å; V53-L230 HydrophobicContact CG2-CD2 4.11Å; V53-V236 HydrophobicContact CG2-CG1 4.44Å
54	S	96.3	Very high	92.1	Very high	74 Å²	74	86.8 Å²	86.8	52%	0.517	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-57.1	144.7	179.5	63.6	0	0	0	0	112.6	F56 K57 Q58	S54-F56 PolarHBondContact O-N 3.38Å; S54-K57 WeakPolarHBondContact O-CA 3.44Å; S54-K57 PolarHBondContact O-N 2.93Å; S54-Q58 PolarHBondContact O-N 3.23Å
55	D	96.7	Very high	92.5	Very high	122 Å²	122	83 Å²	83	65%	0.652	41%	0.408	S	S	*	.	H	α-helix	trans	-53	-42.3	-177.5	-60.3	-16.8	0	0	0	112.4	K57 Q58 M59	D55-K57 VanDerWaalsContact C-N 3.3Å; D55-K57 PolarHBondContact O-N 3.33Å; D55-Q58 PolarHBondContact O-N 3.36Å; D55-Q58 VanDerWaalsContact O-N 3.16Å; D55-M59 WeakPolarHBondContact O-CB 2.83Å; D55-M59 VanDerWaalsContact O-CG 3.32Å; D55-M59 WeakPolarHBondContact O-CG 3.41Å; D55-M59 PolarHBondContact O-N 3.01Å
56	F	97.6	Very high	92.9	Very high	161 Å²	161	80.4 Å²	80.4	71%	0.706	40%	0.401	S	S	*	.	H	α-helix	trans	-55.3	-44.8	175.1	176.1	-97.1	0	0	0	112.4	S54 K60	S54-F56 PolarHBondContact O-N 3.38Å; F56-K60 WeakPolarHBondContact O-CB 3.26Å; F56-K60 PolarHBondContact O-N 3.49Å
57	K	96.8	Very high	93.4	Very high	92 Å²	92	84.2 Å²	84.2	40%	0.4	42%	0.416	S	S	.	.	H	α-helix	trans	-72.6	-36.6	179	179.4	173.3	164.8	-163.9	0	111	V53 S54 D55 K60 L61	V53-K57 HydrophobicContact CG1-CB 3.52Å; V53-K57 HydrophobicContact CG1-CD 3.53Å; V53-K57 HydrophobicContact CG1-CG 3.47Å; V53-K57 VanDerWaalsContact CG1-CG 3.47Å; S54-K57 WeakPolarHBondContact O-CA 3.44Å; S54-K57 PolarHBondContact O-N 2.93Å; D55-K57 VanDerWaalsContact C-N 3.3Å; D55-K57 PolarHBondContact O-N 3.33Å; K57-K60 PolarHBondContact O-N 2.97Å; K57-L61 HydrophobicContact CG-CD1 4.1Å; K57-L61 HydrophobicContact CG-CG 4.45Å; K57-L61 WeakPolarHBondContact O-CB 3.26Å; K57-L61 VanDerWaalsContact O-CG 3.23Å; K57-L61 WeakPolarHBondContact O-CG 3.5Å; K57-L61 PolarHBondContact O-N 2.9Å
58	Q	97.8	Very high	94.1	Very high	43 Å²	43	82.2 Å²	82.2	20%	0.201	40%	0.401	C	S	.	.	H	α-helix	trans	-61.5	-49.4	173.7	-61.3	-164.8	46.5	0	0	111.8	V53 S54 D55 K60 L61 E62 L230	V53-Q58 HydrophobicContact CB-CG 4.08Å; V53-Q58 HydrophobicContact CG1-CG 4Å; V53-Q58 PolarHBondContact O-NE2 3.36Å; S54-Q58 PolarHBondContact O-N 3.23Å; D55-Q58 PolarHBondContact O-N 3.36Å; D55-Q58 VanDerWaalsContact O-N 3.16Å; Q58-K60 VanDerWaalsContact C-N 3.31Å; Q58-K60 PolarHBondContact O-N 2.63Å; Q58-L61 PolarHBondContact O-N 3.45Å; Q58-E62 PolarHBondContact O-N 3.08Å; Q58-L230 HydrophobicContact CG-CD2 4Å; Q58-L230 PolarHBondContact OE1-O 3.06Å
59	M	97.5	Very high	94.9	Very high	138 Å²	138	80.2 Å²	80.2	68%	0.68	38%	0.38	S	S	*	.	H	α-helix	trans	-58.5	-42.4	176	-70.7	176.9	70.6	0	0	111.9	D55 E62 K63	D55-M59 WeakPolarHBondContact O-CB 2.83Å; D55-M59 VanDerWaalsContact O-CG 3.32Å; D55-M59 WeakPolarHBondContact O-CG 3.41Å; D55-M59 PolarHBondContact O-N 3.01Å; M59-E62 PolarHBondContact O-N 2.78Å; M59-K63 WeakPolarHBondContact O-CB 3.39Å; M59-K63 PolarHBondContact O-N 2.8Å
60	K	97.9	Very high	95.8	Very high	108 Å²	108	80.9 Å²	80.9	47%	0.47	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-45.5	176.3	-177.1	175.6	177.1	178.2	0	111.7	F56 K57 Q58 E62 K63 E64	F56-K60 WeakPolarHBondContact O-CB 3.26Å; F56-K60 PolarHBondContact O-N 3.49Å; K57-K60 PolarHBondContact O-N 2.97Å; Q58-K60 VanDerWaalsContact C-N 3.31Å; Q58-K60 PolarHBondContact O-N 2.63Å; K60-E62 VanDerWaalsContact C-N 3.32Å; K60-E62 PolarHBondContact O-N 2.97Å; K60-K63 PolarHBondContact O-N 3.08Å; K60-E64 WeakPolarHBondContact CE-OE2 3.19Å; K60-E64 HydrophobicContact CG-CG 4.37Å; K60-E64 WeakPolarHBondContact CG-OE2 3.39Å; K60-E64 WeakPolarHBondContact O-CB 3.34Å; K60-E64 WeakPolarHBondContact O-CG 3.29Å; K60-E64 PolarHBondContact O-N 3.05Å
61	L	97.8	Very high	96.9	Very high	16 Å²	16	73.6 Å²	73.6	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-61.5	-40.2	178.4	-74.4	165.7	0	0	0	112.1	K57 Q58 E64 A65 L230 V236	K57-L61 HydrophobicContact CG-CD1 4.1Å; K57-L61 HydrophobicContact CG-CG 4.45Å; K57-L61 WeakPolarHBondContact O-CB 3.26Å; K57-L61 VanDerWaalsContact O-CG 3.23Å; K57-L61 WeakPolarHBondContact O-CG 3.5Å; K57-L61 PolarHBondContact O-N 2.9Å; Q58-L61 PolarHBondContact O-N 3.45Å; L61-E64 CarbonylContact O-C 3.38Å; L61-A65 WeakPolarHBondContact O-CA 3.37Å; L61-A65 PolarHBondContact O-N 3.24Å; L61-L230 HydrophobicContact CD1-CD2 3.77Å; L61-V236 HydrophobicContact CD1-CB 4.04Å; L61-V236 HydrophobicContact CD1-CG1 4.14Å; L61-V236 HydrophobicContact CD1-CG2 3.67Å; L61-V236 HydrophobicContact CD2-CG2 3.72Å; L61-V236 HydrophobicContact CG-CG2 4.33Å
62	E	97.5	Very high	97.3	Very high	50 Å²	50	71.9 Å²	71.9	23%	0.234	34%	0.344	C	S	.	.	H	α-helix	trans	-66	-46.1	175.4	-179.5	55.1	-148.9	0	0	111.5	Q58 M59 K60 E64 A65 H188 K191 R242	Q58-E62 PolarHBondContact O-N 3.08Å; M59-E62 PolarHBondContact O-N 2.78Å; K60-E62 VanDerWaalsContact C-N 3.32Å; K60-E62 PolarHBondContact O-N 2.97Å; E62-E64 VanDerWaalsContact C-N 3.3Å; E62-E64 PolarHBondContact O-N 3.35Å; E62-A65 WeakPolarHBondContact O-CB 3.2Å; E62-A65 PolarHBondContact O-N 3.18Å; E62-H188 IonicContact OE2-CD2 3.54Å; E62-K191 WeakPolarHBondContact OE1-CE 3.44Å; E62-K191 IonicContact OE1-NZ 3.66Å; E62-K191 PolarHBondContact OE1-NZ 2.9Å; E62-R242 IonicContact OE2-CZ 3.79Å; E62-R242 VanDerWaalsContact OE2-CZ 3.27Å; E62-R242 IonicContact OE2-NH1 2.73Å; E62-R242 PolarHBondContact OE2-NH1 2.83Å; E62-R242 IonicContact OE2-NH2 2.68Å; E62-R242 PolarHBondContact OE2-NH2 3.02Å
63	K	97.5	Very high	97.4	Very high	193 Å²	193	68 Å²	68	84%	0.839	32%	0.323	S	S	*	.	H	α-helix	trans	-62.7	-36.3	177.6	-174	176.8	179.7	177.8	0	112.6	M59 K60	M59-K63 WeakPolarHBondContact O-CB 3.39Å; M59-K63 PolarHBondContact O-N 2.8Å; K60-K63 PolarHBondContact O-N 3.08Å
64	E	97.8	Very high	97.4	Very high	51 Å²	51	73.9 Å²	73.9	24%	0.238	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	10.3	-177.8	-63.7	-167.7	124.8	0	0	113.6	K60 L61 E62 Q66 K67 N68	K60-E64 WeakPolarHBondContact CE-OE2 3.19Å; K60-E64 HydrophobicContact CG-CG 4.37Å; K60-E64 WeakPolarHBondContact CG-OE2 3.39Å; K60-E64 WeakPolarHBondContact O-CB 3.34Å; K60-E64 WeakPolarHBondContact O-CG 3.29Å; K60-E64 PolarHBondContact O-N 3.05Å; L61-E64 CarbonylContact O-C 3.38Å; E62-E64 VanDerWaalsContact C-N 3.3Å; E62-E64 PolarHBondContact O-N 3.35Å; E64-Q66 VanDerWaalsContact C-N 3.32Å; E64-Q66 PolarHBondContact O-N 3.42Å; E64-K67 WeakPolarHBondContact O-CB 3.48Å; E64-K67 PolarHBondContact O-N 3.39Å; E64-K67 IonicContact OE1-NZ 2.63Å; E64-K67 PolarHBondContact OE1-NZ 3.05Å; E64-N68 PolarHBondContact O-N 3.27Å
65	A	97.8	Very high	97.3	Very high	6 Å²	6	77.8 Å²	77.8	5%	0.05	35%	0.352	C	S	.	.	H	α-helix	trans	-54.5	-45	-173.4	0	0	0	0	0	113	L61 E62 N68 W69 F135	L61-A65 WeakPolarHBondContact O-CA 3.37Å; L61-A65 PolarHBondContact O-N 3.24Å; E62-A65 WeakPolarHBondContact O-CB 3.2Å; E62-A65 PolarHBondContact O-N 3.18Å; A65-N68 PolarHBondContact O-N 3.41Å; A65-W69 PolarHBondContact O-N 2.98Å; A65-F135 HydrophobicContact CB-CE1 3.89Å; A65-F135 HydrophobicContact CB-CZ 4.37Å
66	Q	97.9	Very high	97.2	Very high	76 Å²	76	75 Å²	75	36%	0.355	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-45.4	177.7	-169.1	-179.8	78.1	0	0	111.7	E64 N68 W69 D70 F135 Q158	E64-Q66 VanDerWaalsContact C-N 3.32Å; E64-Q66 PolarHBondContact O-N 3.42Å; Q66-N68 VanDerWaalsContact C-N 3.31Å; Q66-N68 PolarHBondContact O-N 3.43Å; Q66-W69 PolarHBondContact O-N 2.81Å; Q66-D70 PolarHBondContact O-N 2.86Å; Q66-F135 HydrophobicContact CB-CD1 4.25Å; Q66-F135 HydrophobicContact CB-CD2 4.29Å; Q66-F135 HydrophobicContact CB-CE1 3.71Å; Q66-F135 HydrophobicContact CB-CE2 3.71Å; Q66-F135 HydrophobicContact CB-CZ 3.42Å; Q66-F135 VanDerWaalsContact CB-CZ 3.42Å; Q66-F135 HydrophobicContact CG-CD1 4.45Å; Q66-F135 HydrophobicContact CG-CD2 4.05Å; Q66-F135 HydrophobicContact CG-CE1 4.36Å; Q66-F135 HydrophobicContact CG-CE2 3.91Å; Q66-F135 HydrophobicContact CG-CG 4.33Å; Q66-F135 HydrophobicContact CG-CZ 4.1Å; Q66-F135 WeakPolarHBondContact CG-O 3.42Å; Q66-F135 PolarHBondContact NE2-O 3.48Å; Q66-Q158 VanDerWaalsContact NE2-NE2 3.12Å
67	K	97.9	Very high	96.9	Very high	111 Å²	111	70.1 Å²	70.1	48%	0.483	32%	0.32	S	S	.	.	H	α-helix	trans	-62	-39.6	179.7	174.7	-175.7	168.3	-170.6	0	111.2	E64 D70 L71	E64-K67 WeakPolarHBondContact O-CB 3.48Å; E64-K67 PolarHBondContact O-N 3.39Å; E64-K67 IonicContact OE1-NZ 2.63Å; E64-K67 PolarHBondContact OE1-NZ 3.05Å; K67-D70 PolarHBondContact O-N 2.86Å; K67-L71 HydrophobicContact CG-CD1 4.17Å; K67-L71 HydrophobicContact CG-CG 4.48Å; K67-L71 WeakPolarHBondContact O-CB 3.44Å; K67-L71 VanDerWaalsContact O-CG 3.27Å; K67-L71 WeakPolarHBondContact O-CG 3.49Å; K67-L71 PolarHBondContact O-N 2.84Å
68	N	98.1	Very high	96.6	Very high	14 Å²	14	68.6 Å²	68.6	8%	0.075	32%	0.318	C	S	.	.	H	α-helix	trans	-64.2	-42.1	177.7	-66.9	-20.2	0	0	0	111.3	E64 A65 Q66 L71 F72 G240	E64-N68 PolarHBondContact O-N 3.27Å; A65-N68 PolarHBondContact O-N 3.41Å; Q66-N68 VanDerWaalsContact C-N 3.31Å; Q66-N68 PolarHBondContact O-N 3.43Å; N68-L71 PolarHBondContact O-N 3.42Å; N68-F72 WeakPolarHBondContact O-CB 3.36Å; N68-F72 PolarHBondContact O-N 3.17Å; N68-G240 PolarHBondContact ND2-O 2.87Å
69	W	97.8	Very high	95.8	Very high	48 Å²	48	73.3 Å²	73.3	18%	0.182	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-44.6	172.4	-81.4	110.8	0	0	0	112.5	A65 Q66 L71 F72 Y73 A186 T241	A65-W69 PolarHBondContact O-N 2.98Å; Q66-W69 PolarHBondContact O-N 2.81Å; W69-L71 VanDerWaalsContact C-N 3.31Å; W69-L71 PolarHBondContact O-N 2.89Å; W69-F72 HydrophobicContact CE3-CB 4.47Å; W69-F72 HydrophobicContact CE3-CD1 4.04Å; W69-F72 HydrophobicContact CE3-CG 4.37Å; W69-F72 AromaticContact CZ3-CD1 4Å; W69-F72 HydrophobicContact CZ3-CD1 4Å; W69-F72 HydrophobicContact CZ3-CE1 4.25Å; W69-F72 HydrophobicContact CZ3-CG 4.42Å; W69-F72 WeakPolarHBondContact O-CB 3.47Å; W69-F72 PolarHBondContact O-N 2.9Å; W69-F72 VanDerWaalsContact O-N 3.11Å; W69-Y73 AromaticContact CE3-CE2 3.95Å; W69-Y73 HydrophobicContact CE3-CE2 3.95Å; W69-Y73 WeakPolarHBondContact O-CD2 3.1Å; W69-Y73 PolarHBondContact O-N 2.95Å; W69-A186 HydrophobicContact CZ2-CB 3.46Å; W69-A186 VanDerWaalsContact CZ2-CB 3.46Å; W69-T241 HydrophobicContact CD2-CG2 3.97Å; W69-T241 HydrophobicContact CE3-CG2 4.13Å; W69-T241 HydrophobicContact CG-CG2 4.46Å; W69-T241 HydrophobicContact CH2-CG2 4.4Å; W69-T241 HydrophobicContact CZ2-CG2 4.24Å; W69-T241 HydrophobicContact CZ3-CG2 4.35Å
70	D	97	Very high	95	Very high	30 Å²	30	68.8 Å²	68.8	16%	0.16	32%	0.322	C	S	.	.	H	α-helix	trans	-59.7	-42	176.8	-168.6	73.2	0	0	0	112.1	Q66 K67 Y73 K74 S136 R138	Q66-D70 PolarHBondContact O-N 2.86Å; K67-D70 PolarHBondContact O-N 2.86Å; D70-Y73 PolarHBondContact O-N 3.36Å; D70-K74 WeakPolarHBondContact O-CB 3.46Å; D70-K74 PolarHBondContact O-N 3.4Å; D70-S136 PolarHBondContact OD1-OG 2.96Å; D70-R138 PolarHBondContact O-NE 2.86Å; D70-R138 WeakPolarHBondContact OD1-CB 2.95Å; D70-R138 IonicContact OD1-CZ 2.64Å; D70-R138 IonicContact OD1-NE 3.99Å; D70-R138 PolarHBondContact OD1-NE 2.87Å; D70-R138 IonicContact OD1-NH2 3.91Å; D70-R138 IonicContact OD2-CZ 3.21Å; D70-R138 IonicContact OD2-NE 3.23Å; D70-R138 PolarHBondContact OD2-NE 2.93Å; D70-R138 IonicContact OD2-NH2 3.56Å; D70-R138 PolarHBondContact OD2-NH2 3.35Å
71	L	97.5	Very high	94.1	Very high	47 Å²	47	68.3 Å²	68.3	25%	0.246	32%	0.32	C	S	.	.	H	α-helix	trans	-65.6	-37.6	175	-73	175.3	0	0	0	112.3	K67 N68 W69 K74 R75	K67-L71 HydrophobicContact CG-CD1 4.17Å; K67-L71 HydrophobicContact CG-CG 4.48Å; K67-L71 WeakPolarHBondContact O-CB 3.44Å; K67-L71 VanDerWaalsContact O-CG 3.27Å; K67-L71 WeakPolarHBondContact O-CG 3.49Å; K67-L71 PolarHBondContact O-N 2.84Å; N68-L71 PolarHBondContact O-N 3.42Å; W69-L71 VanDerWaalsContact C-N 3.31Å; W69-L71 PolarHBondContact O-N 2.89Å; L71-K74 HydrophobicContact CD2-CD 4.46Å; L71-K74 PolarHBondContact O-N 3.37Å; L71-R75 WeakPolarHBondContact O-CD 3.43Å; L71-R75 VanDerWaalsContact O-CG 3.25Å; L71-R75 WeakPolarHBondContact O-CG 3.39Å; L71-R75 PolarHBondContact O-N 3.23Å
72	F	96.8	Very high	93.4	Very high	26 Å²	26	76.7 Å²	76.7	11%	0.114	36%	0.356	C	S	.	.	H	α-helix	trans	-59.1	-51.8	173	172.5	-88.3	0	0	0	110.5	N68 W69 K74 R75 N76 F80 D239 T241	N68-F72 WeakPolarHBondContact O-CB 3.36Å; N68-F72 PolarHBondContact O-N 3.17Å; W69-F72 HydrophobicContact CE3-CB 4.47Å; W69-F72 HydrophobicContact CE3-CD1 4.04Å; W69-F72 HydrophobicContact CE3-CG 4.37Å; W69-F72 AromaticContact CZ3-CD1 4Å; W69-F72 HydrophobicContact CZ3-CD1 4Å; W69-F72 HydrophobicContact CZ3-CE1 4.25Å; W69-F72 HydrophobicContact CZ3-CG 4.42Å; W69-F72 WeakPolarHBondContact O-CB 3.47Å; W69-F72 PolarHBondContact O-N 2.9Å; W69-F72 VanDerWaalsContact O-N 3.11Å; F72-K74 VanDerWaalsContact C-N 3.3Å; F72-K74 PolarHBondContact O-N 2.88Å; F72-R75 PolarHBondContact O-N 3.4Å; F72-N76 WeakPolarHBondContact CD2-ND2 3.43Å; F72-N76 HydrophobicContact CE1-CB 4.41Å; F72-N76 VanDerWaalsContact CE2-ND2 3.28Å; F72-N76 WeakPolarHBondContact CE2-ND2 3.4Å; F72-N76 HydrophobicContact CZ-CB 4.36Å; F72-N76 WeakPolarHBondContact O-CB 3.49Å; F72-N76 PolarHBondContact O-N 2.92Å; F72-N76 PolarHBondContact O-ND2 3.19Å; F72-F80 AromaticContact CE1-CD2 3.73Å; F72-F80 HydrophobicContact CE1-CD2 3.73Å; F72-F80 AromaticContact CE1-CE2 3.42Å; F72-F80 HydrophobicContact CE1-CE2 3.42Å; F72-F80 VanDerWaalsContact CE1-CE2 3.42Å; F72-F80 HydrophobicContact CE1-CG 4.41Å; F72-F80 AromaticContact CE1-CZ 3.98Å; F72-F80 HydrophobicContact CE1-CZ 3.98Å; F72-F80 AromaticContact CZ-CD2 3.59Å; F72-F80 HydrophobicContact CZ-CD2 3.59Å; F72-F80 AromaticContact CZ-CE2 3.74Å; F72-F80 HydrophobicContact CZ-CE2 3.74Å; F72-F80 HydrophobicContact CZ-CG 4.32Å; F72-D239 WeakPolarHBondContact CD2-OD2 3.46Å; F72-T241 HydrophobicContact CB-CG2 4.15Å; F72-T241 HydrophobicContact CG-CG2 4.49Å
73	Y	97.3	Very high	92.9	Very high	14 Å²	14	78 Å²	78	6%	0.055	36%	0.364	C	S	.	.	H	α-helix	trans	-63.4	-35.4	177.5	-73.7	-68.2	0	0	0	112.4	W69 D70 R75 T77 F80 G113 V114 D134 S136 A139	W69-Y73 AromaticContact CE3-CE2 3.95Å; W69-Y73 HydrophobicContact CE3-CE2 3.95Å; W69-Y73 WeakPolarHBondContact O-CD2 3.1Å; W69-Y73 PolarHBondContact O-N 2.95Å; D70-Y73 PolarHBondContact O-N 3.36Å; Y73-R75 VanDerWaalsContact C-N 3.31Å; Y73-R75 PolarHBondContact O-N 3.27Å; Y73-T77 WeakPolarHBondContact O-CA 3.44Å; Y73-T77 PolarHBondContact O-N 2.95Å; Y73-F80 HydrophobicContact CD1-CE1 4.28Å; Y73-F80 HydrophobicContact CD1-CZ 4.11Å; Y73-F80 HydrophobicContact CE1-CE1 4.26Å; Y73-F80 AromaticContact CE1-CZ 3.69Å; Y73-F80 HydrophobicContact CE1-CZ 3.69Å; Y73-G113 WeakPolarHBondContact OH-CA 3Å; Y73-V114 HydrophobicContact CD1-CG1 3.93Å; Y73-V114 HydrophobicContact CE1-CG1 3.97Å; Y73-D134 PolarHBondContact OH-OD2 2.78Å; Y73-S136 VanDerWaalsContact CD2-CB 3.49Å; Y73-S136 VanDerWaalsContact CD2-OG 3.29Å; Y73-S136 WeakPolarHBondContact CD2-OG 3.32Å; Y73-A139 HydrophobicContact CD1-CB 4.17Å; Y73-A139 HydrophobicContact CD2-CB 3.88Å; Y73-A139 HydrophobicContact CE1-CB 3.91Å; Y73-A139 HydrophobicContact CE2-CB 3.61Å; Y73-A139 HydrophobicContact CG-CB 4.15Å
74	K	96	Very high	92.4	Very high	131 Å²	131	70.3 Å²	70.3	57%	0.57	33%	0.33	S	S	*	.	H	α-helix	trans	-60.8	-40.9	175.3	-175.3	178.3	176.6	177.8	0	112	D70 L71 F72 R138	D70-K74 WeakPolarHBondContact O-CB 3.46Å; D70-K74 PolarHBondContact O-N 3.4Å; L71-K74 HydrophobicContact CD2-CD 4.46Å; L71-K74 PolarHBondContact O-N 3.37Å; F72-K74 VanDerWaalsContact C-N 3.3Å; F72-K74 PolarHBondContact O-N 2.88Å; K74-R138 VanDerWaalsContact N-CD 3.3Å
75	R	94.8	Very high	91.7	Very high	157 Å²	157	72.4 Å²	72.4	59%	0.592	34%	0.34	S	S	*	.	H	α-helix	trans	-78	-39.4	-178	-69.6	166.5	-177	162	1.5	112.4	L71 F72 Y73	L71-R75 WeakPolarHBondContact O-CD 3.43Å; L71-R75 VanDerWaalsContact O-CG 3.25Å; L71-R75 WeakPolarHBondContact O-CG 3.39Å; L71-R75 PolarHBondContact O-N 3.23Å; F72-R75 PolarHBondContact O-N 3.4Å; Y73-R75 VanDerWaalsContact C-N 3.31Å; Y73-R75 PolarHBondContact O-N 3.27Å
76	N	93.4	Very high	90.9	Very high	62 Å²	62	75.2 Å²	75.2	33%	0.332	35%	0.349	S	S	.	.	H	α-helix	trans	-99.5	-14.1	-168.3	-67.8	-74.4	0	0	0	114.5	F72 T78 F80	F72-N76 WeakPolarHBondContact CD2-ND2 3.43Å; F72-N76 HydrophobicContact CE1-CB 4.41Å; F72-N76 VanDerWaalsContact CE2-ND2 3.28Å; F72-N76 WeakPolarHBondContact CE2-ND2 3.4Å; F72-N76 HydrophobicContact CZ-CB 4.36Å; F72-N76 WeakPolarHBondContact O-CB 3.49Å; F72-N76 PolarHBondContact O-N 2.92Å; F72-N76 PolarHBondContact O-ND2 3.19Å; N76-T78 PolarHBondContact O-N 3.34Å; N76-F80 HydrophobicContact CB-CB 3.92Å; N76-F80 HydrophobicContact CB-CD1 3.98Å; N76-F80 HydrophobicContact CB-CG 3.97Å
77	T	92.7	Very high	90.1	Very high	60 Å²	60	71.7 Å²	71.7	37%	0.368	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	-124.3	-179.4	70.4	0	0	0	0	112.5	Y73 F80	Y73-T77 WeakPolarHBondContact O-CA 3.44Å; Y73-T77 PolarHBondContact O-N 2.95Å; T77-F80 WeakPolarHBondContact O-CD1 3.49Å; T77-F80 WeakPolarHBondContact O-CE1 3.34Å
78	T	89.4	Confident	89.2	Confident	59 Å²	59	67.5 Å²	67.5	36%	0.362	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-5.7	-173.9	55.7	0	0	0	0	114.1	N76 V114 F142	N76-T78 PolarHBondContact O-N 3.34Å; T78-V114 HydrophobicContact CG2-CB 4.22Å; T78-V114 HydrophobicContact CG2-CG1 4.25Å; T78-F142 HydrophobicContact CG2-CB 4.12Å; T78-F142 HydrophobicContact CG2-CD1 3.98Å; T78-F142 HydrophobicContact CG2-CD2 4.46Å; T78-F142 HydrophobicContact CG2-CE1 4.5Å; T78-F142 HydrophobicContact CG2-CG 3.97Å
79	N	81.5	Confident	88.3	Confident	142 Å²	142	77.1 Å²	77.1	76%	0.759	35%	0.352	S	S	*	.			trans	-104	11.8	-166.1	-61.7	-37.8	0	0	0	114.2
80	F	80.7	Confident	87.6	Confident	44 Å²	44	76.7 Å²	76.7	19%	0.193	35%	0.352	C	S	.	.	S	Bend	trans	-88.4	-26.4	-172.8	64.5	-78.1	0	0	0	113.6	F72 Y73 N76 T77 V114	F72-F80 AromaticContact CE1-CD2 3.73Å; F72-F80 HydrophobicContact CE1-CD2 3.73Å; F72-F80 AromaticContact CE1-CE2 3.42Å; F72-F80 HydrophobicContact CE1-CE2 3.42Å; F72-F80 VanDerWaalsContact CE1-CE2 3.42Å; F72-F80 HydrophobicContact CE1-CG 4.41Å; F72-F80 AromaticContact CE1-CZ 3.98Å; F72-F80 HydrophobicContact CE1-CZ 3.98Å; F72-F80 AromaticContact CZ-CD2 3.59Å; F72-F80 HydrophobicContact CZ-CD2 3.59Å; F72-F80 AromaticContact CZ-CE2 3.74Å; F72-F80 HydrophobicContact CZ-CE2 3.74Å; F72-F80 HydrophobicContact CZ-CG 4.32Å; Y73-F80 HydrophobicContact CD1-CE1 4.28Å; Y73-F80 HydrophobicContact CD1-CZ 4.11Å; Y73-F80 HydrophobicContact CE1-CE1 4.26Å; Y73-F80 AromaticContact CE1-CZ 3.69Å; Y73-F80 HydrophobicContact CE1-CZ 3.69Å; N76-F80 HydrophobicContact CB-CB 3.92Å; N76-F80 HydrophobicContact CB-CD1 3.98Å; N76-F80 HydrophobicContact CB-CG 3.97Å; T77-F80 WeakPolarHBondContact O-CD1 3.49Å; T77-F80 WeakPolarHBondContact O-CE1 3.34Å; F80-V114 HydrophobicContact CE1-CG1 3.86Å; F80-V114 HydrophobicContact CE1-CG2 3.83Å; F80-V114 HydrophobicContact CZ-CG1 4.3Å; F80-V114 HydrophobicContact CZ-CG2 4.19Å
81	F	79.5	Confident	87	Confident	98 Å²	98	75.3 Å²	75.3	43%	0.43	34%	0.344	S	S	.	.	S	Bend	trans	-120.6	149.4	171.7	-65.1	-38.2	0	0	0	110.7	N116	F81-N116 PolarHBondContact O-ND2 2.85Å
82	K	83.4	Confident	86.5	Confident	191 Å²	191	78.9 Å²	78.9	83%	0.83	36%	0.36	S	S	*	.			trans	-82.9	154.5	173.2	-64.6	-176.1	178.6	-178.3	0	110.1
83	D	86.3	Confident	86	Confident	77 Å²	77	78.9 Å²	78.9	41%	0.412	36%	0.36	S	S	.	.			trans	-60	138.2	169.7	-66.8	-28.8	0	0	0	111.5	H85 N116 P120	D83-H85 WeakPolarHBondContact CB-NE2 3.01Å; D83-H85 PolarHBondContact O-N 3.35Å; D83-N116 WeakPolarHBondContact CA-O 3.19Å; D83-N116 WeakPolarHBondContact OD1-CA 3.24Å; D83-N116 PolarHBondContact OD1-ND2 3.36Å; D83-P120 HydrophobicContact CB-CG 3.82Å
84	R	86.7	Confident	85.4	Confident	32 Å²	32	78.4 Å²	78.4	12%	0.121	36%	0.358	C	S	.	.			trans	-94.5	65.4	-170.3	-64.6	178.9	172.2	72.3	-6.1	111.2	W86 T87 N116	R84-W86 HydrophobicContact CG-CZ2 4.42Å; R84-W86 PolarHBondContact O-N 3.32Å; R84-T87 HydrophobicContact CB-CG2 3.96Å; R84-T87 PolarHBondContact O-N 3.46Å; R84-T87 PolarHBondContact O-OG1 2.73Å; R84-T87 VanDerWaalsContact O-OG1 3.09Å; R84-N116 PolarHBondContact N-O 3.49Å
85	H	82.8	Confident	84.5	Confident	96 Å²	96	78.1 Å²	78.1	44%	0.444	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	0.8	176.5	-61.1	-78.3	0	0	0	115.1	D83	D83-H85 WeakPolarHBondContact CB-NE2 3.01Å; D83-H85 PolarHBondContact O-N 3.35Å
86	W	81.8	Confident	83.5	Confident	65 Å²	65	74 Å²	74	25%	0.246	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-16.2	178.5	58.9	-99	0	0	0	112.7	R84 T88 R89 E90 F91 I181 R212	R84-W86 HydrophobicContact CG-CZ2 4.42Å; R84-W86 PolarHBondContact O-N 3.32Å; W86-T88 PolarHBondContact O-N 2.87Å; W86-R89 WeakPolarHBondContact O-CB 3.46Å; W86-R89 PolarHBondContact O-N 3.38Å; W86-R89 VanDerWaalsContact O-N 3.08Å; W86-E90 HydrophobicContact CE3-CB 4.06Å; W86-E90 HydrophobicContact CE3-CG 4.09Å; W86-E90 HydrophobicContact CZ3-CB 4.35Å; W86-E90 WeakPolarHBondContact CZ3-OE2 3.25Å; W86-E90 PolarHBondContact O-N 2.98Å; W86-E90 VanDerWaalsContact O-N 3.15Å; W86-F91 HydrophobicContact CH2-CE2 4.1Å; W86-F91 HydrophobicContact CZ3-CD2 4.22Å; W86-F91 AromaticContact CZ3-CE2 3.67Å; W86-F91 HydrophobicContact CZ3-CE2 3.67Å; W86-F91 HydrophobicContact CZ3-CZ 4.44Å; W86-I181 HydrophobicContact CH2-CD1 4.36Å; W86-I181 HydrophobicContact CZ2-CG2 4.47Å; W86-R212 HydrophobicContact CH2-CB 4.48Å
87	T	80.3	Confident	82.7	Confident	2 Å²	2	72.9 Å²	72.9	1%	0.012	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-43.9	-170.2	48.2	0	0	0	0	112.5	R84 R89 E90 F91 I181	R84-T87 HydrophobicContact CB-CG2 3.96Å; R84-T87 PolarHBondContact O-N 3.46Å; R84-T87 PolarHBondContact O-OG1 2.73Å; R84-T87 VanDerWaalsContact O-OG1 3.09Å; T87-R89 PolarHBondContact O-N 3.36Å; T87-E90 PolarHBondContact O-N 3.48Å; T87-F91 WeakPolarHBondContact O-CB 3.49Å; T87-F91 PolarHBondContact O-N 3.33Å; T87-I181 HydrophobicContact CG2-CD1 4.04Å
88	T	79.3	Confident	82.1	Confident	23 Å²	23	72.4 Å²	72.4	14%	0.141	35%	0.346	C	S	.	.	H	α-helix	trans	-66.2	-23.1	177.6	51.4	0	0	0	0	113.7	W86 L121	W86-T88 PolarHBondContact O-N 2.87Å; T88-L121 HydrophobicContact CG2-CD2 3.4Å
89	R	79.6	Confident	81.3	Confident	216 Å²	216	77.8 Å²	77.8	82%	0.815	37%	0.368	S	S	*	.	H	α-helix	trans	-83.1	-31.7	177	-58.9	-179.3	-174.6	-178.9	-0.2	112.8	W86 T87	W86-R89 WeakPolarHBondContact O-CB 3.46Å; W86-R89 PolarHBondContact O-N 3.38Å; W86-R89 VanDerWaalsContact O-N 3.08Å; T87-R89 PolarHBondContact O-N 3.36Å
90	E	81.9	Confident	81.1	Confident	39 Å²	39	76.5 Å²	76.5	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-99.7	-17.7	-175.6	-64	-171	168.9	0	0	112.8	W86 T87 R212 R270 Q287	W86-E90 HydrophobicContact CE3-CB 4.06Å; W86-E90 HydrophobicContact CE3-CG 4.09Å; W86-E90 HydrophobicContact CZ3-CB 4.35Å; W86-E90 WeakPolarHBondContact CZ3-OE2 3.25Å; W86-E90 PolarHBondContact O-N 2.98Å; W86-E90 VanDerWaalsContact O-N 3.15Å; T87-E90 PolarHBondContact O-N 3.48Å; E90-R212 IonicContact OE1-NH1 3.54Å; E90-R212 IonicContact OE1-NH2 2.93Å; E90-R212 IonicContact OE2-CZ 4Å; E90-R212 IonicContact OE2-NH1 3.87Å; E90-R212 PolarHBondContact OE2-NH1 2.64Å; E90-R212 IonicContact OE2-NH2 3.57Å; E90-R212 PolarHBondContact OE2-NH2 2.97Å; E90-R270 IonicContact OE1-CZ 2.87Å; E90-R270 IonicContact OE1-NH2 3.5Å; E90-R270 PolarHBondContact OE1-NH2 3.29Å; E90-Q287 PolarHBondContact OE2-OE1 3.05Å; E90-Q287 VanDerWaalsContact OE2-OE1 3.08Å
91	F	85.9	Confident	80.6	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	39%	0.388	C	S	.	.			trans	-126.4	88.6	176.6	-58.5	-56.9	0	0	0	110.6	W86 T87 E93 L94 I181 L210 R212 Q287	W86-F91 HydrophobicContact CH2-CE2 4.1Å; W86-F91 HydrophobicContact CZ3-CD2 4.22Å; W86-F91 AromaticContact CZ3-CE2 3.67Å; W86-F91 HydrophobicContact CZ3-CE2 3.67Å; W86-F91 HydrophobicContact CZ3-CZ 4.44Å; T87-F91 WeakPolarHBondContact O-CB 3.49Å; T87-F91 PolarHBondContact O-N 3.33Å; F91-E93 PolarHBondContact O-N 3.35Å; F91-L94 HydrophobicContact CB-CD1 4.08Å; F91-L94 HydrophobicContact CB-CG 4.22Å; F91-L94 WeakPolarHBondContact O-CB 3.06Å; F91-L94 PolarHBondContact O-N 2.93Å; F91-I181 HydrophobicContact CE2-CD1 4.45Å; F91-L210 HydrophobicContact CB-CD1 3.63Å; F91-L210 HydrophobicContact CB-CD2 4.18Å; F91-L210 HydrophobicContact CB-CG 4.43Å; F91-L210 HydrophobicContact CD1-CB 4.18Å; F91-L210 HydrophobicContact CD1-CD1 4.3Å; F91-L210 HydrophobicContact CD1-CD2 3.71Å; F91-L210 HydrophobicContact CD1-CG 4.28Å; F91-L210 HydrophobicContact CD2-CB 4.38Å; F91-L210 HydrophobicContact CD2-CD1 4.19Å; F91-L210 HydrophobicContact CE1-CB 4.18Å; F91-L210 HydrophobicContact CE1-CD2 4.3Å; F91-L210 HydrophobicContact CE2-CB 4.38Å; F91-L210 HydrophobicContact CG-CB 4.27Å; F91-L210 HydrophobicContact CG-CD1 3.81Å; F91-L210 HydrophobicContact CG-CD2 4.08Å; F91-L210 HydrophobicContact CG-CG 4.27Å; F91-L210 HydrophobicContact CZ-CB 4.28Å; F91-R212 HydrophobicContact CZ-CB 4.47Å; F91-Q287 HydrophobicContact CE1-CG 3.78Å; F91-Q287 HydrophobicContact CZ-CG 3.93Å
92	E	85.4	Confident	80.3	Confident	123 Å²	123	83.2 Å²	83.2	58%	0.575	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.5	178	69.5	-164.4	151.2	0	0	113.1	L94 Q95 A96 K289	E92-L94 PolarHBondContact O-N 2.87Å; E92-L94 VanDerWaalsContact O-N 3.16Å; E92-Q95 CarbonylContact O-C 3.54Å; E92-Q95 WeakPolarHBondContact O-CA 3.26Å; E92-Q95 PolarHBondContact O-N 3.23Å; E92-A96 WeakPolarHBondContact O-CB 3.43Å; E92-A96 PolarHBondContact O-N 3.01Å; E92-K289 IonicContact OE1-NZ 3.35Å; E92-K289 PolarHBondContact OE1-NZ 3.36Å
93	E	88	Confident	80.3	Confident	25 Å²	25	75.9 Å²	75.9	12%	0.117	37%	0.368	C	S	.	.	H	α-helix	trans	-58.7	-27.6	177.6	-66.6	82.4	180	0	0	112.8	F91 Q95 C97 V208 L210 K289	F91-E93 PolarHBondContact O-N 3.35Å; E93-Q95 PolarHBondContact O-N 3.38Å; E93-Q95 VanDerWaalsContact O-N 3.14Å; E93-C97 WeakPolarHBondContact O-CB 3.48Å; E93-C97 PolarHBondContact O-N 2.81Å; E93-C97 PolarHBondContact O-SG 3.31Å; E93-V208 HydrophobicContact CG-CG1 4.23Å; E93-V208 HydrophobicContact CG-CG2 4.32Å; E93-L210 HydrophobicContact CB-CD2 4.23Å; E93-L210 HydrophobicContact CG-CD2 4.27Å; E93-K289 WeakPolarHBondContact OE1-CD 3.41Å; E93-K289 WeakPolarHBondContact OE1-CE 3.49Å; E93-K289 IonicContact OE1-NZ 3.67Å; E93-K289 PolarHBondContact OE1-NZ 3.45Å; E93-K289 WeakPolarHBondContact OE2-CE 3.42Å; E93-K289 IonicContact OE2-NZ 3.41Å; E93-K289 PolarHBondContact OE2-NZ 2.84Å
94	L	83	Confident	80.4	Confident	5 Å²	5	76.9 Å²	76.9	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-65	-14.7	174.7	-64.7	174.5	0	0	0	112.7	F91 E92 L105 L107 L121 V177 L210	F91-L94 HydrophobicContact CB-CD1 4.08Å; F91-L94 HydrophobicContact CB-CG 4.22Å; F91-L94 WeakPolarHBondContact O-CB 3.06Å; F91-L94 PolarHBondContact O-N 2.93Å; E92-L94 PolarHBondContact O-N 2.87Å; E92-L94 VanDerWaalsContact O-N 3.16Å; L94-L105 WeakPolarHBondContact O-CD2 3.44Å; L94-L107 HydrophobicContact CD2-CD1 4.03Å; L94-L121 HydrophobicContact CD1-CD1 4.39Å; L94-L121 HydrophobicContact CD1-CD2 4.16Å; L94-V177 HydrophobicContact CD2-CG1 4.09Å; L94-L210 HydrophobicContact CD1-CD1 4.38Å; L94-L210 HydrophobicContact CD2-CD1 3.89Å; L94-L210 HydrophobicContact CG-CD1 3.86Å
95	Q	78.5	Confident	80.8	Confident	125 Å²	125	75.4 Å²	75.4	58%	0.584	36%	0.363	S	S	*	.	H	α-helix	trans	-115.7	-37.7	174.1	-62.3	-179.7	-10.2	0	0	112	E92 E93	E92-Q95 CarbonylContact O-C 3.54Å; E92-Q95 WeakPolarHBondContact O-CA 3.26Å; E92-Q95 PolarHBondContact O-N 3.23Å; E93-Q95 PolarHBondContact O-N 3.38Å; E93-Q95 VanDerWaalsContact O-N 3.14Å
96	A	74.4	Confident	81.4	Confident	69 Å²	69	72.1 Å²	72.1	57%	0.57	35%	0.35	S	S	*	.	H	α-helix	trans	-85.7	-10.4	-168.4	0	0	0	0	0	115	E92 R98	E92-A96 WeakPolarHBondContact O-CB 3.43Å; E92-A96 PolarHBondContact O-N 3.01Å; A96-R98 PolarHBondContact O-N 3.44Å
97	C	75.9	Confident	82.2	Confident	39 Å²	39	69 Å²	69	26%	0.264	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	9.7	179.5	-75.3	0	0	0	0	114.7	E93 L105 V177	E93-C97 WeakPolarHBondContact O-CB 3.48Å; E93-C97 PolarHBondContact O-N 2.81Å; E93-C97 PolarHBondContact O-SG 3.31Å; C97-L105 HydrophobicContact CB-CD1 3.75Å; C97-V177 HydrophobicContact CB-CG2 4.25Å
98	R	79	Confident	83.1	Confident	50 Å²	50	69 Å²	69	19%	0.189	34%	0.338	C	S	.	.			trans	-103.7	130.2	179.3	-63.3	-179	-176.8	-176.2	4.6	110.3	A96 Q103 D125 S127	A96-R98 PolarHBondContact O-N 3.44Å; R98-Q103 HydrophobicContact CB-CB 4.28Å; R98-Q103 VanDerWaalsContact CD-O 3.26Å; R98-Q103 WeakPolarHBondContact CD-O 3.47Å; R98-Q103 HydrophobicContact CG-CB 4.35Å; R98-Q103 PolarHBondContact NE-O 2.63Å; R98-D125 IonicContact CZ-OD1 3.47Å; R98-D125 IonicContact CZ-OD2 3.9Å; R98-D125 VanDerWaalsContact CZ-OD2 3.23Å; R98-D125 IonicContact NH1-OD1 3.58Å; R98-D125 PolarHBondContact NH1-OD1 3.43Å; R98-D125 IonicContact NH1-OD2 3.01Å; R98-D125 PolarHBondContact NH1-OD2 3.01Å; R98-D125 IonicContact NH2-OD1 2.84Å; R98-D125 PolarHBondContact NH2-OD1 2.77Å; R98-D125 IonicContact NH2-OD2 3.27Å; R98-D125 PolarHBondContact NH2-OD2 2.64Å; R98-S127 PolarHBondContact NH2-O 3.2Å
99	E	72.6	Confident	84	Confident	173 Å²	173	68 Å²	68	81%	0.808	33%	0.332	S	S	*	.	S	Bend	trans	-77	-28.5	173.2	-63	-177.3	-176.5	0	0	111.6
100	F	77.4	Confident	84.9	Confident	115 Å²	115	57.8 Å²	57.8	50%	0.504	29%	0.293	S	S	.	.	S	Bend	trans	-147.2	155.4	177.7	45.1	-91.6	0	0	0	111.6	S102 Q103	F100-S102 WeakPolarHBondContact CD2-OG 3.34Å; F100-S102 PolarHBondContact O-N 2.87Å; F100-S102 VanDerWaalsContact O-N 3.13Å; F100-Q103 HydrophobicContact CD2-CB 3.79Å; F100-Q103 HydrophobicContact CE2-CB 3.64Å; F100-Q103 HydrophobicContact CE2-CG 4.35Å; F100-Q103 HydrophobicContact CG-CB 4.37Å; F100-Q103 HydrophobicContact CZ-CB 4.09Å; F100-Q103 HydrophobicContact CZ-CG 4.37Å; F100-Q103 VanDerWaalsContact O-CB 3.26Å; F100-Q103 WeakPolarHBondContact O-CB 3.46Å; F100-Q103 PolarHBondContact O-N 2.77Å
101	E	70	Confident	85.7	Confident	186 Å²	186	56.7 Å²	56.7	87%	0.869	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.2	-169.7	-167.9	172.1	-162.9	0	0	114.1
102	S	74.5	Confident	86.3	Confident	97 Å²	97	57 Å²	57	68%	0.678	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.8	178.7	61.6	0	0	0	0	114.6	F100 K104	F100-S102 WeakPolarHBondContact CD2-OG 3.34Å; F100-S102 PolarHBondContact O-N 2.87Å; F100-S102 VanDerWaalsContact O-N 3.13Å; S102-K104 PolarHBondContact O-N 3.03Å
103	Q	82.7	Confident	86.9	Confident	36 Å²	36	51.5 Å²	51.5	17%	0.168	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-69	127.9	179.6	-172.9	176.3	-11.6	0	0	110.4	R98 F100	R98-Q103 HydrophobicContact CB-CB 4.28Å; R98-Q103 VanDerWaalsContact CD-O 3.26Å; R98-Q103 WeakPolarHBondContact CD-O 3.47Å; R98-Q103 HydrophobicContact CG-CB 4.35Å; R98-Q103 PolarHBondContact NE-O 2.63Å; F100-Q103 HydrophobicContact CD2-CB 3.79Å; F100-Q103 HydrophobicContact CE2-CB 3.64Å; F100-Q103 HydrophobicContact CE2-CG 4.35Å; F100-Q103 HydrophobicContact CG-CB 4.37Å; F100-Q103 HydrophobicContact CZ-CB 4.09Å; F100-Q103 HydrophobicContact CZ-CG 4.37Å; F100-Q103 VanDerWaalsContact O-CB 3.26Å; F100-Q103 WeakPolarHBondContact O-CB 3.46Å; F100-Q103 PolarHBondContact O-N 2.77Å
104	K	89.6	Confident	87.3	Confident	98 Å²	98	50.7 Å²	50.7	43%	0.426	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-74.1	129.6	173.4	-158.2	-175.8	-161	-173	0	109.8	S102 S127 F129	S102-K104 PolarHBondContact O-N 3.03Å; K104-S127 CarbonylContact C-O 3.57Å; K104-S127 VanDerWaalsContact CA-O 3.23Å; K104-S127 WeakPolarHBondContact CA-O 3.47Å; K104-S127 WeakPolarHBondContact CG-O 3.48Å; K104-F129 HydrophobicContact CD-CB 4.07Å
105	L	93.2	Very high	88	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	128.1	170.3	-177.6	70.7	0	0	0	109.7	L94 C97 S127 I128 F129 D176 V177	L94-L105 WeakPolarHBondContact O-CD2 3.44Å; C97-L105 HydrophobicContact CB-CD1 3.75Å; L105-S127 PolarHBondContact N-O 3.35Å; L105-I128 HydrophobicContact CB-CG1 4.32Å; L105-I128 HydrophobicContact CD2-CD1 4.37Å; L105-I128 HydrophobicContact CD2-CG1 4.35Å; L105-I128 WeakPolarHBondContact O-CA 3.42Å; L105-F129 PolarHBondContact O-N 3.13Å; L105-D176 HydrophobicContact CD1-CB 3.75Å; L105-V177 HydrophobicContact CD1-CG2 4.17Å
106	V	97	Very high	88.7	Confident	26 Å²	26	45.1 Å²	45.1	16%	0.158	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	110.6	174.9	-175	0	0	0	0	109.5	F129 Y131 V175 D176 V177	V106-F129 HydrophobicContact CG1-CD1 4.44Å; V106-Y131 HydrophobicContact CG1-CD2 3.94Å; V106-Y131 HydrophobicContact CG1-CE2 3.74Å; V106-V175 HydrophobicContact CG1-CG2 4.41Å; V106-D176 WeakPolarHBondContact CB-OD2 3.27Å; V106-D176 PolarHBondContact N-OD2 3.28Å; V106-D176 PolarHBondContact O-N 3.27Å; V106-V177 PolarHBondContact O-N 2.87Å
107	L	98	Very high	89.6	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	141.1	-179.4	179.8	73.1	0	0	0	110.6	L94 L121 I128 F129 V130 Y131 V177 T179	L94-L107 HydrophobicContact CD2-CD1 4.03Å; L107-L121 HydrophobicContact CD2-CD1 3.86Å; L107-I128 HydrophobicContact CB-CG2 4.43Å; L107-F129 PolarHBondContact N-O 3.21Å; L107-V130 HydrophobicContact CB-CG2 4.34Å; L107-V130 HydrophobicContact CD2-CG1 4.28Å; L107-V130 HydrophobicContact CD2-CG2 4.13Å; L107-V130 CarbonylContact O-C 3.41Å; L107-V130 WeakPolarHBondContact O-CA 3.4Å; L107-Y131 PolarHBondContact O-N 2.77Å; L107-V177 CarbonylContact C-O 3.45Å; L107-V177 WeakPolarHBondContact CA-O 3.49Å; L107-V177 HydrophobicContact CD1-CB 3.87Å; L107-V177 HydrophobicContact CD1-CG1 3.74Å; L107-V177 WeakPolarHBondContact CD1-O 3.33Å; L107-T179 HydrophobicContact CD1-CG2 4.02Å
108	L	98.8	Very high	90.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	114.6	159.4	172	62.1	0	0	0	109.7	A110 Y131 L166 V175 V177 V178 T179 V202	L108-A110 HydrophobicContact CD2-CB 4.49Å; L108-A110 HydrophobicContact CG-CB 4.29Å; L108-A110 PolarHBondContact O-N 2.78Å; L108-Y131 CarbonylContact C-O 3.52Å; L108-Y131 WeakPolarHBondContact CA-O 3.45Å; L108-L166 HydrophobicContact CD2-CD1 3.89Å; L108-L166 HydrophobicContact CD2-CD2 4.25Å; L108-V175 HydrophobicContact CB-CG1 3.82Å; L108-V175 HydrophobicContact CB-CG2 4.13Å; L108-V177 PolarHBondContact N-O 3.46Å; L108-V178 HydrophobicContact CB-CG2 4.03Å; L108-V178 HydrophobicContact CD2-CG2 4.26Å; L108-V178 CarbonylContact O-C 3.53Å; L108-V178 VanDerWaalsContact O-CA 3.28Å; L108-V178 WeakPolarHBondContact O-CA 3.41Å; L108-T179 PolarHBondContact O-N 2.62Å; L108-T179 PolarHBondContact O-OG1 3.2Å; L108-V202 HydrophobicContact CD2-CG2 3.88Å
109	E	98.6	Very high	91.3	Very high	4 Å²	4	38 Å²	38	2%	0.019	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	100.7	164.1	-177.5	78.7	-156.9	0	0	108.6	C112 C117 I118 V130 Y131 C133 T179	E109-C112 HydrophobicContact CB-CB 4.17Å; E109-C112 HydrophobicContact CG-CB 3.66Å; E109-C117 WeakPolarHBondContact OE2-CB 3.49Å; E109-C117 PolarHBondContact OE2-SG 3.45Å; E109-I118 HydrophobicContact CB-CG2 3.49Å; E109-I118 VanDerWaalsContact CB-CG2 3.49Å; E109-I118 HydrophobicContact CG-CG2 3.69Å; E109-V130 HydrophobicContact CB-CG1 4.47Å; E109-Y131 PolarHBondContact N-O 3.1Å; E109-C133 PolarHBondContact O-N 3.22Å; E109-T179 WeakPolarHBondContact CA-OG1 3.44Å; E109-T179 VanDerWaalsContact OE2-CB 3.23Å; E109-T179 WeakPolarHBondContact OE2-CB 3.32Å; E109-T179 PolarHBondContact OE2-OG1 3.12Å
110	A	98.5	Very high	92.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	108.1	179.4	0	0	0	0	0	109.1	L108 L161 V178 T179 L180 V183 I199	L108-A110 HydrophobicContact CD2-CB 4.49Å; L108-A110 HydrophobicContact CG-CB 4.29Å; L108-A110 PolarHBondContact O-N 2.78Å; A110-L161 HydrophobicContact CB-CD1 4.05Å; A110-L161 HydrophobicContact CB-CD2 4.29Å; A110-V178 HydrophobicContact CB-CG1 4.36Å; A110-T179 PolarHBondContact N-O 3.27Å; A110-T179 VanDerWaalsContact N-O 3.16Å; A110-L180 HydrophobicContact CB-CD2 3.77Å; A110-V183 WeakPolarHBondContact O-CG1 3.47Å; A110-V183 VanDerWaalsContact O-CG2 3.26Å; A110-V183 WeakPolarHBondContact O-CG2 3.23Å; A110-I199 HydrophobicContact CB-CD1 4.29Å
111	G	98.3	Very high	92.9	Very high	17 Å²	17	24.6 Å²	24.6	18%	0.175	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	50.9	-169	0	0	0	0	0	112.6	G113 C133	G111-G113 PolarHBondContact O-N 3.21Å; G111-C133 CarbonylContact C-O 3.5Å; G111-C133 VanDerWaalsContact CA-O 3.24Å; G111-C133 WeakPolarHBondContact CA-O 3.35Å; G111-C133 PolarHBondContact N-O 3.06Å
112	C	98.1	Very high	94	Very high	7 Å²	7	16.2 Å²	16.2	5%	0.047	10%	0.095	C	C	.	.			trans	-69.4	-15.4	-168.7	68.6	0	0	0	0	115.3	E109 V114 G115 A132 C133	E109-C112 HydrophobicContact CB-CB 4.17Å; E109-C112 HydrophobicContact CG-CB 3.66Å; C112-V114 PolarHBondContact O-N 3.35Å; C112-G115 WeakPolarHBondContact O-CA 3.47Å; C112-G115 PolarHBondContact O-N 3.16Å; C112-A132 HydrophobicContact CB-CB 3.82Å; C112-C133 PolarHBondContact N-O 3.27Å
113	G	97.8	Very high	94.8	Very high	7 Å²	7	17 Å²	17	7%	0.072	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	-126.7	-175.8	0	0	0	0	0	112.4	Y73 G111 G115 D134 A139 V143	Y73-G113 WeakPolarHBondContact OH-CA 3Å; G111-G113 PolarHBondContact O-N 3.21Å; G113-G115 VanDerWaalsContact C-N 3.32Å; G113-D134 VanDerWaalsContact CA-OD2 3.3Å; G113-D134 WeakPolarHBondContact CA-OD2 3.43Å; G113-D134 PolarHBondContact N-OD2 3.33Å; G113-A139 CarbonylContact O-C 3.54Å; G113-A139 WeakPolarHBondContact O-CB 3.32Å; G113-V143 WeakPolarHBondContact O-CG2 3.32Å
114	V	97.2	Very high	94.9	Very high	8 Å²	8	20.5 Å²	20.5	5%	0.048	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	10.9	177.4	-57.2	0	0	0	0	113.3	Y73 T78 F80 C112 N116 F142	Y73-V114 HydrophobicContact CD1-CG1 3.93Å; Y73-V114 HydrophobicContact CE1-CG1 3.97Å; T78-V114 HydrophobicContact CG2-CB 4.22Å; T78-V114 HydrophobicContact CG2-CG1 4.25Å; F80-V114 HydrophobicContact CE1-CG1 3.86Å; F80-V114 HydrophobicContact CE1-CG2 3.83Å; F80-V114 HydrophobicContact CZ-CG1 4.3Å; F80-V114 HydrophobicContact CZ-CG2 4.19Å; C112-V114 PolarHBondContact O-N 3.35Å; V114-N116 WeakPolarHBondContact CG2-OD1 3.37Å; V114-F142 HydrophobicContact CB-CB 4.19Å; V114-F142 HydrophobicContact CG1-CB 3.87Å; V114-F142 HydrophobicContact CG1-CD2 3.64Å; V114-F142 HydrophobicContact CG1-CG 4.11Å
115	G	96.9	Very high	94.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.094	C	C	.	.	S	Bend	trans	90.2	13.1	172.4	0	0	0	0	0	116	C112 G113 C117 I118 F119	C112-G115 WeakPolarHBondContact O-CA 3.47Å; C112-G115 PolarHBondContact O-N 3.16Å; G113-G115 VanDerWaalsContact C-N 3.32Å; G115-C117 PolarHBondContact O-N 2.91Å; G115-I118 WeakPolarHBondContact O-CG1 3.38Å; G115-I118 PolarHBondContact O-N 2.91Å; G115-F119 WeakPolarHBondContact O-CD2 3.4Å; G115-F119 PolarHBondContact O-N 3.2Å
116	N	95.2	Very high	94.3	Very high	13 Å²	13	24.1 Å²	24.1	7%	0.07	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-17.9	179.8	-65.3	114.9	0	0	0	114.5	F81 D83 R84 V114	F81-N116 PolarHBondContact O-ND2 2.85Å; D83-N116 WeakPolarHBondContact CA-O 3.19Å; D83-N116 WeakPolarHBondContact OD1-CA 3.24Å; D83-N116 PolarHBondContact OD1-ND2 3.36Å; R84-N116 PolarHBondContact N-O 3.49Å; V114-N116 WeakPolarHBondContact CG2-OD1 3.37Å
117	C	93.3	Very high	94	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.014	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-42	172.2	-167.6	0	0	0	0	111.7	E109 G115 L121	E109-C117 WeakPolarHBondContact OE2-CB 3.49Å; E109-C117 PolarHBondContact OE2-SG 3.45Å; G115-C117 PolarHBondContact O-N 2.91Å; C117-L121 WeakPolarHBondContact O-CG 3.41Å
118	I	95	Very high	93.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-86.9	-32.8	-167.3	68	175	0	0	0	113.4	E109 G115 L121 L122 V130 A132 V143	E109-I118 HydrophobicContact CB-CG2 3.49Å; E109-I118 VanDerWaalsContact CB-CG2 3.49Å; E109-I118 HydrophobicContact CG-CG2 3.69Å; G115-I118 WeakPolarHBondContact O-CG1 3.38Å; G115-I118 PolarHBondContact O-N 2.91Å; I118-L121 PolarHBondContact O-N 2.87Å; I118-L122 WeakPolarHBondContact O-CB 3.32Å; I118-L122 VanDerWaalsContact O-CG 3.3Å; I118-L122 WeakPolarHBondContact O-CG 3.49Å; I118-L122 PolarHBondContact O-N 2.85Å; I118-V130 HydrophobicContact CB-CG1 4.18Å; I118-V130 HydrophobicContact CD1-CG1 4.45Å; I118-V130 HydrophobicContact CG2-CG1 3.78Å; I118-A132 HydrophobicContact CD1-CB 3.81Å; I118-V143 HydrophobicContact CD1-CG1 3.98Å
119	F	95.3	Very high	93.6	Very high	7 Å²	7	26.4 Å²	26.4	3%	0.031	14%	0.141	C	C	.	.	H	α-helix	trans	-66.2	-44.3	-176.6	-70.8	-57.5	0	0	0	113	G115 L121 L122 E123 V143 N146 L148	G115-F119 WeakPolarHBondContact O-CD2 3.4Å; G115-F119 PolarHBondContact O-N 3.2Å; F119-L121 VanDerWaalsContact C-N 3.26Å; F119-L121 PolarHBondContact O-N 2.92Å; F119-L122 HydrophobicContact CD1-CD1 4.22Å; F119-L122 HydrophobicContact CE1-CD1 4.47Å; F119-L122 PolarHBondContact O-N 2.79Å; F119-L122 VanDerWaalsContact O-N 3.16Å; F119-E123 WeakPolarHBondContact O-CG 3.28Å; F119-E123 PolarHBondContact O-N 3.37Å; F119-V143 HydrophobicContact CZ-CG1 3.99Å; F119-N146 HydrophobicContact CD2-CB 4.44Å; F119-N146 WeakPolarHBondContact CD2-ND2 3.34Å; F119-N146 HydrophobicContact CE1-CB 3.81Å; F119-N146 HydrophobicContact CE2-CB 3.56Å; F119-N146 VanDerWaalsContact CE2-CG 3.43Å; F119-N146 WeakPolarHBondContact CE2-ND2 3.44Å; F119-N146 HydrophobicContact CZ-CB 3.2Å; F119-L148 HydrophobicContact CB-CD1 4.12Å; F119-L148 HydrophobicContact CD1-CB 3.66Å; F119-L148 HydrophobicContact CD1-CD1 4.27Å; F119-L148 HydrophobicContact CE1-CB 4.05Å; F119-L148 HydrophobicContact CG-CD1 4.41Å
120	P	92.6	Very high	93.6	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.013	14%	0.14	C	C	.	.	H	α-helix	trans	-55.1	-42	171.8	-28.9	37.6	0	0	0	113.1	D83 E123 E124	D83-P120 HydrophobicContact CB-CG 3.82Å; P120-E123 PolarHBondContact O-N 3.06Å; P120-E124 WeakPolarHBondContact O-CB 3.23Å; P120-E124 VanDerWaalsContact O-CG 3.32Å; P120-E124 WeakPolarHBondContact O-CG 3.37Å; P120-E124 PolarHBondContact O-N 3.02Å
121	L	90.9	Very high	93.6	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-66.1	-42.2	178.5	-61.5	175.9	0	0	0	112.1	T88 L94 L107 C117 I118 F119 E123 E124 D125 I128	T88-L121 HydrophobicContact CG2-CD2 3.4Å; L94-L121 HydrophobicContact CD1-CD1 4.39Å; L94-L121 HydrophobicContact CD1-CD2 4.16Å; L107-L121 HydrophobicContact CD2-CD1 3.86Å; C117-L121 WeakPolarHBondContact O-CG 3.41Å; I118-L121 PolarHBondContact O-N 2.87Å; F119-L121 VanDerWaalsContact C-N 3.26Å; F119-L121 PolarHBondContact O-N 2.92Å; L121-E123 VanDerWaalsContact C-N 3.29Å; L121-E123 PolarHBondContact O-N 3.34Å; L121-E124 PolarHBondContact O-N 2.86Å; L121-D125 PolarHBondContact O-N 3.17Å; L121-D125 VanDerWaalsContact O-N 3.12Å; L121-I128 HydrophobicContact CB-CD1 4.27Å
122	L	92	Very high	93.6	Very high	9 Å²	9	27.1 Å²	27.1	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-67.1	-30.9	178.8	-73.9	170.3	0	0	0	112.5	I118 F119 V130 R153 C154	I118-L122 WeakPolarHBondContact O-CB 3.32Å; I118-L122 VanDerWaalsContact O-CG 3.3Å; I118-L122 WeakPolarHBondContact O-CG 3.49Å; I118-L122 PolarHBondContact O-N 2.85Å; F119-L122 HydrophobicContact CD1-CD1 4.22Å; F119-L122 HydrophobicContact CE1-CD1 4.47Å; F119-L122 PolarHBondContact O-N 2.79Å; F119-L122 VanDerWaalsContact O-N 3.16Å; L122-V130 HydrophobicContact CD2-CG2 3.81Å; L122-V130 HydrophobicContact CG-CG2 4.13Å; L122-R153 HydrophobicContact CD2-CB 4.18Å; L122-R153 PolarHBondContact O-NH1 3.05Å; L122-R153 PolarHBondContact O-NH2 3.37Å; L122-C154 HydrophobicContact CD1-CB 4.16Å
123	E	90.9	Very high	93.6	Very high	113 Å²	113	26.8 Å²	26.8	53%	0.528	14%	0.137	S	C	.	.	H	α-helix	trans	-74	-42.4	174.4	-72.5	-179.5	111.1	0	0	112.3	F119 P120 L121 L148	F119-E123 WeakPolarHBondContact O-CG 3.28Å; F119-E123 PolarHBondContact O-N 3.37Å; P120-E123 PolarHBondContact O-N 3.06Å; L121-E123 VanDerWaalsContact C-N 3.29Å; L121-E123 PolarHBondContact O-N 3.34Å; E123-L148 HydrophobicContact CG-CD1 3.7Å; E123-L148 HydrophobicContact CG-CD2 4.14Å; E123-L148 HydrophobicContact CG-CG 4.5Å; E123-L148 WeakPolarHBondContact OE1-CD1 3.24Å
124	E	86.8	Confident	93.7	Very high	110 Å²	110	27 Å²	27	51%	0.514	14%	0.136	S	C	.	.	H	α-helix	trans	-73.5	-32.2	-175.8	-74	175.8	-166.6	0	0	113.2	P120 L121	P120-E124 WeakPolarHBondContact O-CB 3.23Å; P120-E124 VanDerWaalsContact O-CG 3.32Å; P120-E124 WeakPolarHBondContact O-CG 3.37Å; P120-E124 PolarHBondContact O-N 3.02Å; L121-E124 PolarHBondContact O-N 2.86Å
125	D	83.8	Confident	93.7	Very high	39 Å²	39	29 Å²	29	21%	0.209	14%	0.144	C	C	.	.			trans	-138	115.2	-172.4	-175.9	-19	0	0	0	111.8	R98 L121 S127 I128 R153	R98-D125 IonicContact CZ-OD1 3.47Å; R98-D125 IonicContact CZ-OD2 3.9Å; R98-D125 VanDerWaalsContact CZ-OD2 3.23Å; R98-D125 IonicContact NH1-OD1 3.58Å; R98-D125 PolarHBondContact NH1-OD1 3.43Å; R98-D125 IonicContact NH1-OD2 3.01Å; R98-D125 PolarHBondContact NH1-OD2 3.01Å; R98-D125 IonicContact NH2-OD1 2.84Å; R98-D125 PolarHBondContact NH2-OD1 2.77Å; R98-D125 IonicContact NH2-OD2 3.27Å; R98-D125 PolarHBondContact NH2-OD2 2.64Å; L121-D125 PolarHBondContact O-N 3.17Å; L121-D125 VanDerWaalsContact O-N 3.12Å; D125-S127 VanDerWaalsContact C-N 3.26Å; D125-S127 PolarHBondContact O-N 2.83Å; D125-S127 WeakPolarHBondContact OD1-CA 3.47Å; D125-S127 WeakPolarHBondContact OD1-CB 3.44Å; D125-S127 PolarHBondContact OD1-N 2.63Å; D125-I128 HydrophobicContact CB-CD1 3.72Å; D125-I128 HydrophobicContact CB-CG1 3.88Å; D125-R153 PolarHBondContact O-NH2 2.91Å
126	L	85.3	Confident	93.8	Very high	137 Å²	137	29 Å²	29	72%	0.717	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-16.8	-178.8	-62.8	-177.2	0	0	0	114.2	I128 R153	L126-I128 VanDerWaalsContact C-N 3.34Å; L126-R153 VanDerWaalsContact CD2-NH1 3.31Å; L126-R153 PolarHBondContact O-NE 3.45Å; L126-R153 PolarHBondContact O-NH2 3.42Å
127	S	90.1	Very high	93.9	Very high	41 Å²	41	30.4 Å²	30.4	29%	0.287	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	18.3	-175.9	-66.4	0	0	0	0	112.8	R98 K104 L105 D125	R98-S127 PolarHBondContact NH2-O 3.2Å; K104-S127 CarbonylContact C-O 3.57Å; K104-S127 VanDerWaalsContact CA-O 3.23Å; K104-S127 WeakPolarHBondContact CA-O 3.47Å; K104-S127 WeakPolarHBondContact CG-O 3.48Å; L105-S127 PolarHBondContact N-O 3.35Å; D125-S127 VanDerWaalsContact C-N 3.26Å; D125-S127 PolarHBondContact O-N 2.83Å; D125-S127 WeakPolarHBondContact OD1-CA 3.47Å; D125-S127 WeakPolarHBondContact OD1-CB 3.44Å; D125-S127 PolarHBondContact OD1-N 2.63Å
128	I	92.3	Very high	94.1	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	134.9	171.1	-56.3	-178.8	0	0	0	110.5	L105 L107 L121 D125 L126 V130 R153	L105-I128 HydrophobicContact CB-CG1 4.32Å; L105-I128 HydrophobicContact CD2-CD1 4.37Å; L105-I128 HydrophobicContact CD2-CG1 4.35Å; L105-I128 WeakPolarHBondContact O-CA 3.42Å; L107-I128 HydrophobicContact CB-CG2 4.43Å; L121-I128 HydrophobicContact CB-CD1 4.27Å; D125-I128 HydrophobicContact CB-CD1 3.72Å; D125-I128 HydrophobicContact CB-CG1 3.88Å; L126-I128 VanDerWaalsContact C-N 3.34Å; I128-V130 HydrophobicContact CG2-CG2 3.64Å; I128-R153 PolarHBondContact O-NH2 3.19Å
129	F	96.4	Very high	94.3	Very high	31 Å²	31	33.7 Å²	33.7	14%	0.136	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	135.9	158.3	-170	-94.6	0	0	0	110.2	K104 L105 V106 L107 Y131 E152 R153 C155	K104-F129 HydrophobicContact CD-CB 4.07Å; L105-F129 PolarHBondContact O-N 3.13Å; V106-F129 HydrophobicContact CG1-CD1 4.44Å; L107-F129 PolarHBondContact N-O 3.21Å; F129-Y131 HydrophobicContact CD1-CD2 4.02Å; F129-Y131 AromaticContact CD1-CE2 3.84Å; F129-Y131 HydrophobicContact CD1-CE2 3.84Å; F129-Y131 AromaticContact CE1-CD1 3.9Å; F129-Y131 HydrophobicContact CE1-CD1 3.9Å; F129-Y131 AromaticContact CE1-CD2 3.85Å; F129-Y131 HydrophobicContact CE1-CD2 3.85Å; F129-Y131 AromaticContact CE1-CE1 3.66Å; F129-Y131 HydrophobicContact CE1-CE1 3.66Å; F129-Y131 AromaticContact CE1-CE2 3.59Å; F129-Y131 HydrophobicContact CE1-CE2 3.59Å; F129-Y131 HydrophobicContact CE1-CG 4.01Å; F129-Y131 AromaticContact CE1-CZ 3.5Å; F129-Y131 VanDerWaalsContact CE1-CZ 3.5Å; F129-Y131 HydrophobicContact CZ-CE1 4.33Å; F129-E152 WeakPolarHBondContact CD2-O 3.37Å; F129-R153 CarbonylContact C-O 3.49Å; F129-R153 WeakPolarHBondContact CA-O 3.44Å; F129-C155 HydrophobicContact CE1-CB 4.22Å; F129-C155 HydrophobicContact CZ-CB 3.88Å
130	V	98.3	Very high	94.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	118.8	-178.8	-174.7	0	0	0	0	111.1	L107 E109 I118 L122 I128 A132 R153 C154 C155	L107-V130 HydrophobicContact CB-CG2 4.34Å; L107-V130 HydrophobicContact CD2-CG1 4.28Å; L107-V130 HydrophobicContact CD2-CG2 4.13Å; L107-V130 CarbonylContact O-C 3.41Å; L107-V130 WeakPolarHBondContact O-CA 3.4Å; E109-V130 HydrophobicContact CB-CG1 4.47Å; I118-V130 HydrophobicContact CB-CG1 4.18Å; I118-V130 HydrophobicContact CD1-CG1 4.45Å; I118-V130 HydrophobicContact CG2-CG1 3.78Å; L122-V130 HydrophobicContact CD2-CG2 3.81Å; L122-V130 HydrophobicContact CG-CG2 4.13Å; I128-V130 HydrophobicContact CG2-CG2 3.64Å; V130-A132 HydrophobicContact CG1-CB 4.2Å; V130-R153 PolarHBondContact N-O 2.93Å; V130-C154 CarbonylContact O-C 3.51Å; V130-C154 WeakPolarHBondContact O-CA 3.43Å; V130-C155 PolarHBondContact O-N 3.4Å
131	Y	98.8	Very high	94.7	Very high	35 Å²	35	38 Å²	38	14%	0.137	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	127	154.7	-67.2	-76.6	0	0	0	108.1	V106 L107 L108 E109 F129 C155 F157 N169 V170 P171 V175	V106-Y131 HydrophobicContact CG1-CD2 3.94Å; V106-Y131 HydrophobicContact CG1-CE2 3.74Å; L107-Y131 PolarHBondContact O-N 2.77Å; L108-Y131 CarbonylContact C-O 3.52Å; L108-Y131 WeakPolarHBondContact CA-O 3.45Å; E109-Y131 PolarHBondContact N-O 3.1Å; F129-Y131 HydrophobicContact CD1-CD2 4.02Å; F129-Y131 AromaticContact CD1-CE2 3.84Å; F129-Y131 HydrophobicContact CD1-CE2 3.84Å; F129-Y131 AromaticContact CE1-CD1 3.9Å; F129-Y131 HydrophobicContact CE1-CD1 3.9Å; F129-Y131 AromaticContact CE1-CD2 3.85Å; F129-Y131 HydrophobicContact CE1-CD2 3.85Å; F129-Y131 AromaticContact CE1-CE1 3.66Å; F129-Y131 HydrophobicContact CE1-CE1 3.66Å; F129-Y131 AromaticContact CE1-CE2 3.59Å; F129-Y131 HydrophobicContact CE1-CE2 3.59Å; F129-Y131 HydrophobicContact CE1-CG 4.01Å; F129-Y131 AromaticContact CE1-CZ 3.5Å; F129-Y131 VanDerWaalsContact CE1-CZ 3.5Å; F129-Y131 HydrophobicContact CZ-CE1 4.33Å; Y131-C155 WeakPolarHBondContact CA-O 3.36Å; Y131-C155 HydrophobicContact CD1-CB 3.81Å; Y131-C155 HydrophobicContact CE1-CB 4.1Å; Y131-F157 HydrophobicContact CD1-CE1 4.21Å; Y131-N169 WeakPolarHBondContact CE1-O 3.23Å; Y131-V170 HydrophobicContact CD1-CB 4.44Å; Y131-V170 HydrophobicContact CD1-CG1 4.47Å; Y131-V170 HydrophobicContact CD1-CG2 3.64Å; Y131-V170 HydrophobicContact CD2-CG1 3.82Å; Y131-V170 HydrophobicContact CD2-CG2 4.26Å; Y131-V170 HydrophobicContact CE1-CG1 4.5Å; Y131-V170 HydrophobicContact CE1-CG2 4.14Å; Y131-V170 HydrophobicContact CE2-CG1 3.86Å; Y131-V170 HydrophobicContact CG-CB 4.47Å; Y131-V170 HydrophobicContact CG-CG1 4.13Å; Y131-V170 HydrophobicContact CG-CG2 3.7Å; Y131-P171 WeakPolarHBondContact OH-CD 3.37Å; Y131-V175 HydrophobicContact CD2-CG2 4.38Å
132	A	98.7	Very high	95.1	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	109.2	-176.6	0	0	0	0	0	109.4	C112 I118 V130 C155 A156 F157	C112-A132 HydrophobicContact CB-CB 3.82Å; I118-A132 HydrophobicContact CD1-CB 3.81Å; V130-A132 HydrophobicContact CG1-CB 4.2Å; A132-C155 PolarHBondContact N-O 3.3Å; A132-A156 HydrophobicContact CB-CB 4.39Å; A132-A156 CarbonylContact O-C 3.51Å; A132-A156 WeakPolarHBondContact O-CA 3.46Å; A132-F157 PolarHBondContact O-N 3.17Å
133	C	98.8	Very high	95.4	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.5	179.7	76.2	0	0	0	0	112.9	E109 G111 C112 F157 C159	E109-C133 PolarHBondContact O-N 3.22Å; G111-C133 CarbonylContact C-O 3.5Å; G111-C133 VanDerWaalsContact CA-O 3.24Å; G111-C133 WeakPolarHBondContact CA-O 3.35Å; G111-C133 PolarHBondContact N-O 3.06Å; C112-C133 PolarHBondContact N-O 3.27Å; C133-F157 WeakPolarHBondContact CA-O 3.37Å; C133-F157 HydrophobicContact CB-CD1 4.43Å; C133-F157 HydrophobicContact CB-CD2 3.82Å; C133-F157 HydrophobicContact CB-CE1 4.09Å; C133-F157 HydrophobicContact CB-CE2 3.42Å; C133-F157 VanDerWaalsContact CB-CE2 3.42Å; C133-F157 HydrophobicContact CB-CG 4.31Å; C133-F157 HydrophobicContact CB-CZ 3.57Å; C133-C159 HydrophobicContact CB-CB 3.77Å
134	D	98.8	Very high	95.7	Very high	11 Å²	11	38.9 Å²	38.9	6%	0.059	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	152.6	172.4	-160.6	-79.2	0	0	0	110.4	Y73 G113 S136 A139 V140 F157 Q158 C159	Y73-D134 PolarHBondContact OH-OD2 2.78Å; G113-D134 VanDerWaalsContact CA-OD2 3.3Å; G113-D134 WeakPolarHBondContact CA-OD2 3.43Å; G113-D134 PolarHBondContact N-OD2 3.33Å; D134-S136 PolarHBondContact O-N 2.92Å; D134-S136 WeakPolarHBondContact OD1-CB 3.26Å; D134-S136 PolarHBondContact OD1-N 3.47Å; D134-A139 HydrophobicContact CB-CB 3.87Å; D134-V140 HydrophobicContact CB-CG2 3.99Å; D134-F157 PolarHBondContact N-O 2.83Å; D134-Q158 WeakPolarHBondContact O-CA 3.34Å; D134-C159 CarbonylContact C-O 3.57Å; D134-C159 PolarHBondContact O-N 2.9Å
135	F	98.1	Very high	96.3	Very high	49 Å²	49	40.4 Å²	40.4	22%	0.215	19%	0.193	C	C	.	.	S	Bend	trans	-66.8	-31.7	177.1	-173.3	-149.6	0	0	0	111.9	A65 Q66 Q158 C159 D160	A65-F135 HydrophobicContact CB-CE1 3.89Å; A65-F135 HydrophobicContact CB-CZ 4.37Å; Q66-F135 HydrophobicContact CB-CD1 4.25Å; Q66-F135 HydrophobicContact CB-CD2 4.29Å; Q66-F135 HydrophobicContact CB-CE1 3.71Å; Q66-F135 HydrophobicContact CB-CE2 3.71Å; Q66-F135 HydrophobicContact CB-CZ 3.42Å; Q66-F135 VanDerWaalsContact CB-CZ 3.42Å; Q66-F135 HydrophobicContact CG-CD1 4.45Å; Q66-F135 HydrophobicContact CG-CD2 4.05Å; Q66-F135 HydrophobicContact CG-CE1 4.36Å; Q66-F135 HydrophobicContact CG-CE2 3.91Å; Q66-F135 HydrophobicContact CG-CG 4.33Å; Q66-F135 HydrophobicContact CG-CZ 4.1Å; Q66-F135 WeakPolarHBondContact CG-O 3.42Å; Q66-F135 PolarHBondContact NE2-O 3.48Å; F135-Q158 PolarHBondContact O-NE2 3.16Å; F135-C159 WeakPolarHBondContact CA-O 3.1Å; F135-C159 PolarHBondContact N-O 3.32Å; F135-D160 HydrophobicContact CD2-CB 3.71Å; F135-D160 HydrophobicContact CE2-CB 3.61Å; F135-D160 VanDerWaalsContact CE2-CG 3.43Å; F135-D160 VanDerWaalsContact CE2-OD2 3.29Å; F135-D160 WeakPolarHBondContact CE2-OD2 3.36Å
136	S	98.3	Very high	96.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-88.3	121.9	178.8	173.2	0	0	0	0	111.4	D70 Y73 D134 R138 A139 V140	D70-S136 PolarHBondContact OD1-OG 2.96Å; Y73-S136 VanDerWaalsContact CD2-CB 3.49Å; Y73-S136 VanDerWaalsContact CD2-OG 3.29Å; Y73-S136 WeakPolarHBondContact CD2-OG 3.32Å; D134-S136 PolarHBondContact O-N 2.92Å; D134-S136 WeakPolarHBondContact OD1-CB 3.26Å; D134-S136 PolarHBondContact OD1-N 3.47Å; S136-R138 PolarHBondContact O-N 3.34Å; S136-R138 PolarHBondContact OG-N 2.93Å; S136-A139 WeakPolarHBondContact O-CB 3.22Å; S136-A139 PolarHBondContact O-N 3.24Å; S136-A139 PolarHBondContact OG-N 3.38Å; S136-V140 PolarHBondContact O-N 3.31Å
137	P	97.9	Very high	97.4	Very high	44 Å²	44	39.3 Å²	39.3	29%	0.286	19%	0.194	S	C	.	.	H	α-helix	trans	-62.6	-32.4	175.3	24.9	-29.2	0	0	0	111.6	A139 V140 E141 Q158	P137-A139 PolarHBondContact O-N 3.05Å; P137-V140 WeakPolarHBondContact O-CB 3.36Å; P137-V140 PolarHBondContact O-N 3.42Å; P137-E141 PolarHBondContact O-N 3.49Å; P137-Q158 HydrophobicContact CB-CG 4.48Å
138	R	98.2	Very high	97.6	Very high	70 Å²	70	40.5 Å²	40.5	26%	0.264	20%	0.197	S	C	.	.	H	α-helix	trans	-67.2	-34.2	177.2	-178.2	-176.6	-51.5	-72.1	-9.7	113.4	D70 K74 S136 E141 F142	D70-R138 PolarHBondContact O-NE 2.86Å; D70-R138 WeakPolarHBondContact OD1-CB 2.95Å; D70-R138 IonicContact OD1-CZ 2.64Å; D70-R138 IonicContact OD1-NE 3.99Å; D70-R138 PolarHBondContact OD1-NE 2.87Å; D70-R138 IonicContact OD1-NH2 3.91Å; D70-R138 IonicContact OD2-CZ 3.21Å; D70-R138 IonicContact OD2-NE 3.23Å; D70-R138 PolarHBondContact OD2-NE 2.93Å; D70-R138 IonicContact OD2-NH2 3.56Å; D70-R138 PolarHBondContact OD2-NH2 3.35Å; K74-R138 VanDerWaalsContact N-CD 3.3Å; S136-R138 PolarHBondContact O-N 3.34Å; S136-R138 PolarHBondContact OG-N 2.93Å; R138-E141 WeakPolarHBondContact O-CB 3.41Å; R138-E141 PolarHBondContact O-N 3.36Å; R138-F142 HydrophobicContact CG-CD2 4.15Å; R138-F142 HydrophobicContact CG-CE2 3.64Å; R138-F142 HydrophobicContact CG-CZ 4.02Å; R138-F142 VanDerWaalsContact O-CD2 3.24Å; R138-F142 WeakPolarHBondContact O-CD2 3.28Å; R138-F142 WeakPolarHBondContact O-CG 3.22Å; R138-F142 PolarHBondContact O-N 2.86Å
139	A	98.1	Very high	97.8	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.6	-47.9	175.1	0	0	0	0	0	110.3	Y73 G113 D134 S136 P137 E141 F142 V143	Y73-A139 HydrophobicContact CD1-CB 4.17Å; Y73-A139 HydrophobicContact CD2-CB 3.88Å; Y73-A139 HydrophobicContact CE1-CB 3.91Å; Y73-A139 HydrophobicContact CE2-CB 3.61Å; Y73-A139 HydrophobicContact CG-CB 4.15Å; G113-A139 CarbonylContact O-C 3.54Å; G113-A139 WeakPolarHBondContact O-CB 3.32Å; D134-A139 HydrophobicContact CB-CB 3.87Å; S136-A139 WeakPolarHBondContact O-CB 3.22Å; S136-A139 PolarHBondContact O-N 3.24Å; S136-A139 PolarHBondContact OG-N 3.38Å; P137-A139 PolarHBondContact O-N 3.05Å; A139-E141 VanDerWaalsContact C-N 3.3Å; A139-E141 PolarHBondContact O-N 2.86Å; A139-F142 WeakPolarHBondContact O-CB 3.45Å; A139-F142 PolarHBondContact O-N 3.34Å; A139-V143 PolarHBondContact O-N 3.46Å
140	V	98.6	Very high	97.8	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-41.5	174.2	179.2	0	0	0	0	111.6	D134 S136 P137 F142 V143 K144 A156 F157 Q158	D134-V140 HydrophobicContact CB-CG2 3.99Å; S136-V140 PolarHBondContact O-N 3.31Å; P137-V140 WeakPolarHBondContact O-CB 3.36Å; P137-V140 PolarHBondContact O-N 3.42Å; V140-F142 VanDerWaalsContact C-N 3.34Å; V140-F142 PolarHBondContact O-N 2.78Å; V140-V143 PolarHBondContact O-N 2.91Å; V140-K144 HydrophobicContact CG1-CD 4.33Å; V140-K144 WeakPolarHBondContact O-CG 3.4Å; V140-K144 PolarHBondContact O-N 3.36Å; V140-A156 HydrophobicContact CG1-CB 4.07Å; V140-F157 VanDerWaalsContact CG2-O 3.26Å; V140-F157 WeakPolarHBondContact CG2-O 3.43Å; V140-Q158 HydrophobicContact CG2-CB 4.47Å
141	E	98.4	Very high	97.8	Very high	92 Å²	92	50.5 Å²	50.5	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-40.7	173.9	-77.5	-174.1	-154.6	0	0	112.9	P137 R138 A139 V143 K144 K145	P137-E141 PolarHBondContact O-N 3.49Å; R138-E141 WeakPolarHBondContact O-CB 3.41Å; R138-E141 PolarHBondContact O-N 3.36Å; A139-E141 VanDerWaalsContact C-N 3.3Å; A139-E141 PolarHBondContact O-N 2.86Å; E141-V143 VanDerWaalsContact C-N 3.35Å; E141-K144 PolarHBondContact O-N 3.03Å; E141-K145 WeakPolarHBondContact O-CB 3.27Å; E141-K145 VanDerWaalsContact O-CG 3.28Å; E141-K145 WeakPolarHBondContact O-CG 3.39Å; E141-K145 PolarHBondContact O-N 3.33Å; E141-K145 IonicContact OE2-NZ 2.67Å; E141-K145 PolarHBondContact OE2-NZ 3.37Å
142	F	98.3	Very high	97.6	Very high	43 Å²	43	55.2 Å²	55.2	19%	0.189	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-40.5	177.2	-71.5	-46.3	0	0	0	111.7	T78 V114 R138 A139 V140 K145 N146	T78-F142 HydrophobicContact CG2-CB 4.12Å; T78-F142 HydrophobicContact CG2-CD1 3.98Å; T78-F142 HydrophobicContact CG2-CD2 4.46Å; T78-F142 HydrophobicContact CG2-CE1 4.5Å; T78-F142 HydrophobicContact CG2-CG 3.97Å; V114-F142 HydrophobicContact CB-CB 4.19Å; V114-F142 HydrophobicContact CG1-CB 3.87Å; V114-F142 HydrophobicContact CG1-CD2 3.64Å; V114-F142 HydrophobicContact CG1-CG 4.11Å; R138-F142 HydrophobicContact CG-CD2 4.15Å; R138-F142 HydrophobicContact CG-CE2 3.64Å; R138-F142 HydrophobicContact CG-CZ 4.02Å; R138-F142 VanDerWaalsContact O-CD2 3.24Å; R138-F142 WeakPolarHBondContact O-CD2 3.28Å; R138-F142 WeakPolarHBondContact O-CG 3.22Å; R138-F142 PolarHBondContact O-N 2.86Å; A139-F142 WeakPolarHBondContact O-CB 3.45Å; A139-F142 PolarHBondContact O-N 3.34Å; V140-F142 VanDerWaalsContact C-N 3.34Å; V140-F142 PolarHBondContact O-N 2.78Å; F142-K145 PolarHBondContact O-N 2.95Å; F142-N146 PolarHBondContact O-N 3.17Å
143	V	98.3	Very high	97.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-49.3	172.6	172.5	0	0	0	0	110.6	G113 I118 F119 A139 V140 E141 K145 N146 Y149 A156	G113-V143 WeakPolarHBondContact O-CG2 3.32Å; I118-V143 HydrophobicContact CD1-CG1 3.98Å; F119-V143 HydrophobicContact CZ-CG1 3.99Å; A139-V143 PolarHBondContact O-N 3.46Å; V140-V143 PolarHBondContact O-N 2.91Å; E141-V143 VanDerWaalsContact C-N 3.35Å; V143-K145 VanDerWaalsContact C-N 3.28Å; V143-K145 PolarHBondContact O-N 3.16Å; V143-N146 VanDerWaalsContact O-CB 3.3Å; V143-N146 WeakPolarHBondContact O-CB 3.38Å; V143-N146 PolarHBondContact O-N 3.03Å; V143-N146 VanDerWaalsContact O-N 3.16Å; V143-Y149 HydrophobicContact CG1-CD2 4.01Å; V143-Y149 HydrophobicContact CG1-CE2 4.3Å; V143-Y149 WeakPolarHBondContact O-CB 2.95Å; V143-A156 HydrophobicContact CB-CB 4.37Å; V143-A156 HydrophobicContact CG1-CB 3.79Å
144	K	98.4	Very high	97.4	Very high	103 Å²	103	57.3 Å²	57.3	45%	0.448	28%	0.276	S	S	.	.	H	α-helix	trans	-64.5	-28.8	-179.9	-71.4	-178.9	178.7	179.3	0	114	V140 E141 Y149 A156	V140-K144 HydrophobicContact CG1-CD 4.33Å; V140-K144 WeakPolarHBondContact O-CG 3.4Å; V140-K144 PolarHBondContact O-N 3.36Å; E141-K144 PolarHBondContact O-N 3.03Å; K144-Y149 HydrophobicContact CG-CE1 4.23Å; K144-Y149 HydrophobicContact CG-CE2 4.32Å; K144-A156 WeakPolarHBondContact CE-O 3.46Å; K144-A156 HydrophobicContact CG-CB 4.04Å; K144-A156 PolarHBondContact NZ-O 3.31Å
145	K	97.8	Very high	97.4	Very high	141 Å²	141	58.7 Å²	58.7	61%	0.613	29%	0.286	S	S	*	.	H	α-helix	trans	-83.4	-10.4	178.1	-73.8	167.8	-179	159.5	0	113.2	E141 F142 V143	E141-K145 WeakPolarHBondContact O-CB 3.27Å; E141-K145 VanDerWaalsContact O-CG 3.28Å; E141-K145 WeakPolarHBondContact O-CG 3.39Å; E141-K145 PolarHBondContact O-N 3.33Å; E141-K145 IonicContact OE2-NZ 2.67Å; E141-K145 PolarHBondContact OE2-NZ 3.37Å; F142-K145 PolarHBondContact O-N 2.95Å; V143-K145 VanDerWaalsContact C-N 3.28Å; V143-K145 PolarHBondContact O-N 3.16Å
146	N	97.1	Very high	97.5	Very high	46 Å²	46	56.5 Å²	56.5	25%	0.246	28%	0.277	C	S	.	.	S	Bend	trans	-66.2	134.2	179.3	-171.4	-61.3	0	0	0	110.5	F119 F142 V143 L148 Y149	F119-N146 HydrophobicContact CD2-CB 4.44Å; F119-N146 WeakPolarHBondContact CD2-ND2 3.34Å; F119-N146 HydrophobicContact CE1-CB 3.81Å; F119-N146 HydrophobicContact CE2-CB 3.56Å; F119-N146 VanDerWaalsContact CE2-CG 3.43Å; F119-N146 WeakPolarHBondContact CE2-ND2 3.44Å; F119-N146 HydrophobicContact CZ-CB 3.2Å; F142-N146 PolarHBondContact O-N 3.17Å; V143-N146 VanDerWaalsContact O-CB 3.3Å; V143-N146 WeakPolarHBondContact O-CB 3.38Å; V143-N146 PolarHBondContact O-N 3.03Å; V143-N146 VanDerWaalsContact O-N 3.16Å; N146-L148 PolarHBondContact O-N 3.06Å; N146-L148 VanDerWaalsContact O-N 3.08Å; N146-L148 WeakPolarHBondContact OD1-CB 2.98Å; N146-L148 PolarHBondContact OD1-N 2.95Å; N146-Y149 VanDerWaalsContact O-CB 3.28Å; N146-Y149 WeakPolarHBondContact O-CB 3.43Å; N146-Y149 PolarHBondContact O-N 3.19Å
147	P	95.4	Very high	97.5	Very high	108 Å²	108	57 Å²	57	70%	0.701	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.9	179.1	-26.6	35.4	0	0	0	115.6	R150	P147-R150 PolarHBondContact O-NH1 3.02Å; P147-R150 PolarHBondContact O-NH2 3.37Å
148	L	94.3	Very high	97.5	Very high	66 Å²	66	59 Å²	59	35%	0.346	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-9.5	177.7	-60.9	171.5	0	0	0	113	F119 E123 N146 R150	F119-L148 HydrophobicContact CB-CD1 4.12Å; F119-L148 HydrophobicContact CD1-CB 3.66Å; F119-L148 HydrophobicContact CD1-CD1 4.27Å; F119-L148 HydrophobicContact CE1-CB 4.05Å; F119-L148 HydrophobicContact CG-CD1 4.41Å; E123-L148 HydrophobicContact CG-CD1 3.7Å; E123-L148 HydrophobicContact CG-CD2 4.14Å; E123-L148 HydrophobicContact CG-CG 4.5Å; E123-L148 WeakPolarHBondContact OE1-CD1 3.24Å; N146-L148 PolarHBondContact O-N 3.06Å; N146-L148 VanDerWaalsContact O-N 3.08Å; N146-L148 WeakPolarHBondContact OD1-CB 2.98Å; N146-L148 PolarHBondContact OD1-N 2.95Å; L148-R150 PolarHBondContact O-N 3.08Å
149	Y	97.4	Very high	97.5	Very high	36 Å²	36	55.8 Å²	55.8	14%	0.141	27%	0.273	C	S	.	.			trans	-65.9	125.6	176.9	-176.4	-98.2	0	0	0	110.6	V143 K144 N146 P151 C154 A156	V143-Y149 HydrophobicContact CG1-CD2 4.01Å; V143-Y149 HydrophobicContact CG1-CE2 4.3Å; V143-Y149 WeakPolarHBondContact O-CB 2.95Å; K144-Y149 HydrophobicContact CG-CE1 4.23Å; K144-Y149 HydrophobicContact CG-CE2 4.32Å; N146-Y149 VanDerWaalsContact O-CB 3.28Å; N146-Y149 WeakPolarHBondContact O-CB 3.43Å; N146-Y149 PolarHBondContact O-N 3.19Å; Y149-P151 HydrophobicContact CE1-CG 3.94Å; Y149-C154 HydrophobicContact CD2-CB 3.97Å; Y149-C154 HydrophobicContact CE2-CB 3.8Å; Y149-C154 WeakPolarHBondContact CE2-O 3.3Å; Y149-C154 VanDerWaalsContact CZ-O 3.31Å; Y149-C154 PolarHBondContact OH-O 3.25Å; Y149-C154 VanDerWaalsContact OH-O 3.08Å; Y149-A156 HydrophobicContact CE2-CB 3.82Å; Y149-A156 PolarHBondContact OH-N 2.94Å
150	R	96.8	Very high	97.6	Very high	127 Å²	127	56.5 Å²	56.5	48%	0.479	28%	0.276	S	S	.	.			trans	-131.5	114.5	176.6	-64.2	-66.5	177.7	-90.3	-5.4	107.7	P147 L148 E152 R153 C154	P147-R150 PolarHBondContact O-NH1 3.02Å; P147-R150 PolarHBondContact O-NH2 3.37Å; L148-R150 PolarHBondContact O-N 3.08Å; R150-E152 PolarHBondContact O-N 3.18Å; R150-R153 HydrophobicContact CB-CB 4.23Å; R150-R153 HydrophobicContact CB-CG 4.33Å; R150-R153 CarbonylContact O-C 3.49Å; R150-R153 WeakPolarHBondContact O-CA 3.49Å; R150-R153 PolarHBondContact O-N 3.19Å; R150-C154 PolarHBondContact O-N 2.87Å
151	P	96.5	Very high	97.6	Very high	82 Å²	82	56.9 Å²	56.9	53%	0.532	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-27.2	-179.2	-27.3	34.7	0	0	0	114.3	Y149 R153 C154	Y149-P151 HydrophobicContact CE1-CG 3.94Å; P151-R153 PolarHBondContact O-N 3.39Å; P151-C154 WeakPolarHBondContact CA-O 3.28Å
152	E	95.9	Very high	97.5	Very high	133 Å²	133	53.7 Å²	53.7	62%	0.621	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-17.2	178.8	-53.2	71.9	-151.3	0	0	112.6	F129 R150	F129-E152 WeakPolarHBondContact CD2-O 3.37Å; R150-E152 PolarHBondContact O-N 3.18Å
153	R	95.6	Very high	97.5	Very high	46 Å²	46	58 Å²	58	17%	0.174	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-18.7	-175.5	-58.6	-162.3	61.5	-145.1	-19.2	113.6	L122 D125 L126 I128 F129 V130 R150 P151	L122-R153 HydrophobicContact CD2-CB 4.18Å; L122-R153 PolarHBondContact O-NH1 3.05Å; L122-R153 PolarHBondContact O-NH2 3.37Å; D125-R153 PolarHBondContact O-NH2 2.91Å; L126-R153 VanDerWaalsContact CD2-NH1 3.31Å; L126-R153 PolarHBondContact O-NE 3.45Å; L126-R153 PolarHBondContact O-NH2 3.42Å; I128-R153 PolarHBondContact O-NH2 3.19Å; F129-R153 CarbonylContact C-O 3.49Å; F129-R153 WeakPolarHBondContact CA-O 3.44Å; V130-R153 PolarHBondContact N-O 2.93Å; R150-R153 HydrophobicContact CB-CB 4.23Å; R150-R153 HydrophobicContact CB-CG 4.33Å; R150-R153 CarbonylContact O-C 3.49Å; R150-R153 WeakPolarHBondContact O-CA 3.49Å; R150-R153 PolarHBondContact O-N 3.19Å; P151-R153 PolarHBondContact O-N 3.39Å
154	C	98.1	Very high	97.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	127.2	179.1	-173.7	0	0	0	0	111.1	L122 V130 Y149 R150 P151	L122-C154 HydrophobicContact CD1-CB 4.16Å; V130-C154 CarbonylContact O-C 3.51Å; V130-C154 WeakPolarHBondContact O-CA 3.43Å; Y149-C154 HydrophobicContact CD2-CB 3.97Å; Y149-C154 HydrophobicContact CE2-CB 3.8Å; Y149-C154 WeakPolarHBondContact CE2-O 3.3Å; Y149-C154 VanDerWaalsContact CZ-O 3.31Å; Y149-C154 PolarHBondContact OH-O 3.25Å; Y149-C154 VanDerWaalsContact OH-O 3.08Å; R150-C154 PolarHBondContact O-N 2.87Å; P151-C154 WeakPolarHBondContact CA-O 3.28Å
155	C	98.5	Very high	97.5	Very high	40 Å²	40	60.6 Å²	60.6	27%	0.27	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	103.3	170.2	-178.9	0	0	0	0	109	F129 V130 Y131 A132	F129-C155 HydrophobicContact CE1-CB 4.22Å; F129-C155 HydrophobicContact CZ-CB 3.88Å; V130-C155 PolarHBondContact O-N 3.4Å; Y131-C155 WeakPolarHBondContact CA-O 3.36Å; Y131-C155 HydrophobicContact CD1-CB 3.81Å; Y131-C155 HydrophobicContact CE1-CB 4.1Å; A132-C155 PolarHBondContact N-O 3.3Å
156	A	98.7	Very high	97.6	Very high	3 Å²	3	53.9 Å²	53.9	3%	0.025	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.3	177.6	0	0	0	0	0	112.1	A132 V140 V143 K144 Y149	A132-A156 HydrophobicContact CB-CB 4.39Å; A132-A156 CarbonylContact O-C 3.51Å; A132-A156 WeakPolarHBondContact O-CA 3.46Å; V140-A156 HydrophobicContact CG1-CB 4.07Å; V143-A156 HydrophobicContact CB-CB 4.37Å; V143-A156 HydrophobicContact CG1-CB 3.79Å; K144-A156 WeakPolarHBondContact CE-O 3.46Å; K144-A156 HydrophobicContact CG-CB 4.04Å; K144-A156 PolarHBondContact NZ-O 3.31Å; Y149-A156 HydrophobicContact CE2-CB 3.82Å; Y149-A156 PolarHBondContact OH-N 2.94Å
157	F	98.8	Very high	97.6	Very high	11 Å²	11	54 Å²	54	5%	0.048	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	155.7	-178	60.8	-85.3	0	0	0	112.5	Y131 A132 C133 D134 V140 C159 L166 N169 V170	Y131-F157 HydrophobicContact CD1-CE1 4.21Å; A132-F157 PolarHBondContact O-N 3.17Å; C133-F157 WeakPolarHBondContact CA-O 3.37Å; C133-F157 HydrophobicContact CB-CD1 4.43Å; C133-F157 HydrophobicContact CB-CD2 3.82Å; C133-F157 HydrophobicContact CB-CE1 4.09Å; C133-F157 HydrophobicContact CB-CE2 3.42Å; C133-F157 VanDerWaalsContact CB-CE2 3.42Å; C133-F157 HydrophobicContact CB-CG 4.31Å; C133-F157 HydrophobicContact CB-CZ 3.57Å; D134-F157 PolarHBondContact N-O 2.83Å; V140-F157 VanDerWaalsContact CG2-O 3.26Å; V140-F157 WeakPolarHBondContact CG2-O 3.43Å; F157-C159 HydrophobicContact CD2-CB 4.05Å; F157-C159 HydrophobicContact CE2-CB 3.85Å; F157-L166 HydrophobicContact CE2-CD2 4.05Å; F157-L166 HydrophobicContact CZ-CD2 4.05Å; F157-N169 HydrophobicContact CD1-CB 3.84Å; F157-N169 HydrophobicContact CD2-CB 3.69Å; F157-N169 HydrophobicContact CE1-CB 3.82Å; F157-N169 HydrophobicContact CE2-CB 3.67Å; F157-N169 HydrophobicContact CG-CB 3.79Å; F157-N169 HydrophobicContact CZ-CB 3.74Å; F157-V170 HydrophobicContact CE1-CG2 3.85Å; F157-V170 HydrophobicContact CZ-CG2 3.59Å
158	Q	98.7	Very high	97.8	Very high	84 Å²	84	55.4 Å²	55.4	39%	0.393	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	138.1	174.5	-175	-175.9	8.2	0	0	109.4	Q66 D134 F135 P137 V140	Q66-Q158 VanDerWaalsContact NE2-NE2 3.12Å; D134-Q158 WeakPolarHBondContact O-CA 3.34Å; F135-Q158 PolarHBondContact O-NE2 3.16Å; P137-Q158 HydrophobicContact CB-CG 4.48Å; V140-Q158 HydrophobicContact CG2-CB 4.47Å
159	C	98.6	Very high	98	Very high	4 Å²	4	55.7 Å²	55.7	3%	0.027	27%	0.271	C	S	.	.			trans	-154.7	125.2	175.4	-174.8	0	0	0	0	111.3	C133 D134 F135 F157 L161	C133-C159 HydrophobicContact CB-CB 3.77Å; D134-C159 CarbonylContact C-O 3.57Å; D134-C159 PolarHBondContact O-N 2.9Å; F135-C159 WeakPolarHBondContact CA-O 3.1Å; F135-C159 PolarHBondContact N-O 3.32Å; F157-C159 HydrophobicContact CD2-CB 4.05Å; F157-C159 HydrophobicContact CE2-CB 3.85Å; C159-L161 PolarHBondContact O-N 3.21Å
160	D	98.6	Very high	98	Very high	14 Å²	14	54 Å²	54	8%	0.075	27%	0.265	C	S	.	.			trans	-82.1	100.1	157.8	-175.6	-17.5	0	0	0	108.5	F135 T162 K163 D164	F135-D160 HydrophobicContact CD2-CB 3.71Å; F135-D160 HydrophobicContact CE2-CB 3.61Å; F135-D160 VanDerWaalsContact CE2-CG 3.43Å; F135-D160 VanDerWaalsContact CE2-OD2 3.29Å; F135-D160 WeakPolarHBondContact CE2-OD2 3.36Å; D160-T162 PolarHBondContact O-N 2.95Å; D160-T162 WeakPolarHBondContact OD1-CB 3.29Å; D160-T162 PolarHBondContact OD1-N 2.98Å; D160-T162 PolarHBondContact OD1-OG1 2.86Å; D160-K163 HydrophobicContact CB-CB 4.3Å; D160-K163 PolarHBondContact O-N 2.88Å; D160-K163 WeakPolarHBondContact OD2-CD 3.43Å; D160-K163 IonicContact OD2-NZ 2.66Å; D160-D164 PolarHBondContact N-OD2 2.9Å; D160-D164 PolarHBondContact O-N 3Å
161	L	98.6	Very high	98.1	Very high	16 Å²	16	51.4 Å²	51.4	8%	0.084	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-21.5	-179.5	-66.4	171.5	0	0	0	113.6	A110 C159 L166 V183 A195 N198	A110-L161 HydrophobicContact CB-CD1 4.05Å; A110-L161 HydrophobicContact CB-CD2 4.29Å; C159-L161 PolarHBondContact O-N 3.21Å; L161-L166 HydrophobicContact CD2-CD1 3.94Å; L161-L166 HydrophobicContact CD2-CD2 3.97Å; L161-L166 HydrophobicContact CD2-CG 4.12Å; L161-V183 HydrophobicContact CD1-CG1 4.28Å; L161-A195 HydrophobicContact CB-CB 3.91Å; L161-A195 WeakPolarHBondContact O-CA 3.15Å; L161-N198 PolarHBondContact O-ND2 3.02Å
162	T	98.2	Very high	98.2	Very high	24 Å²	24	54.2 Å²	54.2	15%	0.147	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-7.5	-177.1	75.8	0	0	0	0	114.1	D160 V187 K191 A195	D160-T162 PolarHBondContact O-N 2.95Å; D160-T162 WeakPolarHBondContact OD1-CB 3.29Å; D160-T162 PolarHBondContact OD1-N 2.98Å; D160-T162 PolarHBondContact OD1-OG1 2.86Å; T162-V187 HydrophobicContact CG2-CG1 3.64Å; T162-K191 HydrophobicContact CG2-CB 3.75Å; T162-K191 HydrophobicContact CG2-CD 4.25Å; T162-A195 HydrophobicContact CG2-CB 4.38Å
163	K	97.7	Very high	98.3	Very high	135 Å²	135	50 Å²	50	59%	0.587	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.6	-46.2	-175.3	-65	-177.4	-168.4	158.1	0	113.5	D160	D160-K163 HydrophobicContact CB-CB 4.3Å; D160-K163 PolarHBondContact O-N 2.88Å; D160-K163 WeakPolarHBondContact OD2-CD 3.43Å; D160-K163 IonicContact OD2-NZ 2.66Å
164	D	98.4	Very high	98.4	Very high	64 Å²	64	49 Å²	49	34%	0.342	26%	0.258	S	S	.	.	S	Bend	trans	-79.9	156.3	-175.9	-54.8	-26.1	0	0	0	109.8	D160 N198	D160-D164 PolarHBondContact N-OD2 2.9Å; D160-D164 PolarHBondContact O-N 3Å; D164-N198 PolarHBondContact O-ND2 3.26Å
165	H	98.3	Very high	98.4	Very high	93 Å²	93	49 Å²	49	43%	0.431	26%	0.258	S	S	.	.			trans	-93.2	119.2	176.2	-61.6	-46.3	0	0	0	110.3	T167 E168	H165-T167 PolarHBondContact O-N 3.39Å; H165-T167 VanDerWaalsContact O-N 3.09Å; H165-E168 HydrophobicContact CB-CG 4.15Å; H165-E168 IonicContact CD2-OE1 3Å; H165-E168 WeakPolarHBondContact O-CB 3.3Å; H165-E168 PolarHBondContact O-N 2.97Å
166	L	98.7	Very high	98.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-56.9	-28.4	174.2	-79.2	170.4	0	0	0	111.8	L108 F157 L161 E168 N169 V170 N198 I199 V202	L108-L166 HydrophobicContact CD2-CD1 3.89Å; L108-L166 HydrophobicContact CD2-CD2 4.25Å; F157-L166 HydrophobicContact CE2-CD2 4.05Å; F157-L166 HydrophobicContact CZ-CD2 4.05Å; L161-L166 HydrophobicContact CD2-CD1 3.94Å; L161-L166 HydrophobicContact CD2-CD2 3.97Å; L161-L166 HydrophobicContact CD2-CG 4.12Å; L166-E168 PolarHBondContact O-N 3.16Å; L166-E168 VanDerWaalsContact O-N 3.14Å; L166-N169 PolarHBondContact O-N 3.18Å; L166-V170 WeakPolarHBondContact O-CB 3.33Å; L166-V170 PolarHBondContact O-N 3.46Å; L166-N198 PolarHBondContact N-OD1 3.37Å; L166-N198 VanDerWaalsContact N-OD1 3.11Å; L166-I199 HydrophobicContact CD1-CG1 3.89Å; L166-V202 HydrophobicContact CB-CG1 3.73Å; L166-V202 HydrophobicContact CB-CG2 4.33Å; L166-V202 HydrophobicContact CD1-CG2 4.08Å
167	T	98.6	Very high	98.3	Very high	48 Å²	48	47.7 Å²	47.7	29%	0.294	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-62.3	-16	178.5	53.6	0	0	0	0	114.6	H165 N169 V170 E172 K201 V202	H165-T167 PolarHBondContact O-N 3.39Å; H165-T167 VanDerWaalsContact O-N 3.09Å; T167-N169 VanDerWaalsContact C-N 3.28Å; T167-N169 PolarHBondContact O-N 2.81Å; T167-V170 VanDerWaalsContact CA-O 3.25Å; T167-V170 WeakPolarHBondContact CA-O 3.32Å; T167-E172 HydrophobicContact CG2-CG 3.51Å; T167-K201 HydrophobicContact CG2-CB 4.16Å; T167-V202 HydrophobicContact CG2-CG1 3.85Å
168	E	98.2	Very high	98.3	Very high	138 Å²	138	47.2 Å²	47.2	65%	0.645	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-70.7	-24.4	173.6	-68.2	175.1	-170.6	0	0	112.9	H165 L166	H165-E168 HydrophobicContact CB-CG 4.15Å; H165-E168 IonicContact CD2-OE1 3Å; H165-E168 WeakPolarHBondContact O-CB 3.3Å; H165-E168 PolarHBondContact O-N 2.97Å; L166-E168 PolarHBondContact O-N 3.16Å; L166-E168 VanDerWaalsContact O-N 3.14Å
169	N	98.4	Very high	98.3	Very high	72 Å²	72	43.2 Å²	43.2	39%	0.385	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-20.2	-177.6	-66.9	-90.2	0	0	0	113.1	Y131 F157 L166 T167	Y131-N169 WeakPolarHBondContact CE1-O 3.23Å; F157-N169 HydrophobicContact CD1-CB 3.84Å; F157-N169 HydrophobicContact CD2-CB 3.69Å; F157-N169 HydrophobicContact CE1-CB 3.82Å; F157-N169 HydrophobicContact CE2-CB 3.67Å; F157-N169 HydrophobicContact CG-CB 3.79Å; F157-N169 HydrophobicContact CZ-CB 3.74Å; L166-N169 PolarHBondContact O-N 3.18Å; T167-N169 VanDerWaalsContact C-N 3.28Å; T167-N169 PolarHBondContact O-N 2.81Å
170	V	98.7	Very high	98.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-128.2	120.6	-174.2	-172.7	0	0	0	0	108.8	Y131 F157 L166 T167 V175 V202	Y131-V170 HydrophobicContact CD1-CB 4.44Å; Y131-V170 HydrophobicContact CD1-CG1 4.47Å; Y131-V170 HydrophobicContact CD1-CG2 3.64Å; Y131-V170 HydrophobicContact CD2-CG1 3.82Å; Y131-V170 HydrophobicContact CD2-CG2 4.26Å; Y131-V170 HydrophobicContact CE1-CG1 4.5Å; Y131-V170 HydrophobicContact CE1-CG2 4.14Å; Y131-V170 HydrophobicContact CE2-CG1 3.86Å; Y131-V170 HydrophobicContact CG-CB 4.47Å; Y131-V170 HydrophobicContact CG-CG1 4.13Å; Y131-V170 HydrophobicContact CG-CG2 3.7Å; F157-V170 HydrophobicContact CE1-CG2 3.85Å; F157-V170 HydrophobicContact CZ-CG2 3.59Å; L166-V170 WeakPolarHBondContact O-CB 3.33Å; L166-V170 PolarHBondContact O-N 3.46Å; T167-V170 VanDerWaalsContact CA-O 3.25Å; T167-V170 WeakPolarHBondContact CA-O 3.32Å; V170-V175 HydrophobicContact CG1-CG2 3.56Å; V170-V202 HydrophobicContact CB-CB 4.25Å; V170-V202 HydrophobicContact CB-CG1 4.03Å; V170-V202 HydrophobicContact CG1-CB 3.83Å; V170-V202 HydrophobicContact CG1-CG1 4.17Å; V170-V202 HydrophobicContact CG1-CG2 4.25Å
171	P	98.5	Very high	98.2	Very high	72 Å²	72	42.6 Å²	42.6	47%	0.468	22%	0.224	S	C	.	.			trans	-57.7	146.9	179.1	-22.8	32.7	0	0	0	112.4	Y131 S174	Y131-P171 WeakPolarHBondContact OH-CD 3.37Å; P171-S174 WeakPolarHBondContact O-CB 3.23Å; P171-S174 PolarHBondContact O-OG 3.02Å
172	E	98.4	Very high	98.1	Very high	141 Å²	141	44.2 Å²	44.2	66%	0.659	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	143.4	175.1	-72.5	-173.3	-175.1	0	0	111.5	T167 S174	T167-E172 HydrophobicContact CG2-CG 3.51Å; E172-S174 PolarHBondContact O-N 3.03Å; E172-S174 VanDerWaalsContact O-N 3.08Å
173	A	98	Very high	98.1	Very high	44 Å²	44	44 Å²	44	36%	0.364	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.4	43.6	178.6	0	0	0	0	0	114	K201 V202 K204	A173-K201 PolarHBondContact N-O 2.8Å; A173-V202 CarbonylContact C-O 3.51Å; A173-V202 WeakPolarHBondContact CA-O 3.18Å; A173-V202 PolarHBondContact N-O 2.88Å; A173-K204 WeakPolarHBondContact O-CG 3.19Å
174	S	97.7	Very high	98.2	Very high	26 Å²	26	37.7 Å²	37.7	18%	0.182	20%	0.202	C	C	.	.			trans	-114.3	-15.6	-177	69.6	0	0	0	0	114.2	P171 E172 V202 K204	P171-S174 WeakPolarHBondContact O-CB 3.23Å; P171-S174 PolarHBondContact O-OG 3.02Å; E172-S174 PolarHBondContact O-N 3.03Å; E172-S174 VanDerWaalsContact O-N 3.08Å; S174-V202 PolarHBondContact N-O 3.29Å; S174-K204 VanDerWaalsContact O-CE 3.26Å; S174-K204 WeakPolarHBondContact O-CE 3.46Å
175	V	98.1	Very high	98.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.9	-178.7	178.5	0	0	0	0	110.3	V106 L108 Y131 V170 V177 V178 V202 L203 K204	V106-V175 HydrophobicContact CG1-CG2 4.41Å; L108-V175 HydrophobicContact CB-CG1 3.82Å; L108-V175 HydrophobicContact CB-CG2 4.13Å; Y131-V175 HydrophobicContact CD2-CG2 4.38Å; V170-V175 HydrophobicContact CG1-CG2 3.56Å; V175-V177 WeakPolarHBondContact CG1-O 3.46Å; V175-V178 HydrophobicContact CG1-CG2 3.86Å; V175-V202 WeakPolarHBondContact CB-O 3.5Å; V175-V202 HydrophobicContact CG2-CB 4.39Å; V175-V202 HydrophobicContact CG2-CG2 4.22Å; V175-V202 PolarHBondContact N-O 3.03Å; V175-L203 HydrophobicContact CB-CD1 4.42Å; V175-L203 HydrophobicContact CG1-CD1 4.14Å; V175-L203 WeakPolarHBondContact O-CD1 3.49Å; V175-K204 WeakPolarHBondContact O-CB 3.46Å; V175-K204 WeakPolarHBondContact O-CG 3.3Å; V175-K204 PolarHBondContact O-N 3.15Å
176	D	97.1	Very high	98.1	Very high	16 Å²	16	31 Å²	31	9%	0.086	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-44.5	176.2	-58.8	-59.6	0	0	0	111.2	L105 V106 K204 G207 V208	L105-D176 HydrophobicContact CD1-CB 3.75Å; V106-D176 WeakPolarHBondContact CB-OD2 3.27Å; V106-D176 PolarHBondContact N-OD2 3.28Å; V106-D176 PolarHBondContact O-N 3.27Å; D176-K204 VanDerWaalsContact OD1-CD 3.26Å; D176-K204 WeakPolarHBondContact OD1-CD 3.44Å; D176-K204 WeakPolarHBondContact OD1-CE 3.12Å; D176-K204 IonicContact OD1-NZ 3.64Å; D176-K204 PolarHBondContact OD1-NZ 2.81Å; D176-K204 IonicContact OD2-NZ 3.96Å; D176-G207 VanDerWaalsContact O-CA 3.25Å; D176-G207 WeakPolarHBondContact O-CA 3.49Å; D176-V208 PolarHBondContact O-N 3.44Å; D176-V208 VanDerWaalsContact O-N 3.1Å
177	V	97.9	Very high	98.1	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138.1	-176.2	-179.6	0	0	0	0	110	L94 C97 L105 V106 L107 L108 V175 V208 L210	L94-V177 HydrophobicContact CD2-CG1 4.09Å; C97-V177 HydrophobicContact CB-CG2 4.25Å; L105-V177 HydrophobicContact CD1-CG2 4.17Å; V106-V177 PolarHBondContact O-N 2.87Å; L107-V177 CarbonylContact C-O 3.45Å; L107-V177 WeakPolarHBondContact CA-O 3.49Å; L107-V177 HydrophobicContact CD1-CB 3.87Å; L107-V177 HydrophobicContact CD1-CG1 3.74Å; L107-V177 WeakPolarHBondContact CD1-O 3.33Å; L108-V177 PolarHBondContact N-O 3.46Å; V175-V177 WeakPolarHBondContact CG1-O 3.46Å; V177-V208 CarbonylContact C-O 3.59Å; V177-V208 WeakPolarHBondContact CA-O 3.46Å; V177-L210 HydrophobicContact CG1-CD1 3.52Å; V177-L210 HydrophobicContact CG1-CG 3.84Å
178	V	98.7	Very high	98.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.4	168.6	175.8	0	0	0	0	108.7	L108 A110 V175 L180 I199 L203 V208 V209 L210	L108-V178 HydrophobicContact CB-CG2 4.03Å; L108-V178 HydrophobicContact CD2-CG2 4.26Å; L108-V178 CarbonylContact O-C 3.53Å; L108-V178 VanDerWaalsContact O-CA 3.28Å; L108-V178 WeakPolarHBondContact O-CA 3.41Å; A110-V178 HydrophobicContact CB-CG1 4.36Å; V175-V178 HydrophobicContact CG1-CG2 3.86Å; V178-L180 HydrophobicContact CG1-CG 4.34Å; V178-I199 HydrophobicContact CB-CG2 4.13Å; V178-I199 HydrophobicContact CG1-CD1 4.4Å; V178-I199 HydrophobicContact CG1-CG2 3.83Å; V178-I199 HydrophobicContact CG2-CG2 3.73Å; V178-L203 HydrophobicContact CG2-CD1 3.77Å; V178-V208 PolarHBondContact N-O 3.11Å; V178-V209 HydrophobicContact CB-CG1 4.4Å; V178-V209 HydrophobicContact CB-CG2 4.26Å; V178-V209 HydrophobicContact CG1-CG1 4.37Å; V178-V209 CarbonylContact O-C 3.56Å; V178-V209 WeakPolarHBondContact O-CA 3.47Å; V178-L210 PolarHBondContact O-N 2.49Å
179	T	98.4	Very high	98.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.2	170.1	38.4	0	0	0	0	110	L107 L108 E109 A110 I181 L210	L107-T179 HydrophobicContact CD1-CG2 4.02Å; L108-T179 PolarHBondContact O-N 2.62Å; L108-T179 PolarHBondContact O-OG1 3.2Å; E109-T179 WeakPolarHBondContact CA-OG1 3.44Å; E109-T179 VanDerWaalsContact OE2-CB 3.23Å; E109-T179 WeakPolarHBondContact OE2-CB 3.32Å; E109-T179 PolarHBondContact OE2-OG1 3.12Å; A110-T179 PolarHBondContact N-O 3.27Å; A110-T179 VanDerWaalsContact N-O 3.16Å; T179-I181 HydrophobicContact CG2-CD1 4.24Å; T179-L210 WeakPolarHBondContact CA-O 3.43Å; T179-L210 HydrophobicContact CG2-CB 4.17Å; T179-L210 HydrophobicContact CG2-CD1 4.11Å
180	L	98.1	Very high	98.1	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	80.4	174.4	-79.7	175.9	0	0	0	109	A110 V178 V183 L196 I199 V209 L210 F211 R212 F255	A110-L180 HydrophobicContact CB-CD2 3.77Å; V178-L180 HydrophobicContact CG1-CG 4.34Å; L180-V183 HydrophobicContact CD2-CB 4.25Å; L180-V183 HydrophobicContact CD2-CG1 4.2Å; L180-L196 HydrophobicContact CD1-CD2 3.75Å; L180-I199 HydrophobicContact CD1-CD1 3.79Å; L180-I199 HydrophobicContact CD2-CD1 3.83Å; L180-I199 HydrophobicContact CG-CD1 4.09Å; L180-V209 HydrophobicContact CD1-CG1 3.77Å; L180-V209 HydrophobicContact CG-CG1 4.23Å; L180-L210 PolarHBondContact N-O 3.1Å; L180-F211 HydrophobicContact CB-CD2 4.15Å; L180-R212 PolarHBondContact O-N 3.12Å; L180-F255 HydrophobicContact CD1-CZ 4.23Å
181	I	97.4	Very high	98.1	Very high	5 Å²	5	32.1 Å²	32.1	3%	0.026	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	104	-172.6	-62.8	169.1	0	0	0	110.7	W86 T87 F91 T179 V183 R212	W86-I181 HydrophobicContact CH2-CD1 4.36Å; W86-I181 HydrophobicContact CZ2-CG2 4.47Å; T87-I181 HydrophobicContact CG2-CD1 4.04Å; F91-I181 HydrophobicContact CE2-CD1 4.45Å; T179-I181 HydrophobicContact CG2-CD1 4.24Å; I181-V183 WeakPolarHBondContact O-CG2 3.43Å; I181-R212 CarbonylContact C-O 3.59Å; I181-R212 VanDerWaalsContact CA-O 3.31Å; I181-R212 WeakPolarHBondContact CA-O 3.26Å; I181-R212 HydrophobicContact CG1-CB 4.42Å
182	F	97.2	Very high	98.1	Very high	50 Å²	50	28.7 Å²	28.7	22%	0.219	16%	0.155	C	C	.	.	S	Bend	trans	60.4	45.7	-175.1	-58	-73.1	0	0	0	114.3	R212 D213 Y214 F285	F182-R212 PolarHBondContact N-O 3.48Å; F182-D213 WeakPolarHBondContact CA-OD2 3.49Å; F182-Y214 HydrophobicContact CD1-CD2 4.38Å; F182-Y214 HydrophobicContact CD1-CE1 4.31Å; F182-Y214 HydrophobicContact CD1-CE2 4.13Å; F182-Y214 HydrophobicContact CE1-CD1 4.27Å; F182-Y214 HydrophobicContact CE1-CE1 4.17Å; F182-F285 AromaticContact CE1-CD1 3.6Å; F182-F285 HydrophobicContact CE1-CD1 3.6Å; F182-F285 AromaticContact CE1-CE1 3.57Å; F182-F285 HydrophobicContact CE1-CE1 3.57Å; F182-F285 AromaticContact CZ-CD1 3.59Å; F182-F285 HydrophobicContact CZ-CD1 3.59Å; F182-F285 AromaticContact CZ-CE1 3.44Å; F182-F285 HydrophobicContact CZ-CE1 3.44Å; F182-F285 VanDerWaalsContact CZ-CE1 3.44Å; F182-F285 HydrophobicContact CZ-CG 4.49Å; F182-F285 HydrophobicContact CZ-CZ 4.24Å
183	V	98.1	Very high	98.1	Very high	19 Å²	19	25.4 Å²	25.4	12%	0.115	14%	0.139	C	C	.	.			trans	-121.3	-50.8	-172.2	178.6	0	0	0	0	110.9	A110 L161 L180 I181 S185 A186 D213	A110-V183 WeakPolarHBondContact O-CG1 3.47Å; A110-V183 VanDerWaalsContact O-CG2 3.26Å; A110-V183 WeakPolarHBondContact O-CG2 3.23Å; L161-V183 HydrophobicContact CD1-CG1 4.28Å; L180-V183 HydrophobicContact CD2-CB 4.25Å; L180-V183 HydrophobicContact CD2-CG1 4.2Å; I181-V183 WeakPolarHBondContact O-CG2 3.43Å; V183-S185 PolarHBondContact O-N 2.89Å; V183-A186 WeakPolarHBondContact O-CB 3.45Å; V183-A186 PolarHBondContact O-N 3.16Å; V183-D213 PolarHBondContact N-OD2 3.19Å; V183-D213 VanDerWaalsContact N-OD2 3.11Å
184	L	98.4	Very high	98.2	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-65.6	-30.8	-176.3	-155.6	63.3	0	0	0	110.9	A186 V187 M192 F211 D213 F246 L251 L254 F255	L184-A186 PolarHBondContact O-N 3.2Å; L184-A186 VanDerWaalsContact O-N 3.15Å; L184-V187 WeakPolarHBondContact O-CB 3.3Å; L184-V187 PolarHBondContact O-N 3Å; L184-M192 HydrophobicContact CD1-CB 3.77Å; L184-M192 HydrophobicContact CD1-CG 3.82Å; L184-M192 HydrophobicContact CD2-CB 4.28Å; L184-M192 HydrophobicContact CD2-CG 4.42Å; L184-M192 HydrophobicContact CD2-SD 4.2Å; L184-M192 HydrophobicContact CG-CB 4.05Å; L184-M192 HydrophobicContact CG-CG 3.8Å; L184-M192 HydrophobicContact CG-SD 3.86Å; L184-M192 VanDerWaalsContact O-CE 3.24Å; L184-M192 WeakPolarHBondContact O-CE 3.05Å; L184-F211 HydrophobicContact CB-CE2 3.93Å; L184-F211 HydrophobicContact CD2-CE2 4.01Å; L184-D213 PolarHBondContact N-OD2 2.85Å; L184-F246 HydrophobicContact CB-CE2 4.48Å; L184-F246 HydrophobicContact CB-CZ 3.83Å; L184-F246 HydrophobicContact CD2-CE1 4.09Å; L184-F246 HydrophobicContact CD2-CZ 4.08Å; L184-F246 HydrophobicContact CG-CE1 4.41Å; L184-F246 HydrophobicContact CG-CZ 3.98Å; L184-L251 HydrophobicContact CD2-CD1 4.36Å; L184-L254 HydrophobicContact CD2-CD2 3.95Å; L184-F255 HydrophobicContact CD2-CE2 4.48Å
185	S	98.4	Very high	98.2	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.021	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-61.2	-21.5	174	60.1	0	0	0	0	114.6	V183 D213 S243 Y244	V183-S185 PolarHBondContact O-N 2.89Å; S185-D213 VanDerWaalsContact CB-CG 3.45Å; S185-D213 WeakPolarHBondContact CB-OD1 3.24Å; S185-D213 WeakPolarHBondContact CB-OD2 3.49Å; S185-D213 PolarHBondContact N-OD2 3.02Å; S185-D213 PolarHBondContact OG-OD1 2.86Å; S185-D213 PolarHBondContact OG-OD2 2.96Å; S185-D213 VanDerWaalsContact OG-OD2 3.1Å; S185-S243 CarbonylContact O-C 3.46Å; S185-S243 WeakPolarHBondContact O-CA 3.23Å; S185-Y244 WeakPolarHBondContact CB-O 3.48Å; S185-Y244 PolarHBondContact O-N 3.15Å
186	A	98.1	Very high	98.2	Very high	12 Å²	12	25.3 Å²	25.3	10%	0.099	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-84.4	-16.5	177.1	0	0	0	0	0	113.4	W69 V183 L184	W69-A186 HydrophobicContact CZ2-CB 3.46Å; W69-A186 VanDerWaalsContact CZ2-CB 3.46Å; V183-A186 WeakPolarHBondContact O-CB 3.45Å; V183-A186 PolarHBondContact O-N 3.16Å; L184-A186 PolarHBondContact O-N 3.2Å; L184-A186 VanDerWaalsContact O-N 3.15Å
187	V	98.3	Very high	98.3	Very high	22 Å²	22	28.3 Å²	28.3	13%	0.133	15%	0.146	C	C	.	.	S	Bend	trans	-87.2	143.8	-177.7	-178.1	0	0	0	0	109.4	T162 L184 K191 M192	T162-V187 HydrophobicContact CG2-CG1 3.64Å; L184-V187 WeakPolarHBondContact O-CB 3.3Å; L184-V187 PolarHBondContact O-N 3Å; V187-K191 HydrophobicContact CG1-CB 3.9Å; V187-M192 HydrophobicContact CB-CG 4.29Å; V187-M192 HydrophobicContact CG1-CG 4.18Å; V187-M192 VanDerWaalsContact O-CE 3.27Å; V187-M192 WeakPolarHBondContact O-CE 3.49Å
188	H	98.2	Very high	98.4	Very high	43 Å²	43	28.7 Å²	28.7	20%	0.199	15%	0.148	C	C	.	.			trans	-61.7	134.6	173.2	-167.5	-77.5	0	0	0	110.1	E62 D190 K191 M192 F234	E62-H188 IonicContact OE2-CD2 3.54Å; H188-D190 VanDerWaalsContact C-N 3.3Å; H188-D190 IonicContact CE1-OD1 3.62Å; H188-D190 IonicContact CE1-OD2 3.53Å; H188-D190 PolarHBondContact CE1-OD2 3.19Å; H188-D190 PolarHBondContact ND1-N 3.14Å; H188-D190 IonicContact ND1-OD1 2.63Å; H188-D190 IonicContact ND1-OD2 2.88Å; H188-D190 PolarHBondContact O-N 2.79Å; H188-K191 HydrophobicContact CB-CD 4.4Å; H188-K191 HydrophobicContact CB-CG 4.38Å; H188-K191 WeakPolarHBondContact O-CA 3.49Å; H188-K191 PolarHBondContact O-N 2.88Å; H188-M192 PolarHBondContact O-N 3.02Å; H188-F234 AromaticContact CD2-CE1 3.76Å
189	P	98.3	Very high	98.4	Very high	27 Å²	27	28.8 Å²	28.8	18%	0.175	15%	0.148	C	C	.	.	H	α-helix	trans	-47.5	-47.3	-177.5	-31.8	36.8	0	0	0	114.5	K191 M192 F234 Y244	P189-K191 PolarHBondContact O-N 3.47Å; P189-M192 HydrophobicContact CB-CE 4.39Å; P189-M192 HydrophobicContact CG-CE 4.16Å; P189-M192 WeakPolarHBondContact O-CB 3.2Å; P189-M192 WeakPolarHBondContact O-CG 3.32Å; P189-M192 PolarHBondContact O-N 3.49Å; P189-F234 HydrophobicContact CG-CD1 4.31Å; P189-F234 HydrophobicContact CG-CG 4.28Å; P189-Y244 HydrophobicContact CB-CE2 4.4Å; P189-Y244 HydrophobicContact CG-CD2 3.61Å; P189-Y244 HydrophobicContact CG-CE2 3.69Å
190	D	97.9	Very high	98.4	Very high	133 Å²	133	29.3 Å²	29.3	71%	0.711	15%	0.154	S	C	*	.	H	α-helix	trans	-59	-19.8	178.5	-54.3	-8.9	0	0	0	114.8	H188	H188-D190 VanDerWaalsContact C-N 3.3Å; H188-D190 IonicContact CE1-OD1 3.62Å; H188-D190 IonicContact CE1-OD2 3.53Å; H188-D190 PolarHBondContact CE1-OD2 3.19Å; H188-D190 PolarHBondContact ND1-N 3.14Å; H188-D190 IonicContact ND1-OD1 2.63Å; H188-D190 IonicContact ND1-OD2 2.88Å; H188-D190 PolarHBondContact O-N 2.79Å
191	K	98.6	Very high	98.4	Very high	57 Å²	57	33.9 Å²	33.9	25%	0.248	17%	0.174	C	C	.	.	H	α-helix	trans	-103	-7.9	-178.5	-62.7	-174.2	172.4	-171.9	0	113.5	E62 T162 V187 H188 P189 K193 V194 A195	E62-K191 WeakPolarHBondContact OE1-CE 3.44Å; E62-K191 IonicContact OE1-NZ 3.66Å; E62-K191 PolarHBondContact OE1-NZ 2.9Å; T162-K191 HydrophobicContact CG2-CB 3.75Å; T162-K191 HydrophobicContact CG2-CD 4.25Å; V187-K191 HydrophobicContact CG1-CB 3.9Å; H188-K191 HydrophobicContact CB-CD 4.4Å; H188-K191 HydrophobicContact CB-CG 4.38Å; H188-K191 WeakPolarHBondContact O-CA 3.49Å; H188-K191 PolarHBondContact O-N 2.88Å; P189-K191 PolarHBondContact O-N 3.47Å; K191-K193 VanDerWaalsContact C-N 3.32Å; K191-K193 PolarHBondContact O-N 2.92Å; K191-V194 PolarHBondContact O-N 3.18Å; K191-A195 PolarHBondContact O-N 2.93Å
192	M	98.8	Very high	98.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-40.1	-177.3	-64	-178.8	179.8	0	0	111.4	L184 V187 H188 P189 V194 A195 L196 Y244 F246 F250 L254	L184-M192 HydrophobicContact CD1-CB 3.77Å; L184-M192 HydrophobicContact CD1-CG 3.82Å; L184-M192 HydrophobicContact CD2-CB 4.28Å; L184-M192 HydrophobicContact CD2-CG 4.42Å; L184-M192 HydrophobicContact CD2-SD 4.2Å; L184-M192 HydrophobicContact CG-CB 4.05Å; L184-M192 HydrophobicContact CG-CG 3.8Å; L184-M192 HydrophobicContact CG-SD 3.86Å; L184-M192 VanDerWaalsContact O-CE 3.24Å; L184-M192 WeakPolarHBondContact O-CE 3.05Å; V187-M192 HydrophobicContact CB-CG 4.29Å; V187-M192 HydrophobicContact CG1-CG 4.18Å; V187-M192 VanDerWaalsContact O-CE 3.27Å; V187-M192 WeakPolarHBondContact O-CE 3.49Å; H188-M192 PolarHBondContact O-N 3.02Å; P189-M192 HydrophobicContact CB-CE 4.39Å; P189-M192 HydrophobicContact CG-CE 4.16Å; P189-M192 WeakPolarHBondContact O-CB 3.2Å; P189-M192 WeakPolarHBondContact O-CG 3.32Å; P189-M192 PolarHBondContact O-N 3.49Å; M192-V194 PolarHBondContact O-N 2.87Å; M192-A195 WeakPolarHBondContact O-CB 3.37Å; M192-A195 PolarHBondContact O-N 3.11Å; M192-L196 WeakPolarHBondContact O-CG 3.35Å; M192-L196 PolarHBondContact O-N 3.36Å; M192-Y244 HydrophobicContact CE-CD1 4.15Å; M192-Y244 HydrophobicContact CE-CD2 4.26Å; M192-Y244 HydrophobicContact CE-CG 3.82Å; M192-F246 HydrophobicContact CE-CE1 4.11Å; M192-F246 HydrophobicContact CE-CZ 3.84Å; M192-F246 HydrophobicContact SD-CE1 3.78Å; M192-F246 HydrophobicContact SD-CZ 3.98Å; M192-F250 HydrophobicContact SD-CE1 4.06Å; M192-F250 HydrophobicContact SD-CZ 4.34Å; M192-L254 HydrophobicContact CB-CD1 4.17Å; M192-L254 HydrophobicContact CB-CD2 3.71Å; M192-L254 HydrophobicContact CG-CD2 4.49Å; M192-L254 HydrophobicContact SD-CD2 3.98Å
193	K	98.8	Very high	98.5	Very high	73 Å²	73	31.2 Å²	31.2	32%	0.317	16%	0.162	S	C	.	.	H	α-helix	trans	-60	-48	178.4	-171.6	-173.4	-179.4	-166.4	0	111.8	K191 A195 L196 E197 L254 E257 A258	K191-K193 VanDerWaalsContact C-N 3.32Å; K191-K193 PolarHBondContact O-N 2.92Å; K193-A195 VanDerWaalsContact C-N 3.28Å; K193-A195 PolarHBondContact O-N 3.03Å; K193-L196 WeakPolarHBondContact O-CB 3.34Å; K193-L196 PolarHBondContact O-N 2.92Å; K193-L196 VanDerWaalsContact O-N 3.08Å; K193-E197 WeakPolarHBondContact CE-OE1 3.48Å; K193-E197 HydrophobicContact CG-CG 4.45Å; K193-E197 IonicContact NZ-OE1 3.9Å; K193-E197 WeakPolarHBondContact O-CG 3.5Å; K193-E197 PolarHBondContact O-N 3.4Å; K193-L254 HydrophobicContact CB-CD1 3.88Å; K193-E257 HydrophobicContact CD-CB 4.4Å; K193-E257 WeakPolarHBondContact CE-O 3.18Å; K193-E257 PolarHBondContact NZ-O 3.08Å; K193-A258 HydrophobicContact CG-CB 4.36Å
194	V	98.8	Very high	98.5	Very high	67 Å²	67	33.5 Å²	33.5	41%	0.406	17%	0.17	S	C	.	.	H	α-helix	trans	-60.1	-39.3	178.4	173.5	0	0	0	0	111.4	K191 M192 E197 N198	K191-V194 PolarHBondContact O-N 3.18Å; M192-V194 PolarHBondContact O-N 2.87Å; V194-E197 PolarHBondContact O-N 2.82Å; V194-N198 WeakPolarHBondContact O-CB 3.16Å; V194-N198 PolarHBondContact O-N 2.69Å
195	A	98.8	Very high	98.5	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-41.9	174.7	0	0	0	0	0	112.2	L161 T162 K191 M192 K193 N198 I199	L161-A195 HydrophobicContact CB-CB 3.91Å; L161-A195 WeakPolarHBondContact O-CA 3.15Å; T162-A195 HydrophobicContact CG2-CB 4.38Å; K191-A195 PolarHBondContact O-N 2.93Å; M192-A195 WeakPolarHBondContact O-CB 3.37Å; M192-A195 PolarHBondContact O-N 3.11Å; K193-A195 VanDerWaalsContact C-N 3.28Å; K193-A195 PolarHBondContact O-N 3.03Å; A195-N198 WeakPolarHBondContact O-CB 3.25Å; A195-N198 PolarHBondContact O-N 3.37Å; A195-I199 WeakPolarHBondContact O-CG1 3.38Å; A195-I199 PolarHBondContact O-N 2.93Å
196	L	98.9	Very high	98.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.9	-40.9	176.6	-64.9	177.3	0	0	0	112.4	L180 M192 K193 N198 I199 G200 L254 F255 A258 F260	L180-L196 HydrophobicContact CD1-CD2 3.75Å; M192-L196 WeakPolarHBondContact O-CG 3.35Å; M192-L196 PolarHBondContact O-N 3.36Å; K193-L196 WeakPolarHBondContact O-CB 3.34Å; K193-L196 PolarHBondContact O-N 2.92Å; K193-L196 VanDerWaalsContact O-N 3.08Å; L196-N198 VanDerWaalsContact C-N 3.3Å; L196-N198 PolarHBondContact O-N 2.96Å; L196-I199 WeakPolarHBondContact O-CB 3.37Å; L196-I199 PolarHBondContact O-N 3.49Å; L196-G200 PolarHBondContact O-N 3.06Å; L196-L254 HydrophobicContact CD1-CD1 4.49Å; L196-L254 HydrophobicContact CD1-CD2 4.12Å; L196-L254 HydrophobicContact CD1-CG 3.77Å; L196-F255 HydrophobicContact CD1-CD1 4.27Å; L196-F255 HydrophobicContact CD1-CD2 3.68Å; L196-F255 HydrophobicContact CD1-CE1 4.34Å; L196-F255 HydrophobicContact CD1-CE2 3.74Å; L196-F255 HydrophobicContact CD1-CG 3.98Å; L196-F255 HydrophobicContact CD1-CZ 4.1Å; L196-F255 HydrophobicContact CD2-CD1 4.41Å; L196-F255 HydrophobicContact CD2-CE1 3.73Å; L196-F255 HydrophobicContact CD2-CE2 3.85Å; L196-F255 HydrophobicContact CD2-CZ 3.42Å; L196-F255 VanDerWaalsContact CD2-CZ 3.42Å; L196-F255 HydrophobicContact CG-CE2 4.47Å; L196-F255 HydrophobicContact CG-CZ 4.42Å; L196-A258 HydrophobicContact CB-CB 3.61Å; L196-A258 HydrophobicContact CD1-CB 4.18Å; L196-F260 HydrophobicContact CB-CE2 4.21Å
197	E	98.8	Very high	98.3	Very high	79 Å²	79	36.9 Å²	36.9	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-60.6	-40.4	174.3	-72.1	172.4	168.3	0	0	111.3	K193 V194 G200 K201 A258	K193-E197 WeakPolarHBondContact CE-OE1 3.48Å; K193-E197 HydrophobicContact CG-CG 4.45Å; K193-E197 IonicContact NZ-OE1 3.9Å; K193-E197 WeakPolarHBondContact O-CG 3.5Å; K193-E197 PolarHBondContact O-N 3.4Å; V194-E197 PolarHBondContact O-N 2.82Å; E197-G200 PolarHBondContact O-N 3.43Å; E197-K201 PolarHBondContact O-N 3.17Å; E197-A258 HydrophobicContact CG-CB 4.32Å
198	N	98.8	Very high	98.3	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.043	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-46.7	175	-165.5	11.9	0	0	0	111.8	L161 D164 L166 V194 A195 L196 G200 K201	L161-N198 PolarHBondContact O-ND2 3.02Å; D164-N198 PolarHBondContact O-ND2 3.26Å; L166-N198 PolarHBondContact N-OD1 3.37Å; L166-N198 VanDerWaalsContact N-OD1 3.11Å; V194-N198 WeakPolarHBondContact O-CB 3.16Å; V194-N198 PolarHBondContact O-N 2.69Å; A195-N198 WeakPolarHBondContact O-CB 3.25Å; A195-N198 PolarHBondContact O-N 3.37Å; L196-N198 VanDerWaalsContact C-N 3.3Å; L196-N198 PolarHBondContact O-N 2.96Å; N198-G200 VanDerWaalsContact C-N 3.28Å; N198-G200 PolarHBondContact O-N 2.83Å; N198-K201 WeakPolarHBondContact O-CB 3.41Å; N198-K201 PolarHBondContact O-N 2.95Å; N198-K201 VanDerWaalsContact O-N 3.16Å
199	I	98.9	Very high	98.3	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-58.6	-42.4	173.6	-72.8	167.2	0	0	0	110.9	A110 L166 V178 L180 A195 L196 K201 V202 L203 V209	A110-I199 HydrophobicContact CB-CD1 4.29Å; L166-I199 HydrophobicContact CD1-CG1 3.89Å; V178-I199 HydrophobicContact CB-CG2 4.13Å; V178-I199 HydrophobicContact CG1-CD1 4.4Å; V178-I199 HydrophobicContact CG1-CG2 3.83Å; V178-I199 HydrophobicContact CG2-CG2 3.73Å; L180-I199 HydrophobicContact CD1-CD1 3.79Å; L180-I199 HydrophobicContact CD2-CD1 3.83Å; L180-I199 HydrophobicContact CG-CD1 4.09Å; A195-I199 WeakPolarHBondContact O-CG1 3.38Å; A195-I199 PolarHBondContact O-N 2.93Å; L196-I199 WeakPolarHBondContact O-CB 3.37Å; L196-I199 PolarHBondContact O-N 3.49Å; I199-K201 PolarHBondContact O-N 2.85Å; I199-K201 VanDerWaalsContact O-N 3.16Å; I199-V202 WeakPolarHBondContact O-CG2 3.38Å; I199-V202 PolarHBondContact O-N 3.04Å; I199-L203 PolarHBondContact O-N 3.42Å; I199-L203 VanDerWaalsContact O-N 3.14Å; I199-V209 HydrophobicContact CG2-CG2 4.27Å
200	G	98.7	Very high	98.3	Very high	11 Å²	11	33.1 Å²	33.1	11%	0.113	18%	0.179	C	C	.	.	H	α-helix	trans	-57.2	-28.7	178.1	0	0	0	0	0	113.5	L196 E197 N198 K292	L196-G200 PolarHBondContact O-N 3.06Å; E197-G200 PolarHBondContact O-N 3.43Å; N198-G200 VanDerWaalsContact C-N 3.28Å; N198-G200 PolarHBondContact O-N 2.83Å; G200-K292 WeakPolarHBondContact O-CE 3.48Å; G200-K292 PolarHBondContact O-NZ 3.24Å
201	K	98.6	Very high	98.3	Very high	97 Å²	97	26.8 Å²	26.8	42%	0.422	15%	0.145	S	C	.	.	H	α-helix	trans	-67.9	-39.5	178.7	-64.9	175.1	-176.1	178.3	0	112.9	T167 A173 E197 N198 I199	T167-K201 HydrophobicContact CG2-CB 4.16Å; A173-K201 PolarHBondContact N-O 2.8Å; E197-K201 PolarHBondContact O-N 3.17Å; N198-K201 WeakPolarHBondContact O-CB 3.41Å; N198-K201 PolarHBondContact O-N 2.95Å; N198-K201 VanDerWaalsContact O-N 3.16Å; I199-K201 PolarHBondContact O-N 2.85Å; I199-K201 VanDerWaalsContact O-N 3.16Å
202	V	98.8	Very high	98.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-92.3	-18.9	-174.8	-56	0	0	0	0	112.8	L108 L166 T167 V170 A173 S174 V175 I199	L108-V202 HydrophobicContact CD2-CG2 3.88Å; L166-V202 HydrophobicContact CB-CG1 3.73Å; L166-V202 HydrophobicContact CB-CG2 4.33Å; L166-V202 HydrophobicContact CD1-CG2 4.08Å; T167-V202 HydrophobicContact CG2-CG1 3.85Å; V170-V202 HydrophobicContact CB-CB 4.25Å; V170-V202 HydrophobicContact CB-CG1 4.03Å; V170-V202 HydrophobicContact CG1-CB 3.83Å; V170-V202 HydrophobicContact CG1-CG1 4.17Å; V170-V202 HydrophobicContact CG1-CG2 4.25Å; A173-V202 CarbonylContact C-O 3.51Å; A173-V202 WeakPolarHBondContact CA-O 3.18Å; A173-V202 PolarHBondContact N-O 2.88Å; S174-V202 PolarHBondContact N-O 3.29Å; V175-V202 WeakPolarHBondContact CB-O 3.5Å; V175-V202 HydrophobicContact CG2-CB 4.39Å; V175-V202 HydrophobicContact CG2-CG2 4.22Å; V175-V202 PolarHBondContact N-O 3.03Å; I199-V202 WeakPolarHBondContact O-CG2 3.38Å; I199-V202 PolarHBondContact O-N 3.04Å
203	L	98.6	Very high	98.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.9	174.4	-168.7	68.9	0	0	0	111.6	V175 V178 I199 V209 F260 K292	V175-L203 HydrophobicContact CB-CD1 4.42Å; V175-L203 HydrophobicContact CG1-CD1 4.14Å; V175-L203 WeakPolarHBondContact O-CD1 3.49Å; V178-L203 HydrophobicContact CG2-CD1 3.77Å; I199-L203 PolarHBondContact O-N 3.42Å; I199-L203 VanDerWaalsContact O-N 3.14Å; L203-V209 HydrophobicContact CD2-CG2 3.8Å; L203-F260 HydrophobicContact CD2-CE1 3.8Å; L203-K292 HydrophobicContact CB-CD 4.34Å; L203-K292 HydrophobicContact CD2-CB 3.89Å; L203-K292 HydrophobicContact CG-CB 4.47Å; L203-K292 WeakPolarHBondContact O-CD 3.36Å; L203-K292 PolarHBondContact O-NZ 3.1Å
204	K	97.6	Very high	98.2	Very high	66 Å²	66	22.8 Å²	22.8	29%	0.287	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	148.7	173.5	-75.7	170.1	-175.5	172.5	0	111.5	A173 S174 V175 D176 G206 G207	A173-K204 WeakPolarHBondContact O-CG 3.19Å; S174-K204 VanDerWaalsContact O-CE 3.26Å; S174-K204 WeakPolarHBondContact O-CE 3.46Å; V175-K204 WeakPolarHBondContact O-CB 3.46Å; V175-K204 WeakPolarHBondContact O-CG 3.3Å; V175-K204 PolarHBondContact O-N 3.15Å; D176-K204 VanDerWaalsContact OD1-CD 3.26Å; D176-K204 WeakPolarHBondContact OD1-CD 3.44Å; D176-K204 WeakPolarHBondContact OD1-CE 3.12Å; D176-K204 IonicContact OD1-NZ 3.64Å; D176-K204 PolarHBondContact OD1-NZ 2.81Å; D176-K204 IonicContact OD2-NZ 3.96Å; K204-G206 PolarHBondContact O-N 2.84Å; K204-G207 WeakPolarHBondContact O-CA 3.12Å; K204-G207 PolarHBondContact O-N 2.94Å
205	P	97.3	Very high	98.2	Very high	46 Å²	46	19.6 Å²	19.6	30%	0.299	11%	0.107	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.5	131.6	160.9	-19.1	31.1	0	0	0	109.9	G207	P205-G207 PolarHBondContact O-N 3.16Å
206	G	95.9	Very high	98.1	Very high	36 Å²	36	20.4 Å²	20.4	37%	0.371	11%	0.111	S	C	.	.	E	Extended strand (participates in β ladder)	trans	82	-8.8	-171	0	0	0	0	0	114.9	K204 K292	K204-G206 PolarHBondContact O-N 2.84Å; G206-K292 WeakPolarHBondContact CA-O 3.41Å; G206-K292 PolarHBondContact N-O 2.99Å
207	G	96.8	Very high	97.9	Very high	7 Å²	7	23.5 Å²	23.5	7%	0.072	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	157.8	176.1	0	0	0	0	0	112.7	D176 K204 P205 I291 K292	D176-G207 VanDerWaalsContact O-CA 3.25Å; D176-G207 WeakPolarHBondContact O-CA 3.49Å; K204-G207 WeakPolarHBondContact O-CA 3.12Å; K204-G207 PolarHBondContact O-N 2.94Å; P205-G207 PolarHBondContact O-N 3.16Å; G207-I291 WeakPolarHBondContact O-CA 3.4Å; G207-K292 PolarHBondContact O-N 3.3Å
208	V	97.9	Very high	97.8	Very high	13 Å²	13	19.7 Å²	19.7	8%	0.079	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	141.3	-172.2	171.3	0	0	0	0	111.8	E93 D176 V177 V178 L210 F290 I291	E93-V208 HydrophobicContact CG-CG1 4.23Å; E93-V208 HydrophobicContact CG-CG2 4.32Å; D176-V208 PolarHBondContact O-N 3.44Å; D176-V208 VanDerWaalsContact O-N 3.1Å; V177-V208 CarbonylContact C-O 3.59Å; V177-V208 WeakPolarHBondContact CA-O 3.46Å; V178-V208 PolarHBondContact N-O 3.11Å; V208-L210 HydrophobicContact CG1-CD2 3.49Å; V208-L210 VanDerWaalsContact CG1-CD2 3.49Å; V208-L210 HydrophobicContact CG1-CG 4.04Å; V208-F290 CarbonylContact C-O 3.58Å; V208-F290 VanDerWaalsContact CA-O 3.32Å; V208-F290 WeakPolarHBondContact CA-O 3.45Å; V208-I291 HydrophobicContact CG2-CD1 4.37Å; V208-I291 HydrophobicContact CG2-CG1 3.71Å
209	V	98.6	Very high	97.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.2	163.3	-173.2	0	0	0	0	109.1	V178 L180 I199 L203 F255 F260 K289 F290	V178-V209 HydrophobicContact CB-CG1 4.4Å; V178-V209 HydrophobicContact CB-CG2 4.26Å; V178-V209 HydrophobicContact CG1-CG1 4.37Å; V178-V209 CarbonylContact O-C 3.56Å; V178-V209 WeakPolarHBondContact O-CA 3.47Å; L180-V209 HydrophobicContact CD1-CG1 3.77Å; L180-V209 HydrophobicContact CG-CG1 4.23Å; I199-V209 HydrophobicContact CG2-CG2 4.27Å; L203-V209 HydrophobicContact CD2-CG2 3.8Å; V209-F255 HydrophobicContact CB-CE1 4.04Å; V209-F255 HydrophobicContact CG1-CE1 3.87Å; V209-F255 HydrophobicContact CG1-CZ 4.11Å; V209-F255 HydrophobicContact CG2-CE1 4.39Å; V209-F260 HydrophobicContact CG2-CD1 4.07Å; V209-F260 HydrophobicContact CG2-CE1 3.55Å; V209-F260 HydrophobicContact CG2-CZ 4.19Å; V209-K289 WeakPolarHBondContact O-CA 3.25Å; V209-F290 HydrophobicContact CB-CB 4.42Å; V209-F290 PolarHBondContact N-O 2.82Å; V209-F290 PolarHBondContact O-N 2.88Å
210	L	98.4	Very high	97.2	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	112.3	174.5	-56.3	176	0	0	0	108.8	F91 E93 L94 V177 V178 T179 L180 V208 K289	F91-L210 HydrophobicContact CB-CD1 3.63Å; F91-L210 HydrophobicContact CB-CD2 4.18Å; F91-L210 HydrophobicContact CB-CG 4.43Å; F91-L210 HydrophobicContact CD1-CB 4.18Å; F91-L210 HydrophobicContact CD1-CD1 4.3Å; F91-L210 HydrophobicContact CD1-CD2 3.71Å; F91-L210 HydrophobicContact CD1-CG 4.28Å; F91-L210 HydrophobicContact CD2-CB 4.38Å; F91-L210 HydrophobicContact CD2-CD1 4.19Å; F91-L210 HydrophobicContact CE1-CB 4.18Å; F91-L210 HydrophobicContact CE1-CD2 4.3Å; F91-L210 HydrophobicContact CE2-CB 4.38Å; F91-L210 HydrophobicContact CG-CB 4.27Å; F91-L210 HydrophobicContact CG-CD1 3.81Å; F91-L210 HydrophobicContact CG-CD2 4.08Å; F91-L210 HydrophobicContact CG-CG 4.27Å; F91-L210 HydrophobicContact CZ-CB 4.28Å; E93-L210 HydrophobicContact CB-CD2 4.23Å; E93-L210 HydrophobicContact CG-CD2 4.27Å; L94-L210 HydrophobicContact CD1-CD1 4.38Å; L94-L210 HydrophobicContact CD2-CD1 3.89Å; L94-L210 HydrophobicContact CG-CD1 3.86Å; V177-L210 HydrophobicContact CG1-CD1 3.52Å; V177-L210 HydrophobicContact CG1-CG 3.84Å; V178-L210 PolarHBondContact O-N 2.49Å; T179-L210 WeakPolarHBondContact CA-O 3.43Å; T179-L210 HydrophobicContact CG2-CB 4.17Å; T179-L210 HydrophobicContact CG2-CD1 4.11Å; L180-L210 PolarHBondContact N-O 3.1Å; V208-L210 HydrophobicContact CG1-CD2 3.49Å; V208-L210 VanDerWaalsContact CG1-CD2 3.49Å; V208-L210 HydrophobicContact CG1-CG 4.04Å; L210-K289 HydrophobicContact CD2-CG 4.08Å
211	F	98.5	Very high	97.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.4	-175.2	177.1	-87.2	0	0	0	110.7	L180 L184 D213 F246 L251 F255 L286 Q287 S288 F290	L180-F211 HydrophobicContact CB-CD2 4.15Å; L184-F211 HydrophobicContact CB-CE2 3.93Å; L184-F211 HydrophobicContact CD2-CE2 4.01Å; F211-D213 HydrophobicContact CE1-CB 3.7Å; F211-D213 HydrophobicContact CE2-CB 4.01Å; F211-D213 HydrophobicContact CZ-CB 3.31Å; F211-F246 HydrophobicContact CZ-CD1 4.45Å; F211-F246 AromaticContact CZ-CD2 3.96Å; F211-F246 HydrophobicContact CZ-CD2 3.96Å; F211-F246 HydrophobicContact CZ-CE1 4.47Å; F211-F246 AromaticContact CZ-CE2 3.96Å; F211-F246 HydrophobicContact CZ-CE2 3.96Å; F211-F246 HydrophobicContact CZ-CG 4.22Å; F211-F246 HydrophobicContact CZ-CZ 4.24Å; F211-L251 HydrophobicContact CD1-CD1 4.49Å; F211-L251 HydrophobicContact CD1-CD2 3.51Å; F211-L251 HydrophobicContact CD2-CD1 4.32Å; F211-L251 HydrophobicContact CE1-CD1 4.03Å; F211-L251 HydrophobicContact CE1-CD2 3.42Å; F211-L251 VanDerWaalsContact CE1-CD2 3.42Å; F211-L251 HydrophobicContact CE1-CG 4.4Å; F211-L251 HydrophobicContact CE2-CD1 3.81Å; F211-L251 HydrophobicContact CG-CD2 4.12Å; F211-L251 HydrophobicContact CZ-CD1 3.63Å; F211-L251 HydrophobicContact CZ-CD2 3.95Å; F211-L251 HydrophobicContact CZ-CG 4.48Å; F211-F255 HydrophobicContact CD2-CE2 4.35Å; F211-F255 HydrophobicContact CD2-CZ 4.38Å; F211-L286 HydrophobicContact CE1-CB 4.29Å; F211-L286 HydrophobicContact CE1-CG 4.35Å; F211-Q287 WeakPolarHBondContact O-CA 3.45Å; F211-S288 PolarHBondContact N-O 2.75Å; F211-S288 PolarHBondContact O-N 2.87Å; F211-F290 HydrophobicContact CB-CE2 4.38Å
212	R	97.8	Very high	96.8	Very high	11 Å²	11	18 Å²	18	4%	0.042	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	122.9	161.7	-168.5	176.7	-142.7	165.6	20.9	111.1	W86 E90 F91 L180 I181 F182 F285 L286	W86-R212 HydrophobicContact CH2-CB 4.48Å; E90-R212 IonicContact OE1-NH1 3.54Å; E90-R212 IonicContact OE1-NH2 2.93Å; E90-R212 IonicContact OE2-CZ 4Å; E90-R212 IonicContact OE2-NH1 3.87Å; E90-R212 PolarHBondContact OE2-NH1 2.64Å; E90-R212 IonicContact OE2-NH2 3.57Å; E90-R212 PolarHBondContact OE2-NH2 2.97Å; F91-R212 HydrophobicContact CZ-CB 4.47Å; L180-R212 PolarHBondContact O-N 3.12Å; I181-R212 CarbonylContact C-O 3.59Å; I181-R212 VanDerWaalsContact CA-O 3.31Å; I181-R212 WeakPolarHBondContact CA-O 3.26Å; I181-R212 HydrophobicContact CG1-CB 4.42Å; F182-R212 PolarHBondContact N-O 3.48Å; R212-F285 HydrophobicContact CG-CB 4.2Å; R212-L286 VanDerWaalsContact CA-O 3.32Å; R212-L286 WeakPolarHBondContact CA-O 3.49Å
213	D	98.3	Very high	96.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	-175	176.7	-142.1	-40.4	0	0	0	111.3	F182 V183 L184 S185 F211 G215 F246 F285 L286	F182-D213 WeakPolarHBondContact CA-OD2 3.49Å; V183-D213 PolarHBondContact N-OD2 3.19Å; V183-D213 VanDerWaalsContact N-OD2 3.11Å; L184-D213 PolarHBondContact N-OD2 2.85Å; S185-D213 VanDerWaalsContact CB-CG 3.45Å; S185-D213 WeakPolarHBondContact CB-OD1 3.24Å; S185-D213 WeakPolarHBondContact CB-OD2 3.49Å; S185-D213 PolarHBondContact N-OD2 3.02Å; S185-D213 PolarHBondContact OG-OD1 2.86Å; S185-D213 PolarHBondContact OG-OD2 2.96Å; S185-D213 VanDerWaalsContact OG-OD2 3.1Å; F211-D213 HydrophobicContact CE1-CB 3.7Å; F211-D213 HydrophobicContact CE2-CB 4.01Å; F211-D213 HydrophobicContact CZ-CB 3.31Å; D213-G215 PolarHBondContact O-N 3.17Å; D213-F246 HydrophobicContact CB-CD2 3.96Å; D213-F246 HydrophobicContact CB-CE2 3.88Å; D213-F285 CarbonylContact O-C 3.56Å; D213-F285 VanDerWaalsContact O-CA 3.23Å; D213-F285 WeakPolarHBondContact O-CA 3.39Å; D213-L286 PolarHBondContact N-O 2.77Å; D213-L286 PolarHBondContact O-N 3.09Å
214	Y	98	Very high	96.1	Very high	35 Å²	35	27 Å²	27	14%	0.137	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	126.5	178.6	-57.8	-73.1	0	0	0	111.7	F182 R237 F245 F246	F182-Y214 HydrophobicContact CD1-CD2 4.38Å; F182-Y214 HydrophobicContact CD1-CE1 4.31Å; F182-Y214 HydrophobicContact CD1-CE2 4.13Å; F182-Y214 HydrophobicContact CE1-CD1 4.27Å; F182-Y214 HydrophobicContact CE1-CE1 4.17Å; Y214-R237 PolarHBondContact OH-NH2 2.91Å; Y214-F245 VanDerWaalsContact CB-CD1 3.5Å; Y214-F245 HydrophobicContact CD1-CE1 4.16Å; Y214-F245 HydrophobicContact CG-CD1 4.22Å; Y214-F245 AromaticContact CG-CE1 3.93Å; Y214-F245 HydrophobicContact CG-CE1 3.93Å; Y214-F246 WeakPolarHBondContact O-CD2 3.27Å; Y214-F246 PolarHBondContact O-N 2.96Å
215	G	97.9	Very high	95.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-86.3	163.3	170.4	0	0	0	0	0	111.7	D213 Y217 D218 V284	D213-G215 PolarHBondContact O-N 3.17Å; G215-Y217 PolarHBondContact O-N 2.91Å; G215-D218 PolarHBondContact O-N 3.29Å; G215-V284 PolarHBondContact N-O 3.31Å
216	L	96.8	Very high	95.3	Very high	18 Å²	18	33.4 Å²	33.4	9%	0.094	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	141.4	171.1	-75.5	-176.6	0	0	0	111.6	D218 N233 F245 F246 V284	L216-D218 PolarHBondContact O-N 3.29Å; L216-N233 HydrophobicContact CD2-CB 4.47Å; L216-F245 HydrophobicContact CD2-CB 4.39Å; L216-F246 PolarHBondContact N-O 3.48Å; L216-V284 WeakPolarHBondContact O-CG1 3.39Å
217	Y	95.2	Very high	95	Very high	65 Å²	65	33.3 Å²	33.3	26%	0.255	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	16.5	174.4	-45.8	-35.7	0	0	0	115.1	A35 R36 L38 L46 G215 M221	A35-Y217 HydrophobicContact CB-CD2 3.9Å; A35-Y217 HydrophobicContact CB-CE2 3.72Å; R36-Y217 HydrophobicContact CG-CD2 4.28Å; R36-Y217 VanDerWaalsContact CZ-O 3.3Å; R36-Y217 PolarHBondContact NE-O 3.06Å; R36-Y217 PolarHBondContact NH2-O 3.39Å; R36-Y217 WeakPolarHBondContact O-CD2 3.42Å; L38-Y217 HydrophobicContact CD1-CD1 3.69Å; L38-Y217 HydrophobicContact CD1-CD2 4.36Å; L38-Y217 HydrophobicContact CD1-CE1 3.72Å; L38-Y217 HydrophobicContact CD1-CE2 4.38Å; L38-Y217 HydrophobicContact CD1-CG 4.03Å; L38-Y217 HydrophobicContact CD2-CD1 4.04Å; L38-Y217 HydrophobicContact CD2-CD2 4.17Å; L38-Y217 HydrophobicContact CD2-CG 3.67Å; L38-Y217 HydrophobicContact CG-CD1 4.11Å; L38-Y217 HydrophobicContact CG-CD2 4.03Å; L38-Y217 HydrophobicContact CG-CE1 4.43Å; L38-Y217 HydrophobicContact CG-CE2 4.35Å; L38-Y217 HydrophobicContact CG-CG 3.91Å; L46-Y217 HydrophobicContact CD1-CD1 4.02Å; L46-Y217 HydrophobicContact CD1-CE1 4.07Å; G215-Y217 PolarHBondContact O-N 2.91Å; Y217-M221 HydrophobicContact CD1-SD 4.29Å; Y217-M221 PolarHBondContact N-SD 3.33Å
218	D	96.1	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.			trans	-52.7	144.2	163.6	-177.2	-106	0	0	0	110	G215 L216 A220 M221 F245 R283 V284	G215-D218 PolarHBondContact O-N 3.29Å; L216-D218 PolarHBondContact O-N 3.29Å; D218-A220 PolarHBondContact O-N 3.49Å; D218-A220 WeakPolarHBondContact OD1-CB 3.41Å; D218-A220 PolarHBondContact OD1-N 3.34Å; D218-M221 WeakPolarHBondContact O-CB 3.2Å; D218-M221 PolarHBondContact O-N 2.91Å; D218-F245 HydrophobicContact CB-CD1 4.07Å; D218-F245 HydrophobicContact CB-CE1 3.97Å; D218-R283 IonicContact OD1-CZ 3.24Å; D218-R283 IonicContact OD1-NE 3.19Å; D218-R283 PolarHBondContact OD1-NE 3.35Å; D218-R283 IonicContact OD1-NH2 3.48Å; D218-R283 PolarHBondContact OD1-NH2 2.89Å; D218-R283 WeakPolarHBondContact OD2-CA 3.32Å; D218-R283 IonicContact OD2-CZ 3.35Å; D218-R283 IonicContact OD2-NE 3.8Å; D218-R283 PolarHBondContact OD2-NE 3.32Å; D218-R283 IonicContact OD2-NH2 2.78Å; D218-V284 HydrophobicContact CB-CB 4.12Å; D218-V284 PolarHBondContact OD2-N 2.85Å
219	H	93.3	Very high	94.9	Very high	40 Å²	40	34.9 Å²	34.9	19%	0.185	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-26.9	179.2	177.3	79.5	0	0	0	113.3	M221 L222 R223 V281 P282	H219-M221 VanDerWaalsContact C-N 3.31Å; H219-M221 PolarHBondContact O-N 2.96Å; H219-L222 PolarHBondContact O-N 3.09Å; H219-R223 VanDerWaalsContact CD2-CD 3.48Å; H219-R223 WeakPolarHBondContact CD2-CD 3.45Å; H219-R223 WeakPolarHBondContact NE2-CD 3.31Å; H219-R223 WeakPolarHBondContact O-CG 3.06Å; H219-V281 HydrophobicContact CB-CB 4.27Å; H219-V281 WeakPolarHBondContact NE2-CG1 3.45Å; H219-P282 HydrophobicContact CB-CG 4.38Å; H219-P282 WeakPolarHBondContact CB-O 3.15Å; H219-P282 PolarHBondContact N-O 2.86Å
220	A	92.9	Very high	94.8	Very high	21 Å²	21	35.3 Å²	35.3	17%	0.174	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-31.6	173.9	0	0	0	0	0	112.9	D218 F224 F245	D218-A220 PolarHBondContact O-N 3.49Å; D218-A220 WeakPolarHBondContact OD1-CB 3.41Å; D218-A220 PolarHBondContact OD1-N 3.34Å; A220-F224 WeakPolarHBondContact O-CD2 3.35Å; A220-F224 WeakPolarHBondContact O-CE2 3.33Å; A220-F245 HydrophobicContact CB-CE1 4.19Å; A220-F245 HydrophobicContact CB-CZ 4.16Å
221	M	94.8	Very high	94.7	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.02	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-63.9	-45.8	176.3	-170	-179.5	173.8	0	0	110.6	L46 Y217 D218 H219 R223 F224 N233 Y235 F245	L46-M221 HydrophobicContact CD2-CE 4.05Å; L46-M221 HydrophobicContact CD2-CG 4.4Å; Y217-M221 HydrophobicContact CD1-SD 4.29Å; Y217-M221 PolarHBondContact N-SD 3.33Å; D218-M221 WeakPolarHBondContact O-CB 3.2Å; D218-M221 PolarHBondContact O-N 2.91Å; H219-M221 VanDerWaalsContact C-N 3.31Å; H219-M221 PolarHBondContact O-N 2.96Å; M221-R223 PolarHBondContact O-N 2.75Å; M221-R223 VanDerWaalsContact O-N 3.15Å; M221-F224 PolarHBondContact O-N 2.97Å; M221-N233 VanDerWaalsContact CE-OD1 3.27Å; M221-N233 WeakPolarHBondContact CE-OD1 3.22Å; M221-Y235 HydrophobicContact CE-CE2 4.25Å; M221-Y235 HydrophobicContact CG-CE2 4.06Å; M221-F245 VanDerWaalsContact CA-CZ 3.4Å; M221-F245 HydrophobicContact CB-CD1 3.64Å; M221-F245 HydrophobicContact CB-CD2 3.95Å; M221-F245 HydrophobicContact CB-CE1 3.57Å; M221-F245 HydrophobicContact CB-CE2 3.88Å; M221-F245 HydrophobicContact CB-CG 3.84Å; M221-F245 HydrophobicContact CB-CZ 3.7Å; M221-F245 HydrophobicContact CG-CB 4.41Å; M221-F245 HydrophobicContact CG-CD1 4.15Å; M221-F245 HydrophobicContact CG-CD2 3.72Å; M221-F245 HydrophobicContact CG-CE1 4.41Å; M221-F245 HydrophobicContact CG-CE2 4.01Å; M221-F245 HydrophobicContact CG-CG 3.81Å; M221-F245 HydrophobicContact CG-CZ 4.34Å; M221-F245 VanDerWaalsContact N-CZ 3.34Å; M221-F245 HydrophobicContact SD-CB 3.9Å; M221-F245 HydrophobicContact SD-CD1 4.4Å; M221-F245 HydrophobicContact SD-CD2 4.32Å; M221-F245 HydrophobicContact SD-CG 3.94Å
222	L	92.5	Very high	94.5	Very high	17 Å²	17	42.2 Å²	42.2	9%	0.089	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-73.3	-6.6	-173.8	-59.4	178.1	0	0	0	114.4	L38 E42 L46 H219	L38-L222 HydrophobicContact CD2-CD1 4.34Å; L38-L222 HydrophobicContact CD2-CD2 4.46Å; E42-L222 HydrophobicContact CB-CD1 4.11Å; E42-L222 HydrophobicContact CB-CD2 4.33Å; E42-L222 HydrophobicContact CG-CD1 3.75Å; E42-L222 WeakPolarHBondContact OE1-CD1 3.39Å; L46-L222 HydrophobicContact CD1-CD2 3.66Å; L46-L222 HydrophobicContact CD2-CD2 3.76Å; L46-L222 HydrophobicContact CG-CD2 3.53Å; H219-L222 PolarHBondContact O-N 3.09Å
223	R	91.1	Very high	94.5	Very high	160 Å²	160	43.7 Å²	43.7	60%	0.604	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-103.5	-4.5	-176.3	-82.9	-178.9	47.2	174.1	-0.6	114.2	H219 M221	H219-R223 VanDerWaalsContact CD2-CD 3.48Å; H219-R223 WeakPolarHBondContact CD2-CD 3.45Å; H219-R223 WeakPolarHBondContact NE2-CD 3.31Å; H219-R223 WeakPolarHBondContact O-CG 3.06Å; M221-R223 PolarHBondContact O-N 2.75Å; M221-R223 VanDerWaalsContact O-N 3.15Å
224	F	92.2	Very high	94.4	Very high	29 Å²	29	44 Å²	44	13%	0.127	23%	0.229	C	C	.	.			trans	-60.7	148.4	170.1	-77.3	-73	0	0	0	109.6	A220 M221 Y235 V236 R237 F245	A220-F224 WeakPolarHBondContact O-CD2 3.35Å; A220-F224 WeakPolarHBondContact O-CE2 3.33Å; M221-F224 PolarHBondContact O-N 2.97Å; F224-Y235 HydrophobicContact CB-CD1 3.74Å; F224-Y235 HydrophobicContact CB-CE1 4.17Å; F224-Y235 HydrophobicContact CB-CG 4.37Å; F224-Y235 HydrophobicContact CD1-CD1 4.38Å; F224-Y235 HydrophobicContact CD1-CG 4.38Å; F224-Y235 AromaticContact CD2-CD1 3.82Å; F224-Y235 HydrophobicContact CD2-CD1 3.82Å; F224-Y235 HydrophobicContact CD2-CD2 4.06Å; F224-Y235 AromaticContact CD2-CG 3.56Å; F224-Y235 HydrophobicContact CD2-CG 3.56Å; F224-Y235 HydrophobicContact CE2-CD2 4.26Å; F224-Y235 AromaticContact CE2-CG 3.9Å; F224-Y235 HydrophobicContact CE2-CG 3.9Å; F224-Y235 AromaticContact CG-CD1 3.7Å; F224-Y235 HydrophobicContact CG-CD1 3.7Å; F224-Y235 HydrophobicContact CG-CE1 4.49Å; F224-Y235 AromaticContact CG-CG 3.83Å; F224-Y235 HydrophobicContact CG-CG 3.83Å; F224-Y235 HydrophobicContact CZ-CG 4.42Å; F224-V236 VanDerWaalsContact CE1-O 3.27Å; F224-V236 WeakPolarHBondContact CE1-O 3.43Å; F224-R237 HydrophobicContact CE1-CG 4.01Å; F224-R237 HydrophobicContact CZ-CG 4.04Å; F224-F245 HydrophobicContact CD2-CE2 4.33Å; F224-F245 AromaticContact CE2-CE2 3.72Å; F224-F245 HydrophobicContact CE2-CE2 3.72Å; F224-F245 AromaticContact CE2-CZ 3.89Å; F224-F245 HydrophobicContact CE2-CZ 3.89Å
225	K	88.6	Confident	94.4	Very high	152 Å²	152	42.5 Å²	42.5	66%	0.661	22%	0.223	S	C	*	.			trans	-106.1	156	177.6	-63.5	-175.5	178.8	-175.3	0	108.1	E49 G227 S228	E49-K225 WeakPolarHBondContact OE1-CA 3.36Å; E49-K225 PolarHBondContact OE1-N 3.34Å; K225-G227 PolarHBondContact O-N 2.62Å; K225-S228 WeakPolarHBondContact O-CB 3.26Å; K225-S228 PolarHBondContact O-N 3.28Å; K225-S228 PolarHBondContact O-OG 2.75Å
226	S	88.6	Confident	94.4	Very high	94 Å²	94	42.8 Å²	42.8	66%	0.657	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-45.3	135.9	170.2	-176	0	0	0	0	111.7	E49	E49-S226 PolarHBondContact OE1-N 3.24Å
227	G	91.3	Very high	94.3	Very high	34 Å²	34	45.6 Å²	45.6	35%	0.351	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	11.9	-172.9	0	0	0	0	0	115.3	V53 K225	V53-G227 WeakPolarHBondContact CG2-O 3.43Å; K225-G227 PolarHBondContact O-N 2.62Å
228	S	95.3	Very high	94.3	Very high	22 Å²	22	51.8 Å²	51.8	15%	0.154	27%	0.266	C	S	.	.			trans	-107.3	-15	174	-48.2	0	0	0	0	113.8	K225 L230 Y235 V236	K225-S228 WeakPolarHBondContact O-CB 3.26Å; K225-S228 PolarHBondContact O-N 3.28Å; K225-S228 PolarHBondContact O-OG 2.75Å; S228-L230 PolarHBondContact O-N 2.68Å; S228-Y235 CarbonylContact O-C 3.5Å; S228-Y235 WeakPolarHBondContact O-CA 3.09Å; S228-V236 PolarHBondContact O-N 3.32Å
229	K	96.3	Very high	94.2	Very high	30 Å²	30	53.9 Å²	53.9	13%	0.13	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	121.9	-175.5	-166.3	169.9	178	172.6	0	111	E49 L52 V53 G231 D232 Y235	E49-K229 VanDerWaalsContact O-CD 3.29Å; E49-K229 WeakPolarHBondContact O-CD 3.45Å; E49-K229 PolarHBondContact O-NZ 3.37Å; L52-K229 CarbonylContact C-O 3.51Å; L52-K229 WeakPolarHBondContact CA-O 3.1Å; L52-K229 HydrophobicContact CD2-CB 4.48Å; L52-K229 HydrophobicContact CD2-CD 4.36Å; L52-K229 HydrophobicContact CD2-CG 3.97Å; V53-K229 WeakPolarHBondContact CG2-O 3.39Å; V53-K229 PolarHBondContact N-O 3.06Å; K229-G231 WeakPolarHBondContact CE-O 3.39Å; K229-G231 WeakPolarHBondContact CG-O 3.32Å; K229-D232 IonicContact NZ-OD1 3.84Å; K229-Y235 HydrophobicContact CB-CD1 4.15Å; K229-Y235 HydrophobicContact CB-CE1 4.05Å; K229-Y235 HydrophobicContact CD-CE1 4.29Å; K229-Y235 HydrophobicContact CG-CD1 4.31Å; K229-Y235 HydrophobicContact CG-CE1 3.93Å
230	L	97	Very high	94.4	Very high	9 Å²	9	52.4 Å²	52.4	5%	0.047	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-31.4	175.7	-61.7	178.4	0	0	0	111.4	V53 Q58 L61 S228 F234 V236 R242	V53-L230 HydrophobicContact CB-CD2 4.02Å; V53-L230 HydrophobicContact CG1-CD2 4.33Å; V53-L230 HydrophobicContact CG2-CD2 4.11Å; Q58-L230 HydrophobicContact CG-CD2 4Å; Q58-L230 PolarHBondContact OE1-O 3.06Å; L61-L230 HydrophobicContact CD1-CD2 3.77Å; S228-L230 PolarHBondContact O-N 2.68Å; L230-F234 HydrophobicContact CB-CB 4.45Å; L230-F234 HydrophobicContact CB-CD1 3.47Å; L230-F234 VanDerWaalsContact CB-CD1 3.47Å; L230-F234 HydrophobicContact CB-CE1 3.97Å; L230-F234 HydrophobicContact CB-CG 4.11Å; L230-F234 HydrophobicContact CD1-CD1 3.82Å; L230-F234 HydrophobicContact CD1-CE1 3.54Å; L230-F234 HydrophobicContact CD1-CE2 4.43Å; L230-F234 HydrophobicContact CD1-CG 4.38Å; L230-F234 HydrophobicContact CD1-CZ 3.88Å; L230-F234 HydrophobicContact CG-CD1 4.31Å; L230-F234 HydrophobicContact CG-CE1 4.43Å; L230-F234 PolarHBondContact N-O 2.9Å; L230-V236 HydrophobicContact CD1-CB 3.95Å; L230-V236 HydrophobicContact CD2-CB 4.14Å; L230-V236 HydrophobicContact CD2-CG1 4.19Å; L230-V236 HydrophobicContact CG-CB 4.07Å; L230-V236 HydrophobicContact CG-CG1 4.45Å; L230-R242 HydrophobicContact CD1-CB 4.46Å; L230-R242 HydrophobicContact CD1-CG 3.85Å
231	G	96.1	Very high	94.6	Very high	19 Å²	19	51.6 Å²	51.6	20%	0.196	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	-170.1	177.8	0	0	0	0	0	110	K229 N233 F234	K229-G231 WeakPolarHBondContact CE-O 3.39Å; K229-G231 WeakPolarHBondContact CG-O 3.32Å; G231-N233 PolarHBondContact O-N 3.06Å; G231-F234 PolarHBondContact N-O 3.48Å; G231-F234 VanDerWaalsContact N-O 3.16Å; G231-F234 PolarHBondContact O-N 3.25Å
232	D	94.8	Very high	94.7	Very high	126 Å²	126	52.1 Å²	52.1	67%	0.674	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	128.2	174.8	-70.8	-28.2	0	0	0	110.5	K229 F234 Y244	K229-D232 IonicContact NZ-OD1 3.84Å; D232-F234 PolarHBondContact O-N 3.36Å; D232-Y244 WeakPolarHBondContact O-CE2 3.33Å
233	N	96.6	Very high	95	Very high	42 Å²	42	51.4 Å²	51.4	23%	0.225	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	12.6	-174.5	-52.2	-41.3	0	0	0	115.1	L216 M221 G231 Y244 F245	L216-N233 HydrophobicContact CD2-CB 4.47Å; M221-N233 VanDerWaalsContact CE-OD1 3.27Å; M221-N233 WeakPolarHBondContact CE-OD1 3.22Å; G231-N233 PolarHBondContact O-N 3.06Å; N233-Y244 HydrophobicContact CB-CE2 4.07Å; N233-Y244 CarbonylContact O-C 3.47Å; N233-Y244 VanDerWaalsContact O-CA 3.26Å; N233-Y244 WeakPolarHBondContact O-CA 3.43Å; N233-F245 HydrophobicContact CB-CB 4.35Å; N233-F245 WeakPolarHBondContact CB-O 3.35Å; N233-F245 PolarHBondContact O-N 3Å
234	F	97.9	Very high	95.3	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.026	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.7	-174.5	-168.6	-140.4	0	0	0	111.7	H188 P189 L230 G231 D232 R242 Y244	H188-F234 AromaticContact CD2-CE1 3.76Å; P189-F234 HydrophobicContact CG-CD1 4.31Å; P189-F234 HydrophobicContact CG-CG 4.28Å; L230-F234 HydrophobicContact CB-CB 4.45Å; L230-F234 HydrophobicContact CB-CD1 3.47Å; L230-F234 VanDerWaalsContact CB-CD1 3.47Å; L230-F234 HydrophobicContact CB-CE1 3.97Å; L230-F234 HydrophobicContact CB-CG 4.11Å; L230-F234 HydrophobicContact CD1-CD1 3.82Å; L230-F234 HydrophobicContact CD1-CE1 3.54Å; L230-F234 HydrophobicContact CD1-CE2 4.43Å; L230-F234 HydrophobicContact CD1-CG 4.38Å; L230-F234 HydrophobicContact CD1-CZ 3.88Å; L230-F234 HydrophobicContact CG-CD1 4.31Å; L230-F234 HydrophobicContact CG-CE1 4.43Å; L230-F234 PolarHBondContact N-O 2.9Å; G231-F234 PolarHBondContact N-O 3.48Å; G231-F234 VanDerWaalsContact N-O 3.16Å; G231-F234 PolarHBondContact O-N 3.25Å; D232-F234 PolarHBondContact O-N 3.36Å; F234-R242 HydrophobicContact CE2-CB 3.69Å; F234-R242 HydrophobicContact CZ-CB 3.93Å; F234-R242 HydrophobicContact CZ-CG 4.28Å; F234-Y244 HydrophobicContact CB-CD2 3.78Å; F234-Y244 HydrophobicContact CB-CE2 4.32Å; F234-Y244 HydrophobicContact CD2-CD2 4.05Å; F234-Y244 HydrophobicContact CG-CD2 4.18Å
235	Y	97.6	Very high	95.6	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.016	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.6	-169.7	-58.6	-94.7	0	0	0	112.4	E49 M221 F224 S228 K229 R242 S243 F245	E49-Y235 WeakPolarHBondContact OE2-CE1 3.06Å; M221-Y235 HydrophobicContact CE-CE2 4.25Å; M221-Y235 HydrophobicContact CG-CE2 4.06Å; F224-Y235 HydrophobicContact CB-CD1 3.74Å; F224-Y235 HydrophobicContact CB-CE1 4.17Å; F224-Y235 HydrophobicContact CB-CG 4.37Å; F224-Y235 HydrophobicContact CD1-CD1 4.38Å; F224-Y235 HydrophobicContact CD1-CG 4.38Å; F224-Y235 AromaticContact CD2-CD1 3.82Å; F224-Y235 HydrophobicContact CD2-CD1 3.82Å; F224-Y235 HydrophobicContact CD2-CD2 4.06Å; F224-Y235 AromaticContact CD2-CG 3.56Å; F224-Y235 HydrophobicContact CD2-CG 3.56Å; F224-Y235 HydrophobicContact CE2-CD2 4.26Å; F224-Y235 AromaticContact CE2-CG 3.9Å; F224-Y235 HydrophobicContact CE2-CG 3.9Å; F224-Y235 AromaticContact CG-CD1 3.7Å; F224-Y235 HydrophobicContact CG-CD1 3.7Å; F224-Y235 HydrophobicContact CG-CE1 4.49Å; F224-Y235 AromaticContact CG-CG 3.83Å; F224-Y235 HydrophobicContact CG-CG 3.83Å; F224-Y235 HydrophobicContact CZ-CG 4.42Å; S228-Y235 CarbonylContact O-C 3.5Å; S228-Y235 WeakPolarHBondContact O-CA 3.09Å; K229-Y235 HydrophobicContact CB-CD1 4.15Å; K229-Y235 HydrophobicContact CB-CE1 4.05Å; K229-Y235 HydrophobicContact CD-CE1 4.29Å; K229-Y235 HydrophobicContact CG-CD1 4.31Å; K229-Y235 HydrophobicContact CG-CE1 3.93Å; Y235-R242 CarbonylContact O-C 3.5Å; Y235-R242 VanDerWaalsContact O-CA 3.25Å; Y235-R242 WeakPolarHBondContact O-CA 3.28Å; Y235-S243 PolarHBondContact N-O 2.99Å; Y235-S243 PolarHBondContact O-N 2.73Å; Y235-F245 AromaticContact CD2-CD2 3.84Å; Y235-F245 HydrophobicContact CD2-CD2 3.84Å; Y235-F245 AromaticContact CD2-CE2 3.77Å; Y235-F245 HydrophobicContact CD2-CE2 3.77Å; Y235-F245 HydrophobicContact CE2-CD2 4.04Å; Y235-F245 HydrophobicContact CE2-CE2 4.28Å
236	V	97.3	Very high	96.1	Very high	7 Å²	7	36 Å²	36	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	137.2	172.7	70.5	0	0	0	0	111.3	V53 L61 F224 S228 L230 T241 R242	V53-V236 HydrophobicContact CG2-CG1 4.44Å; L61-V236 HydrophobicContact CD1-CB 4.04Å; L61-V236 HydrophobicContact CD1-CG1 4.14Å; L61-V236 HydrophobicContact CD1-CG2 3.67Å; L61-V236 HydrophobicContact CD2-CG2 3.72Å; L61-V236 HydrophobicContact CG-CG2 4.33Å; F224-V236 VanDerWaalsContact CE1-O 3.27Å; F224-V236 WeakPolarHBondContact CE1-O 3.43Å; S228-V236 PolarHBondContact O-N 3.32Å; L230-V236 HydrophobicContact CD1-CB 3.95Å; L230-V236 HydrophobicContact CD2-CB 4.14Å; L230-V236 HydrophobicContact CD2-CG1 4.19Å; L230-V236 HydrophobicContact CG-CB 4.07Å; L230-V236 HydrophobicContact CG-CG1 4.45Å; V236-T241 WeakPolarHBondContact CG2-O 3.3Å; V236-R242 HydrophobicContact CG2-CG 4.26Å
237	R	95.5	Very high	96.6	Very high	76 Å²	76	32.3 Å²	32.3	29%	0.287	18%	0.175	S	C	.	.			trans	-85.1	168.7	172.6	-61.1	-177.8	-174.2	-88.9	-2.7	111	Y214 F224 D239 G240 T241 S243	Y214-R237 PolarHBondContact OH-NH2 2.91Å; F224-R237 HydrophobicContact CE1-CG 4.01Å; F224-R237 HydrophobicContact CZ-CG 4.04Å; R237-D239 WeakPolarHBondContact CB-OD1 3.24Å; R237-D239 PolarHBondContact O-N 3.24Å; R237-G240 PolarHBondContact O-N 2.86Å; R237-T241 WeakPolarHBondContact CD-OG1 2.76Å; R237-T241 PolarHBondContact N-O 3.08Å; R237-S243 PolarHBondContact NE-OG 3.49Å; R237-S243 PolarHBondContact NH2-OG 3.08Å
238	Q	94.1	Very high	96.9	Very high	196 Å²	196	32.4 Å²	32.4	92%	0.916	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-28	-178.9	-67.4	-178.8	-11.2	0	0	113.6	G240	Q238-G240 VanDerWaalsContact C-N 3.27Å; Q238-G240 PolarHBondContact O-N 2.85Å
239	D	95.2	Very high	97	Very high	43 Å²	43	37.5 Å²	37.5	23%	0.23	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	0.4	177.4	60	13.1	0	0	0	113.8	F72 R237 T241	F72-D239 WeakPolarHBondContact CD2-OD2 3.46Å; R237-D239 WeakPolarHBondContact CB-OD1 3.24Å; R237-D239 PolarHBondContact O-N 3.24Å; D239-T241 VanDerWaalsContact C-N 3.32Å; D239-T241 WeakPolarHBondContact OD1-CB 3.46Å; D239-T241 WeakPolarHBondContact OD1-CG2 3.48Å; D239-T241 PolarHBondContact OD1-N 2.67Å; D239-T241 PolarHBondContact OD1-OG1 3.35Å
240	G	96.8	Very high	97.1	Very high	9 Å²	9	39 Å²	39	9%	0.093	19%	0.194	C	C	.	.	S	Bend	trans	84.9	-2.7	-178.9	0	0	0	0	0	114.7	N68 R237 Q238	N68-G240 PolarHBondContact ND2-O 2.87Å; R237-G240 PolarHBondContact O-N 2.86Å; Q238-G240 VanDerWaalsContact C-N 3.27Å; Q238-G240 PolarHBondContact O-N 2.85Å
241	T	97.1	Very high	97.2	Very high	4 Å²	4	38.6 Å²	38.6	3%	0.025	19%	0.192	C	C	.	.			trans	-71.7	162	167.8	65.6	0	0	0	0	110.3	W69 F72 V236 R237 D239	W69-T241 HydrophobicContact CD2-CG2 3.97Å; W69-T241 HydrophobicContact CE3-CG2 4.13Å; W69-T241 HydrophobicContact CG-CG2 4.46Å; W69-T241 HydrophobicContact CH2-CG2 4.4Å; W69-T241 HydrophobicContact CZ2-CG2 4.24Å; W69-T241 HydrophobicContact CZ3-CG2 4.35Å; F72-T241 HydrophobicContact CB-CG2 4.15Å; F72-T241 HydrophobicContact CG-CG2 4.49Å; V236-T241 WeakPolarHBondContact CG2-O 3.3Å; R237-T241 WeakPolarHBondContact CD-OG1 2.76Å; R237-T241 PolarHBondContact N-O 3.08Å; D239-T241 VanDerWaalsContact C-N 3.32Å; D239-T241 WeakPolarHBondContact OD1-CB 3.46Å; D239-T241 WeakPolarHBondContact OD1-CG2 3.48Å; D239-T241 PolarHBondContact OD1-N 2.67Å; D239-T241 PolarHBondContact OD1-OG1 3.35Å
242	R	97.4	Very high	97.3	Very high	15 Å²	15	39 Å²	39	6%	0.057	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	158.4	-170.1	-58	176.9	-62.6	-174.2	-4	111.1	E62 L230 F234 Y235 V236	E62-R242 IonicContact OE2-CZ 3.79Å; E62-R242 VanDerWaalsContact OE2-CZ 3.27Å; E62-R242 IonicContact OE2-NH1 2.73Å; E62-R242 PolarHBondContact OE2-NH1 2.83Å; E62-R242 IonicContact OE2-NH2 2.68Å; E62-R242 PolarHBondContact OE2-NH2 3.02Å; L230-R242 HydrophobicContact CD1-CB 4.46Å; L230-R242 HydrophobicContact CD1-CG 3.85Å; F234-R242 HydrophobicContact CE2-CB 3.69Å; F234-R242 HydrophobicContact CZ-CB 3.93Å; F234-R242 HydrophobicContact CZ-CG 4.28Å; Y235-R242 CarbonylContact O-C 3.5Å; Y235-R242 VanDerWaalsContact O-CA 3.25Å; Y235-R242 WeakPolarHBondContact O-CA 3.28Å; V236-R242 HydrophobicContact CG2-CG 4.26Å
243	S	97.8	Very high	97.5	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	123.9	177.4	-59.4	0	0	0	0	110.1	S185 Y235 R237	S185-S243 CarbonylContact O-C 3.46Å; S185-S243 WeakPolarHBondContact O-CA 3.23Å; Y235-S243 PolarHBondContact N-O 2.99Å; Y235-S243 PolarHBondContact O-N 2.73Å; R237-S243 PolarHBondContact NE-OG 3.49Å; R237-S243 PolarHBondContact NH2-OG 3.08Å
244	Y	98.6	Very high	97.6	Very high	16 Å²	16	37.4 Å²	37.4	6%	0.063	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	144.4	166.2	-166.7	-94.1	0	0	0	110.4	S185 P189 M192 D232 N233 F234 F246 F250	S185-Y244 WeakPolarHBondContact CB-O 3.48Å; S185-Y244 PolarHBondContact O-N 3.15Å; P189-Y244 HydrophobicContact CB-CE2 4.4Å; P189-Y244 HydrophobicContact CG-CD2 3.61Å; P189-Y244 HydrophobicContact CG-CE2 3.69Å; M192-Y244 HydrophobicContact CE-CD1 4.15Å; M192-Y244 HydrophobicContact CE-CD2 4.26Å; M192-Y244 HydrophobicContact CE-CG 3.82Å; D232-Y244 WeakPolarHBondContact O-CE2 3.33Å; N233-Y244 HydrophobicContact CB-CE2 4.07Å; N233-Y244 CarbonylContact O-C 3.47Å; N233-Y244 VanDerWaalsContact O-CA 3.26Å; N233-Y244 WeakPolarHBondContact O-CA 3.43Å; F234-Y244 HydrophobicContact CB-CD2 3.78Å; F234-Y244 HydrophobicContact CB-CE2 4.32Å; F234-Y244 HydrophobicContact CD2-CD2 4.05Å; F234-Y244 HydrophobicContact CG-CD2 4.18Å; Y244-F246 AromaticContact CD1-CD1 3.7Å; Y244-F246 HydrophobicContact CD1-CD1 3.7Å; Y244-F246 AromaticContact CD1-CD2 3.99Å; Y244-F246 HydrophobicContact CD1-CD2 3.99Å; Y244-F246 AromaticContact CD1-CE1 3.66Å; Y244-F246 HydrophobicContact CD1-CE1 3.66Å; Y244-F246 AromaticContact CD1-CE2 3.97Å; Y244-F246 HydrophobicContact CD1-CE2 3.97Å; Y244-F246 AromaticContact CD1-CG 3.86Å; Y244-F246 HydrophobicContact CD1-CG 3.86Å; Y244-F246 AromaticContact CD1-CZ 3.79Å; Y244-F246 HydrophobicContact CD1-CZ 3.79Å; Y244-F246 AromaticContact CE1-CD1 3.82Å; Y244-F246 HydrophobicContact CE1-CD1 3.82Å; Y244-F246 HydrophobicContact CE1-CE1 4.04Å; Y244-F246 HydrophobicContact CE1-CG 4.19Å; Y244-F246 HydrophobicContact CG-CZ 4.47Å; Y244-F250 HydrophobicContact CD1-CE1 4.45Å; Y244-F250 AromaticContact CE1-CD1 3.72Å; Y244-F250 HydrophobicContact CE1-CD1 3.72Å; Y244-F250 AromaticContact CE1-CE1 3.6Å; Y244-F250 HydrophobicContact CE1-CE1 3.6Å; Y244-F250 HydrophobicContact CE1-CZ 4.37Å; Y244-F250 AromaticContact CZ-CE1 3.83Å
245	F	98.4	Very high	97.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.			trans	-112.7	116.9	176.1	-63.7	-91.8	0	0	0	109.6	Y214 L216 D218 A220 M221 F224 N233 Y235	Y214-F245 VanDerWaalsContact CB-CD1 3.5Å; Y214-F245 HydrophobicContact CD1-CE1 4.16Å; Y214-F245 HydrophobicContact CG-CD1 4.22Å; Y214-F245 AromaticContact CG-CE1 3.93Å; Y214-F245 HydrophobicContact CG-CE1 3.93Å; L216-F245 HydrophobicContact CD2-CB 4.39Å; D218-F245 HydrophobicContact CB-CD1 4.07Å; D218-F245 HydrophobicContact CB-CE1 3.97Å; A220-F245 HydrophobicContact CB-CE1 4.19Å; A220-F245 HydrophobicContact CB-CZ 4.16Å; M221-F245 VanDerWaalsContact CA-CZ 3.4Å; M221-F245 HydrophobicContact CB-CD1 3.64Å; M221-F245 HydrophobicContact CB-CD2 3.95Å; M221-F245 HydrophobicContact CB-CE1 3.57Å; M221-F245 HydrophobicContact CB-CE2 3.88Å; M221-F245 HydrophobicContact CB-CG 3.84Å; M221-F245 HydrophobicContact CB-CZ 3.7Å; M221-F245 HydrophobicContact CG-CB 4.41Å; M221-F245 HydrophobicContact CG-CD1 4.15Å; M221-F245 HydrophobicContact CG-CD2 3.72Å; M221-F245 HydrophobicContact CG-CE1 4.41Å; M221-F245 HydrophobicContact CG-CE2 4.01Å; M221-F245 HydrophobicContact CG-CG 3.81Å; M221-F245 HydrophobicContact CG-CZ 4.34Å; M221-F245 VanDerWaalsContact N-CZ 3.34Å; M221-F245 HydrophobicContact SD-CB 3.9Å; M221-F245 HydrophobicContact SD-CD1 4.4Å; M221-F245 HydrophobicContact SD-CD2 4.32Å; M221-F245 HydrophobicContact SD-CG 3.94Å; F224-F245 HydrophobicContact CD2-CE2 4.33Å; F224-F245 AromaticContact CE2-CE2 3.72Å; F224-F245 HydrophobicContact CE2-CE2 3.72Å; F224-F245 AromaticContact CE2-CZ 3.89Å; F224-F245 HydrophobicContact CE2-CZ 3.89Å; N233-F245 HydrophobicContact CB-CB 4.35Å; N233-F245 WeakPolarHBondContact CB-O 3.35Å; N233-F245 PolarHBondContact O-N 3Å; Y235-F245 AromaticContact CD2-CD2 3.84Å; Y235-F245 HydrophobicContact CD2-CD2 3.84Å; Y235-F245 AromaticContact CD2-CE2 3.77Å; Y235-F245 HydrophobicContact CD2-CE2 3.77Å; Y235-F245 HydrophobicContact CE2-CD2 4.04Å; Y235-F245 HydrophobicContact CE2-CE2 4.28Å
246	F	98.6	Very high	97.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-87.3	131.7	-168.1	-67.2	-90.5	0	0	0	112.3	L184 M192 F211 D213 Y214 L216 Y244 F250 L251 L286	L184-F246 HydrophobicContact CB-CE2 4.48Å; L184-F246 HydrophobicContact CB-CZ 3.83Å; L184-F246 HydrophobicContact CD2-CE1 4.09Å; L184-F246 HydrophobicContact CD2-CZ 4.08Å; L184-F246 HydrophobicContact CG-CE1 4.41Å; L184-F246 HydrophobicContact CG-CZ 3.98Å; M192-F246 HydrophobicContact CE-CE1 4.11Å; M192-F246 HydrophobicContact CE-CZ 3.84Å; M192-F246 HydrophobicContact SD-CE1 3.78Å; M192-F246 HydrophobicContact SD-CZ 3.98Å; F211-F246 HydrophobicContact CZ-CD1 4.45Å; F211-F246 AromaticContact CZ-CD2 3.96Å; F211-F246 HydrophobicContact CZ-CD2 3.96Å; F211-F246 HydrophobicContact CZ-CE1 4.47Å; F211-F246 AromaticContact CZ-CE2 3.96Å; F211-F246 HydrophobicContact CZ-CE2 3.96Å; F211-F246 HydrophobicContact CZ-CG 4.22Å; F211-F246 HydrophobicContact CZ-CZ 4.24Å; D213-F246 HydrophobicContact CB-CD2 3.96Å; D213-F246 HydrophobicContact CB-CE2 3.88Å; Y214-F246 WeakPolarHBondContact O-CD2 3.27Å; Y214-F246 PolarHBondContact O-N 2.96Å; L216-F246 PolarHBondContact N-O 3.48Å; Y244-F246 AromaticContact CD1-CD1 3.7Å; Y244-F246 HydrophobicContact CD1-CD1 3.7Å; Y244-F246 AromaticContact CD1-CD2 3.99Å; Y244-F246 HydrophobicContact CD1-CD2 3.99Å; Y244-F246 AromaticContact CD1-CE1 3.66Å; Y244-F246 HydrophobicContact CD1-CE1 3.66Å; Y244-F246 AromaticContact CD1-CE2 3.97Å; Y244-F246 HydrophobicContact CD1-CE2 3.97Å; Y244-F246 AromaticContact CD1-CG 3.86Å; Y244-F246 HydrophobicContact CD1-CG 3.86Å; Y244-F246 AromaticContact CD1-CZ 3.79Å; Y244-F246 HydrophobicContact CD1-CZ 3.79Å; Y244-F246 AromaticContact CE1-CD1 3.82Å; Y244-F246 HydrophobicContact CE1-CD1 3.82Å; Y244-F246 HydrophobicContact CE1-CE1 4.04Å; Y244-F246 HydrophobicContact CE1-CG 4.19Å; Y244-F246 HydrophobicContact CG-CZ 4.47Å; F246-F250 AromaticContact CD1-CD1 3.9Å; F246-F250 HydrophobicContact CD1-CD1 3.9Å; F246-F250 HydrophobicContact CD1-CE1 4.08Å; F246-F250 HydrophobicContact CE1-CD1 4.29Å; F246-F250 AromaticContact CE1-CE1 3.99Å; F246-F250 HydrophobicContact CE1-CE1 3.99Å; F246-L251 HydrophobicContact CD1-CB 4.41Å; F246-L251 HydrophobicContact CD1-CD1 3.81Å; F246-L251 HydrophobicContact CE1-CD1 4.03Å; F246-L286 HydrophobicContact CB-CB 4.45Å; F246-L286 HydrophobicContact CB-CD2 3.56Å
247	S	98.2	Very high	97.7	Very high	18 Å²	18	48.1 Å²	48.1	13%	0.126	23%	0.228	C	C	.	.			trans	-82	151.2	156	67.9	0	0	0	0	110.4	E249 F250 L251 Y267	S247-E249 VanDerWaalsContact C-N 3.27Å; S247-E249 PolarHBondContact O-N 2.93Å; S247-F250 PolarHBondContact O-N 2.8Å; S247-F250 WeakPolarHBondContact OG-CB 3.45Å; S247-F250 PolarHBondContact OG-N 2.75Å; S247-F250 VanDerWaalsContact OG-N 3.09Å; S247-L251 PolarHBondContact O-N 3.27Å; S247-L251 VanDerWaalsContact O-N 3.08Å; S247-Y267 VanDerWaalsContact CA-OH 3.3Å; S247-Y267 WeakPolarHBondContact CA-OH 3.17Å
248	K	97.9	Very high	97.8	Very high	36 Å²	36	45.2 Å²	45.2	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-56	-43.3	173.2	-67.4	172.5	75.1	-140.5	0	112.1	S33 L251 A252 N265 Y267 L286	S33-K248 WeakPolarHBondContact O-CD 3.49Å; S33-K248 VanDerWaalsContact O-CE 3.29Å; S33-K248 WeakPolarHBondContact O-CE 3.33Å; S33-K248 PolarHBondContact O-NZ 2.68Å; K248-L251 PolarHBondContact O-N 3.3Å; K248-A252 WeakPolarHBondContact O-CB 3.29Å; K248-A252 PolarHBondContact O-N 3.43Å; K248-N265 WeakPolarHBondContact CE-O 3.2Å; K248-N265 PolarHBondContact O-ND2 2.97Å; K248-Y267 HydrophobicContact CD-CD2 3.83Å; K248-Y267 HydrophobicContact CD-CE2 3.55Å; K248-Y267 HydrophobicContact CG-CD2 4.07Å; K248-Y267 HydrophobicContact CG-CE1 4.45Å; K248-Y267 HydrophobicContact CG-CE2 3.56Å; K248-Y267 PolarHBondContact N-OH 2.75Å; K248-L286 HydrophobicContact CG-CD1 3.68Å
249	E	97.9	Very high	98	Very high	128 Å²	128	38 Å²	38	60%	0.598	20%	0.199	S	C	*	.	H	α-helix	trans	-66.2	-49.5	-173.9	-62.7	67.1	-145.3	0	0	110.3	S247 A252 K253	S247-E249 VanDerWaalsContact C-N 3.27Å; S247-E249 PolarHBondContact O-N 2.93Å; E249-A252 PolarHBondContact O-N 3.15Å; E249-K253 WeakPolarHBondContact O-CB 3.23Å; E249-K253 PolarHBondContact O-N 2.92Å
250	F	98.4	Very high	98.2	Very high	63 Å²	63	36.3 Å²	36.3	28%	0.276	19%	0.19	S	C	.	.	H	α-helix	trans	-58	-48.2	173.9	177.7	-99.3	0	0	0	112.3	M192 Y244 F246 S247 K253 L254	M192-F250 HydrophobicContact SD-CE1 4.06Å; M192-F250 HydrophobicContact SD-CZ 4.34Å; Y244-F250 HydrophobicContact CD1-CE1 4.45Å; Y244-F250 AromaticContact CE1-CD1 3.72Å; Y244-F250 HydrophobicContact CE1-CD1 3.72Å; Y244-F250 AromaticContact CE1-CE1 3.6Å; Y244-F250 HydrophobicContact CE1-CE1 3.6Å; Y244-F250 HydrophobicContact CE1-CZ 4.37Å; Y244-F250 AromaticContact CZ-CE1 3.83Å; F246-F250 AromaticContact CD1-CD1 3.9Å; F246-F250 HydrophobicContact CD1-CD1 3.9Å; F246-F250 HydrophobicContact CD1-CE1 4.08Å; F246-F250 HydrophobicContact CE1-CD1 4.29Å; F246-F250 AromaticContact CE1-CE1 3.99Å; F246-F250 HydrophobicContact CE1-CE1 3.99Å; S247-F250 PolarHBondContact O-N 2.8Å; S247-F250 WeakPolarHBondContact OG-CB 3.45Å; S247-F250 PolarHBondContact OG-N 2.75Å; S247-F250 VanDerWaalsContact OG-N 3.09Å; F250-K253 PolarHBondContact O-N 3.06Å; F250-L254 HydrophobicContact CE1-CD2 4.05Å; F250-L254 HydrophobicContact CZ-CD2 4.38Å; F250-L254 WeakPolarHBondContact O-CB 3.32Å; F250-L254 PolarHBondContact O-N 3.47Å
251	L	98.6	Very high	98.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.1	-44.9	-178.2	-172.3	73	0	0	0	111.7	L184 F211 F246 S247 K248 L254 F255 L286 S288 F290	L184-L251 HydrophobicContact CD2-CD1 4.36Å; F211-L251 HydrophobicContact CD1-CD1 4.49Å; F211-L251 HydrophobicContact CD1-CD2 3.51Å; F211-L251 HydrophobicContact CD2-CD1 4.32Å; F211-L251 HydrophobicContact CE1-CD1 4.03Å; F211-L251 HydrophobicContact CE1-CD2 3.42Å; F211-L251 VanDerWaalsContact CE1-CD2 3.42Å; F211-L251 HydrophobicContact CE1-CG 4.4Å; F211-L251 HydrophobicContact CE2-CD1 3.81Å; F211-L251 HydrophobicContact CG-CD2 4.12Å; F211-L251 HydrophobicContact CZ-CD1 3.63Å; F211-L251 HydrophobicContact CZ-CD2 3.95Å; F211-L251 HydrophobicContact CZ-CG 4.48Å; F246-L251 HydrophobicContact CD1-CB 4.41Å; F246-L251 HydrophobicContact CD1-CD1 3.81Å; F246-L251 HydrophobicContact CE1-CD1 4.03Å; S247-L251 PolarHBondContact O-N 3.27Å; S247-L251 VanDerWaalsContact O-N 3.08Å; K248-L251 PolarHBondContact O-N 3.3Å; L251-L254 PolarHBondContact O-N 2.84Å; L251-F255 HydrophobicContact CD1-CD2 3.91Å; L251-F255 HydrophobicContact CD1-CE2 3.68Å; L251-F255 HydrophobicContact CG-CD2 4.07Å; L251-F255 HydrophobicContact CG-CE2 4.19Å; L251-F255 WeakPolarHBondContact O-CD2 3.49Å; L251-F255 PolarHBondContact O-N 3.33Å; L251-L286 HydrophobicContact CB-CD2 3.78Å; L251-L286 HydrophobicContact CD2-CD2 3.43Å; L251-L286 VanDerWaalsContact CD2-CD2 3.43Å; L251-L286 HydrophobicContact CD2-CG 3.88Å; L251-L286 HydrophobicContact CG-CD2 4.21Å; L251-S288 VanDerWaalsContact CD2-OG 3.3Å; L251-S288 WeakPolarHBondContact CD2-OG 3.38Å; L251-F290 HydrophobicContact CD2-CE2 3.94Å; L251-F290 HydrophobicContact CD2-CZ 3.93Å; L251-F290 HydrophobicContact CG-CE2 4.2Å; L251-F290 HydrophobicContact CG-CZ 3.93Å
252	A	98.4	Very high	98.2	Very high	27 Å²	27	42 Å²	42	22%	0.223	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-49.4	178.4	0	0	0	0	0	111.3	K248 E249 L254 F255 E256	K248-A252 WeakPolarHBondContact O-CB 3.29Å; K248-A252 PolarHBondContact O-N 3.43Å; E249-A252 PolarHBondContact O-N 3.15Å; A252-L254 VanDerWaalsContact C-N 3.33Å; A252-L254 PolarHBondContact O-N 3.41Å; A252-F255 PolarHBondContact O-N 3.5Å; A252-E256 WeakPolarHBondContact O-CB 3.27Å; A252-E256 PolarHBondContact O-N 3.25Å
253	K	98.6	Very high	98.2	Very high	123 Å²	123	45.3 Å²	45.3	54%	0.535	24%	0.243	S	C	.	.	H	α-helix	trans	-59.7	-43.7	177.9	-176.8	178.6	175.1	-176.4	0	111.8	E249 F250 F255 E256 E257	E249-K253 WeakPolarHBondContact O-CB 3.23Å; E249-K253 PolarHBondContact O-N 2.92Å; F250-K253 PolarHBondContact O-N 3.06Å; K253-F255 PolarHBondContact O-N 3.45Å; K253-E256 PolarHBondContact O-N 2.97Å; K253-E257 WeakPolarHBondContact CE-OE1 3.29Å; K253-E257 HydrophobicContact CG-CG 4.41Å; K253-E257 IonicContact NZ-OE1 3.87Å; K253-E257 WeakPolarHBondContact O-CB 3.03Å; K253-E257 WeakPolarHBondContact O-CG 3.12Å; K253-E257 PolarHBondContact O-N 3.39Å
254	L	98.7	Very high	98.1	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.063	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-43.4	179.5	176.9	65.9	0	0	0	112.3	L184 M192 K193 L196 F250 L251 A252 A258	L184-L254 HydrophobicContact CD2-CD2 3.95Å; M192-L254 HydrophobicContact CB-CD1 4.17Å; M192-L254 HydrophobicContact CB-CD2 3.71Å; M192-L254 HydrophobicContact CG-CD2 4.49Å; M192-L254 HydrophobicContact SD-CD2 3.98Å; K193-L254 HydrophobicContact CB-CD1 3.88Å; L196-L254 HydrophobicContact CD1-CD1 4.49Å; L196-L254 HydrophobicContact CD1-CD2 4.12Å; L196-L254 HydrophobicContact CD1-CG 3.77Å; F250-L254 HydrophobicContact CE1-CD2 4.05Å; F250-L254 HydrophobicContact CZ-CD2 4.38Å; F250-L254 WeakPolarHBondContact O-CB 3.32Å; F250-L254 PolarHBondContact O-N 3.47Å; L251-L254 PolarHBondContact O-N 2.84Å; A252-L254 VanDerWaalsContact C-N 3.33Å; A252-L254 PolarHBondContact O-N 3.41Å; L254-A258 WeakPolarHBondContact O-CB 3.33Å; L254-A258 PolarHBondContact O-N 3.11Å
255	F	98.7	Very high	98	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-70.2	-39.3	176.6	-92.1	-99.3	0	0	0	112.4	L180 L184 L196 V209 F211 L251 A252 K253 A258 G259 F260 F290	L180-F255 HydrophobicContact CD1-CZ 4.23Å; L184-F255 HydrophobicContact CD2-CE2 4.48Å; L196-F255 HydrophobicContact CD1-CD1 4.27Å; L196-F255 HydrophobicContact CD1-CD2 3.68Å; L196-F255 HydrophobicContact CD1-CE1 4.34Å; L196-F255 HydrophobicContact CD1-CE2 3.74Å; L196-F255 HydrophobicContact CD1-CG 3.98Å; L196-F255 HydrophobicContact CD1-CZ 4.1Å; L196-F255 HydrophobicContact CD2-CD1 4.41Å; L196-F255 HydrophobicContact CD2-CE1 3.73Å; L196-F255 HydrophobicContact CD2-CE2 3.85Å; L196-F255 HydrophobicContact CD2-CZ 3.42Å; L196-F255 VanDerWaalsContact CD2-CZ 3.42Å; L196-F255 HydrophobicContact CG-CE2 4.47Å; L196-F255 HydrophobicContact CG-CZ 4.42Å; V209-F255 HydrophobicContact CB-CE1 4.04Å; V209-F255 HydrophobicContact CG1-CE1 3.87Å; V209-F255 HydrophobicContact CG1-CZ 4.11Å; V209-F255 HydrophobicContact CG2-CE1 4.39Å; F211-F255 HydrophobicContact CD2-CE2 4.35Å; F211-F255 HydrophobicContact CD2-CZ 4.38Å; L251-F255 HydrophobicContact CD1-CD2 3.91Å; L251-F255 HydrophobicContact CD1-CE2 3.68Å; L251-F255 HydrophobicContact CG-CD2 4.07Å; L251-F255 HydrophobicContact CG-CE2 4.19Å; L251-F255 WeakPolarHBondContact O-CD2 3.49Å; L251-F255 PolarHBondContact O-N 3.33Å; A252-F255 PolarHBondContact O-N 3.5Å; K253-F255 PolarHBondContact O-N 3.45Å; F255-A258 CarbonylContact O-C 3.6Å; F255-A258 PolarHBondContact O-N 2.82Å; F255-G259 PolarHBondContact O-N 3.36Å; F255-F260 HydrophobicContact CB-CB 4.2Å; F255-F260 HydrophobicContact CD1-CB 3.91Å; F255-F260 AromaticContact CD1-CD2 3.99Å; F255-F260 HydrophobicContact CD1-CD2 3.99Å; F255-F260 AromaticContact CD1-CG 3.9Å; F255-F260 HydrophobicContact CD1-CG 3.9Å; F255-F260 WeakPolarHBondContact O-CB 3.28Å; F255-F260 PolarHBondContact O-N 2.86Å; F255-F290 HydrophobicContact CB-CD1 3.53Å; F255-F290 HydrophobicContact CB-CE1 3.53Å; F255-F290 HydrophobicContact CB-CE2 4.47Å; F255-F290 HydrophobicContact CB-CG 4.06Å; F255-F290 HydrophobicContact CB-CZ 4.03Å; F255-F290 HydrophobicContact CD1-CB 3.57Å; F255-F290 AromaticContact CD1-CD1 3.71Å; F255-F290 HydrophobicContact CD1-CD1 3.71Å; F255-F290 AromaticContact CD1-CD2 3.43Å; F255-F290 HydrophobicContact CD1-CD2 3.43Å; F255-F290 VanDerWaalsContact CD1-CD2 3.43Å; F255-F290 HydrophobicContact CD1-CE1 4.24Å; F255-F290 AromaticContact CD1-CE2 3.96Å; F255-F290 HydrophobicContact CD1-CE2 3.96Å; F255-F290 AromaticContact CD1-CG 3.28Å; F255-F290 HydrophobicContact CD1-CG 3.28Å; F255-F290 HydrophobicContact CD1-CZ 4.35Å; F255-F290 HydrophobicContact CD2-CD1 4.44Å; F255-F290 HydrophobicContact CD2-CD2 4Å; F255-F290 HydrophobicContact CD2-CE1 4.16Å; F255-F290 AromaticContact CD2-CE2 3.64Å; F255-F290 HydrophobicContact CD2-CE2 3.64Å; F255-F290 HydrophobicContact CD2-CG 4.38Å; F255-F290 AromaticContact CD2-CZ 3.75Å; F255-F290 HydrophobicContact CD2-CZ 3.75Å; F255-F290 HydrophobicContact CE1-CB 3.89Å; F255-F290 AromaticContact CE1-CD2 3.41Å; F255-F290 HydrophobicContact CE1-CD2 3.41Å; F255-F290 VanDerWaalsContact CE1-CD2 3.41Å; F255-F290 HydrophobicContact CE1-CE2 4.02Å; F255-F290 AromaticContact CE1-CG 3.7Å; F255-F290 HydrophobicContact CE1-CG 3.7Å; F255-F290 HydrophobicContact CE2-CD2 4Å; F255-F290 AromaticContact CE2-CE2 3.72Å; F255-F290 HydrophobicContact CE2-CE2 3.72Å; F255-F290 HydrophobicContact CE2-CZ 4.28Å; F255-F290 HydrophobicContact CG-CB 4.39Å; F255-F290 AromaticContact CG-CD1 3.64Å; F255-F290 HydrophobicContact CG-CD1 3.64Å; F255-F290 AromaticContact CG-CD2 3.72Å; F255-F290 HydrophobicContact CG-CD2 3.72Å; F255-F290 AromaticContact CG-CE1 3.72Å; F255-F290 HydrophobicContact CG-CE1 3.72Å; F255-F290 AromaticContact CG-CE2 3.76Å; F255-F290 HydrophobicContact CG-CE2 3.76Å; F255-F290 AromaticContact CG-CG 3.66Å; F255-F290 HydrophobicContact CG-CG 3.66Å; F255-F290 AromaticContact CG-CZ 3.78Å; F255-F290 HydrophobicContact CG-CZ 3.78Å; F255-F290 AromaticContact CZ-CD2 3.7Å; F255-F290 HydrophobicContact CZ-CD2 3.7Å; F255-F290 AromaticContact CZ-CE2 3.89Å; F255-F290 HydrophobicContact CZ-CE2 3.89Å; F255-F290 HydrophobicContact CZ-CG 4.41Å
256	E	98.4	Very high	98	Very high	143 Å²	143	51.1 Å²	51.1	67%	0.668	27%	0.273	S	S	*	.	H	α-helix	trans	-60.3	-47.4	174.6	-177.1	178.5	-168.3	0	0	111.5	A252 K253 A258 G259 F260	A252-E256 WeakPolarHBondContact O-CB 3.27Å; A252-E256 PolarHBondContact O-N 3.25Å; K253-E256 PolarHBondContact O-N 2.97Å; E256-A258 PolarHBondContact O-N 3.2Å; E256-G259 WeakPolarHBondContact O-CA 3.37Å; E256-G259 PolarHBondContact O-N 2.86Å; E256-F260 WeakPolarHBondContact CA-O 3.23Å
257	E	98.3	Very high	97.9	Very high	97 Å²	97	51.2 Å²	51.2	45%	0.453	27%	0.274	S	S	.	.	H	α-helix	trans	-62.8	-26.2	176.3	-73.8	179.5	174.6	0	0	113	K193 K253 G259	K193-E257 HydrophobicContact CD-CB 4.4Å; K193-E257 WeakPolarHBondContact CE-O 3.18Å; K193-E257 PolarHBondContact NZ-O 3.08Å; K253-E257 WeakPolarHBondContact CE-OE1 3.29Å; K253-E257 HydrophobicContact CG-CG 4.41Å; K253-E257 IonicContact NZ-OE1 3.87Å; K253-E257 WeakPolarHBondContact O-CB 3.03Å; K253-E257 WeakPolarHBondContact O-CG 3.12Å; K253-E257 PolarHBondContact O-N 3.39Å; E257-G259 VanDerWaalsContact C-N 3.3Å
258	A	98.4	Very high	97.7	Very high	16 Å²	16	50.6 Å²	50.6	13%	0.132	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	2.7	173.6	0	0	0	0	0	113.4	K193 L196 E197 L254 F255 E256 F260	K193-A258 HydrophobicContact CG-CB 4.36Å; L196-A258 HydrophobicContact CB-CB 3.61Å; L196-A258 HydrophobicContact CD1-CB 4.18Å; E197-A258 HydrophobicContact CG-CB 4.32Å; L254-A258 WeakPolarHBondContact O-CB 3.33Å; L254-A258 PolarHBondContact O-N 3.11Å; F255-A258 CarbonylContact O-C 3.6Å; F255-A258 PolarHBondContact O-N 2.82Å; E256-A258 PolarHBondContact O-N 3.2Å; A258-F260 HydrophobicContact CB-CD2 3.93Å; A258-F260 HydrophobicContact CB-CE2 4.07Å
259	G	98.1	Very high	97.5	Very high	45 Å²	45	49.2 Å²	49.2	46%	0.464	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	18	174.4	0	0	0	0	0	115.4	F255 E256 E257 P293	F255-G259 PolarHBondContact O-N 3.36Å; E256-G259 WeakPolarHBondContact O-CA 3.37Å; E256-G259 PolarHBondContact O-N 2.86Å; E257-G259 VanDerWaalsContact C-N 3.3Å; G259-P293 WeakPolarHBondContact O-CD 3.36Å
260	F	98.6	Very high	97.1	Very high	7 Å²	7	47.4 Å²	47.4	3%	0.031	25%	0.251	C	S	.	.			trans	-102	161	176.1	-61.6	-95.7	0	0	0	112	L196 L203 V209 F255 E256 A258 F290 I291 K292	L196-F260 HydrophobicContact CB-CE2 4.21Å; L203-F260 HydrophobicContact CD2-CE1 3.8Å; V209-F260 HydrophobicContact CG2-CD1 4.07Å; V209-F260 HydrophobicContact CG2-CE1 3.55Å; V209-F260 HydrophobicContact CG2-CZ 4.19Å; F255-F260 HydrophobicContact CB-CB 4.2Å; F255-F260 HydrophobicContact CD1-CB 3.91Å; F255-F260 AromaticContact CD1-CD2 3.99Å; F255-F260 HydrophobicContact CD1-CD2 3.99Å; F255-F260 AromaticContact CD1-CG 3.9Å; F255-F260 HydrophobicContact CD1-CG 3.9Å; F255-F260 WeakPolarHBondContact O-CB 3.28Å; F255-F260 PolarHBondContact O-N 2.86Å; E256-F260 WeakPolarHBondContact CA-O 3.23Å; A258-F260 HydrophobicContact CB-CD2 3.93Å; A258-F260 HydrophobicContact CB-CE2 4.07Å; F260-F290 HydrophobicContact CB-CB 4.15Å; F260-I291 WeakPolarHBondContact CA-O 3.05Å; F260-K292 HydrophobicContact CD1-CB 4.25Å; F260-K292 HydrophobicContact CE1-CB 4.2Å
261	Q	98	Very high	96.7	Very high	68 Å²	68	48.3 Å²	48.3	32%	0.318	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	134.7	173.2	-72.2	170.7	-9.8	0	0	110.5	F290 I291 P293	Q261-F290 CarbonylContact O-C 3.56Å; Q261-F290 WeakPolarHBondContact O-CA 3.31Å; Q261-I291 PolarHBondContact N-O 2.97Å; Q261-I291 PolarHBondContact O-N 2.98Å; Q261-P293 HydrophobicContact CG-CG 3.95Å
262	S	97	Very high	96.1	Very high	65 Å²	65	51 Å²	51	46%	0.455	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	128	175.9	-177	0	0	0	0	111
263	V	96.1	Very high	95.6	Very high	84 Å²	84	53.8 Å²	53.8	51%	0.509	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	-49	173	-175.7	0	0	0	0	110.3	K289 I291	V263-K289 HydrophobicContact CB-CB 4.27Å; V263-K289 WeakPolarHBondContact CB-O 3.37Å; V263-K289 PolarHBondContact N-O 2.85Å; V263-I291 HydrophobicContact CG2-CB 4.24Å; V263-I291 HydrophobicContact CG2-CD1 3.44Å; V263-I291 VanDerWaalsContact CG2-CD1 3.44Å; V263-I291 HydrophobicContact CG2-CG1 3.62Å
264	V	96.3	Very high	94.8	Very high	45 Å²	45	50.3 Å²	50.3	27%	0.273	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.2	175.6	176.2	0	0	0	0	108.1	E266 S288 K289	V264-E266 HydrophobicContact CG1-CG 4.22Å; V264-S288 CarbonylContact O-C 3.47Å; V264-S288 WeakPolarHBondContact O-CA 3.19Å; V264-S288 VanDerWaalsContact O-CB 3.24Å; V264-S288 WeakPolarHBondContact O-CB 3.47Å; V264-K289 HydrophobicContact CB-CB 4.01Å; V264-K289 HydrophobicContact CB-CD 4.04Å; V264-K289 HydrophobicContact CB-CG 4.06Å; V264-K289 HydrophobicContact CG2-CB 4.43Å; V264-K289 HydrophobicContact CG2-CD 3.83Å; V264-K289 HydrophobicContact CG2-CG 4.4Å; V264-K289 PolarHBondContact N-O 3.18Å; V264-K289 PolarHBondContact O-N 2.81Å
265	N	97.2	Very high	94.1	Very high	22 Å²	22	58.9 Å²	58.9	12%	0.118	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	90.6	176.5	-172.4	28.7	0	0	0	108.4	K248 L286 S288	K248-N265 WeakPolarHBondContact CE-O 3.2Å; K248-N265 PolarHBondContact O-ND2 2.97Å; N265-L286 WeakPolarHBondContact OD1-CD1 2.98Å; N265-S288 PolarHBondContact OD1-OG 3.35Å
266	E	96.6	Very high	93.5	Very high	73 Å²	73	68.6 Å²	68.6	34%	0.341	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.5	-170.9	-63.6	-171.8	166	0	0	112	T31 V264 L286 Q287	T31-E266 WeakPolarHBondContact CB-OE2 3.18Å; T31-E266 PolarHBondContact OG1-OE2 2.89Å; V264-E266 HydrophobicContact CG1-CG 4.22Å; E266-L286 WeakPolarHBondContact O-CD1 2.98Å; E266-Q287 PolarHBondContact N-O 2.89Å; E266-Q287 PolarHBondContact O-N 2.95Å
267	Y	97.1	Very high	92.7	Very high	3 Å²	3	68.6 Å²	68.6	1%	0.012	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	137	168.5	-64.6	-70.3	0	0	0	109.9	T31 T32 T34 A35 S247 K248 V284 F285 L286	T31-Y267 CarbonylContact C-O 3.53Å; T31-Y267 WeakPolarHBondContact CA-O 3.45Å; T32-Y267 PolarHBondContact N-O 2.77Å; T32-Y267 PolarHBondContact O-N 2.86Å; T34-Y267 WeakPolarHBondContact O-CD2 3.34Å; A35-Y267 HydrophobicContact CB-CE2 3.95Å; S247-Y267 VanDerWaalsContact CA-OH 3.3Å; S247-Y267 WeakPolarHBondContact CA-OH 3.17Å; K248-Y267 HydrophobicContact CD-CD2 3.83Å; K248-Y267 HydrophobicContact CD-CE2 3.55Å; K248-Y267 HydrophobicContact CG-CD2 4.07Å; K248-Y267 HydrophobicContact CG-CE1 4.45Å; K248-Y267 HydrophobicContact CG-CE2 3.56Å; K248-Y267 PolarHBondContact N-OH 2.75Å; Y267-V284 HydrophobicContact CD1-CG1 3.83Å; Y267-V284 HydrophobicContact CG-CG1 4.31Å; Y267-F285 CarbonylContact C-O 3.56Å; Y267-F285 VanDerWaalsContact CA-O 3.23Å; Y267-F285 WeakPolarHBondContact CA-O 3.43Å; Y267-L286 HydrophobicContact CD1-CB 4.32Å; Y267-L286 HydrophobicContact CD1-CD1 4.03Å; Y267-L286 HydrophobicContact CE1-CB 4.41Å; Y267-L286 HydrophobicContact CE1-CD1 4.11Å
268	V	94.3	Very high	91.9	Very high	4 Å²	4	67.4 Å²	67.4	2%	0.024	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.6	171.5	-171.9	0	0	0	0	108.5	T31 R270 F285 Q287	T31-V268 HydrophobicContact CG2-CG2 4.13Å; V268-R270 HydrophobicContact CG1-CG 4.19Å; V268-F285 PolarHBondContact N-O 2.99Å; V268-F285 PolarHBondContact O-N 3.31Å; V268-Q287 HydrophobicContact CG2-CB 3.53Å; V268-Q287 HydrophobicContact CG2-CG 4.4Å
269	L	93.5	Very high	91.3	Very high	7 Å²	7	69.4 Å²	69.4	4%	0.037	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.7	-179	-56.5	-178.2	0	0	0	109.1	F26 P27 G29 Q30 T32 V284	F26-L269 HydrophobicContact CE1-CB 3.74Å; F26-L269 HydrophobicContact CE2-CD2 4.31Å; F26-L269 HydrophobicContact CZ-CB 3.73Å; F26-L269 HydrophobicContact CZ-CD1 4.46Å; F26-L269 HydrophobicContact CZ-CD2 3.81Å; F26-L269 HydrophobicContact CZ-CG 4.19Å; P27-L269 HydrophobicContact CG-CD1 3.72Å; P27-L269 VanDerWaalsContact O-CB 3.31Å; P27-L269 WeakPolarHBondContact O-CB 3.5Å; G29-L269 WeakPolarHBondContact CA-O 3.35Å; G29-L269 PolarHBondContact N-O 3.33Å; Q30-L269 PolarHBondContact O-N 2.99Å; T32-L269 HydrophobicContact CG2-CD1 3.91Å; T32-L269 HydrophobicContact CG2-CD2 4.43Å; T32-L269 HydrophobicContact CG2-CG 4.11Å; L269-V284 HydrophobicContact CD2-CB 4.34Å; L269-V284 HydrophobicContact CD2-CG1 3.92Å; L269-V284 HydrophobicContact CD2-CG2 3.88Å
270	R	90.6	Very high	90.8	Very high	91 Å²	91	70.6 Å²	70.6	34%	0.343	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	165.7	179.9	-63.9	-65.3	-168.5	177.3	-1.1	109.9	F26 E90 V268 R283 F285	F26-R270 WeakPolarHBondContact CE1-O 3.42Å; E90-R270 IonicContact OE1-CZ 2.87Å; E90-R270 IonicContact OE1-NH2 3.5Å; E90-R270 PolarHBondContact OE1-NH2 3.29Å; V268-R270 HydrophobicContact CG1-CG 4.19Å; R270-R283 HydrophobicContact CB-CB 4.2Å; R270-R283 PolarHBondContact N-O 2.7Å; R270-R283 WeakPolarHBondContact O-CA 3.39Å; R270-R283 PolarHBondContact O-N 3.3Å; R270-F285 HydrophobicContact CB-CE2 4.17Å; R270-F285 HydrophobicContact CG-CD2 4.22Å; R270-F285 HydrophobicContact CG-CE2 4.16Å
271	E	89.4	Confident	90.3	Very high	81 Å²	81	70.9 Å²	70.9	38%	0.379	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.2	169.2	-70	177.3	124.5	0	0	110.1	F26 C28 V281	F26-E271 HydrophobicContact CD1-CG 3.88Å; F26-E271 HydrophobicContact CE1-CG 4.45Å; C28-E271 HydrophobicContact CB-CG 3.89Å; C28-E271 WeakPolarHBondContact CB-OE2 3.48Å; C28-E271 PolarHBondContact SG-N 2.89Å; C28-E271 VanDerWaalsContact SG-N 3.35Å; E271-V281 WeakPolarHBondContact CA-O 3.41Å
272	T	86.5	Confident	90	Very high	57 Å²	57	69 Å²	69	35%	0.35	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	115	166.4	-63	0	0	0	0	108.8	C280 V281 R283	T272-C280 WeakPolarHBondContact O-CA 3.43Å; T272-V281 PolarHBondContact N-O 3.23Å; T272-V281 PolarHBondContact O-N 3.03Å; T272-R283 WeakPolarHBondContact OG1-CG 3.23Å
273	V	86.3	Confident	89.9	Confident	85 Å²	85	68.3 Å²	68.3	52%	0.515	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	113.9	177.1	-172.8	0	0	0	0	109.6	K275 L279 C280	V273-K275 HydrophobicContact CG1-CG 3.96Å; V273-L279 CarbonylContact C-O 3.54Å; V273-L279 VanDerWaalsContact CA-O 3.28Å; V273-L279 WeakPolarHBondContact CA-O 3.48Å; V273-C280 HydrophobicContact CG2-CB 4.49Å
274	N	82.9	Confident	89.9	Confident	50 Å²	50	64.3 Å²	64.3	27%	0.267	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	94.4	165.1	-172.2	-13.7	0	0	0	109.3	K276 E277 G278 L279	N274-K276 PolarHBondContact O-N 3.47Å; N274-K276 WeakPolarHBondContact OD1-CB 3.19Å; N274-K276 PolarHBondContact OD1-N 2.69Å; N274-K276 VanDerWaalsContact OD1-N 3.1Å; N274-E277 HydrophobicContact CB-CB 4.24Å; N274-E277 WeakPolarHBondContact ND2-CG 3.02Å; N274-E277 PolarHBondContact ND2-OE2 2.96Å; N274-E277 CarbonylContact O-C 3.54Å; N274-E277 PolarHBondContact O-N 3.38Å; N274-E277 PolarHBondContact OD1-N 3.42Å; N274-G278 PolarHBondContact O-N 2.94Å; N274-L279 HydrophobicContact CB-CB 4.08Å; N274-L279 PolarHBondContact N-O 3.44Å; N274-L279 PolarHBondContact O-N 2.95Å
275	K	84.7	Confident	89.9	Confident	192 Å²	192	63.2 Å²	63.2	84%	0.835	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.5	-179.9	-64.5	-174.2	178.7	-177.8	0	113.2	V273	V273-K275 HydrophobicContact CG1-CG 3.96Å
276	K	84.5	Confident	89.9	Confident	206 Å²	206	62.1 Å²	62.1	90%	0.896	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-34.1	179.7	-66	-176	178.3	-178	0	112.1	N274	N274-K276 PolarHBondContact O-N 3.47Å; N274-K276 WeakPolarHBondContact OD1-CB 3.19Å; N274-K276 PolarHBondContact OD1-N 2.69Å; N274-K276 VanDerWaalsContact OD1-N 3.1Å
277	E	82.5	Confident	90	Very high	143 Å²	143	59.9 Å²	59.9	67%	0.668	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	1.3	180	-66.7	176.4	175.4	0	0	112.6	N274 L279	N274-E277 HydrophobicContact CB-CB 4.24Å; N274-E277 WeakPolarHBondContact ND2-CG 3.02Å; N274-E277 PolarHBondContact ND2-OE2 2.96Å; N274-E277 CarbonylContact O-C 3.54Å; N274-E277 PolarHBondContact O-N 3.38Å; N274-E277 PolarHBondContact OD1-N 3.42Å; E277-L279 HydrophobicContact CB-CB 4.46Å; E277-L279 PolarHBondContact O-N 3.36Å
278	G	82.5	Confident	90	Very high	72 Å²	72	59.8 Å²	59.8	74%	0.742	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	24.6	-175.5	0	0	0	0	0	113.7	N274	N274-G278 PolarHBondContact O-N 2.94Å
279	L	85.1	Confident	90.2	Very high	57 Å²	57	60.6 Å²	60.6	30%	0.298	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.9	-174.5	-168.5	70.3	0	0	0	110.5	V273 N274 E277 V281	V273-L279 CarbonylContact C-O 3.54Å; V273-L279 VanDerWaalsContact CA-O 3.28Å; V273-L279 WeakPolarHBondContact CA-O 3.48Å; N274-L279 HydrophobicContact CB-CB 4.08Å; N274-L279 PolarHBondContact N-O 3.44Å; N274-L279 PolarHBondContact O-N 2.95Å; E277-L279 HydrophobicContact CB-CB 4.46Å; E277-L279 PolarHBondContact O-N 3.36Å; L279-V281 HydrophobicContact CD1-CG1 3.49Å; L279-V281 VanDerWaalsContact CD1-CG1 3.49Å; L279-V281 HydrophobicContact CD2-CG1 4.37Å; L279-V281 HydrophobicContact CD2-CG2 4.17Å; L279-V281 HydrophobicContact CG-CG1 3.77Å; L279-V281 HydrophobicContact CG-CG2 4.22Å
280	C	87.3	Confident	90.4	Very high	71 Å²	71	60.3 Å²	60.3	48%	0.48	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	113.4	162.7	-172.9	0	0	0	0	107.3	T272 V273	T272-C280 WeakPolarHBondContact O-CA 3.43Å; V273-C280 HydrophobicContact CG2-CB 4.49Å
281	V	88.9	Confident	90.8	Very high	13 Å²	13	58.5 Å²	58.5	8%	0.079	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	141.3	-173.8	-67.9	0	0	0	0	112.6	H219 E271 T272 L279	H219-V281 HydrophobicContact CB-CB 4.27Å; H219-V281 WeakPolarHBondContact NE2-CG1 3.45Å; E271-V281 WeakPolarHBondContact CA-O 3.41Å; T272-V281 PolarHBondContact N-O 3.23Å; T272-V281 PolarHBondContact O-N 3.03Å; L279-V281 HydrophobicContact CD1-CG1 3.49Å; L279-V281 VanDerWaalsContact CD1-CG1 3.49Å; L279-V281 HydrophobicContact CD2-CG1 4.37Å; L279-V281 HydrophobicContact CD2-CG2 4.17Å; L279-V281 HydrophobicContact CG-CG1 3.77Å; L279-V281 HydrophobicContact CG-CG2 4.22Å
282	P	91	Very high	91.2	Very high	29 Å²	29	56.4 Å²	56.4	19%	0.188	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	135	178	28.4	-34.3	0	0	0	110.3	F26 H219	F26-P282 HydrophobicContact CD1-CB 3.93Å; F26-P282 HydrophobicContact CD2-CB 3.46Å; F26-P282 VanDerWaalsContact CD2-CB 3.46Å; F26-P282 HydrophobicContact CD2-CG 4.49Å; F26-P282 HydrophobicContact CE1-CB 3.8Å; F26-P282 HydrophobicContact CE2-CB 3.31Å; F26-P282 HydrophobicContact CE2-CG 4.49Å; F26-P282 HydrophobicContact CG-CB 3.76Å; F26-P282 HydrophobicContact CZ-CB 3.47Å; F26-P282 VanDerWaalsContact CZ-CB 3.47Å; H219-P282 HydrophobicContact CB-CG 4.38Å; H219-P282 WeakPolarHBondContact CB-O 3.15Å; H219-P282 PolarHBondContact N-O 2.86Å
283	R	94.3	Very high	91.6	Very high	49 Å²	49	54.2 Å²	54.2	19%	0.185	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.2	173.8	-58.7	-54.9	-53.3	-77.1	-3.6	109.1	D218 R270 T272 F285	D218-R283 IonicContact OD1-CZ 3.24Å; D218-R283 IonicContact OD1-NE 3.19Å; D218-R283 PolarHBondContact OD1-NE 3.35Å; D218-R283 IonicContact OD1-NH2 3.48Å; D218-R283 PolarHBondContact OD1-NH2 2.89Å; D218-R283 WeakPolarHBondContact OD2-CA 3.32Å; D218-R283 IonicContact OD2-CZ 3.35Å; D218-R283 IonicContact OD2-NE 3.8Å; D218-R283 PolarHBondContact OD2-NE 3.32Å; D218-R283 IonicContact OD2-NH2 2.78Å; R270-R283 HydrophobicContact CB-CB 4.2Å; R270-R283 PolarHBondContact N-O 2.7Å; R270-R283 WeakPolarHBondContact O-CA 3.39Å; R270-R283 PolarHBondContact O-N 3.3Å; T272-R283 WeakPolarHBondContact OG1-CG 3.23Å; R283-F285 HydrophobicContact CB-CE2 3.78Å; R283-F285 HydrophobicContact CB-CZ 3.83Å; R283-F285 HydrophobicContact CG-CZ 4.42Å
284	V	96.4	Very high	91.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.1	179.1	-171.6	0	0	0	0	107.5	F26 R36 G215 L216 D218 Y267 L269	F26-V284 HydrophobicContact CZ-CG2 4.28Å; R36-V284 HydrophobicContact CG-CG2 4.37Å; G215-V284 PolarHBondContact N-O 3.31Å; L216-V284 WeakPolarHBondContact O-CG1 3.39Å; D218-V284 HydrophobicContact CB-CB 4.12Å; D218-V284 PolarHBondContact OD2-N 2.85Å; Y267-V284 HydrophobicContact CD1-CG1 3.83Å; Y267-V284 HydrophobicContact CG-CG1 4.31Å; L269-V284 HydrophobicContact CD2-CB 4.34Å; L269-V284 HydrophobicContact CD2-CG1 3.92Å; L269-V284 HydrophobicContact CD2-CG2 3.88Å
285	F	96.9	Very high	91.5	Very high	22 Å²	22	57 Å²	57	10%	0.096	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	146.6	173.6	-55.4	-64.4	0	0	0	109	F182 R212 D213 Y267 V268 R270 R283	F182-F285 AromaticContact CE1-CD1 3.6Å; F182-F285 HydrophobicContact CE1-CD1 3.6Å; F182-F285 AromaticContact CE1-CE1 3.57Å; F182-F285 HydrophobicContact CE1-CE1 3.57Å; F182-F285 AromaticContact CZ-CD1 3.59Å; F182-F285 HydrophobicContact CZ-CD1 3.59Å; F182-F285 AromaticContact CZ-CE1 3.44Å; F182-F285 HydrophobicContact CZ-CE1 3.44Å; F182-F285 VanDerWaalsContact CZ-CE1 3.44Å; F182-F285 HydrophobicContact CZ-CG 4.49Å; F182-F285 HydrophobicContact CZ-CZ 4.24Å; R212-F285 HydrophobicContact CG-CB 4.2Å; D213-F285 CarbonylContact O-C 3.56Å; D213-F285 VanDerWaalsContact O-CA 3.23Å; D213-F285 WeakPolarHBondContact O-CA 3.39Å; Y267-F285 CarbonylContact C-O 3.56Å; Y267-F285 VanDerWaalsContact CA-O 3.23Å; Y267-F285 WeakPolarHBondContact CA-O 3.43Å; V268-F285 PolarHBondContact N-O 2.99Å; V268-F285 PolarHBondContact O-N 3.31Å; R270-F285 HydrophobicContact CB-CE2 4.17Å; R270-F285 HydrophobicContact CG-CD2 4.22Å; R270-F285 HydrophobicContact CG-CE2 4.16Å; R283-F285 HydrophobicContact CB-CE2 3.78Å; R283-F285 HydrophobicContact CB-CZ 3.83Å; R283-F285 HydrophobicContact CG-CZ 4.42Å
286	L	97.6	Very high	90.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.1	163.9	-175.4	57.4	0	0	0	107.2	F211 R212 D213 F246 K248 L251 N265 E266 Y267	F211-L286 HydrophobicContact CE1-CB 4.29Å; F211-L286 HydrophobicContact CE1-CG 4.35Å; R212-L286 VanDerWaalsContact CA-O 3.32Å; R212-L286 WeakPolarHBondContact CA-O 3.49Å; D213-L286 PolarHBondContact N-O 2.77Å; D213-L286 PolarHBondContact O-N 3.09Å; F246-L286 HydrophobicContact CB-CB 4.45Å; F246-L286 HydrophobicContact CB-CD2 3.56Å; K248-L286 HydrophobicContact CG-CD1 3.68Å; L251-L286 HydrophobicContact CB-CD2 3.78Å; L251-L286 HydrophobicContact CD2-CD2 3.43Å; L251-L286 VanDerWaalsContact CD2-CD2 3.43Å; L251-L286 HydrophobicContact CD2-CG 3.88Å; L251-L286 HydrophobicContact CG-CD2 4.21Å; N265-L286 WeakPolarHBondContact OD1-CD1 2.98Å; E266-L286 WeakPolarHBondContact O-CD1 2.98Å; Y267-L286 HydrophobicContact CD1-CB 4.32Å; Y267-L286 HydrophobicContact CD1-CD1 4.03Å; Y267-L286 HydrophobicContact CE1-CB 4.41Å; Y267-L286 HydrophobicContact CE1-CD1 4.11Å
287	Q	97.4	Very high	89.1	Confident	26 Å²	26	46.9 Å²	46.9	12%	0.121	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	124	178.6	-179.8	170.7	-53.3	0	0	109.2	E90 F91 F211 E266 V268	E90-Q287 PolarHBondContact OE2-OE1 3.05Å; E90-Q287 VanDerWaalsContact OE2-OE1 3.08Å; F91-Q287 HydrophobicContact CE1-CG 3.78Å; F91-Q287 HydrophobicContact CZ-CG 3.93Å; F211-Q287 WeakPolarHBondContact O-CA 3.45Å; E266-Q287 PolarHBondContact N-O 2.89Å; E266-Q287 PolarHBondContact O-N 2.95Å; V268-Q287 HydrophobicContact CG2-CB 3.53Å; V268-Q287 HydrophobicContact CG2-CG 4.4Å
288	S	97.8	Very high	87.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152.7	-169.4	-45.5	0	0	0	0	111.1	F211 L251 V264 N265	F211-S288 PolarHBondContact N-O 2.75Å; F211-S288 PolarHBondContact O-N 2.87Å; L251-S288 VanDerWaalsContact CD2-OG 3.3Å; L251-S288 WeakPolarHBondContact CD2-OG 3.38Å; V264-S288 CarbonylContact O-C 3.47Å; V264-S288 WeakPolarHBondContact O-CA 3.19Å; V264-S288 VanDerWaalsContact O-CB 3.24Å; V264-S288 WeakPolarHBondContact O-CB 3.47Å; N265-S288 PolarHBondContact OD1-OG 3.35Å
289	K	97.9	Very high	86	Confident	21 Å²	21	42.5 Å²	42.5	9%	0.091	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	126	176.2	-61.2	173.7	170	-164.9	0	107.3	E92 E93 V209 L210 V263 V264	E92-K289 IonicContact OE1-NZ 3.35Å; E92-K289 PolarHBondContact OE1-NZ 3.36Å; E93-K289 WeakPolarHBondContact OE1-CD 3.41Å; E93-K289 WeakPolarHBondContact OE1-CE 3.49Å; E93-K289 IonicContact OE1-NZ 3.67Å; E93-K289 PolarHBondContact OE1-NZ 3.45Å; E93-K289 WeakPolarHBondContact OE2-CE 3.42Å; E93-K289 IonicContact OE2-NZ 3.41Å; E93-K289 PolarHBondContact OE2-NZ 2.84Å; V209-K289 WeakPolarHBondContact O-CA 3.25Å; L210-K289 HydrophobicContact CD2-CG 4.08Å; V263-K289 HydrophobicContact CB-CB 4.27Å; V263-K289 WeakPolarHBondContact CB-O 3.37Å; V263-K289 PolarHBondContact N-O 2.85Å; V264-K289 HydrophobicContact CB-CB 4.01Å; V264-K289 HydrophobicContact CB-CD 4.04Å; V264-K289 HydrophobicContact CB-CG 4.06Å; V264-K289 HydrophobicContact CG2-CB 4.43Å; V264-K289 HydrophobicContact CG2-CD 3.83Å; V264-K289 HydrophobicContact CG2-CG 4.4Å; V264-K289 PolarHBondContact N-O 3.18Å; V264-K289 PolarHBondContact O-N 2.81Å
290	F	98.4	Very high	84.3	Confident	1 Å²	1	42.9 Å²	42.9	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.3	178.7	-60.7	-87.3	0	0	0	110.4	V208 V209 F211 L251 F255 F260 Q261	V208-F290 CarbonylContact C-O 3.58Å; V208-F290 VanDerWaalsContact CA-O 3.32Å; V208-F290 WeakPolarHBondContact CA-O 3.45Å; V209-F290 HydrophobicContact CB-CB 4.42Å; V209-F290 PolarHBondContact N-O 2.82Å; V209-F290 PolarHBondContact O-N 2.88Å; F211-F290 HydrophobicContact CB-CE2 4.38Å; L251-F290 HydrophobicContact CD2-CE2 3.94Å; L251-F290 HydrophobicContact CD2-CZ 3.93Å; L251-F290 HydrophobicContact CG-CE2 4.2Å; L251-F290 HydrophobicContact CG-CZ 3.93Å; F255-F290 HydrophobicContact CB-CD1 3.53Å; F255-F290 HydrophobicContact CB-CE1 3.53Å; F255-F290 HydrophobicContact CB-CE2 4.47Å; F255-F290 HydrophobicContact CB-CG 4.06Å; F255-F290 HydrophobicContact CB-CZ 4.03Å; F255-F290 HydrophobicContact CD1-CB 3.57Å; F255-F290 AromaticContact CD1-CD1 3.71Å; F255-F290 HydrophobicContact CD1-CD1 3.71Å; F255-F290 AromaticContact CD1-CD2 3.43Å; F255-F290 HydrophobicContact CD1-CD2 3.43Å; F255-F290 VanDerWaalsContact CD1-CD2 3.43Å; F255-F290 HydrophobicContact CD1-CE1 4.24Å; F255-F290 AromaticContact CD1-CE2 3.96Å; F255-F290 HydrophobicContact CD1-CE2 3.96Å; F255-F290 AromaticContact CD1-CG 3.28Å; F255-F290 HydrophobicContact CD1-CG 3.28Å; F255-F290 HydrophobicContact CD1-CZ 4.35Å; F255-F290 HydrophobicContact CD2-CD1 4.44Å; F255-F290 HydrophobicContact CD2-CD2 4Å; F255-F290 HydrophobicContact CD2-CE1 4.16Å; F255-F290 AromaticContact CD2-CE2 3.64Å; F255-F290 HydrophobicContact CD2-CE2 3.64Å; F255-F290 HydrophobicContact CD2-CG 4.38Å; F255-F290 AromaticContact CD2-CZ 3.75Å; F255-F290 HydrophobicContact CD2-CZ 3.75Å; F255-F290 HydrophobicContact CE1-CB 3.89Å; F255-F290 AromaticContact CE1-CD2 3.41Å; F255-F290 HydrophobicContact CE1-CD2 3.41Å; F255-F290 VanDerWaalsContact CE1-CD2 3.41Å; F255-F290 HydrophobicContact CE1-CE2 4.02Å; F255-F290 AromaticContact CE1-CG 3.7Å; F255-F290 HydrophobicContact CE1-CG 3.7Å; F255-F290 HydrophobicContact CE2-CD2 4Å; F255-F290 AromaticContact CE2-CE2 3.72Å; F255-F290 HydrophobicContact CE2-CE2 3.72Å; F255-F290 HydrophobicContact CE2-CZ 4.28Å; F255-F290 HydrophobicContact CG-CB 4.39Å; F255-F290 AromaticContact CG-CD1 3.64Å; F255-F290 HydrophobicContact CG-CD1 3.64Å; F255-F290 AromaticContact CG-CD2 3.72Å; F255-F290 HydrophobicContact CG-CD2 3.72Å; F255-F290 AromaticContact CG-CE1 3.72Å; F255-F290 HydrophobicContact CG-CE1 3.72Å; F255-F290 AromaticContact CG-CE2 3.76Å; F255-F290 HydrophobicContact CG-CE2 3.76Å; F255-F290 AromaticContact CG-CG 3.66Å; F255-F290 HydrophobicContact CG-CG 3.66Å; F255-F290 AromaticContact CG-CZ 3.78Å; F255-F290 HydrophobicContact CG-CZ 3.78Å; F255-F290 AromaticContact CZ-CD2 3.7Å; F255-F290 HydrophobicContact CZ-CD2 3.7Å; F255-F290 AromaticContact CZ-CE2 3.89Å; F255-F290 HydrophobicContact CZ-CE2 3.89Å; F255-F290 HydrophobicContact CZ-CG 4.41Å; F260-F290 HydrophobicContact CB-CB 4.15Å; Q261-F290 CarbonylContact O-C 3.56Å; Q261-F290 WeakPolarHBondContact O-CA 3.31Å
291	I	97.9	Very high	82.6	Confident	53 Å²	53	42.7 Å²	42.7	27%	0.272	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	139.4	178.8	-72.1	173.9	0	0	0	109.7	G207 V208 F260 Q261 V263 P293	G207-I291 WeakPolarHBondContact O-CA 3.4Å; V208-I291 HydrophobicContact CG2-CD1 4.37Å; V208-I291 HydrophobicContact CG2-CG1 3.71Å; F260-I291 WeakPolarHBondContact CA-O 3.05Å; Q261-I291 PolarHBondContact N-O 2.97Å; Q261-I291 PolarHBondContact O-N 2.98Å; V263-I291 HydrophobicContact CG2-CB 4.24Å; V263-I291 HydrophobicContact CG2-CD1 3.44Å; V263-I291 VanDerWaalsContact CG2-CD1 3.44Å; V263-I291 HydrophobicContact CG2-CG1 3.62Å; I291-P293 WeakPolarHBondContact O-CD 3.41Å
292	K	98	Very high	80.6	Confident	38 Å²	38	47.9 Å²	47.9	17%	0.165	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-77.6	120.1	163.8	177.9	174.3	173.5	-175.2	0	108.8	G200 L203 G206 G207 F260	G200-K292 WeakPolarHBondContact O-CE 3.48Å; G200-K292 PolarHBondContact O-NZ 3.24Å; L203-K292 HydrophobicContact CB-CD 4.34Å; L203-K292 HydrophobicContact CD2-CB 3.89Å; L203-K292 HydrophobicContact CG-CB 4.47Å; L203-K292 WeakPolarHBondContact O-CD 3.36Å; L203-K292 PolarHBondContact O-NZ 3.1Å; G206-K292 WeakPolarHBondContact CA-O 3.41Å; G206-K292 PolarHBondContact N-O 2.99Å; G207-K292 PolarHBondContact O-N 3.3Å; F260-K292 HydrophobicContact CD1-CB 4.25Å; F260-K292 HydrophobicContact CE1-CB 4.2Å
293	P	96.1	Very high	78.6	Confident	11 Å²	11	52.4 Å²	52.4	7%	0.071	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-56.6	145.7	-177.5	-25.2	34.1	0	0	0	112.7	G259 Q261 I291 Q297 Q298	G259-P293 WeakPolarHBondContact O-CD 3.36Å; Q261-P293 HydrophobicContact CG-CG 3.95Å; I291-P293 WeakPolarHBondContact O-CD 3.41Å; P293-Q297 HydrophobicContact CB-CB 4.23Å; P293-Q298 HydrophobicContact CB-CG 4.31Å
294	T	91.3	Very high	76.3	Confident	52 Å²	52	53 Å²	53	32%	0.319	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-72.6	157.5	169.6	56.3	0	0	0	0	110.4	S296 Q297 Q298	T294-S296 PolarHBondContact O-N 2.78Å; T294-S296 VanDerWaalsContact O-N 3.07Å; T294-S296 PolarHBondContact OG1-OG 3.03Å; T294-Q297 PolarHBondContact O-N 3.43Å; T294-Q298 PolarHBondContact O-N 2.77Å
295	H	74.1	Confident	74.1	Confident	141 Å²	141	59 Å²	59	65%	0.653	33%	0.326	S	S	*	.	H	α-helix	trans	-55.7	-28.2	-179	-69.3	-64	0	0	0	113.8	Q297	H295-Q297 VanDerWaalsContact C-N 3.34Å
296	S	61.5	Low	71.6	Confident	99 Å²	99	63.3 Å²	63.3	69%	0.692	35%	0.349	S	S	*	.	H	α-helix	trans	-70.4	-25.5	175.2	46.8	0	0	0	0	113.9	T294	T294-S296 PolarHBondContact O-N 2.78Å; T294-S296 VanDerWaalsContact O-N 3.07Å; T294-S296 PolarHBondContact OG1-OG 3.03Å
297	Q	57.8	Low	69.1	Low	87 Å²	87	67.3 Å²	67.3	41%	0.407	38%	0.377	S	S	.	.	H	α-helix	trans	-91.6	-17	178.2	-65.7	-159.1	5.3	0	0	114	P293 T294 H295 S300 V301	P293-Q297 HydrophobicContact CB-CB 4.23Å; T294-Q297 PolarHBondContact O-N 3.43Å; H295-Q297 VanDerWaalsContact C-N 3.34Å; Q297-S300 PolarHBondContact O-OG 3.46Å; Q297-V301 WeakPolarHBondContact O-CG2 3.28Å
298	Q	52.8	Low	66.7	Low	85 Å²	85	70.2 Å²	70.2	40%	0.397	40%	0.401	S	S	.	.	H	α-helix	trans	-70.9	-32.7	174.4	-77.8	174.1	-20.5	0	0	112.4	P293 T294 L302	P293-Q298 HydrophobicContact CB-CG 4.31Å; T294-Q298 PolarHBondContact O-N 2.77Å; Q298-L302 PolarHBondContact O-N 3.12Å
299	G	47.2	Very low	64.4	Low	37 Å²	37	78.6 Å²	78.6	38%	0.381	44%	0.437	S	S	.	.	H	α-helix	trans	-68.4	-33.3	177.7	0	0	0	0	0	114	L303	G299-L303 WeakPolarHBondContact O-CD1 3.44Å; G299-L303 WeakPolarHBondContact O-CG 3.41Å; G299-L303 PolarHBondContact O-N 3.31Å
300	S	48.9	Very low	61.8	Low	65 Å²	65	85.7 Å²	85.7	46%	0.455	47%	0.471	S	S	.	.	H	α-helix	trans	-75.1	-32.3	179.8	56.6	0	0	0	0	113.2	Q297 L303 S304	Q297-S300 PolarHBondContact O-OG 3.46Å; S300-L303 PolarHBondContact O-N 3.44Å; S300-S304 PolarHBondContact O-N 3.04Å; S300-S304 VanDerWaalsContact O-N 3.09Å; S300-S304 PolarHBondContact O-OG 3.14Å
301	V	52	Low	59.3	Low	68 Å²	68	90.2 Å²	90.2	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-70.4	-36.5	176.6	178.5	0	0	0	0	111.9	Q297 S304 H305	Q297-V301 WeakPolarHBondContact O-CG2 3.28Å; V301-S304 PolarHBondContact O-OG 2.87Å; V301-H305 PolarHBondContact O-N 3.46Å; V301-H305 PolarHBondContact O-ND1 3.01Å; V301-H305 VanDerWaalsContact O-ND1 3.07Å
302	L	48.3	Very low	56.9	Low	121 Å²	121	96.9 Å²	96.9	63%	0.634	53%	0.529	S	S	*	.	H	α-helix	trans	-68.8	-36.3	175.1	-75	166.4	0	0	0	112	Q298 N306	Q298-L302 PolarHBondContact O-N 3.12Å; L302-N306 PolarHBondContact O-N 3.25Å
303	L	47.1	Very low	54.3	Low	124 Å²	124	103.9 Å²	103.9	65%	0.649	56%	0.563	S	S	*	*	H	α-helix	trans	-68.1	-40.4	175.6	-73.6	163.3	0	0	0	112.1	G299 S300 H305 N306 S307	G299-L303 WeakPolarHBondContact O-CD1 3.44Å; G299-L303 WeakPolarHBondContact O-CG 3.41Å; G299-L303 PolarHBondContact O-N 3.31Å; S300-L303 PolarHBondContact O-N 3.44Å; L303-H305 PolarHBondContact O-N 3.08Å; L303-N306 PolarHBondContact O-N 2.97Å; L303-S307 PolarHBondContact O-N 3.24Å; L303-S307 PolarHBondContact O-OG 2.84Å
304	S	47.4	Very low	51.7	Low	61 Å²	61	112.5 Å²	112.5	43%	0.427	60%	0.602	S	S	.	*	H	α-helix	trans	-69.3	-31.9	178.3	65.8	0	0	0	0	113.7	S300 V301 S308	S300-S304 PolarHBondContact O-N 3.04Å; S300-S304 VanDerWaalsContact O-N 3.09Å; S300-S304 PolarHBondContact O-OG 3.14Å; V301-S304 PolarHBondContact O-OG 2.87Å; S304-S308 PolarHBondContact O-N 3.41Å; S304-S308 PolarHBondContact O-OG 2.97Å
305	H	48.7	Very low	49.3	Very low	128 Å²	128	121.9 Å²	121.9	59%	0.593	65%	0.65	S	S	*	*	H	α-helix	trans	-70.2	-32.4	173	-84.7	69.7	0	0	0	112.9	V301 L303	V301-H305 PolarHBondContact O-N 3.46Å; V301-H305 PolarHBondContact O-ND1 3.01Å; V301-H305 VanDerWaalsContact O-ND1 3.07Å; L303-H305 PolarHBondContact O-N 3.08Å
306	N	45.1	Very low	48.1	Very low	111 Å²	111	120.9 Å²	120.9	59%	0.594	65%	0.65	S	S	*	*	H	α-helix	trans	-76	-37.3	175.5	-82.3	-6.8	0	0	0	112.3	L302 L303 S308 K309	L302-N306 PolarHBondContact O-N 3.25Å; L303-N306 PolarHBondContact O-N 2.97Å; N306-S308 PolarHBondContact O-N 3Å; N306-K309 PolarHBondContact O-N 2.97Å
307	S	45.9	Very low	47.4	Very low	84 Å²	84	122.1 Å²	122.1	59%	0.587	65%	0.648	S	S	*	*	H	α-helix	trans	-66.6	-19	175	-63.5	0	0	0	0	114	L303	L303-S307 PolarHBondContact O-N 3.24Å; L303-S307 PolarHBondContact O-OG 2.84Å
308	S	47.7	Very low	46.8	Very low	87 Å²	87	124 Å²	124	61%	0.608	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-9.4	177	-57.1	0	0	0	0	113.8	S304 N306	S304-S308 PolarHBondContact O-N 3.41Å; S304-S308 PolarHBondContact O-OG 2.97Å; N306-S308 PolarHBondContact O-N 3Å
309	K	47.7	Very low	46.5	Very low	177 Å²	177	126.3 Å²	126.3	77%	0.77	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.3	-15.2	177.5	-78.7	-175	176.6	178.3	0	114.1	N306	N306-K309 PolarHBondContact O-N 2.97Å
310	E	44.7	Very low	46.4	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.794	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-4	-179.1	-75.6	-178.8	157.2	0	0	114.4
311	S	44.9	Very low	46.3	Very low	95 Å²	95	136.3 Å²	136.3	66%	0.664	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	15.8	-178.6	56.5	0	0	0	0	115.4
312	K	48.8	Very low	45.9	Very low	193 Å²	193	141.2 Å²	141.2	84%	0.839	73%	0.732	S	S	*	*	S	Bend	trans	-128.7	57	174.9	-74.4	-169.8	177.1	-177.4	0	112.2
313	Q	42.7	Very low	45.7	Very low	186 Å²	186	142.8 Å²	142.8	87%	0.869	74%	0.74	S	S	*	*			trans	-158.6	68.5	161	-137.8	159.4	16.8	0	0	111
314	E	41.9	Very low	45.6	Very low	191 Å²	191	144.3 Å²	144.3	89%	0.893	75%	0.747	S	S	*	*			trans	-160.9	92.9	158.3	-110	170.2	-160.5	0	0	107.2
315	D	41.2	Very low	45.4	Very low	249 Å²	249	151.9 Å²	151.9	100%	1.332	78%	0.777	S	S	*	*			trans	-163.7	0	151.8	-93.5	-22.8	0	0	0	108

Retrieved 315 of 315 residues in 346.1 ms (Link to these results)

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