A0A060Y327_ONCMY Loading...

Kelch repeat and BTB (POZ) domain containing 4

AlphaFold DB , UniProt , Accession A0A060Y327, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene kbtbd4, Length 529 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	33.8	Very low	246 Å²	246	156.3 Å²	156.3	100%	1.212	86%	0.861	S	S	*	*				0	110.5	0	-87.9	167.3	169	0	0	106.6
2	E	33.8	Very low	33.7	Very low	193 Å²	193	149.3 Å²	149.3	90%	0.902	85%	0.852	S	S	*	*			trans	16	141.6	159.2	-69.1	172.7	168.9	0	0	119.7
3	S	31.7	Very low	33.7	Very low	101 Å²	101	152.8 Å²	152.8	71%	0.706	86%	0.856	S	S	*	*			cis	-159.8	128.8	14.1	56.9	0	0	0	0	111.7
4	S	34	Very low	33.9	Very low	117 Å²	117	148.9 Å²	148.9	82%	0.818	84%	0.844	S	S	*	*			trans	21	113.6	139.2	52	0	0	0	0	120.9
5	G	33.8	Very low	34.4	Very low	70 Å²	70	149.1 Å²	149.1	72%	0.722	85%	0.849	S	S	*	*			trans	-103.2	153.1	133.5	0	0	0	0	0	109.3
6	D	35.5	Very low	34.3	Very low	163 Å²	163	144.5 Å²	144.5	87%	0.872	84%	0.844	S	S	*	*				-169.9	156.3	127.2	-122.1	-31.4	0	0	0	114.4
7	R	35.7	Very low	34.8	Very low	234 Å²	234	142.6 Å²	142.6	88%	0.883	85%	0.85	S	S	*	*			trans	-62.4	155.9	-177.5	-70.8	162.9	157.7	171.3	-4.4	114.5
8	A	32.4	Very low	34.9	Very low	104 Å²	104	139.2 Å²	139.2	86%	0.86	85%	0.849	S	S	*	*			trans	-141.4	135.2	149	0	0	0	0	0	111.8
9	R	35	Very low	35.1	Very low	217 Å²	217	137.1 Å²	137.1	82%	0.819	84%	0.841	S	S	*	*			trans	-131.4	148.5	162.8	-108	-163.2	-176.3	-171.2	1.6	108.9
10	F	36.2	Very low	35.6	Very low	194 Å²	194	138.2 Å²	138.2	85%	0.851	84%	0.84	S	S	*	*			trans	103.7	126.1	154.7	-75.4	-72.4	0	0	0	120.4
11	G	29.5	Very low	36.2	Very low	80 Å²	80	137.9 Å²	137.9	83%	0.825	84%	0.838	S	S	*	*			trans	158.2	109	161.4	0	0	0	0	0	110
12	G	32.8	Very low	36.8	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	82%	0.817	S	S	*	*			trans	-113.6	-174.3	-177.1	0	0	0	0	0	115.1
13	Q	33.6	Very low	37.6	Very low	195 Å²	195	130.1 Å²	130.1	91%	0.911	82%	0.815	S	S	*	*			trans	126.5	144.2	166.3	-77.7	-175.4	-1.9	0	0	111.1
14	S	35.9	Very low	38.5	Very low	97 Å²	97	131.9 Å²	131.9	68%	0.678	81%	0.812	S	S	*	*			cis	-169.4	142.7	-22.5	52.9	0	0	0	0	108.6
15	V	41	Very low	39.6	Very low	153 Å²	153	133.5 Å²	133.5	93%	0.927	81%	0.811	S	S	*	*			trans	41.6	128.4	145.8	-165.7	0	0	0	0	121.9
16	G	33.3	Very low	40.5	Very low	75 Å²	75	138 Å²	138	77%	0.773	81%	0.808	S	S	*	*			trans	-179.8	104.5	151.1	0	0	0	0	0	113.7
17	A	42.3	Very low	41.8	Very low	113 Å²	113	139.6 Å²	139.6	93%	0.934	81%	0.807	S	S	*	*			trans	-73.4	138.9	177.5	0	0	0	0	0	112.7
18	G	36.9	Very low	43.4	Very low	81 Å²	81	136 Å²	136	84%	0.835	81%	0.805	S	S	*	*			trans	-154.6	114.1	168.4	0	0	0	0	0	109.1
19	S	38.3	Very low	45.4	Very low	99 Å²	99	135 Å²	135	69%	0.692	80%	0.804	S	S	*	*			trans	-105	137.7	-171.3	-170.3	0	0	0	0	110.2
20	L	45.5	Very low	47.6	Very low	158 Å²	158	133.7 Å²	133.7	83%	0.827	80%	0.8	S	S	*	*			trans	71.1	130.6	154.2	-61.3	156.5	0	0	0	115.8
21	V	48.6	Very low	50.1	Low	133 Å²	133	130.2 Å²	130.2	81%	0.806	80%	0.796	S	S	*	*			cis	-152.2	122.1	28.2	179.5	0	0	0	0	107.4
22	A	47.8	Very low	53.1	Low	92 Å²	92	133.2 Å²	133.2	76%	0.76	79%	0.786	S	S	*	*			trans	-126.4	123.3	161.5	0	0	0	0	0	106.7	E24	A22-E24 PolarHBondContact O-N 2.93Å
23	E	50.1	Low	55.9	Low	183 Å²	183	134.8 Å²	134.8	86%	0.855	78%	0.781	S	S	*	*			trans	-45.7	119.6	-177	-67	175.1	147.4	0	0	111.4	N25	E23-N25 VanDerWaalsContact C-N 3.35Å; E23-N25 PolarHBondContact O-N 2.83Å
24	E	50.5	Low	58.7	Low	139 Å²	139	127.9 Å²	127.9	65%	0.65	75%	0.75	S	S	*	*			trans	-73.3	89.5	178.8	-62	177.5	134.1	0	0	109.4	A22 Y26	A22-E24 PolarHBondContact O-N 2.93Å; E24-Y26 HydrophobicContact CB-CD2 3.41Å; E24-Y26 VanDerWaalsContact CB-CD2 3.41Å; E24-Y26 HydrophobicContact CB-CE2 3.18Å; E24-Y26 HydrophobicContact CB-CG 4.26Å; E24-Y26 HydrophobicContact CG-CD2 4.47Å; E24-Y26 HydrophobicContact CG-CE2 3.81Å; E24-Y26 WeakPolarHBondContact O-CD2 3.39Å; E24-Y26 PolarHBondContact O-N 2.95Å; E24-Y26 PolarHBondContact OE1-OH 3.35Å; E24-Y26 WeakPolarHBondContact OE2-CE2 3.23Å; E24-Y26 PolarHBondContact OE2-OH 3.49Å
25	N	56	Low	61.5	Low	150 Å²	150	134.2 Å²	134.2	80%	0.802	76%	0.76	S	S	*	*			trans	-69.3	82.1	157.3	-91.8	-24.4	0	0	0	108.3	E23 F27	E23-N25 VanDerWaalsContact C-N 3.35Å; E23-N25 PolarHBondContact O-N 2.83Å; N25-F27 PolarHBondContact O-N 2.8Å; N25-F27 VanDerWaalsContact O-N 3.17Å
26	Y	54.4	Low	64.1	Low	165 Å²	165	130 Å²	130	65%	0.647	74%	0.737	S	S	*	*			trans	-66.2	-6.7	176.8	-81.9	-77.7	0	0	0	114.6	E24 L28	E24-Y26 HydrophobicContact CB-CD2 3.41Å; E24-Y26 VanDerWaalsContact CB-CD2 3.41Å; E24-Y26 HydrophobicContact CB-CE2 3.18Å; E24-Y26 HydrophobicContact CB-CG 4.26Å; E24-Y26 HydrophobicContact CG-CD2 4.47Å; E24-Y26 HydrophobicContact CG-CE2 3.81Å; E24-Y26 WeakPolarHBondContact O-CD2 3.39Å; E24-Y26 PolarHBondContact O-N 2.95Å; E24-Y26 PolarHBondContact OE1-OH 3.35Å; E24-Y26 WeakPolarHBondContact OE2-CE2 3.23Å; E24-Y26 PolarHBondContact OE2-OH 3.49Å; Y26-L28 PolarHBondContact O-N 3.16Å
27	F	61.5	Low	67	Low	196 Å²	196	131.7 Å²	131.7	86%	0.86	72%	0.724	S	S	*	*			trans	-82.2	73.6	171.8	-63.6	-74.6	0	0	0	109.8	N25 G29	N25-F27 PolarHBondContact O-N 2.8Å; N25-F27 VanDerWaalsContact O-N 3.17Å; F27-G29 PolarHBondContact O-N 3.48Å
28	L	69.3	Low	69.5	Low	159 Å²	159	130 Å²	130	83%	0.832	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-53.4	124	158	-77.7	152.5	0	0	0	107.6	Y26 Y30	Y26-L28 PolarHBondContact O-N 3.16Å; L28-Y30 PolarHBondContact O-N 3.47Å; L28-Y30 VanDerWaalsContact O-N 3.12Å
29	G	74.4	Confident	72.1	Confident	82 Å²	82	130 Å²	130	85%	0.845	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-52.9	120.7	178	0	0	0	0	0	110.8	F27	F27-G29 PolarHBondContact O-N 3.48Å
30	Y	82.6	Confident	74.8	Confident	190 Å²	190	131.1 Å²	131.1	75%	0.745	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-102.3	122	177.9	175.6	-103.9	0	0	0	109.7	L28 F32	L28-Y30 PolarHBondContact O-N 3.47Å; L28-Y30 VanDerWaalsContact O-N 3.12Å; Y30-F32 HydrophobicContact CD1-CB 4.47Å; Y30-F32 HydrophobicContact CE1-CB 3.8Å
31	T	87.1	Confident	77.2	Confident	122 Å²	122	126.6 Å²	126.6	75%	0.748	66%	0.66	S	S	*	*			trans	-98.5	115.8	171.8	-58.2	0	0	0	0	109
32	F	92.2	Very high	79.2	Confident	142 Å²	142	124.1 Å²	124.1	62%	0.623	65%	0.646	S	S	*	*			trans	-86.2	127.9	170.3	173.4	-112.6	0	0	0	110	Y30 D34	Y30-F32 HydrophobicContact CD1-CB 4.47Å; Y30-F32 HydrophobicContact CE1-CB 3.8Å; F32-D34 HydrophobicContact CE1-CB 3.63Å; F32-D34 HydrophobicContact CZ-CB 3.8Å
33	T	91.8	Very high	81.3	Confident	106 Å²	106	125.1 Å²	125.1	65%	0.65	63%	0.634	S	S	*	*			trans	-117.2	105.9	174.4	-53.7	0	0	0	0	109.5	R35	T33-R35 PolarHBondContact O-N 3.11Å
34	D	94.1	Very high	83.3	Confident	50 Å²	50	119.5 Å²	119.5	27%	0.267	62%	0.615	S	S	.	*			trans	-79	105.8	171.3	-175.9	-11.4	0	0	0	110.6	F32 S36 H37 R40	F32-D34 HydrophobicContact CE1-CB 3.63Å; F32-D34 HydrophobicContact CZ-CB 3.8Å; D34-S36 PolarHBondContact O-N 3.49Å; D34-S36 PolarHBondContact OD1-N 2.73Å; D34-H37 HydrophobicContact CB-CB 4.02Å; D34-H37 PolarHBondContact O-N 2.95Å; D34-H37 PolarHBondContact OD1-N 3.11Å; D34-R40 IonicContact OD1-NH1 3.62Å; D34-R40 PolarHBondContact OD1-NH1 2.89Å; D34-R40 IonicContact OD2-CZ 3.81Å; D34-R40 VanDerWaalsContact OD2-CZ 3.31Å; D34-R40 IonicContact OD2-NH1 2.73Å; D34-R40 PolarHBondContact OD2-NH1 3.18Å; D34-R40 VanDerWaalsContact OD2-NH1 3.11Å; D34-R40 IonicContact OD2-NH2 2.96Å; D34-R40 PolarHBondContact OD2-NH2 3.19Å
35	R	94.5	Very high	85.3	Confident	231 Å²	231	116 Å²	116	87%	0.872	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-16.4	-178.5	-61.4	-175.1	-177	-174.2	0.3	114	T33	T33-R35 PolarHBondContact O-N 3.11Å
36	S	95.1	Very high	87.1	Confident	64 Å²	64	110.5 Å²	110.5	45%	0.448	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.2	1.3	-177.5	-59.6	0	0	0	0	113.3	D34 S38 S39 R40	D34-S36 PolarHBondContact O-N 3.49Å; D34-S36 PolarHBondContact OD1-N 2.73Å; S36-S38 PolarHBondContact O-N 3.2Å; S36-S39 PolarHBondContact O-N 3.45Å; S36-R40 WeakPolarHBondContact O-CG 3.48Å; S36-R40 PolarHBondContact O-N 2.84Å
37	H	95.1	Very high	88.9	Confident	111 Å²	111	105 Å²	105	51%	0.514	55%	0.552	S	S	.	*	H	α-helix	trans	-57.6	-49.2	-176.1	-177.9	90.2	0	0	0	112.2	D34 S39 R40 V41	D34-H37 HydrophobicContact CB-CB 4.02Å; D34-H37 PolarHBondContact O-N 2.95Å; D34-H37 PolarHBondContact OD1-N 3.11Å; H37-S39 PolarHBondContact O-N 3.33Å; H37-R40 PolarHBondContact O-N 3.07Å; H37-V41 VanDerWaalsContact O-CG2 3.32Å; H37-V41 WeakPolarHBondContact O-CG2 3.18Å; H37-V41 PolarHBondContact O-N 2.73Å
38	S	93.1	Very high	90.4	Very high	76 Å²	76	98.7 Å²	98.7	53%	0.531	53%	0.527	S	S	.	.	H	α-helix	trans	-60.2	-48	-179.7	50.8	0	0	0	0	112.3	S36 R40 V41 V42	S36-S38 PolarHBondContact O-N 3.2Å; S38-R40 PolarHBondContact O-N 2.87Å; S38-V41 PolarHBondContact O-N 2.71Å; S38-V42 WeakPolarHBondContact O-CG2 3.48Å; S38-V42 PolarHBondContact O-N 3.49Å
39	S	93.1	Very high	91.5	Very high	81 Å²	81	91.9 Å²	91.9	57%	0.566	49%	0.492	S	S	*	.	H	α-helix	trans	-61.8	-41.9	179	-53.6	0	0	0	0	112.1	S36 H37 V42 Q43	S36-S39 PolarHBondContact O-N 3.45Å; H37-S39 PolarHBondContact O-N 3.33Å; S39-V42 PolarHBondContact O-N 2.82Å; S39-Q43 WeakPolarHBondContact O-CB 3.02Å; S39-Q43 PolarHBondContact O-N 2.77Å
40	R	95	Very high	92.2	Very high	124 Å²	124	91.6 Å²	91.6	47%	0.468	47%	0.471	S	S	.	.	H	α-helix	trans	-66.8	-39.6	177	-69	-163.9	-47.7	-89.1	-4.3	112.4	D34 S36 H37 S38 S44	D34-R40 IonicContact OD1-NH1 3.62Å; D34-R40 PolarHBondContact OD1-NH1 2.89Å; D34-R40 IonicContact OD2-CZ 3.81Å; D34-R40 VanDerWaalsContact OD2-CZ 3.31Å; D34-R40 IonicContact OD2-NH1 2.73Å; D34-R40 PolarHBondContact OD2-NH1 3.18Å; D34-R40 VanDerWaalsContact OD2-NH1 3.11Å; D34-R40 IonicContact OD2-NH2 2.96Å; D34-R40 PolarHBondContact OD2-NH2 3.19Å; S36-R40 WeakPolarHBondContact O-CG 3.48Å; S36-R40 PolarHBondContact O-N 2.84Å; H37-R40 PolarHBondContact O-N 3.07Å; S38-R40 PolarHBondContact O-N 2.87Å; R40-S44 WeakPolarHBondContact O-CB 2.91Å; R40-S44 PolarHBondContact O-N 2.84Å; R40-S44 PolarHBondContact O-OG 3.4Å
41	V	94.2	Very high	92.5	Very high	62 Å²	62	89.4 Å²	89.4	38%	0.376	47%	0.468	S	S	.	.	H	α-helix	trans	-63.2	-48	175.5	169.7	0	0	0	0	110.5	H37 S38 Q43 S44 I45	H37-V41 VanDerWaalsContact O-CG2 3.32Å; H37-V41 WeakPolarHBondContact O-CG2 3.18Å; H37-V41 PolarHBondContact O-N 2.73Å; S38-V41 PolarHBondContact O-N 2.71Å; V41-Q43 PolarHBondContact O-N 3.29Å; V41-S44 PolarHBondContact O-N 3.35Å; V41-I45 HydrophobicContact CG1-CD1 3.72Å; V41-I45 HydrophobicContact CG1-CG1 4.42Å; V41-I45 VanDerWaalsContact O-CG1 3.28Å; V41-I45 WeakPolarHBondContact O-CG1 3.48Å; V41-I45 PolarHBondContact O-N 2.72Å
42	V	91.1	Very high	92.6	Very high	82 Å²	82	88.3 Å²	88.3	50%	0.497	46%	0.457	S	S	.	.	H	α-helix	trans	-60	-47.3	177.8	171.8	0	0	0	0	110.9	S38 S39 S44 I45 M46	S38-V42 WeakPolarHBondContact O-CG2 3.48Å; S38-V42 PolarHBondContact O-N 3.49Å; S39-V42 PolarHBondContact O-N 2.82Å; V42-S44 PolarHBondContact O-N 2.84Å; V42-I45 PolarHBondContact O-N 2.85Å; V42-M46 WeakPolarHBondContact O-CG 3.44Å; V42-M46 PolarHBondContact O-N 3.01Å
43	Q	92.2	Very high	92.3	Very high	112 Å²	112	84 Å²	84	52%	0.523	45%	0.453	S	S	.	.	H	α-helix	trans	-59.2	-47.2	177.6	-173.1	62.6	51	0	0	111.5	S39 V41 I45 M46 D47	S39-Q43 WeakPolarHBondContact O-CB 3.02Å; S39-Q43 PolarHBondContact O-N 2.77Å; V41-Q43 PolarHBondContact O-N 3.29Å; Q43-I45 VanDerWaalsContact C-N 3.33Å; Q43-I45 PolarHBondContact O-N 2.81Å; Q43-M46 PolarHBondContact O-N 2.79Å; Q43-M46 VanDerWaalsContact O-N 3.17Å; Q43-D47 PolarHBondContact NE2-OD1 2.9Å; Q43-D47 VanDerWaalsContact O-CG 3.26Å; Q43-D47 PolarHBondContact O-N 2.84Å
44	S	92.6	Very high	92.3	Very high	65 Å²	65	82.6 Å²	82.6	46%	0.455	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-38.7	-179.7	-54	0	0	0	0	112	R40 V41 V42 D47 L48	R40-S44 WeakPolarHBondContact O-CB 2.91Å; R40-S44 PolarHBondContact O-N 2.84Å; R40-S44 PolarHBondContact O-OG 3.4Å; V41-S44 PolarHBondContact O-N 3.35Å; V42-S44 PolarHBondContact O-N 2.84Å; S44-D47 PolarHBondContact O-N 2.79Å; S44-L48 VanDerWaalsContact O-CG 3.29Å; S44-L48 WeakPolarHBondContact O-CG 3.42Å; S44-L48 PolarHBondContact O-N 2.98Å; S44-L48 VanDerWaalsContact O-N 3.1Å
45	I	92.9	Very high	92.2	Very high	67 Å²	67	87.6 Å²	87.6	34%	0.344	46%	0.461	S	S	.	.	H	α-helix	trans	-62.8	-45.5	174.5	-70.6	167.9	0	0	0	110.1	V41 V42 Q43 L48 C49	V41-I45 HydrophobicContact CG1-CD1 3.72Å; V41-I45 HydrophobicContact CG1-CG1 4.42Å; V41-I45 VanDerWaalsContact O-CG1 3.28Å; V41-I45 WeakPolarHBondContact O-CG1 3.48Å; V41-I45 PolarHBondContact O-N 2.72Å; V42-I45 PolarHBondContact O-N 2.85Å; Q43-I45 VanDerWaalsContact C-N 3.33Å; Q43-I45 PolarHBondContact O-N 2.81Å; I45-L48 PolarHBondContact O-N 3.17Å; I45-C49 PolarHBondContact O-N 3.44Å; I45-C49 PolarHBondContact O-SG 2.79Å
46	M	92.6	Very high	92.2	Very high	33 Å²	33	77.9 Å²	77.9	16%	0.163	43%	0.43	C	S	.	.	H	α-helix	trans	-65.6	-38.7	179.3	-67.5	-54	-170	0	0	112.3	V42 Q43 C49 L50 V73 Y115	V42-M46 WeakPolarHBondContact O-CG 3.44Å; V42-M46 PolarHBondContact O-N 3.01Å; Q43-M46 PolarHBondContact O-N 2.79Å; Q43-M46 VanDerWaalsContact O-N 3.17Å; M46-C49 PolarHBondContact O-N 3.07Å; M46-L50 WeakPolarHBondContact O-CB 3.39Å; M46-L50 WeakPolarHBondContact O-CG 3.31Å; M46-L50 PolarHBondContact O-N 3.28Å; M46-V73 HydrophobicContact CE-CG1 4.11Å; M46-V73 HydrophobicContact SD-CG1 4.46Å; M46-Y115 HydrophobicContact SD-CD1 4.21Å
47	D	92.4	Very high	92.1	Very high	51 Å²	51	77.9 Å²	77.9	27%	0.273	43%	0.425	S	S	.	.	H	α-helix	trans	-61.7	-45.4	175.7	-67	-22.3	0	0	0	111.2	Q43 S44 C49 L50 Q51 D52	Q43-D47 PolarHBondContact NE2-OD1 2.9Å; Q43-D47 VanDerWaalsContact O-CG 3.26Å; Q43-D47 PolarHBondContact O-N 2.84Å; S44-D47 PolarHBondContact O-N 2.79Å; D47-C49 VanDerWaalsContact C-N 3.3Å; D47-C49 PolarHBondContact O-N 2.6Å; D47-L50 PolarHBondContact O-N 2.76Å; D47-Q51 WeakPolarHBondContact O-CA 3.33Å; D47-Q51 VanDerWaalsContact O-CB 3.3Å; D47-Q51 WeakPolarHBondContact O-CB 3.33Å; D47-Q51 PolarHBondContact O-N 3.15Å; D47-Q51 PolarHBondContact OD1-NE2 2.8Å; D47-D52 PolarHBondContact O-N 3.44Å
48	L	93.6	Very high	92.1	Very high	62 Å²	62	72.7 Å²	72.7	33%	0.325	40%	0.401	S	S	.	.	H	α-helix	trans	-60.6	-38.9	175.3	-70.4	168.7	0	0	0	112.5	S44 I45 G53 L54 F55	S44-L48 VanDerWaalsContact O-CG 3.29Å; S44-L48 WeakPolarHBondContact O-CG 3.42Å; S44-L48 PolarHBondContact O-N 2.98Å; S44-L48 VanDerWaalsContact O-N 3.1Å; I45-L48 PolarHBondContact O-N 3.17Å; L48-G53 PolarHBondContact O-N 3.33Å; L48-L54 HydrophobicContact CD2-CD1 4.2Å; L48-L54 PolarHBondContact O-N 2.79Å; L48-F55 HydrophobicContact CB-CD2 4.44Å; L48-F55 HydrophobicContact CB-CE2 4.38Å; L48-F55 HydrophobicContact CD1-CE2 4.11Å; L48-F55 HydrophobicContact CD2-CE2 4.24Å; L48-F55 HydrophobicContact CG-CE2 4.48Å
49	C	92.3	Very high	92.2	Very high	16 Å²	16	70.1 Å²	70.1	11%	0.108	38%	0.382	C	S	.	.	H	α-helix	trans	-73.2	-44.3	-179.1	-67.2	0	0	0	0	112.4	I45 M46 D47 G53 Y115	I45-C49 PolarHBondContact O-N 3.44Å; I45-C49 PolarHBondContact O-SG 2.79Å; M46-C49 PolarHBondContact O-N 3.07Å; D47-C49 VanDerWaalsContact C-N 3.3Å; D47-C49 PolarHBondContact O-N 2.6Å; C49-G53 WeakPolarHBondContact O-CA 3.35Å; C49-Y115 HydrophobicContact CB-CD1 4.35Å; C49-Y115 HydrophobicContact CB-CE1 3.94Å
50	L	89.4	Confident	92.3	Very high	77 Å²	77	66.2 Å²	66.2	40%	0.403	36%	0.355	S	S	.	.	H	α-helix	trans	-96.4	-41.2	-168.2	-66.7	173.1	0	0	0	113.6	M46 D47 Y115	M46-L50 WeakPolarHBondContact O-CB 3.39Å; M46-L50 WeakPolarHBondContact O-CG 3.31Å; M46-L50 PolarHBondContact O-N 3.28Å; D47-L50 PolarHBondContact O-N 2.76Å; L50-Y115 HydrophobicContact CD2-CD1 3.67Å; L50-Y115 HydrophobicContact CD2-CG 3.98Å; L50-Y115 HydrophobicContact CG-CD1 4.03Å
51	Q	88.1	Confident	92.3	Very high	144 Å²	144	64 Å²	64	67%	0.673	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-47.3	-177.9	-57.5	-175.8	14.3	0	0	111	D47	D47-Q51 WeakPolarHBondContact O-CA 3.33Å; D47-Q51 VanDerWaalsContact O-CB 3.3Å; D47-Q51 WeakPolarHBondContact O-CB 3.33Å; D47-Q51 PolarHBondContact O-N 3.15Å; D47-Q51 PolarHBondContact OD1-NE2 2.8Å
52	D	88.5	Confident	92.4	Very high	98 Å²	98	61 Å²	61	52%	0.524	33%	0.331	S	S	.	.	S	Bend	trans	-91.8	-15.6	-174.7	-59	-32.2	0	0	0	113	D47 L54	D47-D52 PolarHBondContact O-N 3.44Å; D52-L54 HydrophobicContact CB-CB 4.48Å; D52-L54 HydrophobicContact CB-CD1 3.76Å; D52-L54 HydrophobicContact CB-CG 3.72Å; D52-L54 PolarHBondContact O-N 2.92Å
53	G	87.4	Confident	92.5	Very high	51 Å²	51	63.8 Å²	63.8	53%	0.526	34%	0.338	S	S	.	.			trans	62.2	25.9	-179	0	0	0	0	0	113.6	L48 C49	L48-G53 PolarHBondContact O-N 3.33Å; C49-G53 WeakPolarHBondContact O-CA 3.35Å
54	L	91.6	Very high	92.3	Very high	78 Å²	78	62.2 Å²	62.2	41%	0.408	35%	0.352	S	S	.	.			trans	-89.5	153.7	-173	-66	175.9	0	0	0	112	L48 D52 A56 H70	L48-L54 HydrophobicContact CD2-CD1 4.2Å; L48-L54 PolarHBondContact O-N 2.79Å; D52-L54 HydrophobicContact CB-CB 4.48Å; D52-L54 HydrophobicContact CB-CD1 3.76Å; D52-L54 HydrophobicContact CB-CG 3.72Å; D52-L54 PolarHBondContact O-N 2.92Å; L54-A56 VanDerWaalsContact C-N 3.27Å; L54-A56 PolarHBondContact O-N 3.22Å; L54-H70 PolarHBondContact O-NE2 3.39Å
55	F	92.3	Very high	92.4	Very high	155 Å²	155	66.5 Å²	66.5	68%	0.68	36%	0.358	S	S	*	.			trans	69	11	172.8	-44.8	-72	0	0	0	116.4	L48 D57 H70	L48-F55 HydrophobicContact CB-CD2 4.44Å; L48-F55 HydrophobicContact CB-CE2 4.38Å; L48-F55 HydrophobicContact CD1-CE2 4.11Å; L48-F55 HydrophobicContact CD2-CE2 4.24Å; L48-F55 HydrophobicContact CG-CE2 4.48Å; F55-D57 PolarHBondContact O-N 2.92Å; F55-D57 VanDerWaalsContact O-N 3.15Å; F55-H70 VanDerWaalsContact C-CD2 3.41Å; F55-H70 PolarHBondContact O-CD2 3.11Å
56	A	93.4	Very high	92.6	Very high	27 Å²	27	67.6 Å²	67.6	22%	0.223	36%	0.364	C	S	.	.			trans	-59.4	117.6	173.1	0	0	0	0	0	111.5	L54 N68 L69 H70 R95	L54-A56 VanDerWaalsContact C-N 3.27Å; L54-A56 PolarHBondContact O-N 3.22Å; A56-N68 HydrophobicContact CB-CB 4.29Å; A56-L69 WeakPolarHBondContact CA-O 3.42Å; A56-H70 WeakPolarHBondContact CA-NE2 3.34Å; A56-H70 PolarHBondContact N-CD2 2.83Å; A56-H70 PolarHBondContact N-NE2 2.68Å; A56-R95 PolarHBondContact O-NH2 3.48Å
57	D	93.6	Very high	92.7	Very high	64 Å²	64	66.8 Å²	66.8	34%	0.342	36%	0.36	S	S	.	.			trans	-122.2	5.6	-168.7	64.7	-9.6	0	0	0	113.1	F55 L69 H70 R71	F55-D57 PolarHBondContact O-N 2.92Å; F55-D57 VanDerWaalsContact O-N 3.15Å; D57-L69 PolarHBondContact N-O 2.81Å; D57-L69 VanDerWaalsContact N-O 3.11Å; D57-H70 VanDerWaalsContact OD1-CA 3.31Å; D57-H70 WeakPolarHBondContact OD1-CA 3.31Å; D57-R71 PolarHBondContact O-NE 3.21Å; D57-R71 WeakPolarHBondContact OD1-CG 3.27Å; D57-R71 PolarHBondContact OD1-N 3.16Å
58	V	94.9	Very high	92.8	Very high	1 Å²	1	69.7 Å²	69.7	1%	0.006	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	143.4	171.7	63.7	0	0	0	0	111.7	V60 L69 R71 L74 F85 R95 I97	V58-V60 HydrophobicContact CG2-CG2 4.36Å; V58-L69 HydrophobicContact CG1-CB 4.07Å; V58-L69 WeakPolarHBondContact CG1-O 3.45Å; V58-L69 PolarHBondContact N-O 3.12Å; V58-L69 PolarHBondContact O-N 3.48Å; V58-R71 HydrophobicContact CB-CG 3.89Å; V58-R71 HydrophobicContact CG1-CG 3.84Å; V58-L74 HydrophobicContact CG1-CD1 4.09Å; V58-F85 HydrophobicContact CG1-CZ 4.24Å; V58-F85 HydrophobicContact CG2-CE1 4.12Å; V58-F85 HydrophobicContact CG2-CZ 4.22Å; V58-R95 CarbonylContact C-O 3.5Å; V58-R95 WeakPolarHBondContact CA-O 3.34Å; V58-I97 HydrophobicContact CG2-CD1 3.86Å; V58-I97 HydrophobicContact CG2-CG1 4.31Å
59	T	95.6	Very high	92.9	Very high	22 Å²	22	67.1 Å²	67.1	14%	0.135	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	113.8	172	-53.9	0	0	0	0	109.1	D66 F67 N68 R95 S96 I97	T59-D66 HydrophobicContact CG2-CB 3.94Å; T59-F67 CarbonylContact C-O 3.52Å; T59-F67 VanDerWaalsContact CA-O 3.27Å; T59-F67 WeakPolarHBondContact CA-O 3.3Å; T59-N68 PolarHBondContact OG1-OD1 3.46Å; T59-R95 PolarHBondContact N-O 2.78Å; T59-S96 CarbonylContact O-C 3.59Å; T59-S96 VanDerWaalsContact O-CA 3.28Å; T59-S96 WeakPolarHBondContact O-CA 3.46Å; T59-I97 PolarHBondContact O-N 2.92Å
60	V	95.3	Very high	93.1	Very high	0 Å²	0	67 Å²	67	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.4	176.4	-176.6	0	0	0	0	109.1	V58 V62 F67 L69 I97 L99 F107	V58-V60 HydrophobicContact CG2-CG2 4.36Å; V60-V62 HydrophobicContact CG1-CG2 4.05Å; V60-F67 HydrophobicContact CB-CB 4.43Å; V60-F67 PolarHBondContact N-O 3.15Å; V60-F67 WeakPolarHBondContact O-CB 3.45Å; V60-F67 WeakPolarHBondContact O-CD2 3.24Å; V60-F67 PolarHBondContact O-N 2.59Å; V60-L69 HydrophobicContact CB-CD1 4.27Å; V60-L69 HydrophobicContact CG2-CD1 3.98Å; V60-I97 CarbonylContact C-O 3.5Å; V60-I97 WeakPolarHBondContact CA-O 3.31Å; V60-L99 HydrophobicContact CG1-CD1 3.45Å; V60-L99 VanDerWaalsContact CG1-CD1 3.45Å; V60-L99 HydrophobicContact CG1-CG 3.72Å; V60-F107 HydrophobicContact CB-CE1 4.18Å; V60-F107 HydrophobicContact CB-CZ 4.1Å; V60-F107 HydrophobicContact CG1-CE1 3.9Å; V60-F107 HydrophobicContact CG1-CE2 4.36Å; V60-F107 HydrophobicContact CG1-CZ 3.61Å; V60-F107 HydrophobicContact CG2-CZ 4.49Å
61	K	95.1	Very high	93.3	Very high	77 Å²	77	65.2 Å²	65.2	34%	0.335	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.4	-178.2	-56.2	-162.6	168.1	-165.8	0	110	R65 D66 S96 I97 L99	K61-R65 WeakPolarHBondContact CA-O 3.41Å; K61-D66 WeakPolarHBondContact CD-OD1 3.45Å; K61-D66 VanDerWaalsContact CE-OD1 3.28Å; K61-D66 WeakPolarHBondContact CE-OD1 3.34Å; K61-D66 WeakPolarHBondContact CE-OD2 3.11Å; K61-D66 VanDerWaalsContact CG-OD1 3.27Å; K61-D66 WeakPolarHBondContact CG-OD1 3.48Å; K61-D66 IonicContact NZ-OD1 3.81Å; K61-D66 IonicContact NZ-OD2 2.65Å; K61-S96 VanDerWaalsContact CE-OG 3.28Å; K61-S96 WeakPolarHBondContact CE-OG 3.44Å; K61-I97 PolarHBondContact N-O 2.91Å; K61-L99 PolarHBondContact O-N 2.74Å
62	V	95.7	Very high	93.6	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	123.2	-178.8	-177	0	0	0	0	108.8	V60 G64 R65 F67 L99 V102 A104 F107	V60-V62 HydrophobicContact CG1-CG2 4.05Å; V62-G64 PolarHBondContact O-N 3.29Å; V62-R65 PolarHBondContact N-O 2.99Å; V62-R65 WeakPolarHBondContact O-CB 3.24Å; V62-R65 PolarHBondContact O-N 2.97Å; V62-F67 HydrophobicContact CB-CE2 3.99Å; V62-F67 HydrophobicContact CG2-CD2 4.42Å; V62-F67 HydrophobicContact CG2-CE2 4.27Å; V62-L99 HydrophobicContact CG2-CB 4.22Å; V62-L99 HydrophobicContact CG2-CD1 4.45Å; V62-V102 HydrophobicContact CG1-CG1 3.73Å; V62-V102 WeakPolarHBondContact CG1-O 3.48Å; V62-V102 HydrophobicContact CG2-CG1 4.29Å; V62-A104 HydrophobicContact CG1-CB 4.31Å; V62-F107 HydrophobicContact CG1-CB 4.24Å; V62-F107 HydrophobicContact CG2-CB 4.27Å; V62-F107 HydrophobicContact CG2-CD1 3.72Å; V62-F107 HydrophobicContact CG2-CD2 4.22Å; V62-F107 HydrophobicContact CG2-CE1 4.1Å; V62-F107 HydrophobicContact CG2-CG 3.79Å
63	E	92.4	Very high	93.9	Very high	139 Å²	139	60 Å²	60	65%	0.65	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	40.8	-179.9	-61	-171.3	134.2	0	0	114.7	R65 S103 A104	E63-R65 VanDerWaalsContact C-N 3.27Å; E63-R65 PolarHBondContact O-N 3.3Å; E63-S103 VanDerWaalsContact OE2-CA 3.3Å; E63-S103 WeakPolarHBondContact OE2-CA 3.3Å; E63-A104 HydrophobicContact CB-CB 4.25Å; E63-A104 PolarHBondContact OE2-N 3.39Å
64	G	88.2	Confident	94.3	Very high	79 Å²	79	57.6 Å²	57.6	81%	0.814	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	4	179.9	0	0	0	0	0	115.5	V62	V62-G64 PolarHBondContact O-N 3.29Å
65	R	95.5	Very high	94.5	Very high	155 Å²	155	54.7 Å²	54.7	59%	0.585	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	140.5	168.4	-59.2	-164.8	-170.6	175	-1	111	K61 V62 E63 F67 A104	K61-R65 WeakPolarHBondContact CA-O 3.41Å; V62-R65 PolarHBondContact N-O 2.99Å; V62-R65 WeakPolarHBondContact O-CB 3.24Å; V62-R65 PolarHBondContact O-N 2.97Å; E63-R65 VanDerWaalsContact C-N 3.27Å; E63-R65 PolarHBondContact O-N 3.3Å; R65-F67 HydrophobicContact CB-CE2 3.85Å; R65-F67 HydrophobicContact CB-CZ 4.42Å; R65-A104 HydrophobicContact CB-CB 4.45Å; R65-A104 HydrophobicContact CG-CB 4.17Å
66	D	95.8	Very high	94.6	Very high	90 Å²	90	50 Å²	50	48%	0.481	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	124.5	179.7	-75.1	6.7	0	0	0	110	T59 K61	T59-D66 HydrophobicContact CG2-CB 3.94Å; K61-D66 WeakPolarHBondContact CD-OD1 3.45Å; K61-D66 VanDerWaalsContact CE-OD1 3.28Å; K61-D66 WeakPolarHBondContact CE-OD1 3.34Å; K61-D66 WeakPolarHBondContact CE-OD2 3.11Å; K61-D66 VanDerWaalsContact CG-OD1 3.27Å; K61-D66 WeakPolarHBondContact CG-OD1 3.48Å; K61-D66 IonicContact NZ-OD1 3.81Å; K61-D66 IonicContact NZ-OD2 2.65Å
67	F	95.7	Very high	94.6	Very high	17 Å²	17	53.2 Å²	53.2	8%	0.075	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	111.9	178.4	-63.4	-101.7	0	0	0	109.5	T59 V60 V62 R65 L69 F107 Q108 V111	T59-F67 CarbonylContact C-O 3.52Å; T59-F67 VanDerWaalsContact CA-O 3.27Å; T59-F67 WeakPolarHBondContact CA-O 3.3Å; V60-F67 HydrophobicContact CB-CB 4.43Å; V60-F67 PolarHBondContact N-O 3.15Å; V60-F67 WeakPolarHBondContact O-CB 3.45Å; V60-F67 WeakPolarHBondContact O-CD2 3.24Å; V60-F67 PolarHBondContact O-N 2.59Å; V62-F67 HydrophobicContact CB-CE2 3.99Å; V62-F67 HydrophobicContact CG2-CD2 4.42Å; V62-F67 HydrophobicContact CG2-CE2 4.27Å; R65-F67 HydrophobicContact CB-CE2 3.85Å; R65-F67 HydrophobicContact CB-CZ 4.42Å; F67-L69 HydrophobicContact CB-CD1 3.94Å; F67-L69 HydrophobicContact CB-CD2 4.47Å; F67-L69 HydrophobicContact CB-CG 4.04Å; F67-F107 HydrophobicContact CB-CE1 4.16Å; F67-F107 AromaticContact CD1-CD1 3.99Å; F67-F107 HydrophobicContact CD1-CD1 3.99Å; F67-F107 HydrophobicContact CD1-CE1 4.11Å; F67-F107 AromaticContact CD2-CD1 3.82Å; F67-F107 HydrophobicContact CD2-CD1 3.82Å; F67-F107 AromaticContact CD2-CE1 3.95Å; F67-F107 HydrophobicContact CD2-CE1 3.95Å; F67-F107 AromaticContact CE1-CD1 3.9Å; F67-F107 HydrophobicContact CE1-CD1 3.9Å; F67-F107 HydrophobicContact CE1-CE1 4.49Å; F67-F107 AromaticContact CE2-CD1 3.77Å; F67-F107 HydrophobicContact CE2-CD1 3.77Å; F67-F107 HydrophobicContact CE2-CE1 4.37Å; F67-F107 AromaticContact CG-CD1 3.94Å; F67-F107 HydrophobicContact CG-CD1 3.94Å; F67-F107 AromaticContact CG-CE1 3.82Å; F67-F107 HydrophobicContact CG-CE1 3.82Å; F67-F107 AromaticContact CZ-CD1 3.8Å; F67-F107 HydrophobicContact CZ-CD1 3.8Å; F67-Q108 HydrophobicContact CE1-CB 4.24Å; F67-Q108 VanDerWaalsContact CE1-OE1 3.3Å; F67-V111 HydrophobicContact CD1-CG2 4.44Å
68	N	95.2	Very high	94.8	Very high	111 Å²	111	50.2 Å²	50.2	59%	0.594	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.6	114.2	175.5	-67.1	-48.6	0	0	0	109.8	A56 T59	A56-N68 HydrophobicContact CB-CB 4.29Å; T59-N68 PolarHBondContact OG1-OD1 3.46Å
69	L	95.9	Very high	94.8	Very high	8 Å²	8	52.2 Å²	52.2	4%	0.042	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	176.6	-167.6	-57.2	172.5	0	0	0	110.8	A56 D57 V58 V60 F67 L74 F107 V111 Y115	A56-L69 WeakPolarHBondContact CA-O 3.42Å; D57-L69 PolarHBondContact N-O 2.81Å; D57-L69 VanDerWaalsContact N-O 3.11Å; V58-L69 HydrophobicContact CG1-CB 4.07Å; V58-L69 WeakPolarHBondContact CG1-O 3.45Å; V58-L69 PolarHBondContact N-O 3.12Å; V58-L69 PolarHBondContact O-N 3.48Å; V60-L69 HydrophobicContact CB-CD1 4.27Å; V60-L69 HydrophobicContact CG2-CD1 3.98Å; F67-L69 HydrophobicContact CB-CD1 3.94Å; F67-L69 HydrophobicContact CB-CD2 4.47Å; F67-L69 HydrophobicContact CB-CG 4.04Å; L69-L74 HydrophobicContact CB-CD1 3.95Å; L69-L74 HydrophobicContact CB-CG 4.45Å; L69-L74 HydrophobicContact CD1-CD1 4.06Å; L69-L74 HydrophobicContact CD1-CD2 4.28Å; L69-F107 HydrophobicContact CD1-CE1 4.19Å; L69-F107 HydrophobicContact CD1-CZ 4.28Å; L69-V111 HydrophobicContact CD1-CG2 4.03Å; L69-V111 HydrophobicContact CD2-CG1 3.74Å; L69-V111 HydrophobicContact CD2-CG2 4.21Å; L69-Y115 HydrophobicContact CD2-CE2 3.91Å
70	H	95.4	Very high	94.8	Very high	13 Å²	13	53.9 Å²	53.9	6%	0.06	29%	0.29	C	S	.	.			trans	-116.4	120.5	-176.1	-51.2	83.1	0	0	0	110	L54 F55 A56 D57 L72 V73 L74 Y115	L54-H70 PolarHBondContact O-NE2 3.39Å; F55-H70 VanDerWaalsContact C-CD2 3.41Å; F55-H70 PolarHBondContact O-CD2 3.11Å; A56-H70 WeakPolarHBondContact CA-NE2 3.34Å; A56-H70 PolarHBondContact N-CD2 2.83Å; A56-H70 PolarHBondContact N-NE2 2.68Å; D57-H70 VanDerWaalsContact OD1-CA 3.31Å; D57-H70 WeakPolarHBondContact OD1-CA 3.31Å; H70-L72 PolarHBondContact O-N 2.96Å; H70-V73 HydrophobicContact CB-CB 4.1Å; H70-V73 HydrophobicContact CB-CG2 3.82Å; H70-V73 PolarHBondContact O-N 2.78Å; H70-L74 WeakPolarHBondContact O-CG 3.4Å; H70-L74 PolarHBondContact O-N 2.82Å; H70-Y115 PolarHBondContact N-OH 3.25Å; H70-Y115 AromaticContact ND1-CE1 3.57Å; H70-Y115 AromaticContact ND1-CZ 3.62Å; H70-Y115 PolarHBondContact ND1-OH 3.49Å
71	R	94.2	Very high	94.8	Very high	41 Å²	41	54 Å²	54	16%	0.155	29%	0.29	C	S	.	.	H	α-helix	trans	-56.6	-40.2	179.4	-69.6	172.3	-177.1	-93.9	-8.2	111.8	D57 V58 S75 F85 A92 T94	D57-R71 PolarHBondContact O-NE 3.21Å; D57-R71 WeakPolarHBondContact OD1-CG 3.27Å; D57-R71 PolarHBondContact OD1-N 3.16Å; V58-R71 HydrophobicContact CB-CG 3.89Å; V58-R71 HydrophobicContact CG1-CG 3.84Å; R71-S75 WeakPolarHBondContact O-CB 3.49Å; R71-S75 PolarHBondContact O-N 2.91Å; R71-S75 PolarHBondContact O-OG 2.97Å; R71-F85 HydrophobicContact CB-CD2 3.97Å; R71-F85 HydrophobicContact CB-CE2 4.1Å; R71-F85 HydrophobicContact CB-CG 4.38Å; R71-F85 HydrophobicContact CG-CD1 4.21Å; R71-F85 HydrophobicContact CG-CD2 4.08Å; R71-F85 HydrophobicContact CG-CE1 4.09Å; R71-F85 HydrophobicContact CG-CE2 4.01Å; R71-F85 HydrophobicContact CG-CG 4.18Å; R71-F85 HydrophobicContact CG-CZ 4.01Å; R71-A92 PolarHBondContact NH1-O 3.32Å; R71-T94 PolarHBondContact NH2-O 2.79Å
72	L	93.3	Very high	94.7	Very high	124 Å²	124	56.1 Å²	56.1	65%	0.649	30%	0.296	S	S	*	.	H	α-helix	trans	-62.7	-46.5	179.5	-177	64.6	0	0	0	111.6	H70 S75 A76	H70-L72 PolarHBondContact O-N 2.96Å; L72-S75 PolarHBondContact O-N 2.77Å; L72-A76 VanDerWaalsContact O-CB 3.29Å; L72-A76 WeakPolarHBondContact O-CB 3.39Å; L72-A76 PolarHBondContact O-N 2.87Å
73	V	95.3	Very high	94.6	Very high	9 Å²	9	59.5 Å²	59.5	6%	0.055	32%	0.32	C	S	.	.	H	α-helix	trans	-67.3	-47.5	-178.9	-178.3	0	0	0	0	110.6	M46 H70 S75 A76 Q77 I114 Y115	M46-V73 HydrophobicContact CE-CG1 4.11Å; M46-V73 HydrophobicContact SD-CG1 4.46Å; H70-V73 HydrophobicContact CB-CB 4.1Å; H70-V73 HydrophobicContact CB-CG2 3.82Å; H70-V73 PolarHBondContact O-N 2.78Å; V73-S75 PolarHBondContact O-N 3.01Å; V73-A76 PolarHBondContact O-N 2.95Å; V73-Q77 PolarHBondContact O-N 3.07Å; V73-I114 HydrophobicContact CG1-CG2 3.84Å; V73-Y115 HydrophobicContact CB-CE1 4.14Å; V73-Y115 HydrophobicContact CG1-CD1 4.08Å; V73-Y115 HydrophobicContact CG1-CD2 4.39Å; V73-Y115 HydrophobicContact CG1-CE1 3.78Å; V73-Y115 HydrophobicContact CG1-CE2 4.1Å; V73-Y115 HydrophobicContact CG1-CG 4.39Å; V73-Y115 HydrophobicContact CG2-CE1 4.18Å
74	L	95.8	Very high	94.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.2	-46.8	175.3	-70.7	176.3	0	0	0	111.6	V58 L69 H70 A76 Q77 S78 F81 F85 I114	V58-L74 HydrophobicContact CG1-CD1 4.09Å; L69-L74 HydrophobicContact CB-CD1 3.95Å; L69-L74 HydrophobicContact CB-CG 4.45Å; L69-L74 HydrophobicContact CD1-CD1 4.06Å; L69-L74 HydrophobicContact CD1-CD2 4.28Å; H70-L74 WeakPolarHBondContact O-CG 3.4Å; H70-L74 PolarHBondContact O-N 2.82Å; L74-A76 VanDerWaalsContact C-N 3.32Å; L74-A76 PolarHBondContact O-N 2.83Å; L74-Q77 PolarHBondContact O-N 3.47Å; L74-S78 WeakPolarHBondContact O-CB 3.48Å; L74-S78 PolarHBondContact O-N 3.37Å; L74-F81 HydrophobicContact CB-CB 3.94Å; L74-F81 HydrophobicContact CB-CD2 4.24Å; L74-F81 HydrophobicContact CB-CG 4.09Å; L74-F81 HydrophobicContact CD1-CD1 4.49Å; L74-F81 HydrophobicContact CD2-CD2 4.14Å; L74-F81 HydrophobicContact CD2-CE2 4.27Å; L74-F85 HydrophobicContact CB-CE2 3.93Å; L74-F85 HydrophobicContact CD1-CE2 3.96Å; L74-F85 HydrophobicContact CD1-CZ 3.97Å; L74-I114 HydrophobicContact CD2-CD1 3.77Å; L74-I114 HydrophobicContact CD2-CG2 4.31Å
75	S	95.6	Very high	94.8	Very high	17 Å²	17	51.8 Å²	51.8	12%	0.119	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-33.8	178.7	-59.6	0	0	0	0	112.9	R71 L72 V73 Q77 R82 F85	R71-S75 WeakPolarHBondContact O-CB 3.49Å; R71-S75 PolarHBondContact O-N 2.91Å; R71-S75 PolarHBondContact O-OG 2.97Å; L72-S75 PolarHBondContact O-N 2.77Å; V73-S75 PolarHBondContact O-N 3.01Å; S75-Q77 VanDerWaalsContact C-N 3.34Å; S75-R82 VanDerWaalsContact O-CZ 3.23Å; S75-R82 PolarHBondContact O-NE 2.84Å; S75-R82 PolarHBondContact O-NH2 3.21Å; S75-F85 WeakPolarHBondContact OG-CD2 3.44Å
76	A	94.1	Very high	94.6	Very high	57 Å²	57	49.5 Å²	49.5	47%	0.471	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-41.5	179.9	0	0	0	0	0	110.9	L72 V73 L74 R82	L72-A76 VanDerWaalsContact O-CB 3.29Å; L72-A76 WeakPolarHBondContact O-CB 3.39Å; L72-A76 PolarHBondContact O-N 2.87Å; V73-A76 PolarHBondContact O-N 2.95Å; L74-A76 VanDerWaalsContact C-N 3.32Å; L74-A76 PolarHBondContact O-N 2.83Å; A76-R82 PolarHBondContact O-NH2 3.12Å; A76-R82 VanDerWaalsContact O-NH2 3.08Å
77	Q	95.1	Very high	94.2	Very high	94 Å²	94	46.6 Å²	46.6	44%	0.439	25%	0.253	S	S	.	.	H	α-helix	trans	-93.5	-25.5	-175.5	-63.1	-57	-32.6	0	0	114.7	V73 L74 S75 I114 L138	V73-Q77 PolarHBondContact O-N 3.07Å; L74-Q77 PolarHBondContact O-N 3.47Å; S75-Q77 VanDerWaalsContact C-N 3.34Å; Q77-I114 HydrophobicContact CB-CG1 4.19Å; Q77-I114 HydrophobicContact CB-CG2 4.12Å; Q77-I114 HydrophobicContact CG-CG2 4.09Å; Q77-L138 HydrophobicContact CB-CD2 4.37Å
78	S	96.9	Very high	93.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.29	C	S	.	.			trans	-125.6	121	-176.7	162.5	0	0	0	0	111.2	L74 F80 F81 R82 Y136	L74-S78 WeakPolarHBondContact O-CB 3.48Å; L74-S78 PolarHBondContact O-N 3.37Å; S78-F80 VanDerWaalsContact C-N 3.28Å; S78-F80 PolarHBondContact O-N 2.81Å; S78-F80 PolarHBondContact OG-N 2.81Å; S78-F81 PolarHBondContact O-N 3.16Å; S78-F81 WeakPolarHBondContact OG-CD2 3.49Å; S78-F81 PolarHBondContact OG-N 2.79Å; S78-F81 VanDerWaalsContact OG-N 3.1Å; S78-R82 WeakPolarHBondContact O-CB 3.47Å; S78-R82 PolarHBondContact O-N 3.02Å; S78-Y136 WeakPolarHBondContact CB-O 2.97Å; S78-Y136 PolarHBondContact OG-O 3.12Å
79	S	95.3	Very high	92.6	Very high	44 Å²	44	53.5 Å²	53.5	31%	0.308	29%	0.289	S	S	.	.	H	α-helix	trans	-70.6	-24.6	174	42.5	0	0	0	0	112.9	S83 Q137	S79-S83 VanDerWaalsContact O-CB 3.29Å; S79-S83 WeakPolarHBondContact O-CB 3.47Å; S79-S83 PolarHBondContact O-N 3.22Å; S79-S83 PolarHBondContact O-OG 2.8Å; S79-Q137 WeakPolarHBondContact OG-CB 3.1Å; S79-Q137 PolarHBondContact OG-OE1 3.14Å
80	F	94.7	Very high	91.6	Very high	57 Å²	57	62.4 Å²	62.4	25%	0.25	32%	0.323	C	S	.	.	H	α-helix	trans	-61.1	-54.9	169.6	171.8	-89.9	0	0	0	110.8	S78 R82 S83 M84 Y136 Q137	S78-F80 VanDerWaalsContact C-N 3.28Å; S78-F80 PolarHBondContact O-N 2.81Å; S78-F80 PolarHBondContact OG-N 2.81Å; F80-R82 VanDerWaalsContact C-N 3.33Å; F80-R82 PolarHBondContact O-N 2.8Å; F80-S83 PolarHBondContact O-N 3.24Å; F80-M84 HydrophobicContact CD1-CE 4.35Å; F80-M84 HydrophobicContact CE1-CE 3.32Å; F80-M84 HydrophobicContact CE1-SD 4.48Å; F80-M84 HydrophobicContact CE2-CE 4.43Å; F80-M84 HydrophobicContact CZ-CE 3.37Å; F80-M84 WeakPolarHBondContact O-CB 3.49Å; F80-M84 PolarHBondContact O-N 2.86Å; F80-Y136 WeakPolarHBondContact CB-O 3.12Å; F80-Y136 AromaticContact CD1-CD1 3.55Å; F80-Y136 HydrophobicContact CD1-CD1 3.55Å; F80-Y136 HydrophobicContact CD1-CE1 4.15Å; F80-Y136 AromaticContact CE1-CD1 3.6Å; F80-Y136 HydrophobicContact CE1-CD1 3.6Å; F80-Y136 AromaticContact CE1-CE1 3.7Å; F80-Y136 HydrophobicContact CE1-CE1 3.7Å; F80-Y136 HydrophobicContact CG-CD1 4.2Å; F80-Y136 HydrophobicContact CZ-CD1 4.29Å; F80-Y136 HydrophobicContact CZ-CE1 4.17Å; F80-Q137 HydrophobicContact CB-CB 4.35Å; F80-Q137 HydrophobicContact CB-CG 4.24Å
81	F	94.8	Very high	90.7	Very high	3 Å²	3	65.6 Å²	65.6	1%	0.013	34%	0.337	C	S	.	.	H	α-helix	trans	-65.8	-38.2	179.8	-76.1	-60.5	0	0	0	111.7	L74 S78 S83 M84 F85 L99 F107 Y136	L74-F81 HydrophobicContact CB-CB 3.94Å; L74-F81 HydrophobicContact CB-CD2 4.24Å; L74-F81 HydrophobicContact CB-CG 4.09Å; L74-F81 HydrophobicContact CD1-CD1 4.49Å; L74-F81 HydrophobicContact CD2-CD2 4.14Å; L74-F81 HydrophobicContact CD2-CE2 4.27Å; S78-F81 PolarHBondContact O-N 3.16Å; S78-F81 WeakPolarHBondContact OG-CD2 3.49Å; S78-F81 PolarHBondContact OG-N 2.79Å; S78-F81 VanDerWaalsContact OG-N 3.1Å; F81-S83 PolarHBondContact O-N 2.83Å; F81-M84 HydrophobicContact CD1-SD 4.32Å; F81-M84 PolarHBondContact O-N 2.93Å; F81-F85 HydrophobicContact CB-CD2 4.21Å; F81-F85 HydrophobicContact CB-CE2 3.82Å; F81-F85 HydrophobicContact CD1-CE2 4.16Å; F81-F85 HydrophobicContact CD1-CZ 4.09Å; F81-F85 HydrophobicContact CG-CE2 4.33Å; F81-F85 WeakPolarHBondContact O-CB 3.43Å; F81-F85 WeakPolarHBondContact O-CD2 3.48Å; F81-F85 VanDerWaalsContact O-CG 3.25Å; F81-F85 WeakPolarHBondContact O-CG 3.48Å; F81-F85 PolarHBondContact O-N 2.89Å; F81-L99 HydrophobicContact CE1-CD1 4.34Å; F81-L99 HydrophobicContact CZ-CD1 4.15Å; F81-F107 HydrophobicContact CZ-CE2 4.12Å; F81-F107 HydrophobicContact CZ-CZ 4.41Å; F81-Y136 AromaticContact CE2-CD1 3.83Å; F81-Y136 HydrophobicContact CE2-CD1 3.83Å; F81-Y136 HydrophobicContact CE2-CE1 4.49Å; F81-Y136 HydrophobicContact CE2-CG 4.37Å; F81-Y136 AromaticContact CZ-CD1 3.74Å; F81-Y136 HydrophobicContact CZ-CD1 3.74Å; F81-Y136 AromaticContact CZ-CE1 3.95Å; F81-Y136 HydrophobicContact CZ-CE1 3.95Å
82	R	95.1	Very high	89.9	Confident	121 Å²	121	64.3 Å²	64.3	46%	0.457	34%	0.336	S	S	.	.	H	α-helix	trans	-54.4	-53.4	172	-170.9	-179.5	-57.1	173.7	5.3	110.8	S75 A76 S78 F80 M84 F85 T86	S75-R82 VanDerWaalsContact O-CZ 3.23Å; S75-R82 PolarHBondContact O-NE 2.84Å; S75-R82 PolarHBondContact O-NH2 3.21Å; A76-R82 PolarHBondContact O-NH2 3.12Å; A76-R82 VanDerWaalsContact O-NH2 3.08Å; S78-R82 WeakPolarHBondContact O-CB 3.47Å; S78-R82 PolarHBondContact O-N 3.02Å; F80-R82 VanDerWaalsContact C-N 3.33Å; F80-R82 PolarHBondContact O-N 2.8Å; R82-M84 VanDerWaalsContact C-N 3.34Å; R82-M84 PolarHBondContact O-N 3.08Å; R82-F85 PolarHBondContact O-N 2.81Å; R82-T86 WeakPolarHBondContact O-CG2 3.16Å; R82-T86 PolarHBondContact O-N 2.75Å; R82-T86 PolarHBondContact O-OG1 3.24Å
83	S	93.6	Very high	89.2	Confident	71 Å²	71	65.5 Å²	65.5	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-61.3	-43	-179.7	-58.9	0	0	0	0	111.5	S79 F80 F81 F85 T86 S87	S79-S83 VanDerWaalsContact O-CB 3.29Å; S79-S83 WeakPolarHBondContact O-CB 3.47Å; S79-S83 PolarHBondContact O-N 3.22Å; S79-S83 PolarHBondContact O-OG 2.8Å; F80-S83 PolarHBondContact O-N 3.24Å; F81-S83 PolarHBondContact O-N 2.83Å; S83-F85 PolarHBondContact O-N 2.89Å; S83-T86 PolarHBondContact O-N 2.96Å; S83-S87 VanDerWaalsContact O-CB 3.25Å; S83-S87 WeakPolarHBondContact O-CB 3.36Å; S83-S87 PolarHBondContact O-N 2.75Å
84	M	91.6	Very high	88.7	Confident	33 Å²	33	67.2 Å²	67.2	16%	0.163	35%	0.348	C	S	.	.	H	α-helix	trans	-57.8	-48.5	176.2	-178.7	-177.1	-74.2	0	0	111.5	F80 F81 R82 S87 E91 A92 I97 L99	F80-M84 HydrophobicContact CD1-CE 4.35Å; F80-M84 HydrophobicContact CE1-CE 3.32Å; F80-M84 HydrophobicContact CE1-SD 4.48Å; F80-M84 HydrophobicContact CE2-CE 4.43Å; F80-M84 HydrophobicContact CZ-CE 3.37Å; F80-M84 WeakPolarHBondContact O-CB 3.49Å; F80-M84 PolarHBondContact O-N 2.86Å; F81-M84 HydrophobicContact CD1-SD 4.32Å; F81-M84 PolarHBondContact O-N 2.93Å; R82-M84 VanDerWaalsContact C-N 3.34Å; R82-M84 PolarHBondContact O-N 3.08Å; M84-S87 PolarHBondContact O-N 3.19Å; M84-S87 PolarHBondContact O-OG 2.99Å; M84-E91 HydrophobicContact CG-CB 3.94Å; M84-E91 HydrophobicContact SD-CB 4.33Å; M84-A92 WeakPolarHBondContact O-CB 3.32Å; M84-I97 HydrophobicContact SD-CD1 3.89Å; M84-I97 HydrophobicContact SD-CG2 4.16Å; M84-L99 HydrophobicContact CE-CD2 4.34Å
85	F	92.4	Very high	88.3	Confident	23 Å²	23	75.2 Å²	75.2	10%	0.101	38%	0.379	C	S	.	.	H	α-helix	trans	-78	-23.1	-175.7	-61.3	-40.9	0	0	0	114.6	V58 R71 L74 S75 F81 R82 S83 I97	V58-F85 HydrophobicContact CG1-CZ 4.24Å; V58-F85 HydrophobicContact CG2-CE1 4.12Å; V58-F85 HydrophobicContact CG2-CZ 4.22Å; R71-F85 HydrophobicContact CB-CD2 3.97Å; R71-F85 HydrophobicContact CB-CE2 4.1Å; R71-F85 HydrophobicContact CB-CG 4.38Å; R71-F85 HydrophobicContact CG-CD1 4.21Å; R71-F85 HydrophobicContact CG-CD2 4.08Å; R71-F85 HydrophobicContact CG-CE1 4.09Å; R71-F85 HydrophobicContact CG-CE2 4.01Å; R71-F85 HydrophobicContact CG-CG 4.18Å; R71-F85 HydrophobicContact CG-CZ 4.01Å; L74-F85 HydrophobicContact CB-CE2 3.93Å; L74-F85 HydrophobicContact CD1-CE2 3.96Å; L74-F85 HydrophobicContact CD1-CZ 3.97Å; S75-F85 WeakPolarHBondContact OG-CD2 3.44Å; F81-F85 HydrophobicContact CB-CD2 4.21Å; F81-F85 HydrophobicContact CB-CE2 3.82Å; F81-F85 HydrophobicContact CD1-CE2 4.16Å; F81-F85 HydrophobicContact CD1-CZ 4.09Å; F81-F85 HydrophobicContact CG-CE2 4.33Å; F81-F85 WeakPolarHBondContact O-CB 3.43Å; F81-F85 WeakPolarHBondContact O-CD2 3.48Å; F81-F85 VanDerWaalsContact O-CG 3.25Å; F81-F85 WeakPolarHBondContact O-CG 3.48Å; F81-F85 PolarHBondContact O-N 2.89Å; R82-F85 PolarHBondContact O-N 2.81Å; S83-F85 PolarHBondContact O-N 2.89Å; F85-I97 HydrophobicContact CD1-CD1 4.29Å; F85-I97 HydrophobicContact CE1-CD1 3.46Å; F85-I97 VanDerWaalsContact CE1-CD1 3.46Å; F85-I97 HydrophobicContact CZ-CD1 4.31Å
86	T	90.4	Very high	88.2	Confident	107 Å²	107	76.9 Å²	76.9	66%	0.656	39%	0.39	S	S	*	.	H	α-helix	trans	-96.6	1	175.2	62.7	0	0	0	0	113.4	R82 S83	R82-T86 WeakPolarHBondContact O-CG2 3.16Å; R82-T86 PolarHBondContact O-N 2.75Å; R82-T86 PolarHBondContact O-OG1 3.24Å; S83-T86 PolarHBondContact O-N 2.96Å
87	S	87.1	Confident	88.1	Confident	29 Å²	29	74.6 Å²	74.6	20%	0.203	37%	0.37	C	S	.	.	S	Bend	trans	-77.1	165.2	178.3	72.1	0	0	0	0	112.4	S83 M84 L89 A92	S83-S87 VanDerWaalsContact O-CB 3.25Å; S83-S87 WeakPolarHBondContact O-CB 3.36Å; S83-S87 PolarHBondContact O-N 2.75Å; M84-S87 PolarHBondContact O-N 3.19Å; M84-S87 PolarHBondContact O-OG 2.99Å; S87-L89 PolarHBondContact O-N 2.87Å; S87-L89 WeakPolarHBondContact OG-CB 3.28Å; S87-L89 PolarHBondContact OG-N 2.74Å; S87-A92 WeakPolarHBondContact O-CB 3.29Å
88	N	77.6	Confident	87.9	Confident	162 Å²	162	77 Å²	77	87%	0.866	38%	0.381	S	S	*	.	S	Bend	trans	-84.7	14.8	170.6	-67.6	-29	0	0	0	112.9
89	L	81.1	Confident	87.6	Confident	110 Å²	110	77.9 Å²	77.9	58%	0.576	39%	0.386	S	S	*	.	S	Bend	trans	-83.7	169.9	-178.6	-58.4	176.4	0	0	0	111.6	S87 E91 A92 H93	S87-L89 PolarHBondContact O-N 2.87Å; S87-L89 WeakPolarHBondContact OG-CB 3.28Å; S87-L89 PolarHBondContact OG-N 2.74Å; L89-E91 VanDerWaalsContact C-N 3.27Å; L89-E91 WeakPolarHBondContact CB-OE2 3.44Å; L89-E91 PolarHBondContact O-N 3.37Å; L89-A92 WeakPolarHBondContact O-CB 3.35Å; L89-A92 PolarHBondContact O-N 3.18Å; L89-H93 PolarHBondContact O-ND1 3.1Å
90	R	75.2	Confident	87.2	Confident	196 Å²	196	83 Å²	83	74%	0.74	40%	0.403	S	S	*	.	H	α-helix	trans	-63.2	-36.8	-176.5	180	178.6	174.3	-175.3	-1	111.6	A92 H93 T94	R90-A92 VanDerWaalsContact C-N 3.26Å; R90-A92 PolarHBondContact O-N 3.08Å; R90-H93 PolarHBondContact O-N 3.22Å; R90-H93 VanDerWaalsContact O-N 3.11Å; R90-T94 WeakPolarHBondContact O-CB 3.32Å; R90-T94 PolarHBondContact O-N 3.35Å; R90-T94 PolarHBondContact O-OG1 2.87Å
91	E	76.7	Confident	86.8	Confident	79 Å²	79	87.4 Å²	87.4	37%	0.369	43%	0.429	S	S	.	.	H	α-helix	trans	-62.2	-33.6	-178.5	-65.3	76	-169.8	0	0	111.6	M84 L89 H93 I97	M84-E91 HydrophobicContact CG-CB 3.94Å; M84-E91 HydrophobicContact SD-CB 4.33Å; L89-E91 VanDerWaalsContact C-N 3.27Å; L89-E91 WeakPolarHBondContact CB-OE2 3.44Å; L89-E91 PolarHBondContact O-N 3.37Å; E91-H93 VanDerWaalsContact C-N 3.26Å; E91-H93 PolarHBondContact O-N 2.85Å; E91-I97 HydrophobicContact CB-CD1 4.39Å
92	A	76.6	Confident	86.7	Confident	15 Å²	15	87.7 Å²	87.7	12%	0.124	43%	0.431	C	S	.	.	H	α-helix	trans	-61.5	-36.2	175.3	0	0	0	0	0	112.1	R71 M84 S87 L89 R90	R71-A92 PolarHBondContact NH1-O 3.32Å; M84-A92 WeakPolarHBondContact O-CB 3.32Å; S87-A92 WeakPolarHBondContact O-CB 3.29Å; L89-A92 WeakPolarHBondContact O-CB 3.35Å; L89-A92 PolarHBondContact O-N 3.18Å; R90-A92 VanDerWaalsContact C-N 3.26Å; R90-A92 PolarHBondContact O-N 3.08Å
93	H	77.7	Confident	86.6	Confident	148 Å²	148	83.4 Å²	83.4	69%	0.685	42%	0.419	S	S	*	.	H	α-helix	trans	-100.2	-8.3	-172.8	-57.1	87.7	0	0	0	113.7	L89 R90 E91	L89-H93 PolarHBondContact O-ND1 3.1Å; R90-H93 PolarHBondContact O-N 3.22Å; R90-H93 VanDerWaalsContact O-N 3.11Å; E91-H93 VanDerWaalsContact C-N 3.26Å; E91-H93 PolarHBondContact O-N 2.85Å
94	T	86.3	Confident	86.6	Confident	46 Å²	46	80.2 Å²	80.2	28%	0.282	40%	0.397	S	S	.	.			trans	-100.7	132.7	-176	-51.5	0	0	0	0	110.7	R71 R90 S96	R71-T94 PolarHBondContact NH2-O 2.79Å; R90-T94 WeakPolarHBondContact O-CB 3.32Å; R90-T94 PolarHBondContact O-N 3.35Å; R90-T94 PolarHBondContact O-OG1 2.87Å; T94-S96 VanDerWaalsContact C-N 3.29Å; T94-S96 WeakPolarHBondContact CG2-O 3.37Å; T94-S96 PolarHBondContact O-N 2.94Å
95	R	87.6	Confident	86.7	Confident	168 Å²	168	81.6 Å²	81.6	63%	0.634	41%	0.41	S	S	*	.	S	Bend	trans	-68.8	-24.4	178.6	-169.4	170.5	-175.3	154.9	3.3	113.7	A56 V58 T59	A56-R95 PolarHBondContact O-NH2 3.48Å; V58-R95 CarbonylContact C-O 3.5Å; V58-R95 WeakPolarHBondContact CA-O 3.34Å; T59-R95 PolarHBondContact N-O 2.78Å
96	S	91.6	Very high	86.7	Confident	52 Å²	52	80.5 Å²	80.5	36%	0.364	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130	178.8	-175.3	0	0	0	0	111.3	T59 K61 T94	T59-S96 CarbonylContact O-C 3.59Å; T59-S96 VanDerWaalsContact O-CA 3.28Å; T59-S96 WeakPolarHBondContact O-CA 3.46Å; K61-S96 VanDerWaalsContact CE-OG 3.28Å; K61-S96 WeakPolarHBondContact CE-OG 3.44Å; T94-S96 VanDerWaalsContact C-N 3.29Å; T94-S96 WeakPolarHBondContact CG2-O 3.37Å; T94-S96 PolarHBondContact O-N 2.94Å
97	I	92.7	Very high	87	Confident	8 Å²	8	75.5 Å²	75.5	4%	0.041	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.7	-177.9	-62.1	173.4	0	0	0	108.3	V58 T59 V60 K61 M84 F85 E91 L99	V58-I97 HydrophobicContact CG2-CD1 3.86Å; V58-I97 HydrophobicContact CG2-CG1 4.31Å; T59-I97 PolarHBondContact O-N 2.92Å; V60-I97 CarbonylContact C-O 3.5Å; V60-I97 WeakPolarHBondContact CA-O 3.31Å; K61-I97 PolarHBondContact N-O 2.91Å; M84-I97 HydrophobicContact SD-CD1 3.89Å; M84-I97 HydrophobicContact SD-CG2 4.16Å; F85-I97 HydrophobicContact CD1-CD1 4.29Å; F85-I97 HydrophobicContact CE1-CD1 3.46Å; F85-I97 VanDerWaalsContact CE1-CD1 3.46Å; F85-I97 HydrophobicContact CZ-CD1 4.31Å; E91-I97 HydrophobicContact CB-CD1 4.39Å; I97-L99 HydrophobicContact CG2-CD2 4.17Å
98	Q	91.7	Very high	87.3	Confident	146 Å²	146	77.6 Å²	77.6	68%	0.682	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.1	176.8	-174.1	173.5	12.6	0	0	109.2
99	L	91.1	Very high	88.2	Confident	18 Å²	18	70.8 Å²	70.8	9%	0.094	34%	0.344	C	S	.	.			trans	-96.2	140.8	172.5	-56.7	175.6	0	0	0	108.8	V60 K61 V62 F81 M84 I97 V102 F107 Y136	V60-L99 HydrophobicContact CG1-CD1 3.45Å; V60-L99 VanDerWaalsContact CG1-CD1 3.45Å; V60-L99 HydrophobicContact CG1-CG 3.72Å; K61-L99 PolarHBondContact O-N 2.74Å; V62-L99 HydrophobicContact CG2-CB 4.22Å; V62-L99 HydrophobicContact CG2-CD1 4.45Å; F81-L99 HydrophobicContact CE1-CD1 4.34Å; F81-L99 HydrophobicContact CZ-CD1 4.15Å; M84-L99 HydrophobicContact CE-CD2 4.34Å; I97-L99 HydrophobicContact CG2-CD2 4.17Å; L99-V102 HydrophobicContact CB-CG1 4.13Å; L99-F107 HydrophobicContact CD1-CD2 4.18Å; L99-F107 HydrophobicContact CD1-CE2 3.52Å; L99-F107 HydrophobicContact CD1-CZ 3.99Å; L99-Y136 HydrophobicContact CD1-CE1 3.86Å; L99-Y136 HydrophobicContact CD2-CE1 4.48Å
100	K	86.7	Confident	88.9	Confident	152 Å²	152	65.6 Å²	65.6	66%	0.661	32%	0.317	S	S	*	.			trans	-111.8	160.8	175.8	-61.3	-179.5	-177.9	178.1	0	107.8	V102	K100-V102 VanDerWaalsContact C-N 3.26Å; K100-V102 PolarHBondContact O-N 2.96Å
101	D	86.3	Confident	89.8	Confident	148 Å²	148	56.8 Å²	56.8	79%	0.791	29%	0.285	S	S	*	.	S	Bend	trans	64.5	26.3	171.5	-43.7	-45.6	0	0	0	114.9
102	V	91.8	Very high	90.6	Very high	10 Å²	10	55.4 Å²	55.4	6%	0.061	28%	0.28	C	S	.	.			trans	-136.1	136.9	168.7	62.4	0	0	0	0	109.4	V62 L99 K100 V106 F107 M132 Y136	V62-V102 HydrophobicContact CG1-CG1 3.73Å; V62-V102 WeakPolarHBondContact CG1-O 3.48Å; V62-V102 HydrophobicContact CG2-CG1 4.29Å; L99-V102 HydrophobicContact CB-CG1 4.13Å; K100-V102 VanDerWaalsContact C-N 3.26Å; K100-V102 PolarHBondContact O-N 2.96Å; V102-V106 HydrophobicContact CG2-CB 4.45Å; V102-V106 HydrophobicContact CG2-CG1 4.45Å; V102-F107 HydrophobicContact CG1-CD2 4.41Å; V102-F107 HydrophobicContact CG2-CB 4.08Å; V102-M132 HydrophobicContact CB-SD 3.75Å; V102-M132 HydrophobicContact CG2-CG 3.92Å; V102-M132 HydrophobicContact CG2-SD 3.68Å; V102-Y136 HydrophobicContact CB-CE2 4.49Å; V102-Y136 WeakPolarHBondContact CG1-OH 3.25Å; V102-Y136 HydrophobicContact CG2-CE2 4.36Å
103	S	92.4	Very high	91.5	Very high	31 Å²	31	56.6 Å²	56.6	22%	0.217	28%	0.282	C	S	.	.			trans	-75.7	148.9	176	68.8	0	0	0	0	111	E63 S105 V106 F107	E63-S103 VanDerWaalsContact OE2-CA 3.3Å; E63-S103 WeakPolarHBondContact OE2-CA 3.3Å; S103-S105 PolarHBondContact O-N 3.46Å; S103-S105 PolarHBondContact OG-OG 2.91Å; S103-V106 PolarHBondContact O-N 2.88Å; S103-V106 WeakPolarHBondContact OG-CB 3.48Å; S103-V106 WeakPolarHBondContact OG-CG2 3.29Å; S103-V106 PolarHBondContact OG-N 3.43Å; S103-F107 WeakPolarHBondContact O-CB 3.47Å; S103-F107 PolarHBondContact O-N 3.45Å
104	A	94.1	Very high	92.4	Very high	3 Å²	3	49.9 Å²	49.9	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-26.3	179.5	0	0	0	0	0	112.9	V62 E63 R65 Q108	V62-A104 HydrophobicContact CG1-CB 4.31Å; E63-A104 HydrophobicContact CB-CB 4.25Å; E63-A104 PolarHBondContact OE2-N 3.39Å; R65-A104 HydrophobicContact CB-CB 4.45Å; R65-A104 HydrophobicContact CG-CB 4.17Å; A104-Q108 WeakPolarHBondContact O-CB 3.49Å; A104-Q108 PolarHBondContact O-N 3.21Å; A104-Q108 VanDerWaalsContact O-N 3.12Å
105	S	93.1	Very high	92.7	Very high	62 Å²	62	48.3 Å²	48.3	43%	0.434	24%	0.24	S	C	.	.	H	α-helix	trans	-69.3	-49.3	174.2	49.1	0	0	0	0	111.6	S103 F107 Q108 L109	S103-S105 PolarHBondContact O-N 3.46Å; S103-S105 PolarHBondContact OG-OG 2.91Å; S105-F107 PolarHBondContact O-N 2.85Å; S105-Q108 WeakPolarHBondContact O-CB 3.46Å; S105-Q108 PolarHBondContact O-N 2.9Å; S105-L109 PolarHBondContact O-N 2.95Å; S105-L109 VanDerWaalsContact O-N 3.15Å
106	V	94.1	Very high	92.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-41.5	178.7	175.8	0	0	0	0	110.3	V102 S103 Q108 L109 L110 D128 M132	V102-V106 HydrophobicContact CG2-CB 4.45Å; V102-V106 HydrophobicContact CG2-CG1 4.45Å; S103-V106 PolarHBondContact O-N 2.88Å; S103-V106 WeakPolarHBondContact OG-CB 3.48Å; S103-V106 WeakPolarHBondContact OG-CG2 3.29Å; S103-V106 PolarHBondContact OG-N 3.43Å; V106-Q108 VanDerWaalsContact C-N 3.28Å; V106-Q108 PolarHBondContact O-N 2.95Å; V106-L109 WeakPolarHBondContact O-CB 3.29Å; V106-L109 PolarHBondContact O-N 2.79Å; V106-L110 WeakPolarHBondContact O-CG 3.22Å; V106-L110 PolarHBondContact O-N 3.18Å; V106-D128 HydrophobicContact CG1-CB 4.44Å; V106-D128 HydrophobicContact CG2-CB 3.7Å; V106-M132 HydrophobicContact CG1-CB 4.07Å; V106-M132 HydrophobicContact CG1-CG 3.77Å
107	F	95.6	Very high	92.8	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-61	-37.8	176	-168.2	-104.4	0	0	0	112.5	V60 V62 F67 L69 F81 L99 V102 S103 S105 L109 L110 V111	V60-F107 HydrophobicContact CB-CE1 4.18Å; V60-F107 HydrophobicContact CB-CZ 4.1Å; V60-F107 HydrophobicContact CG1-CE1 3.9Å; V60-F107 HydrophobicContact CG1-CE2 4.36Å; V60-F107 HydrophobicContact CG1-CZ 3.61Å; V60-F107 HydrophobicContact CG2-CZ 4.49Å; V62-F107 HydrophobicContact CG1-CB 4.24Å; V62-F107 HydrophobicContact CG2-CB 4.27Å; V62-F107 HydrophobicContact CG2-CD1 3.72Å; V62-F107 HydrophobicContact CG2-CD2 4.22Å; V62-F107 HydrophobicContact CG2-CE1 4.1Å; V62-F107 HydrophobicContact CG2-CG 3.79Å; F67-F107 HydrophobicContact CB-CE1 4.16Å; F67-F107 AromaticContact CD1-CD1 3.99Å; F67-F107 HydrophobicContact CD1-CD1 3.99Å; F67-F107 HydrophobicContact CD1-CE1 4.11Å; F67-F107 AromaticContact CD2-CD1 3.82Å; F67-F107 HydrophobicContact CD2-CD1 3.82Å; F67-F107 AromaticContact CD2-CE1 3.95Å; F67-F107 HydrophobicContact CD2-CE1 3.95Å; F67-F107 AromaticContact CE1-CD1 3.9Å; F67-F107 HydrophobicContact CE1-CD1 3.9Å; F67-F107 HydrophobicContact CE1-CE1 4.49Å; F67-F107 AromaticContact CE2-CD1 3.77Å; F67-F107 HydrophobicContact CE2-CD1 3.77Å; F67-F107 HydrophobicContact CE2-CE1 4.37Å; F67-F107 AromaticContact CG-CD1 3.94Å; F67-F107 HydrophobicContact CG-CD1 3.94Å; F67-F107 AromaticContact CG-CE1 3.82Å; F67-F107 HydrophobicContact CG-CE1 3.82Å; F67-F107 AromaticContact CZ-CD1 3.8Å; F67-F107 HydrophobicContact CZ-CD1 3.8Å; L69-F107 HydrophobicContact CD1-CE1 4.19Å; L69-F107 HydrophobicContact CD1-CZ 4.28Å; F81-F107 HydrophobicContact CZ-CE2 4.12Å; F81-F107 HydrophobicContact CZ-CZ 4.41Å; L99-F107 HydrophobicContact CD1-CD2 4.18Å; L99-F107 HydrophobicContact CD1-CE2 3.52Å; L99-F107 HydrophobicContact CD1-CZ 3.99Å; V102-F107 HydrophobicContact CG1-CD2 4.41Å; V102-F107 HydrophobicContact CG2-CB 4.08Å; S103-F107 WeakPolarHBondContact O-CB 3.47Å; S103-F107 PolarHBondContact O-N 3.45Å; S105-F107 PolarHBondContact O-N 2.85Å; F107-L109 VanDerWaalsContact C-N 3.34Å; F107-L109 PolarHBondContact O-N 2.94Å; F107-L110 HydrophobicContact CD2-CD1 4.46Å; F107-L110 PolarHBondContact O-N 2.83Å; F107-V111 HydrophobicContact CD1-CG2 4.04Å; F107-V111 HydrophobicContact CE1-CG2 3.69Å; F107-V111 HydrophobicContact CZ-CG2 4.11Å; F107-V111 WeakPolarHBondContact O-CG2 3.15Å; F107-V111 PolarHBondContact O-N 2.85Å
108	Q	94.7	Very high	92.6	Very high	72 Å²	72	49.7 Å²	49.7	34%	0.336	27%	0.269	S	S	.	.	H	α-helix	trans	-60.4	-42.7	172.7	-176.7	67.5	61.4	0	0	111.4	F67 A104 S105 V106 L110 V111 D112	F67-Q108 HydrophobicContact CE1-CB 4.24Å; F67-Q108 VanDerWaalsContact CE1-OE1 3.3Å; A104-Q108 WeakPolarHBondContact O-CB 3.49Å; A104-Q108 PolarHBondContact O-N 3.21Å; A104-Q108 VanDerWaalsContact O-N 3.12Å; S105-Q108 WeakPolarHBondContact O-CB 3.46Å; S105-Q108 PolarHBondContact O-N 2.9Å; V106-Q108 VanDerWaalsContact C-N 3.28Å; V106-Q108 PolarHBondContact O-N 2.95Å; Q108-L110 VanDerWaalsContact C-N 3.32Å; Q108-L110 PolarHBondContact O-N 2.85Å; Q108-V111 PolarHBondContact O-N 3.46Å; Q108-D112 PolarHBondContact NE2-OD1 3.22Å; Q108-D112 WeakPolarHBondContact O-CB 3.33Å; Q108-D112 PolarHBondContact O-N 2.81Å
109	L	95	Very high	92.6	Very high	19 Å²	19	44.8 Å²	44.8	10%	0.099	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-39.6	176.5	-65.8	170.7	0	0	0	112.2	S105 V106 F107 D112 Y113 V119 L121 E125	S105-L109 PolarHBondContact O-N 2.95Å; S105-L109 VanDerWaalsContact O-N 3.15Å; V106-L109 WeakPolarHBondContact O-CB 3.29Å; V106-L109 PolarHBondContact O-N 2.79Å; F107-L109 VanDerWaalsContact C-N 3.34Å; F107-L109 PolarHBondContact O-N 2.94Å; L109-D112 PolarHBondContact O-N 3.11Å; L109-Y113 WeakPolarHBondContact O-CB 3.23Å; L109-Y113 PolarHBondContact O-N 3.28Å; L109-V119 HydrophobicContact CB-CG2 3.93Å; L109-V119 HydrophobicContact CD2-CG2 3.82Å; L109-V119 HydrophobicContact CG-CG2 4.41Å; L109-L121 HydrophobicContact CD1-CD2 3.89Å; L109-E125 HydrophobicContact CD1-CB 4.12Å; L109-E125 HydrophobicContact CD1-CG 4.27Å
110	L	95.8	Very high	92.4	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-42.5	175.1	-56.2	-176.9	0	0	0	111.7	V106 F107 Q108 Y113 I114 T129 M132 Y136 L138 L141	V106-L110 WeakPolarHBondContact O-CG 3.22Å; V106-L110 PolarHBondContact O-N 3.18Å; F107-L110 HydrophobicContact CD2-CD1 4.46Å; F107-L110 PolarHBondContact O-N 2.83Å; Q108-L110 VanDerWaalsContact C-N 3.32Å; Q108-L110 PolarHBondContact O-N 2.85Å; L110-Y113 PolarHBondContact O-N 2.86Å; L110-I114 WeakPolarHBondContact O-CB 3.42Å; L110-I114 WeakPolarHBondContact O-CD1 3.1Å; L110-I114 WeakPolarHBondContact O-CG1 2.85Å; L110-I114 PolarHBondContact O-N 3.06Å; L110-T129 HydrophobicContact CD2-CG2 4.28Å; L110-M132 HydrophobicContact CD1-CB 3.92Å; L110-Y136 HydrophobicContact CD1-CD2 3.41Å; L110-Y136 VanDerWaalsContact CD1-CD2 3.41Å; L110-Y136 HydrophobicContact CD1-CE2 3.89Å; L110-Y136 HydrophobicContact CD1-CG 4.26Å; L110-L138 HydrophobicContact CB-CD1 4.1Å; L110-L138 HydrophobicContact CD1-CD1 4.44Å; L110-L138 HydrophobicContact CD2-CD1 3.92Å; L110-L138 HydrophobicContact CG-CD1 4.36Å; L110-L141 HydrophobicContact CD2-CD2 3.72Å
111	V	94.8	Very high	92.5	Very high	11 Å²	11	48.9 Å²	48.9	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-45.3	175.6	170.7	0	0	0	0	110.2	F67 L69 F107 Q108 Y113 I114 Y115	F67-V111 HydrophobicContact CD1-CG2 4.44Å; L69-V111 HydrophobicContact CD1-CG2 4.03Å; L69-V111 HydrophobicContact CD2-CG1 3.74Å; L69-V111 HydrophobicContact CD2-CG2 4.21Å; F107-V111 HydrophobicContact CD1-CG2 4.04Å; F107-V111 HydrophobicContact CE1-CG2 3.69Å; F107-V111 HydrophobicContact CZ-CG2 4.11Å; F107-V111 WeakPolarHBondContact O-CG2 3.15Å; F107-V111 PolarHBondContact O-N 2.85Å; Q108-V111 PolarHBondContact O-N 3.46Å; V111-Y113 VanDerWaalsContact C-N 3.29Å; V111-Y113 PolarHBondContact O-N 2.87Å; V111-I114 PolarHBondContact O-N 3.01Å; V111-I114 VanDerWaalsContact O-N 3.15Å; V111-Y115 HydrophobicContact CG1-CD2 3.95Å; V111-Y115 HydrophobicContact CG1-CE2 4.2Å; V111-Y115 WeakPolarHBondContact O-CD2 3.45Å; V111-Y115 PolarHBondContact O-N 3.03Å
112	D	93.5	Very high	92.5	Very high	50 Å²	50	45.3 Å²	45.3	27%	0.267	25%	0.252	S	S	.	.	H	α-helix	trans	-59.2	-43.9	178.1	-69.6	-13.3	0	0	0	110.7	Q108 L109 H116	Q108-D112 PolarHBondContact NE2-OD1 3.22Å; Q108-D112 WeakPolarHBondContact O-CB 3.33Å; Q108-D112 PolarHBondContact O-N 2.81Å; L109-D112 PolarHBondContact O-N 3.11Å; D112-H116 WeakPolarHBondContact O-CA 3.41Å; D112-H116 VanDerWaalsContact O-CB 3.24Å; D112-H116 WeakPolarHBondContact O-CB 3.44Å; D112-H116 PolarHBondContact O-N 3.38Å; D112-H116 PolarHBondContact O-ND1 3.4Å
113	Y	95.9	Very high	92.1	Very high	39 Å²	39	50.7 Å²	50.7	15%	0.153	28%	0.284	C	S	.	.	H	α-helix	trans	-60.7	-48.4	172.9	171.7	-102.4	0	0	0	112.5	L109 L110 V111 Y115 G117 L138 A140 L141	L109-Y113 WeakPolarHBondContact O-CB 3.23Å; L109-Y113 PolarHBondContact O-N 3.28Å; L110-Y113 PolarHBondContact O-N 2.86Å; V111-Y113 VanDerWaalsContact C-N 3.29Å; V111-Y113 PolarHBondContact O-N 2.87Å; Y113-Y115 VanDerWaalsContact C-N 3.27Å; Y113-Y115 PolarHBondContact O-N 2.75Å; Y113-G117 WeakPolarHBondContact O-CA 3.34Å; Y113-G117 PolarHBondContact O-N 2.95Å; Y113-L138 HydrophobicContact CD1-CD1 4.31Å; Y113-L138 HydrophobicContact CD1-CD2 4.35Å; Y113-L138 HydrophobicContact CE1-CB 4.34Å; Y113-L138 HydrophobicContact CE1-CD2 4.18Å; Y113-A140 WeakPolarHBondContact OH-CB 3.41Å; Y113-L141 HydrophobicContact CD1-CB 4.05Å; Y113-L141 HydrophobicContact CD1-CD2 3.9Å; Y113-L141 HydrophobicContact CD2-CB 4.37Å; Y113-L141 HydrophobicContact CD2-CD1 4.29Å; Y113-L141 HydrophobicContact CE1-CB 3.78Å; Y113-L141 HydrophobicContact CE1-CD2 4.47Å; Y113-L141 HydrophobicContact CE2-CB 4.11Å; Y113-L141 HydrophobicContact CG-CB 4.34Å; Y113-L141 HydrophobicContact CG-CD1 4.49Å; Y113-L141 HydrophobicContact CG-CD2 3.94Å; Y113-L141 HydrophobicContact CG-CG 4.5Å
114	I	95.3	Very high	91.7	Very high	7 Å²	7	57.6 Å²	57.6	4%	0.036	31%	0.313	C	S	.	.	H	α-helix	trans	-59.9	-38	-177.5	-74	166.1	0	0	0	111.8	V73 L74 Q77 L110 V111 L138	V73-I114 HydrophobicContact CG1-CG2 3.84Å; L74-I114 HydrophobicContact CD2-CD1 3.77Å; L74-I114 HydrophobicContact CD2-CG2 4.31Å; Q77-I114 HydrophobicContact CB-CG1 4.19Å; Q77-I114 HydrophobicContact CB-CG2 4.12Å; Q77-I114 HydrophobicContact CG-CG2 4.09Å; L110-I114 WeakPolarHBondContact O-CB 3.42Å; L110-I114 WeakPolarHBondContact O-CD1 3.1Å; L110-I114 WeakPolarHBondContact O-CG1 2.85Å; L110-I114 PolarHBondContact O-N 3.06Å; V111-I114 PolarHBondContact O-N 3.01Å; V111-I114 VanDerWaalsContact O-N 3.15Å; I114-L138 HydrophobicContact CD1-CD1 4.29Å; I114-L138 HydrophobicContact CD1-CD2 4.02Å; I114-L138 HydrophobicContact CG1-CD1 4.37Å; I114-L138 HydrophobicContact CG1-CD2 3.76Å
115	Y	93.4	Very high	91.4	Very high	13 Å²	13	60 Å²	60	5%	0.051	32%	0.324	C	S	.	.	H	α-helix	trans	-93.7	-36.2	-175.2	-79.7	-96.1	0	0	0	113.9	M46 C49 L50 L69 H70 V73 V111 Y113	M46-Y115 HydrophobicContact SD-CD1 4.21Å; C49-Y115 HydrophobicContact CB-CD1 4.35Å; C49-Y115 HydrophobicContact CB-CE1 3.94Å; L50-Y115 HydrophobicContact CD2-CD1 3.67Å; L50-Y115 HydrophobicContact CD2-CG 3.98Å; L50-Y115 HydrophobicContact CG-CD1 4.03Å; L69-Y115 HydrophobicContact CD2-CE2 3.91Å; H70-Y115 PolarHBondContact N-OH 3.25Å; H70-Y115 AromaticContact ND1-CE1 3.57Å; H70-Y115 AromaticContact ND1-CZ 3.62Å; H70-Y115 PolarHBondContact ND1-OH 3.49Å; V73-Y115 HydrophobicContact CB-CE1 4.14Å; V73-Y115 HydrophobicContact CG1-CD1 4.08Å; V73-Y115 HydrophobicContact CG1-CD2 4.39Å; V73-Y115 HydrophobicContact CG1-CE1 3.78Å; V73-Y115 HydrophobicContact CG1-CE2 4.1Å; V73-Y115 HydrophobicContact CG1-CG 4.39Å; V73-Y115 HydrophobicContact CG2-CE1 4.18Å; V111-Y115 HydrophobicContact CG1-CD2 3.95Å; V111-Y115 HydrophobicContact CG1-CE2 4.2Å; V111-Y115 WeakPolarHBondContact O-CD2 3.45Å; V111-Y115 PolarHBondContact O-N 3.03Å; Y113-Y115 VanDerWaalsContact C-N 3.27Å; Y113-Y115 PolarHBondContact O-N 2.75Å
116	H	91.2	Very high	91.3	Very high	104 Å²	104	57.5 Å²	57.5	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-104.3	-13.4	-174.7	-52.8	88.5	0	0	0	113.2	D112 T118	D112-H116 WeakPolarHBondContact O-CA 3.41Å; D112-H116 VanDerWaalsContact O-CB 3.24Å; D112-H116 WeakPolarHBondContact O-CB 3.44Å; D112-H116 PolarHBondContact O-N 3.38Å; D112-H116 PolarHBondContact O-ND1 3.4Å; H116-T118 PolarHBondContact O-N 2.95Å
117	G	90.2	Very high	91.2	Very high	53 Å²	53	60 Å²	60	55%	0.546	32%	0.318	S	S	.	.	S	Bend	trans	66.4	10.7	-174	0	0	0	0	0	114	Y113	Y113-G117 WeakPolarHBondContact O-CA 3.34Å; Y113-G117 PolarHBondContact O-N 2.95Å
118	T	88.5	Confident	91.1	Very high	101 Å²	101	63.7 Å²	63.7	62%	0.62	34%	0.337	S	S	*	.			trans	-135.4	144.4	-179	60	0	0	0	0	110.1	H116	H116-T118 PolarHBondContact O-N 2.95Å
119	V	90.6	Very high	91.1	Very high	43 Å²	43	60.2 Å²	60.2	26%	0.261	32%	0.321	S	S	.	.			trans	-141.8	141.5	176.7	66.6	0	0	0	0	108.8	L109 L121 L141	L109-V119 HydrophobicContact CB-CG2 3.93Å; L109-V119 HydrophobicContact CD2-CG2 3.82Å; L109-V119 HydrophobicContact CG-CG2 4.41Å; V119-L121 HydrophobicContact CG1-CD1 4.23Å; V119-L121 HydrophobicContact CG1-CD2 4.39Å; V119-L121 HydrophobicContact CG1-CG 4.05Å; V119-L121 HydrophobicContact CG2-CD2 3.59Å; V119-L121 HydrophobicContact CG2-CG 4.05Å; V119-L141 HydrophobicContact CG1-CD1 3.74Å
120	K	88.3	Confident	91.1	Very high	196 Å²	196	59.3 Å²	59.3	85%	0.852	32%	0.316	S	S	*	.			trans	-110	106.8	174.2	-69.8	-179.3	-179.3	176.1	0	107.7
121	L	87.3	Confident	91.1	Very high	59 Å²	59	60.5 Å²	60.5	31%	0.309	32%	0.322	S	S	.	.			trans	-99.6	135.6	-176.9	-60.1	175.2	0	0	0	110.6	L109 V119 L126 T129	L109-L121 HydrophobicContact CD1-CD2 3.89Å; V119-L121 HydrophobicContact CG1-CD1 4.23Å; V119-L121 HydrophobicContact CG1-CD2 4.39Å; V119-L121 HydrophobicContact CG1-CG 4.05Å; V119-L121 HydrophobicContact CG2-CD2 3.59Å; V119-L121 HydrophobicContact CG2-CG 4.05Å; L121-L126 HydrophobicContact CD1-CD1 4.11Å; L121-T129 HydrophobicContact CD1-CG2 4.21Å; L121-T129 HydrophobicContact CD2-CG2 3.87Å
122	T	87.6	Confident	91.1	Very high	74 Å²	74	60.8 Å²	60.8	45%	0.454	32%	0.322	S	S	.	.			trans	-84.1	167	161.5	64.5	0	0	0	0	110.5	E124 E125 L126	T122-E124 PolarHBondContact O-N 2.81Å; T122-E125 WeakPolarHBondContact CB-OE2 3.1Å; T122-E125 WeakPolarHBondContact CG2-OE2 3.25Å; T122-E125 PolarHBondContact N-OE2 3.26Å; T122-E125 VanDerWaalsContact N-OE2 3.12Å; T122-E125 PolarHBondContact O-N 2.77Å; T122-E125 VanDerWaalsContact OG1-CG 3.3Å; T122-E125 WeakPolarHBondContact OG1-CG 3.38Å; T122-E125 PolarHBondContact OG1-N 2.82Å; T122-E125 PolarHBondContact OG1-OE2 3.05Å; T122-L126 PolarHBondContact O-N 2.86Å
123	V	82.1	Confident	91.2	Very high	122 Å²	122	58.4 Å²	58.4	74%	0.739	31%	0.31	S	S	*	.	H	α-helix	trans	-63.8	-32.8	175.9	-179.3	0	0	0	0	111.2
124	E	83.8	Confident	91.2	Very high	177 Å²	177	59.5 Å²	59.5	83%	0.827	32%	0.318	S	S	*	.	H	α-helix	trans	-71.2	-37	-179.7	-62.9	176.5	-171.4	0	0	111.9	T122	T122-E124 PolarHBondContact O-N 2.81Å
125	E	89.3	Confident	91.2	Very high	53 Å²	53	63.4 Å²	63.4	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-83.8	-13.9	-179	-66.9	160.6	144.8	0	0	113.5	L109 T122 Q127 T129	L109-E125 HydrophobicContact CD1-CB 4.12Å; L109-E125 HydrophobicContact CD1-CG 4.27Å; T122-E125 WeakPolarHBondContact CB-OE2 3.1Å; T122-E125 WeakPolarHBondContact CG2-OE2 3.25Å; T122-E125 PolarHBondContact N-OE2 3.26Å; T122-E125 VanDerWaalsContact N-OE2 3.12Å; T122-E125 PolarHBondContact O-N 2.77Å; T122-E125 VanDerWaalsContact OG1-CG 3.3Å; T122-E125 WeakPolarHBondContact OG1-CG 3.38Å; T122-E125 PolarHBondContact OG1-N 2.82Å; T122-E125 PolarHBondContact OG1-OE2 3.05Å; E125-Q127 PolarHBondContact O-N 2.82Å; E125-T129 VanDerWaalsContact O-CB 3.26Å; E125-T129 WeakPolarHBondContact O-CB 2.99Å; E125-T129 PolarHBondContact O-N 3.09Å; E125-T129 PolarHBondContact O-OG1 3.06Å
126	L	90.7	Very high	91.3	Very high	9 Å²	9	63 Å²	63	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-61.9	-45.7	-172.2	176.9	66.7	0	0	0	112.4	L121 T122 T129 Y130 C145 F148 L149	L121-L126 HydrophobicContact CD1-CD1 4.11Å; T122-L126 PolarHBondContact O-N 2.86Å; L126-T129 PolarHBondContact O-N 3.27Å; L126-Y130 WeakPolarHBondContact O-CB 3.29Å; L126-Y130 PolarHBondContact O-N 3.24Å; L126-C145 HydrophobicContact CD1-CB 4.08Å; L126-F148 HydrophobicContact CD1-CD1 4.28Å; L126-F148 HydrophobicContact CD2-CD1 3.39Å; L126-F148 HydrophobicContact CD2-CE1 3.76Å; L126-F148 HydrophobicContact CD2-CG 4.46Å; L126-F148 HydrophobicContact CG-CD1 4.48Å; L126-L149 HydrophobicContact CD2-CD2 3.53Å; L126-L149 HydrophobicContact CD2-CG 3.9Å; L126-L149 HydrophobicContact CG-CD2 4.09Å; L126-L149 HydrophobicContact CG-CG 4.24Å
127	Q	91.9	Very high	91.5	Very high	55 Å²	55	62.2 Å²	62.2	26%	0.257	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-53.1	-179.6	-177.7	179.8	-36.6	0	0	110.2	E125 T129 Y130 E131 L164	E125-Q127 PolarHBondContact O-N 2.82Å; Q127-T129 VanDerWaalsContact C-N 3.26Å; Q127-T129 PolarHBondContact O-N 3.22Å; Q127-Y130 WeakPolarHBondContact O-CB 3.34Å; Q127-Y130 PolarHBondContact O-N 2.79Å; Q127-Y130 VanDerWaalsContact O-N 3.09Å; Q127-E131 PolarHBondContact NE2-OE1 2.89Å; Q127-E131 WeakPolarHBondContact O-CG 3.23Å; Q127-E131 PolarHBondContact O-N 3.06Å; Q127-L164 HydrophobicContact CG-CD1 4.23Å; Q127-L164 HydrophobicContact CG-CD2 3.89Å
128	D	92.9	Very high	91.8	Very high	78 Å²	78	59.8 Å²	59.8	42%	0.417	31%	0.307	S	S	.	.	H	α-helix	trans	-60.5	-38.5	-179.6	-65.2	-12.9	0	0	0	111.7	V106 E131 M132	V106-D128 HydrophobicContact CG1-CB 4.44Å; V106-D128 HydrophobicContact CG2-CB 3.7Å; D128-E131 PolarHBondContact O-N 3.16Å; D128-M132 WeakPolarHBondContact O-CB 3.35Å; D128-M132 WeakPolarHBondContact O-CG 3.28Å; D128-M132 PolarHBondContact O-N 3.28Å
129	T	94.8	Very high	92.1	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-41.2	176.3	-55.9	0	0	0	0	111.5	L110 L121 E125 L126 Q127 M132 A133 L141	L110-T129 HydrophobicContact CD2-CG2 4.28Å; L121-T129 HydrophobicContact CD1-CG2 4.21Å; L121-T129 HydrophobicContact CD2-CG2 3.87Å; E125-T129 VanDerWaalsContact O-CB 3.26Å; E125-T129 WeakPolarHBondContact O-CB 2.99Å; E125-T129 PolarHBondContact O-N 3.09Å; E125-T129 PolarHBondContact O-OG1 3.06Å; L126-T129 PolarHBondContact O-N 3.27Å; Q127-T129 VanDerWaalsContact C-N 3.26Å; Q127-T129 PolarHBondContact O-N 3.22Å; T129-M132 PolarHBondContact O-N 2.83Å; T129-A133 WeakPolarHBondContact O-CB 3.28Å; T129-A133 PolarHBondContact O-N 2.76Å; T129-L141 HydrophobicContact CG2-CD1 4.49Å; T129-L141 HydrophobicContact CG2-CD2 4.09Å; T129-L141 HydrophobicContact CG2-CG 4.42Å
130	Y	95.5	Very high	92.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.5	-49.9	174.8	171.1	-95.2	0	0	0	111.2	L126 Q127 M132 A133 D134 F142 C145 L149 L164 H168 D170 L173	L126-Y130 WeakPolarHBondContact O-CB 3.29Å; L126-Y130 PolarHBondContact O-N 3.24Å; Q127-Y130 WeakPolarHBondContact O-CB 3.34Å; Q127-Y130 PolarHBondContact O-N 2.79Å; Q127-Y130 VanDerWaalsContact O-N 3.09Å; Y130-M132 PolarHBondContact O-N 3.43Å; Y130-A133 PolarHBondContact O-N 2.73Å; Y130-D134 PolarHBondContact O-N 3.39Å; Y130-F142 AromaticContact CD2-CD2 3.84Å; Y130-F142 HydrophobicContact CD2-CD2 3.84Å; Y130-F142 AromaticContact CD2-CE2 3.82Å; Y130-F142 HydrophobicContact CD2-CE2 3.82Å; Y130-F142 AromaticContact CE1-CE2 3.98Å; Y130-F142 HydrophobicContact CE1-CE2 3.98Å; Y130-F142 AromaticContact CE2-CD2 3.67Å; Y130-F142 HydrophobicContact CE2-CD2 3.67Å; Y130-F142 AromaticContact CE2-CE2 3.2Å; Y130-F142 HydrophobicContact CE2-CE2 3.2Å; Y130-F142 AromaticContact CE2-CZ 3.76Å; Y130-F142 HydrophobicContact CE2-CZ 3.76Å; Y130-F142 HydrophobicContact CG-CD2 4.49Å; Y130-F142 HydrophobicContact CG-CE2 4.44Å; Y130-F142 AromaticContact CZ-CE2 3.31Å; Y130-F142 AromaticContact CZ-CZ 3.81Å; Y130-C145 HydrophobicContact CD2-CB 3.84Å; Y130-C145 HydrophobicContact CG-CB 4.39Å; Y130-L149 HydrophobicContact CD1-CD1 4.36Å; Y130-L149 HydrophobicContact CD2-CD1 3.89Å; Y130-L149 HydrophobicContact CE2-CD1 4.27Å; Y130-L149 HydrophobicContact CG-CD1 3.92Å; Y130-L164 HydrophobicContact CD1-CD1 4.17Å; Y130-L164 HydrophobicContact CD1-CD2 3.81Å; Y130-L164 HydrophobicContact CD1-CG 3.96Å; Y130-L164 HydrophobicContact CE1-CD1 4.19Å; Y130-L164 HydrophobicContact CE1-CD2 3.97Å; Y130-L164 HydrophobicContact CE1-CG 3.73Å; Y130-H168 HydrophobicContact CE1-CB 3.91Å; Y130-H168 AromaticContact CE1-CD2 3.59Å; Y130-H168 AromaticContact CE1-CG 3.73Å; Y130-D170 WeakPolarHBondContact OH-CB 3.48Å; Y130-D170 PolarHBondContact OH-OD2 3.26Å; Y130-L173 HydrophobicContact CE2-CD2 4.33Å
131	E	95.1	Very high	92.7	Very high	27 Å²	27	50.7 Å²	50.7	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-43.5	-179.8	-61.7	-170.4	-160	0	0	111.8	Q127 D128 M135 L164 R167 H168	Q127-E131 PolarHBondContact NE2-OE1 2.89Å; Q127-E131 WeakPolarHBondContact O-CG 3.23Å; Q127-E131 PolarHBondContact O-N 3.06Å; D128-E131 PolarHBondContact O-N 3.16Å; E131-M135 WeakPolarHBondContact O-CB 3.34Å; E131-M135 PolarHBondContact O-N 3.16Å; E131-L164 HydrophobicContact CG-CD1 3.85Å; E131-L164 WeakPolarHBondContact OE1-CD1 3.38Å; E131-R167 IonicContact OE1-CZ 2.72Å; E131-R167 IonicContact OE1-NH2 2.85Å; E131-R167 PolarHBondContact OE1-NH2 3.23Å; E131-R167 IonicContact OE2-CZ 3.59Å; E131-R167 IonicContact OE2-NH1 3.92Å; E131-R167 PolarHBondContact OE2-NH1 2.95Å; E131-R167 IonicContact OE2-NH2 3.95Å; E131-R167 PolarHBondContact OE2-NH2 3.16Å; E131-H168 WeakPolarHBondContact CG-NE2 3.45Å
132	M	95.4	Very high	93.1	Very high	16 Å²	16	49.3 Å²	49.3	8%	0.079	27%	0.265	C	S	.	.	H	α-helix	trans	-73.8	-34	-179.7	-65.5	-62.1	102.3	0	0	112.4	V102 V106 L110 D128 T129 Y130 D134 M135 Y136	V102-M132 HydrophobicContact CB-SD 3.75Å; V102-M132 HydrophobicContact CG2-CG 3.92Å; V102-M132 HydrophobicContact CG2-SD 3.68Å; V106-M132 HydrophobicContact CG1-CB 4.07Å; V106-M132 HydrophobicContact CG1-CG 3.77Å; L110-M132 HydrophobicContact CD1-CB 3.92Å; D128-M132 WeakPolarHBondContact O-CB 3.35Å; D128-M132 WeakPolarHBondContact O-CG 3.28Å; D128-M132 PolarHBondContact O-N 3.28Å; T129-M132 PolarHBondContact O-N 2.83Å; Y130-M132 PolarHBondContact O-N 3.43Å; M132-D134 VanDerWaalsContact C-N 3.29Å; M132-D134 PolarHBondContact O-N 2.98Å; M132-M135 HydrophobicContact CE-CE 3.63Å; M132-M135 HydrophobicContact CE-SD 3.97Å; M132-M135 PolarHBondContact O-N 2.91Å; M132-M135 HydrophobicContact SD-SD 4.08Å; M132-Y136 HydrophobicContact CB-CD2 4.09Å; M132-Y136 HydrophobicContact CB-CE2 4.22Å; M132-Y136 WeakPolarHBondContact O-CB 3.48Å; M132-Y136 WeakPolarHBondContact O-CD2 3.49Å; M132-Y136 PolarHBondContact O-N 3.08Å; M132-Y136 HydrophobicContact SD-CE2 3.83Å
133	A	96.1	Very high	93.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-38.8	175.6	0	0	0	0	0	111.2	T129 Y130 Q137 L138 L141 F142	T129-A133 WeakPolarHBondContact O-CB 3.28Å; T129-A133 PolarHBondContact O-N 2.76Å; Y130-A133 PolarHBondContact O-N 2.73Å; A133-Q137 WeakPolarHBondContact O-CA 3.05Å; A133-Q137 PolarHBondContact O-N 3.26Å; A133-Q137 VanDerWaalsContact O-N 3.09Å; A133-L138 HydrophobicContact CB-CB 4.4Å; A133-L138 PolarHBondContact O-N 2.9Å; A133-L141 HydrophobicContact CB-CB 4.25Å; A133-L141 HydrophobicContact CB-CD2 4.06Å; A133-L141 HydrophobicContact CB-CG 3.95Å; A133-F142 HydrophobicContact CB-CB 3.93Å
134	D	96.1	Very high	94	Very high	62 Å²	62	49 Å²	49	33%	0.332	25%	0.25	S	S	.	.	H	α-helix	trans	-65.3	-52.1	171.4	-175.4	39.6	0	0	0	111.6	Y130 M132 Y136 Q137 F142 H168	Y130-D134 PolarHBondContact O-N 3.39Å; M132-D134 VanDerWaalsContact C-N 3.29Å; M132-D134 PolarHBondContact O-N 2.98Å; D134-Y136 VanDerWaalsContact C-N 3.34Å; D134-Y136 PolarHBondContact O-N 3.04Å; D134-Q137 WeakPolarHBondContact O-CA 3.31Å; D134-Q137 PolarHBondContact O-N 2.79Å; D134-F142 HydrophobicContact CB-CD2 3.62Å; D134-F142 HydrophobicContact CB-CE2 3.71Å; D134-F142 HydrophobicContact CB-CG 4.45Å; D134-H168 IonicContact OD2-CE1 2.6Å; D134-H168 IonicContact OD2-CG 2.73Å; D134-H168 IonicContact OD2-ND1 3.86Å; D134-H168 PolarHBondContact OD2-ND1 3.12Å
135	M	94.6	Very high	94.5	Very high	90 Å²	90	40.7 Å²	40.7	44%	0.443	21%	0.212	S	C	.	.	H	α-helix	trans	-56.1	-45.5	-178.7	-177.4	-178.1	-69.4	0	0	112.8	E131 M132 Q137	E131-M135 WeakPolarHBondContact O-CB 3.34Å; E131-M135 PolarHBondContact O-N 3.16Å; M132-M135 HydrophobicContact CE-CE 3.63Å; M132-M135 HydrophobicContact CE-SD 3.97Å; M132-M135 PolarHBondContact O-N 2.91Å; M132-M135 HydrophobicContact SD-SD 4.08Å; M135-Q137 VanDerWaalsContact C-N 3.27Å; M135-Q137 PolarHBondContact O-N 2.72Å
136	Y	95.3	Very high	94.8	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.016	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	6.4	177.8	-65	-69.6	0	0	0	113	S78 F80 F81 L99 V102 L110 M132 D134 L138	S78-Y136 WeakPolarHBondContact CB-O 2.97Å; S78-Y136 PolarHBondContact OG-O 3.12Å; F80-Y136 WeakPolarHBondContact CB-O 3.12Å; F80-Y136 AromaticContact CD1-CD1 3.55Å; F80-Y136 HydrophobicContact CD1-CD1 3.55Å; F80-Y136 HydrophobicContact CD1-CE1 4.15Å; F80-Y136 AromaticContact CE1-CD1 3.6Å; F80-Y136 HydrophobicContact CE1-CD1 3.6Å; F80-Y136 AromaticContact CE1-CE1 3.7Å; F80-Y136 HydrophobicContact CE1-CE1 3.7Å; F80-Y136 HydrophobicContact CG-CD1 4.2Å; F80-Y136 HydrophobicContact CZ-CD1 4.29Å; F80-Y136 HydrophobicContact CZ-CE1 4.17Å; F81-Y136 AromaticContact CE2-CD1 3.83Å; F81-Y136 HydrophobicContact CE2-CD1 3.83Å; F81-Y136 HydrophobicContact CE2-CE1 4.49Å; F81-Y136 HydrophobicContact CE2-CG 4.37Å; F81-Y136 AromaticContact CZ-CD1 3.74Å; F81-Y136 HydrophobicContact CZ-CD1 3.74Å; F81-Y136 AromaticContact CZ-CE1 3.95Å; F81-Y136 HydrophobicContact CZ-CE1 3.95Å; L99-Y136 HydrophobicContact CD1-CE1 3.86Å; L99-Y136 HydrophobicContact CD2-CE1 4.48Å; V102-Y136 HydrophobicContact CB-CE2 4.49Å; V102-Y136 WeakPolarHBondContact CG1-OH 3.25Å; V102-Y136 HydrophobicContact CG2-CE2 4.36Å; L110-Y136 HydrophobicContact CD1-CD2 3.41Å; L110-Y136 VanDerWaalsContact CD1-CD2 3.41Å; L110-Y136 HydrophobicContact CD1-CE2 3.89Å; L110-Y136 HydrophobicContact CD1-CG 4.26Å; M132-Y136 HydrophobicContact CB-CD2 4.09Å; M132-Y136 HydrophobicContact CB-CE2 4.22Å; M132-Y136 WeakPolarHBondContact O-CB 3.48Å; M132-Y136 WeakPolarHBondContact O-CD2 3.49Å; M132-Y136 PolarHBondContact O-N 3.08Å; M132-Y136 HydrophobicContact SD-CE2 3.83Å; D134-Y136 VanDerWaalsContact C-N 3.34Å; D134-Y136 PolarHBondContact O-N 3.04Å; Y136-L138 VanDerWaalsContact C-N 3.33Å; Y136-L138 PolarHBondContact O-N 2.86Å
137	Q	96.2	Very high	94.9	Very high	88 Å²	88	43.1 Å²	43.1	41%	0.411	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	46.4	176.2	-55.7	179.9	-3	0	0	113.2	S79 F80 A133 D134 M135 T139	S79-Q137 WeakPolarHBondContact OG-CB 3.1Å; S79-Q137 PolarHBondContact OG-OE1 3.14Å; F80-Q137 HydrophobicContact CB-CB 4.35Å; F80-Q137 HydrophobicContact CB-CG 4.24Å; A133-Q137 WeakPolarHBondContact O-CA 3.05Å; A133-Q137 PolarHBondContact O-N 3.26Å; A133-Q137 VanDerWaalsContact O-N 3.09Å; D134-Q137 WeakPolarHBondContact O-CA 3.31Å; D134-Q137 PolarHBondContact O-N 2.79Å; M135-Q137 VanDerWaalsContact C-N 3.27Å; M135-Q137 PolarHBondContact O-N 2.72Å; Q137-T139 PolarHBondContact O-N 3.5Å
138	L	96.9	Very high	94.8	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.227	C	C	.	.			trans	-92.8	71.8	171.5	-66.5	169.5	0	0	0	109.1	Q77 L110 Y113 I114 A133 Y136 A140 L141 F142	Q77-L138 HydrophobicContact CB-CD2 4.37Å; L110-L138 HydrophobicContact CB-CD1 4.1Å; L110-L138 HydrophobicContact CD1-CD1 4.44Å; L110-L138 HydrophobicContact CD2-CD1 3.92Å; L110-L138 HydrophobicContact CG-CD1 4.36Å; Y113-L138 HydrophobicContact CD1-CD1 4.31Å; Y113-L138 HydrophobicContact CD1-CD2 4.35Å; Y113-L138 HydrophobicContact CE1-CB 4.34Å; Y113-L138 HydrophobicContact CE1-CD2 4.18Å; I114-L138 HydrophobicContact CD1-CD1 4.29Å; I114-L138 HydrophobicContact CD1-CD2 4.02Å; I114-L138 HydrophobicContact CG1-CD1 4.37Å; I114-L138 HydrophobicContact CG1-CD2 3.76Å; A133-L138 HydrophobicContact CB-CB 4.4Å; A133-L138 PolarHBondContact O-N 2.9Å; Y136-L138 VanDerWaalsContact C-N 3.33Å; Y136-L138 PolarHBondContact O-N 2.86Å; L138-A140 PolarHBondContact O-N 3.17Å; L138-L141 HydrophobicContact CB-CB 4.2Å; L138-L141 HydrophobicContact CD1-CD2 4.32Å; L138-L141 PolarHBondContact O-N 3.03Å; L138-F142 PolarHBondContact O-N 2.93Å
139	T	94.8	Very high	94.8	Very high	84 Å²	84	41.9 Å²	41.9	52%	0.515	21%	0.21	S	C	.	.	H	α-helix	trans	-51.4	-48.9	-166.7	-51.1	0	0	0	0	114.2	Q137 L141 F142 E143	Q137-T139 PolarHBondContact O-N 3.5Å; T139-L141 VanDerWaalsContact C-N 3.32Å; T139-L141 PolarHBondContact O-N 2.71Å; T139-F142 WeakPolarHBondContact O-CB 3.36Å; T139-F142 PolarHBondContact O-N 3.14Å; T139-E143 HydrophobicContact CG2-CG 4.4Å; T139-E143 WeakPolarHBondContact CG2-OE1 3.38Å; T139-E143 WeakPolarHBondContact O-CB 3.4Å; T139-E143 WeakPolarHBondContact O-CG 3.3Å; T139-E143 PolarHBondContact O-N 3.15Å
140	A	95.1	Very high	94.5	Very high	58 Å²	58	44.1 Å²	44.1	48%	0.479	23%	0.226	S	C	.	.	H	α-helix	trans	-67.7	-30.8	-177.6	0	0	0	0	0	113.2	Y113 L138 E144	Y113-A140 WeakPolarHBondContact OH-CB 3.41Å; L138-A140 PolarHBondContact O-N 3.17Å; A140-E144 PolarHBondContact O-N 2.72Å
141	L	96	Very high	94.1	Very high	6 Å²	6	53 Å²	53	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-72.2	-42.8	173.7	177.7	60.4	0	0	0	110.9	L110 Y113 V119 T129 A133 L138 T139 E144 C145	L110-L141 HydrophobicContact CD2-CD2 3.72Å; Y113-L141 HydrophobicContact CD1-CB 4.05Å; Y113-L141 HydrophobicContact CD1-CD2 3.9Å; Y113-L141 HydrophobicContact CD2-CB 4.37Å; Y113-L141 HydrophobicContact CD2-CD1 4.29Å; Y113-L141 HydrophobicContact CE1-CB 3.78Å; Y113-L141 HydrophobicContact CE1-CD2 4.47Å; Y113-L141 HydrophobicContact CE2-CB 4.11Å; Y113-L141 HydrophobicContact CG-CB 4.34Å; Y113-L141 HydrophobicContact CG-CD1 4.49Å; Y113-L141 HydrophobicContact CG-CD2 3.94Å; Y113-L141 HydrophobicContact CG-CG 4.5Å; V119-L141 HydrophobicContact CG1-CD1 3.74Å; T129-L141 HydrophobicContact CG2-CD1 4.49Å; T129-L141 HydrophobicContact CG2-CD2 4.09Å; T129-L141 HydrophobicContact CG2-CG 4.42Å; A133-L141 HydrophobicContact CB-CB 4.25Å; A133-L141 HydrophobicContact CB-CD2 4.06Å; A133-L141 HydrophobicContact CB-CG 3.95Å; L138-L141 HydrophobicContact CB-CB 4.2Å; L138-L141 HydrophobicContact CD1-CD2 4.32Å; L138-L141 PolarHBondContact O-N 3.03Å; T139-L141 VanDerWaalsContact C-N 3.32Å; T139-L141 PolarHBondContact O-N 2.71Å; L141-E144 PolarHBondContact O-N 2.86Å; L141-C145 PolarHBondContact O-N 3.05Å; L141-C145 PolarHBondContact O-SG 2.83Å
142	F	96.1	Very high	93.7	Very high	30 Å²	30	54.2 Å²	54.2	13%	0.132	27%	0.269	C	S	.	.	H	α-helix	trans	-58	-49.6	175.1	171.3	-99.9	0	0	0	111.5	Y130 A133 D134 L138 T139 E144 C145 S146 H168 D170	Y130-F142 AromaticContact CD2-CD2 3.84Å; Y130-F142 HydrophobicContact CD2-CD2 3.84Å; Y130-F142 AromaticContact CD2-CE2 3.82Å; Y130-F142 HydrophobicContact CD2-CE2 3.82Å; Y130-F142 AromaticContact CE1-CE2 3.98Å; Y130-F142 HydrophobicContact CE1-CE2 3.98Å; Y130-F142 AromaticContact CE2-CD2 3.67Å; Y130-F142 HydrophobicContact CE2-CD2 3.67Å; Y130-F142 AromaticContact CE2-CE2 3.2Å; Y130-F142 HydrophobicContact CE2-CE2 3.2Å; Y130-F142 AromaticContact CE2-CZ 3.76Å; Y130-F142 HydrophobicContact CE2-CZ 3.76Å; Y130-F142 HydrophobicContact CG-CD2 4.49Å; Y130-F142 HydrophobicContact CG-CE2 4.44Å; Y130-F142 AromaticContact CZ-CE2 3.31Å; Y130-F142 AromaticContact CZ-CZ 3.81Å; A133-F142 HydrophobicContact CB-CB 3.93Å; D134-F142 HydrophobicContact CB-CD2 3.62Å; D134-F142 HydrophobicContact CB-CE2 3.71Å; D134-F142 HydrophobicContact CB-CG 4.45Å; L138-F142 PolarHBondContact O-N 2.93Å; T139-F142 WeakPolarHBondContact O-CB 3.36Å; T139-F142 PolarHBondContact O-N 3.14Å; F142-E144 VanDerWaalsContact C-N 3.33Å; F142-E144 PolarHBondContact O-N 2.8Å; F142-C145 PolarHBondContact O-N 3.2Å; F142-S146 WeakPolarHBondContact O-CB 3.44Å; F142-S146 PolarHBondContact O-N 2.85Å; F142-H168 HydrophobicContact CE2-CB 4.27Å; F142-H168 HydrophobicContact CZ-CB 4.41Å; F142-D170 HydrophobicContact CZ-CB 4.21Å
143	E	94.6	Very high	93.3	Very high	96 Å²	96	55 Å²	55	45%	0.449	27%	0.274	S	S	.	.	H	α-helix	trans	-60.4	-39	178	-73.9	175.5	-174.3	0	0	112.5	T139 R147	T139-E143 HydrophobicContact CG2-CG 4.4Å; T139-E143 WeakPolarHBondContact CG2-OE1 3.38Å; T139-E143 WeakPolarHBondContact O-CB 3.4Å; T139-E143 WeakPolarHBondContact O-CG 3.3Å; T139-E143 PolarHBondContact O-N 3.15Å; E143-R147 VanDerWaalsContact O-CB 3.29Å; E143-R147 WeakPolarHBondContact O-CB 2.99Å; E143-R147 PolarHBondContact O-N 2.96Å
144	E	93.3	Very high	93	Very high	94 Å²	94	59 Å²	59	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-70.1	-40	177	-170.9	59.2	-154.9	0	0	111.9	A140 L141 F142 R147 F148	A140-E144 PolarHBondContact O-N 2.72Å; L141-E144 PolarHBondContact O-N 2.86Å; F142-E144 VanDerWaalsContact C-N 3.33Å; F142-E144 PolarHBondContact O-N 2.8Å; E144-R147 PolarHBondContact O-N 2.88Å; E144-R147 IonicContact OE2-CZ 3.36Å; E144-R147 IonicContact OE2-NH1 3.35Å; E144-R147 PolarHBondContact OE2-NH1 2.8Å; E144-F148 WeakPolarHBondContact O-CB 3.47Å; E144-F148 PolarHBondContact O-N 2.84Å
145	C	95	Very high	92.6	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.014	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-43.9	173.9	-65.2	0	0	0	0	111.3	L126 Y130 L141 F142 R147 F148 L149	L126-C145 HydrophobicContact CD1-CB 4.08Å; Y130-C145 HydrophobicContact CD2-CB 3.84Å; Y130-C145 HydrophobicContact CG-CB 4.39Å; L141-C145 PolarHBondContact O-N 3.05Å; L141-C145 PolarHBondContact O-SG 2.83Å; F142-C145 PolarHBondContact O-N 3.2Å; C145-R147 PolarHBondContact O-N 2.74Å; C145-F148 PolarHBondContact O-N 2.91Å; C145-L149 WeakPolarHBondContact O-CG 3.28Å; C145-L149 PolarHBondContact O-N 3.19Å
146	S	95	Very high	92.5	Very high	10 Å²	10	61.9 Å²	61.9	7%	0.07	31%	0.305	C	S	.	.	H	α-helix	trans	-56.2	-50	173.8	178.5	0	0	0	0	111.7	F142 F148 L149 S150 D170	F142-S146 WeakPolarHBondContact O-CB 3.44Å; F142-S146 PolarHBondContact O-N 2.85Å; S146-F148 VanDerWaalsContact C-N 3.3Å; S146-F148 PolarHBondContact O-N 3.03Å; S146-L149 PolarHBondContact O-N 2.81Å; S146-S150 WeakPolarHBondContact O-CB 3.32Å; S146-S150 PolarHBondContact O-N 2.69Å; S146-D170 WeakPolarHBondContact CB-OD2 3.17Å; S146-D170 PolarHBondContact OG-OD1 3.32Å; S146-D170 PolarHBondContact OG-OD2 3.39Å
147	R	91.6	Very high	92.3	Very high	104 Å²	104	63.9 Å²	63.9	39%	0.392	32%	0.316	S	S	.	.	H	α-helix	trans	-61.3	-38.7	179.2	-171.6	-179.8	-65.6	110.1	9	112	E143 E144 C145 R151	E143-R147 VanDerWaalsContact O-CB 3.29Å; E143-R147 WeakPolarHBondContact O-CB 2.99Å; E143-R147 PolarHBondContact O-N 2.96Å; E144-R147 PolarHBondContact O-N 2.88Å; E144-R147 IonicContact OE2-CZ 3.36Å; E144-R147 IonicContact OE2-NH1 3.35Å; E144-R147 PolarHBondContact OE2-NH1 2.8Å; C145-R147 PolarHBondContact O-N 2.74Å; R147-R151 WeakPolarHBondContact O-CG 3.44Å; R147-R151 PolarHBondContact O-N 3.45Å
148	F	90.6	Very high	92.3	Very high	92 Å²	92	59.7 Å²	59.7	40%	0.404	30%	0.296	S	S	.	.	H	α-helix	trans	-67.8	-48.5	175.3	-170.8	-83.1	0	0	0	111.4	L126 E144 C145 S146 S150 R151 T152	L126-F148 HydrophobicContact CD1-CD1 4.28Å; L126-F148 HydrophobicContact CD2-CD1 3.39Å; L126-F148 HydrophobicContact CD2-CE1 3.76Å; L126-F148 HydrophobicContact CD2-CG 4.46Å; L126-F148 HydrophobicContact CG-CD1 4.48Å; E144-F148 WeakPolarHBondContact O-CB 3.47Å; E144-F148 PolarHBondContact O-N 2.84Å; C145-F148 PolarHBondContact O-N 2.91Å; S146-F148 VanDerWaalsContact C-N 3.3Å; S146-F148 PolarHBondContact O-N 3.03Å; F148-S150 VanDerWaalsContact C-N 3.28Å; F148-S150 PolarHBondContact O-N 3.46Å; F148-R151 PolarHBondContact O-N 3.28Å; F148-R151 VanDerWaalsContact O-N 3.11Å; F148-T152 HydrophobicContact CD1-CG2 4.07Å; F148-T152 HydrophobicContact CE1-CG2 3.71Å; F148-T152 HydrophobicContact CZ-CG2 4.2Å; F148-T152 PolarHBondContact O-N 2.84Å; F148-T152 PolarHBondContact O-OG1 3.17Å
149	L	92	Very high	92.2	Very high	14 Å²	14	60 Å²	60	7%	0.073	30%	0.298	C	S	.	.	H	α-helix	trans	-54.2	-46.3	176.4	-75.8	168.7	0	0	0	111	L126 Y130 C145 S146 R151 T152 V153 L164 L173	L126-L149 HydrophobicContact CD2-CD2 3.53Å; L126-L149 HydrophobicContact CD2-CG 3.9Å; L126-L149 HydrophobicContact CG-CD2 4.09Å; L126-L149 HydrophobicContact CG-CG 4.24Å; Y130-L149 HydrophobicContact CD1-CD1 4.36Å; Y130-L149 HydrophobicContact CD2-CD1 3.89Å; Y130-L149 HydrophobicContact CE2-CD1 4.27Å; Y130-L149 HydrophobicContact CG-CD1 3.92Å; C145-L149 WeakPolarHBondContact O-CG 3.28Å; C145-L149 PolarHBondContact O-N 3.19Å; S146-L149 PolarHBondContact O-N 2.81Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.44Å; L149-T152 WeakPolarHBondContact CA-OG1 3.17Å; L149-T152 CarbonylContact O-C 3.57Å; L149-T152 WeakPolarHBondContact O-CA 3.41Å; L149-T152 PolarHBondContact O-N 3.16Å; L149-T152 PolarHBondContact O-OG1 3.5Å; L149-V153 WeakPolarHBondContact O-CG2 3.26Å; L149-V153 PolarHBondContact O-N 3.25Å; L149-V153 VanDerWaalsContact O-N 3.11Å; L149-L164 HydrophobicContact CD1-CD2 4.06Å; L149-L173 HydrophobicContact CB-CD1 3.75Å; L149-L173 HydrophobicContact CB-CD2 3.97Å; L149-L173 HydrophobicContact CD1-CD2 3.87Å
150	S	89.1	Confident	92.1	Very high	47 Å²	47	61 Å²	61	33%	0.329	30%	0.296	S	S	.	.	H	α-helix	trans	-56.5	-40	178.4	-175	0	0	0	0	113	S146 F148 T152 L173	S146-S150 WeakPolarHBondContact O-CB 3.32Å; S146-S150 PolarHBondContact O-N 2.69Å; F148-S150 VanDerWaalsContact C-N 3.28Å; F148-S150 PolarHBondContact O-N 3.46Å; S150-T152 VanDerWaalsContact C-N 3.26Å; S150-T152 PolarHBondContact O-N 3.06Å; S150-L173 VanDerWaalsContact N-CD1 3.34Å
151	R	86.6	Confident	92	Very high	186 Å²	186	58.6 Å²	58.6	70%	0.702	28%	0.276	S	S	*	.	H	α-helix	trans	-71.7	-19.6	176.5	-70.1	173.5	-179.1	169.7	2.8	113.9	R147 F148 L149	R147-R151 WeakPolarHBondContact O-CG 3.44Å; R147-R151 PolarHBondContact O-N 3.45Å; F148-R151 PolarHBondContact O-N 3.28Å; F148-R151 VanDerWaalsContact O-N 3.11Å; L149-R151 VanDerWaalsContact C-N 3.3Å; L149-R151 PolarHBondContact O-N 3.44Å
152	T	86.4	Confident	92	Very high	54 Å²	54	58.3 Å²	58.3	33%	0.331	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	6	-177.8	61.4	0	0	0	0	113.4	F148 L149 S150 D154 N157	F148-T152 HydrophobicContact CD1-CG2 4.07Å; F148-T152 HydrophobicContact CE1-CG2 3.71Å; F148-T152 HydrophobicContact CZ-CG2 4.2Å; F148-T152 PolarHBondContact O-N 2.84Å; F148-T152 PolarHBondContact O-OG1 3.17Å; L149-T152 WeakPolarHBondContact CA-OG1 3.17Å; L149-T152 CarbonylContact O-C 3.57Å; L149-T152 WeakPolarHBondContact O-CA 3.41Å; L149-T152 PolarHBondContact O-N 3.16Å; L149-T152 PolarHBondContact O-OG1 3.5Å; S150-T152 VanDerWaalsContact C-N 3.26Å; S150-T152 PolarHBondContact O-N 3.06Å; T152-D154 PolarHBondContact O-N 3.48Å; T152-N157 PolarHBondContact O-ND2 3.02Å
153	V	88.6	Confident	91.9	Very high	31 Å²	31	62.4 Å²	62.4	19%	0.188	29%	0.289	C	S	.	.			trans	-61.6	123.8	173.4	172.9	0	0	0	0	109.2	L149 N157 C158 V161 L173 A177 C180	L149-V153 WeakPolarHBondContact O-CG2 3.26Å; L149-V153 PolarHBondContact O-N 3.25Å; L149-V153 VanDerWaalsContact O-N 3.11Å; V153-N157 WeakPolarHBondContact CA-OD1 3.3Å; V153-C158 HydrophobicContact CG1-CB 3.99Å; V153-V161 HydrophobicContact CG2-CG1 4.04Å; V153-L173 HydrophobicContact CG2-CD1 4.4Å; V153-A177 HydrophobicContact CG2-CB 4.47Å; V153-C180 HydrophobicContact CG1-CB 3.53Å
154	D	88.9	Confident	91.8	Very high	84 Å²	84	58 Å²	58	45%	0.449	27%	0.269	S	S	.	.			trans	-143.7	168.7	178.4	-170	5.3	0	0	0	108.7	T152 K156 N157 C158	T152-D154 PolarHBondContact O-N 3.48Å; D154-K156 PolarHBondContact O-N 2.93Å; D154-K156 VanDerWaalsContact O-N 3.08Å; D154-N157 PolarHBondContact N-OD1 3.38Å; D154-N157 PolarHBondContact O-N 2.91Å; D154-N157 VanDerWaalsContact O-N 3.08Å; D154-N157 PolarHBondContact O-OD1 3.48Å; D154-C158 VanDerWaalsContact O-CB 3.24Å; D154-C158 WeakPolarHBondContact O-CB 3.44Å; D154-C158 PolarHBondContact O-N 3.18Å
155	V	88.8	Confident	91.9	Very high	23 Å²	23	53.5 Å²	53.5	14%	0.139	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	-38.3	178.6	-172.7	0	0	0	0	111.1	N157 C158 H184 Q187 L188	V155-N157 PolarHBondContact O-N 3.28Å; V155-C158 PolarHBondContact O-SG 3.47Å; V155-H184 HydrophobicContact CG1-CB 4.16Å; V155-H184 HydrophobicContact CG2-CB 3.85Å; V155-Q187 HydrophobicContact CG1-CB 3.99Å; V155-L188 HydrophobicContact CG1-CD2 3.83Å; V155-L188 HydrophobicContact CG1-CG 4.19Å; V155-L188 WeakPolarHBondContact O-CD2 3.35Å
156	K	90.6	Very high	91.9	Very high	191 Å²	191	57.2 Å²	57.2	83%	0.83	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-26.4	-176.4	-61.6	-179	-175.7	175.1	0	114.7	D154	D154-K156 PolarHBondContact O-N 2.93Å; D154-K156 VanDerWaalsContact O-N 3.08Å
157	N	92.1	Very high	91.8	Very high	46 Å²	46	62 Å²	62	25%	0.246	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-9	-173.2	68.4	5.9	0	0	0	113.7	T152 V153 D154 V155 L159 Q160 V161	T152-N157 PolarHBondContact O-ND2 3.02Å; V153-N157 WeakPolarHBondContact CA-OD1 3.3Å; D154-N157 PolarHBondContact N-OD1 3.38Å; D154-N157 PolarHBondContact O-N 2.91Å; D154-N157 VanDerWaalsContact O-N 3.08Å; D154-N157 PolarHBondContact O-OD1 3.48Å; V155-N157 PolarHBondContact O-N 3.28Å; N157-L159 VanDerWaalsContact C-N 3.29Å; N157-L159 PolarHBondContact O-N 2.79Å; N157-Q160 PolarHBondContact O-N 3.38Å; N157-Q160 VanDerWaalsContact O-N 3.1Å; N157-V161 HydrophobicContact CB-CG2 4.3Å; N157-V161 WeakPolarHBondContact O-CG2 3.46Å; N157-V161 PolarHBondContact O-N 3.24Å
158	C	95.1	Very high	91.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-56.1	-38.5	-171.5	61.8	0	0	0	0	113.7	V153 D154 V155 M162 C180	V153-C158 HydrophobicContact CG1-CB 3.99Å; D154-C158 VanDerWaalsContact O-CB 3.24Å; D154-C158 WeakPolarHBondContact O-CB 3.44Å; D154-C158 PolarHBondContact O-N 3.18Å; V155-C158 PolarHBondContact O-SG 3.47Å; C158-M162 WeakPolarHBondContact O-CB 3.41Å; C158-M162 PolarHBondContact O-N 2.94Å; C158-C180 HydrophobicContact CB-CB 3.83Å
159	L	95.3	Very high	92.1	Very high	8 Å²	8	59 Å²	59	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-69.4	-41.6	179	-62	179	0	0	0	112.4	N157 M162 W163 A181 L188 E193 F194 L197 I205	N157-L159 VanDerWaalsContact C-N 3.29Å; N157-L159 PolarHBondContact O-N 2.79Å; L159-M162 PolarHBondContact O-N 3.45Å; L159-W163 PolarHBondContact O-N 3.47Å; L159-A181 HydrophobicContact CD2-CB 3.88Å; L159-L188 HydrophobicContact CD1-CD1 4.47Å; L159-L188 HydrophobicContact CD1-CD2 4.11Å; L159-L188 HydrophobicContact CD2-CD1 4.29Å; L159-L188 HydrophobicContact CG-CD1 4.31Å; L159-L188 HydrophobicContact CG-CD2 4.36Å; L159-E193 HydrophobicContact CB-CB 4.45Å; L159-E193 HydrophobicContact CD1-CB 4.09Å; L159-F194 HydrophobicContact CD1-CB 3.73Å; L159-F194 HydrophobicContact CD1-CD2 4.14Å; L159-F194 HydrophobicContact CD1-CG 4.46Å; L159-L197 HydrophobicContact CB-CD1 4.41Å; L159-L197 HydrophobicContact CD2-CD1 4.12Å; L159-I205 HydrophobicContact CD2-CD1 4.27Å
160	Q	92.7	Very high	92.3	Very high	104 Å²	104	59 Å²	59	49%	0.486	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-44	176	-178	179.5	-1	0	0	111.1	N157 M162 W163 L164	N157-Q160 PolarHBondContact O-N 3.38Å; N157-Q160 VanDerWaalsContact O-N 3.1Å; Q160-M162 VanDerWaalsContact C-N 3.35Å; Q160-W163 PolarHBondContact O-N 3.12Å; Q160-L164 WeakPolarHBondContact O-CB 3.46Å; Q160-L164 PolarHBondContact O-N 3.27Å
161	V	94.5	Very high	92.6	Very high	9 Å²	9	62.9 Å²	62.9	6%	0.055	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-39.4	177.1	176.3	0	0	0	0	111.1	V153 N157 L164 A165 L173 A177	V153-V161 HydrophobicContact CG2-CG1 4.04Å; N157-V161 HydrophobicContact CB-CG2 4.3Å; N157-V161 WeakPolarHBondContact O-CG2 3.46Å; N157-V161 PolarHBondContact O-N 3.24Å; V161-L164 PolarHBondContact O-N 3.02Å; V161-A165 VanDerWaalsContact O-CB 3.31Å; V161-A165 WeakPolarHBondContact O-CB 3.45Å; V161-A165 PolarHBondContact O-N 3.02Å; V161-L173 HydrophobicContact CG1-CD1 3.57Å; V161-L173 HydrophobicContact CG1-CD2 3.99Å; V161-L173 HydrophobicContact CG1-CG 3.72Å; V161-A177 HydrophobicContact CB-CB 4.27Å; V161-A177 HydrophobicContact CG1-CB 4.03Å
162	M	95.4	Very high	92.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-45.3	175.3	-177.6	178.7	165.5	0	0	111.2	C158 L159 Q160 A165 D166 Y174 A177 K178 L201 D204 I205	C158-M162 WeakPolarHBondContact O-CB 3.41Å; C158-M162 PolarHBondContact O-N 2.94Å; L159-M162 PolarHBondContact O-N 3.45Å; Q160-M162 VanDerWaalsContact C-N 3.35Å; M162-A165 PolarHBondContact O-N 2.87Å; M162-D166 PolarHBondContact O-N 3.17Å; M162-Y174 HydrophobicContact CE-CE1 4.47Å; M162-Y174 HydrophobicContact CE-CE2 3.73Å; M162-Y174 VanDerWaalsContact CE-OH 3.27Å; M162-Y174 WeakPolarHBondContact CE-OH 3.28Å; M162-Y174 HydrophobicContact CG-CD2 3.8Å; M162-Y174 HydrophobicContact CG-CE2 3.56Å; M162-Y174 WeakPolarHBondContact O-CD2 3.44Å; M162-Y174 HydrophobicContact SD-CE2 4.5Å; M162-A177 HydrophobicContact CB-CB 3.7Å; M162-K178 HydrophobicContact CE-CB 4.28Å; M162-K178 HydrophobicContact CE-CG 4.27Å; M162-K178 HydrophobicContact SD-CB 4.06Å; M162-L201 HydrophobicContact CE-CB 3.99Å; M162-L201 HydrophobicContact CE-CD2 4.08Å; M162-D204 HydrophobicContact CE-CB 4.34Å; M162-I205 HydrophobicContact CE-CD1 4.22Å; M162-I205 HydrophobicContact CE-CG1 3.83Å; M162-I205 HydrophobicContact SD-CD1 4.12Å; M162-I205 HydrophobicContact SD-CG1 4.11Å
163	W	93.1	Very high	93.3	Very high	116 Å²	116	59.1 Å²	59.1	44%	0.439	29%	0.288	S	S	.	.	H	α-helix	trans	-64	-41	175.9	-179.6	80.6	0	0	0	112.5	L159 Q160 D166 R167 L201	L159-W163 PolarHBondContact O-N 3.47Å; Q160-W163 PolarHBondContact O-N 3.12Å; W163-D166 PolarHBondContact O-N 3.39Å; W163-R167 PolarHBondContact O-N 2.91Å; W163-L201 HydrophobicContact CB-CD1 4.21Å
164	L	93.3	Very high	93.6	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-47.8	175.4	-177.1	66.7	0	0	0	111.1	Q127 Y130 E131 L149 Q160 V161 D166 R167 H168	Q127-L164 HydrophobicContact CG-CD1 4.23Å; Q127-L164 HydrophobicContact CG-CD2 3.89Å; Y130-L164 HydrophobicContact CD1-CD1 4.17Å; Y130-L164 HydrophobicContact CD1-CD2 3.81Å; Y130-L164 HydrophobicContact CD1-CG 3.96Å; Y130-L164 HydrophobicContact CE1-CD1 4.19Å; Y130-L164 HydrophobicContact CE1-CD2 3.97Å; Y130-L164 HydrophobicContact CE1-CG 3.73Å; E131-L164 HydrophobicContact CG-CD1 3.85Å; E131-L164 WeakPolarHBondContact OE1-CD1 3.38Å; L149-L164 HydrophobicContact CD1-CD2 4.06Å; Q160-L164 WeakPolarHBondContact O-CB 3.46Å; Q160-L164 PolarHBondContact O-N 3.27Å; V161-L164 PolarHBondContact O-N 3.02Å; L164-D166 PolarHBondContact O-N 2.95Å; L164-R167 PolarHBondContact O-N 3.35Å; L164-H168 PolarHBondContact O-CD2 2.9Å; L164-H168 VanDerWaalsContact O-CD2 3.27Å; L164-H168 PolarHBondContact O-N 2.92Å
165	A	95.8	Very high	93.8	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-38.3	-179.8	0	0	0	0	0	112.7	V161 M162 H168 S169 D170 L173 Y174	V161-A165 VanDerWaalsContact O-CB 3.31Å; V161-A165 WeakPolarHBondContact O-CB 3.45Å; V161-A165 PolarHBondContact O-N 3.02Å; M162-A165 PolarHBondContact O-N 2.87Å; A165-H168 CarbonylContact O-C 3.45Å; A165-H168 PolarHBondContact O-N 2.79Å; A165-S169 PolarHBondContact O-N 3.11Å; A165-D170 HydrophobicContact CB-CB 4.28Å; A165-D170 PolarHBondContact O-N 3.19Å; A165-L173 HydrophobicContact CB-CB 3.94Å; A165-L173 HydrophobicContact CB-CD2 4.03Å; A165-L173 HydrophobicContact CB-CG 3.87Å; A165-Y174 HydrophobicContact CB-CD2 4.4Å
166	D	94.3	Very high	93.7	Very high	80 Å²	80	58.2 Å²	58.2	43%	0.428	29%	0.287	S	S	.	.	H	α-helix	trans	-59.9	-47.4	174.5	-174.5	64.7	0	0	0	111.4	M162 W163 L164 H168 S169 Y174 L201	M162-D166 PolarHBondContact O-N 3.17Å; W163-D166 PolarHBondContact O-N 3.39Å; L164-D166 PolarHBondContact O-N 2.95Å; D166-H168 VanDerWaalsContact C-N 3.27Å; D166-H168 PolarHBondContact O-N 3.42Å; D166-S169 PolarHBondContact O-N 3.17Å; D166-S169 VanDerWaalsContact O-N 3.16Å; D166-Y174 HydrophobicContact CB-CD2 3.98Å; D166-Y174 HydrophobicContact CB-CE2 3.89Å; D166-L201 HydrophobicContact CB-CD2 4.24Å
167	R	92.9	Very high	93.9	Very high	110 Å²	110	49.1 Å²	49.1	42%	0.415	25%	0.248	S	C	.	.	H	α-helix	trans	-61.4	-34	179.5	-179	165.6	56.9	116.9	-5.1	113.1	E131 W163 L164	E131-R167 IonicContact OE1-CZ 2.72Å; E131-R167 IonicContact OE1-NH2 2.85Å; E131-R167 PolarHBondContact OE1-NH2 3.23Å; E131-R167 IonicContact OE2-CZ 3.59Å; E131-R167 IonicContact OE2-NH1 3.92Å; E131-R167 PolarHBondContact OE2-NH1 2.95Å; E131-R167 IonicContact OE2-NH2 3.95Å; E131-R167 PolarHBondContact OE2-NH2 3.16Å; W163-R167 PolarHBondContact O-N 2.91Å; L164-R167 PolarHBondContact O-N 3.35Å
168	H	94.4	Very high	94	Very high	23 Å²	23	47.6 Å²	47.6	11%	0.106	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	8.2	-179.5	-69.6	-78.4	0	0	0	113.6	Y130 E131 D134 F142 L164 A165 D166 D170	Y130-H168 HydrophobicContact CE1-CB 3.91Å; Y130-H168 AromaticContact CE1-CD2 3.59Å; Y130-H168 AromaticContact CE1-CG 3.73Å; E131-H168 WeakPolarHBondContact CG-NE2 3.45Å; D134-H168 IonicContact OD2-CE1 2.6Å; D134-H168 IonicContact OD2-CG 2.73Å; D134-H168 IonicContact OD2-ND1 3.86Å; D134-H168 PolarHBondContact OD2-ND1 3.12Å; F142-H168 HydrophobicContact CE2-CB 4.27Å; F142-H168 HydrophobicContact CZ-CB 4.41Å; L164-H168 PolarHBondContact O-CD2 2.9Å; L164-H168 VanDerWaalsContact O-CD2 3.27Å; L164-H168 PolarHBondContact O-N 2.92Å; A165-H168 CarbonylContact O-C 3.45Å; A165-H168 PolarHBondContact O-N 2.79Å; D166-H168 VanDerWaalsContact C-N 3.27Å; D166-H168 PolarHBondContact O-N 3.42Å; H168-D170 PolarHBondContact O-N 3.32Å
169	S	94.3	Very high	93.7	Very high	110 Å²	110	53 Å²	53	77%	0.769	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	32.5	-178.4	-56.7	0	0	0	0	113.8	A165 D166 Q171	A165-S169 PolarHBondContact O-N 3.11Å; D166-S169 PolarHBondContact O-N 3.17Å; D166-S169 VanDerWaalsContact O-N 3.16Å; S169-Q171 PolarHBondContact O-N 3.49Å
170	D	96.3	Very high	93.4	Very high	15 Å²	15	53.2 Å²	53.2	8%	0.08	27%	0.266	C	S	.	.			trans	-89.8	90.4	-179.4	-173.4	-21.1	0	0	0	110.6	Y130 F142 S146 A165 H168 E172 L173 Y174	Y130-D170 WeakPolarHBondContact OH-CB 3.48Å; Y130-D170 PolarHBondContact OH-OD2 3.26Å; F142-D170 HydrophobicContact CZ-CB 4.21Å; S146-D170 WeakPolarHBondContact CB-OD2 3.17Å; S146-D170 PolarHBondContact OG-OD1 3.32Å; S146-D170 PolarHBondContact OG-OD2 3.39Å; A165-D170 HydrophobicContact CB-CB 4.28Å; A165-D170 PolarHBondContact O-N 3.19Å; H168-D170 PolarHBondContact O-N 3.32Å; D170-E172 VanDerWaalsContact C-N 3.34Å; D170-E172 PolarHBondContact O-N 3.17Å; D170-E172 PolarHBondContact OD1-N 2.94Å; D170-L173 HydrophobicContact CB-CB 4.23Å; D170-L173 VanDerWaalsContact CG-CB 3.45Å; D170-L173 WeakPolarHBondContact OD1-CB 3.2Å; D170-L173 PolarHBondContact OD1-N 3.08Å; D170-L173 VanDerWaalsContact OD1-N 3.1Å; D170-L173 WeakPolarHBondContact OD2-CB 3.48Å; D170-Y174 WeakPolarHBondContact O-CB 3.32Å; D170-Y174 PolarHBondContact O-N 3.15Å
171	Q	94.6	Very high	93.4	Very high	129 Å²	129	48.2 Å²	48.2	60%	0.603	24%	0.243	S	C	*	.	H	α-helix	trans	-67	-33.6	-172.1	-168.6	60.4	48.7	0	0	113.4	S169 T175	S169-Q171 PolarHBondContact O-N 3.49Å; Q171-T175 PolarHBondContact NE2-OG1 3.46Å; Q171-T175 WeakPolarHBondContact O-CB 3.26Å; Q171-T175 PolarHBondContact O-N 3.28Å; Q171-T175 PolarHBondContact O-OG1 3.08Å
172	E	91.7	Very high	93.1	Very high	161 Å²	161	48.9 Å²	48.9	75%	0.752	25%	0.245	S	C	*	.	H	α-helix	trans	-69.2	-49.4	-179.3	-69.1	-170.2	177.6	0	0	110.3	D170 T175 A176	D170-E172 VanDerWaalsContact C-N 3.34Å; D170-E172 PolarHBondContact O-N 3.17Å; D170-E172 PolarHBondContact OD1-N 2.94Å; E172-T175 PolarHBondContact O-N 3.12Å; E172-A176 PolarHBondContact O-N 3.13Å; E172-A176 VanDerWaalsContact O-N 3.13Å
173	L	95.6	Very high	92.4	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-63.9	-42.8	177.1	-175.4	59.5	0	0	0	111.6	Y130 L149 S150 V153 V161 A165 D170 T175 A176 A177	Y130-L173 HydrophobicContact CE2-CD2 4.33Å; L149-L173 HydrophobicContact CB-CD1 3.75Å; L149-L173 HydrophobicContact CB-CD2 3.97Å; L149-L173 HydrophobicContact CD1-CD2 3.87Å; S150-L173 VanDerWaalsContact N-CD1 3.34Å; V153-L173 HydrophobicContact CG2-CD1 4.4Å; V161-L173 HydrophobicContact CG1-CD1 3.57Å; V161-L173 HydrophobicContact CG1-CD2 3.99Å; V161-L173 HydrophobicContact CG1-CG 3.72Å; A165-L173 HydrophobicContact CB-CB 3.94Å; A165-L173 HydrophobicContact CB-CD2 4.03Å; A165-L173 HydrophobicContact CB-CG 3.87Å; D170-L173 HydrophobicContact CB-CB 4.23Å; D170-L173 VanDerWaalsContact CG-CB 3.45Å; D170-L173 WeakPolarHBondContact OD1-CB 3.2Å; D170-L173 PolarHBondContact OD1-N 3.08Å; D170-L173 VanDerWaalsContact OD1-N 3.1Å; D170-L173 WeakPolarHBondContact OD2-CB 3.48Å; L173-T175 VanDerWaalsContact C-N 3.31Å; L173-T175 PolarHBondContact O-N 3.16Å; L173-A176 PolarHBondContact O-N 3.16Å; L173-A177 WeakPolarHBondContact O-CB 3.25Å; L173-A177 PolarHBondContact O-N 2.85Å
174	Y	96.3	Very high	92	Very high	13 Å²	13	49 Å²	49	5%	0.051	25%	0.251	C	S	.	.	H	α-helix	trans	-58.1	-44.7	177	-177.2	-96.6	0	0	0	111.3	M162 A165 D166 D170 A176 A177 K178 L201 D204	M162-Y174 HydrophobicContact CE-CE1 4.47Å; M162-Y174 HydrophobicContact CE-CE2 3.73Å; M162-Y174 VanDerWaalsContact CE-OH 3.27Å; M162-Y174 WeakPolarHBondContact CE-OH 3.28Å; M162-Y174 HydrophobicContact CG-CD2 3.8Å; M162-Y174 HydrophobicContact CG-CE2 3.56Å; M162-Y174 WeakPolarHBondContact O-CD2 3.44Å; M162-Y174 HydrophobicContact SD-CE2 4.5Å; A165-Y174 HydrophobicContact CB-CD2 4.4Å; D166-Y174 HydrophobicContact CB-CD2 3.98Å; D166-Y174 HydrophobicContact CB-CE2 3.89Å; D170-Y174 WeakPolarHBondContact O-CB 3.32Å; D170-Y174 PolarHBondContact O-N 3.15Å; Y174-A176 PolarHBondContact O-N 3.32Å; Y174-A177 PolarHBondContact O-N 2.95Å; Y174-K178 HydrophobicContact CD1-CD 4.38Å; Y174-K178 HydrophobicContact CE1-CD 3.81Å; Y174-K178 WeakPolarHBondContact O-CB 3.35Å; Y174-K178 PolarHBondContact O-N 3.4Å; Y174-L201 HydrophobicContact CE2-CD2 3.87Å; Y174-D204 VanDerWaalsContact OH-CB 3.31Å; Y174-D204 WeakPolarHBondContact OH-CB 3.48Å; Y174-D204 VanDerWaalsContact OH-CG 3.24Å; Y174-D204 PolarHBondContact OH-OD2 2.48Å
175	T	92.3	Very high	91.8	Very high	75 Å²	75	48.9 Å²	48.9	46%	0.46	25%	0.251	S	S	.	.	H	α-helix	trans	-65.3	-41.6	-179.3	-56.7	0	0	0	0	111.6	Q171 E172 L173 H179	Q171-T175 PolarHBondContact NE2-OG1 3.46Å; Q171-T175 WeakPolarHBondContact O-CB 3.26Å; Q171-T175 PolarHBondContact O-N 3.28Å; Q171-T175 PolarHBondContact O-OG1 3.08Å; E172-T175 PolarHBondContact O-N 3.12Å; L173-T175 VanDerWaalsContact C-N 3.31Å; L173-T175 PolarHBondContact O-N 3.16Å; T175-H179 WeakPolarHBondContact O-CB 3.43Å; T175-H179 PolarHBondContact O-N 2.88Å
176	A	87.8	Confident	91.4	Very high	31 Å²	31	51.6 Å²	51.6	26%	0.256	27%	0.267	S	S	.	.	H	α-helix	trans	-63.5	-47.8	176.3	0	0	0	0	0	111.9	E172 L173 Y174 H179 C180	E172-A176 PolarHBondContact O-N 3.13Å; E172-A176 VanDerWaalsContact O-N 3.13Å; L173-A176 PolarHBondContact O-N 3.16Å; Y174-A176 PolarHBondContact O-N 3.32Å; A176-H179 PolarHBondContact O-N 2.89Å; A176-C180 PolarHBondContact O-N 3.01Å; A176-C180 VanDerWaalsContact O-N 3.09Å
177	A	94.9	Very high	91.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-44.5	179.3	0	0	0	0	0	112.3	V153 V161 M162 L173 Y174 H179 C180 A181	V153-A177 HydrophobicContact CG2-CB 4.47Å; V161-A177 HydrophobicContact CB-CB 4.27Å; V161-A177 HydrophobicContact CG1-CB 4.03Å; M162-A177 HydrophobicContact CB-CB 3.7Å; L173-A177 WeakPolarHBondContact O-CB 3.25Å; L173-A177 PolarHBondContact O-N 2.85Å; Y174-A177 PolarHBondContact O-N 2.95Å; A177-H179 VanDerWaalsContact C-N 3.35Å; A177-H179 PolarHBondContact O-N 2.77Å; A177-C180 WeakPolarHBondContact O-CB 3.46Å; A177-C180 PolarHBondContact O-N 2.85Å; A177-A181 PolarHBondContact O-N 3.24Å
178	K	94.4	Very high	91.1	Very high	14 Å²	14	48.5 Å²	48.5	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-42.1	173.8	179.1	179	-176.8	173.4	0	112.2	M162 Y174 A181 K182 D204 D208	M162-K178 HydrophobicContact CE-CB 4.28Å; M162-K178 HydrophobicContact CE-CG 4.27Å; M162-K178 HydrophobicContact SD-CB 4.06Å; Y174-K178 HydrophobicContact CD1-CD 4.38Å; Y174-K178 HydrophobicContact CE1-CD 3.81Å; Y174-K178 WeakPolarHBondContact O-CB 3.35Å; Y174-K178 PolarHBondContact O-N 3.4Å; K178-A181 PolarHBondContact O-N 3.28Å; K178-K182 WeakPolarHBondContact O-CG 3.4Å; K178-K182 PolarHBondContact O-N 2.91Å; K178-D204 WeakPolarHBondContact CE-O 3.4Å; K178-D204 PolarHBondContact NZ-O 2.91Å; K178-D204 IonicContact NZ-OD2 2.86Å; K178-D204 PolarHBondContact NZ-OD2 2.84Å; K178-D208 WeakPolarHBondContact CE-OD2 3.44Å; K178-D208 IonicContact NZ-OD1 2.85Å; K178-D208 IonicContact NZ-OD2 3.51Å; K178-D208 PolarHBondContact NZ-OD2 2.97Å
179	H	88.7	Confident	91	Very high	112 Å²	112	48.5 Å²	48.5	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-45.2	177.4	-177.1	63.8	0	0	0	111.4	T175 A176 A177 A181 K182 I183	T175-H179 WeakPolarHBondContact O-CB 3.43Å; T175-H179 PolarHBondContact O-N 2.88Å; A176-H179 PolarHBondContact O-N 2.89Å; A177-H179 VanDerWaalsContact C-N 3.35Å; A177-H179 PolarHBondContact O-N 2.77Å; H179-A181 PolarHBondContact O-N 2.91Å; H179-K182 PolarHBondContact O-N 3.45Å; H179-I183 WeakPolarHBondContact O-CG1 3.1Å; H179-I183 PolarHBondContact O-N 2.92Å
180	C	87.7	Confident	90.8	Very high	13 Å²	13	50.3 Å²	50.3	9%	0.088	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-46	174.7	-174.8	0	0	0	0	111.7	V153 C158 A176 A177 K182 I183 H184	V153-C180 HydrophobicContact CG1-CB 3.53Å; C158-C180 HydrophobicContact CB-CB 3.83Å; A176-C180 PolarHBondContact O-N 3.01Å; A176-C180 VanDerWaalsContact O-N 3.09Å; A177-C180 WeakPolarHBondContact O-CB 3.46Å; A177-C180 PolarHBondContact O-N 2.85Å; C180-K182 VanDerWaalsContact C-N 3.32Å; C180-K182 PolarHBondContact O-N 2.87Å; C180-I183 WeakPolarHBondContact O-CG1 3.38Å; C180-I183 PolarHBondContact O-N 2.73Å; C180-H184 PolarHBondContact O-CD2 3.46Å; C180-H184 PolarHBondContact O-N 2.8Å
181	A	93.4	Very high	90.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-40.3	177.4	0	0	0	0	0	112.7	L159 A177 K178 H179 L185 L188 I205	L159-A181 HydrophobicContact CD2-CB 3.88Å; A177-A181 PolarHBondContact O-N 3.24Å; K178-A181 PolarHBondContact O-N 3.28Å; H179-A181 PolarHBondContact O-N 2.91Å; A181-L185 PolarHBondContact O-N 3.08Å; A181-L185 VanDerWaalsContact O-N 3.16Å; A181-L188 HydrophobicContact CB-CD1 4.11Å; A181-I205 HydrophobicContact CB-CD1 4.07Å; A181-I205 HydrophobicContact CB-CG1 4.37Å
182	K	88.7	Confident	90.7	Very high	23 Å²	23	50.6 Å²	50.6	10%	0.1	26%	0.259	C	S	.	.	H	α-helix	trans	-63.3	-46.1	178	-76	176.5	175.6	-174.9	0	113.1	K178 H179 C180 H184 I205 D208 V210	K178-K182 WeakPolarHBondContact O-CG 3.4Å; K178-K182 PolarHBondContact O-N 2.91Å; H179-K182 PolarHBondContact O-N 3.45Å; C180-K182 VanDerWaalsContact C-N 3.32Å; C180-K182 PolarHBondContact O-N 2.87Å; K182-H184 VanDerWaalsContact C-N 3.32Å; K182-H184 PolarHBondContact O-N 2.78Å; K182-I205 WeakPolarHBondContact CE-O 3.13Å; K182-I205 HydrophobicContact CG-CG2 3.9Å; K182-I205 WeakPolarHBondContact CG-O 3.44Å; K182-D208 VanDerWaalsContact NZ-CB 3.32Å; K182-D208 IonicContact NZ-OD2 3.31Å; K182-D208 PolarHBondContact NZ-OD2 3.42Å; K182-V210 HydrophobicContact CG-CG2 4.5Å
183	I	80.8	Confident	90.7	Very high	62 Å²	62	48.3 Å²	48.3	32%	0.318	25%	0.248	S	C	.	.	H	α-helix	trans	-82.6	-8.6	-173.8	66.3	177.3	0	0	0	113.6	H179 C180 Q214	H179-I183 WeakPolarHBondContact O-CG1 3.1Å; H179-I183 PolarHBondContact O-N 2.92Å; C180-I183 WeakPolarHBondContact O-CG1 3.38Å; C180-I183 PolarHBondContact O-N 2.73Å; I183-Q214 PolarHBondContact O-NE2 2.72Å; I183-Q214 PolarHBondContact O-OE1 3.19Å
184	H	83.6	Confident	90.7	Very high	55 Å²	55	48.3 Å²	48.3	26%	0.255	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125	20.6	178.8	-62.2	-59.5	0	0	0	113.5	V155 C180 K182 V186 Q187 L188 Q214	V155-H184 HydrophobicContact CG1-CB 4.16Å; V155-H184 HydrophobicContact CG2-CB 3.85Å; C180-H184 PolarHBondContact O-CD2 3.46Å; C180-H184 PolarHBondContact O-N 2.8Å; K182-H184 VanDerWaalsContact C-N 3.32Å; K182-H184 PolarHBondContact O-N 2.78Å; H184-V186 PolarHBondContact O-N 2.79Å; H184-V186 VanDerWaalsContact O-N 3.12Å; H184-Q187 PolarHBondContact O-N 3.01Å; H184-L188 PolarHBondContact O-N 2.7Å; H184-Q214 VanDerWaalsContact C-OE1 3.32Å
185	L	89.8	Confident	90.6	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-32.1	-176.2	-171	67.3	0	0	0	112.8	A181 Q187 L188 H189 F194 I205 V210 Q214 P216 A219	A181-L185 PolarHBondContact O-N 3.08Å; A181-L185 VanDerWaalsContact O-N 3.16Å; L185-Q187 PolarHBondContact O-N 3.21Å; L185-L188 PolarHBondContact O-N 2.73Å; L185-L188 VanDerWaalsContact O-N 3.16Å; L185-H189 PolarHBondContact O-N 3.29Å; L185-F194 HydrophobicContact CD1-CD2 4.2Å; L185-F194 HydrophobicContact CD1-CE2 3.36Å; L185-F194 HydrophobicContact CD1-CZ 3.77Å; L185-I205 HydrophobicContact CD1-CG2 4.44Å; L185-V210 HydrophobicContact CD2-CG1 3.87Å; L185-Q214 HydrophobicContact CB-CB 4.01Å; L185-Q214 VanDerWaalsContact N-OE1 3.13Å; L185-P216 HydrophobicContact CD2-CB 3.99Å; L185-A219 HydrophobicContact CD1-CB 4.13Å; L185-A219 HydrophobicContact CD2-CB 3.76Å; L185-A219 HydrophobicContact CG-CB 3.73Å
186	V	86.9	Confident	90.7	Very high	57 Å²	57	50 Å²	50	35%	0.345	26%	0.255	S	S	.	.	H	α-helix	trans	-66.2	-24.2	176.2	76.8	0	0	0	0	113.5	H184 H189 Q214	H184-V186 PolarHBondContact O-N 2.79Å; H184-V186 VanDerWaalsContact O-N 3.12Å; V186-H189 PolarHBondContact O-CD2 2.78Å; V186-Q214 VanDerWaalsContact N-OE1 3.15Å
187	Q	87.3	Confident	91	Very high	119 Å²	119	48.9 Å²	48.9	56%	0.556	25%	0.245	S	C	*	.	H	α-helix	trans	-87.3	-27.7	174.6	-60.6	-178.5	20.9	0	0	111.2	V155 H184 L185	V155-Q187 HydrophobicContact CG1-CB 3.99Å; H184-Q187 PolarHBondContact O-N 3.01Å; L185-Q187 PolarHBondContact O-N 3.21Å
188	L	92.8	Very high	90.9	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-86.3	-29.5	-174.7	-66.5	172.5	0	0	0	113.8	V155 L159 A181 H184 L185 Q190 T191 F194	V155-L188 HydrophobicContact CG1-CD2 3.83Å; V155-L188 HydrophobicContact CG1-CG 4.19Å; V155-L188 WeakPolarHBondContact O-CD2 3.35Å; L159-L188 HydrophobicContact CD1-CD1 4.47Å; L159-L188 HydrophobicContact CD1-CD2 4.11Å; L159-L188 HydrophobicContact CD2-CD1 4.29Å; L159-L188 HydrophobicContact CG-CD1 4.31Å; L159-L188 HydrophobicContact CG-CD2 4.36Å; A181-L188 HydrophobicContact CB-CD1 4.11Å; H184-L188 PolarHBondContact O-N 2.7Å; L185-L188 PolarHBondContact O-N 2.73Å; L185-L188 VanDerWaalsContact O-N 3.16Å; L188-Q190 PolarHBondContact O-N 2.96Å; L188-T191 PolarHBondContact O-N 2.95Å; L188-T191 PolarHBondContact O-OG1 3.03Å; L188-F194 HydrophobicContact CB-CD2 4.34Å; L188-F194 WeakPolarHBondContact O-CB 3.42Å
189	H	92.4	Very high	90.9	Very high	23 Å²	23	53.1 Å²	53.1	11%	0.106	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.7	-165	81.2	95.7	0	0	0	116.2	L185 V186 F194 A219 S222	L185-H189 PolarHBondContact O-N 3.29Å; V186-H189 PolarHBondContact O-CD2 2.78Å; H189-F194 HydrophobicContact CB-CD1 4.36Å; H189-F194 HydrophobicContact CB-CE1 4.22Å; H189-A219 HydrophobicContact CB-CB 3.61Å; H189-S222 PolarHBondContact ND1-OG 2.9Å; H189-S222 VanDerWaalsContact ND1-OG 3.11Å
190	Q	90.8	Very high	91	Very high	148 Å²	148	51.5 Å²	51.5	69%	0.692	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-3.6	178	-59.1	-173.3	-15.8	0	0	113.5	L188	L188-Q190 PolarHBondContact O-N 2.96Å
191	T	94.8	Very high	91.3	Very high	42 Å²	42	51 Å²	51	26%	0.258	27%	0.267	S	S	.	.	S	Bend	trans	-81.6	149.1	-177.7	82.9	0	0	0	0	111	L188 E193 F194 L195	L188-T191 PolarHBondContact O-N 2.95Å; L188-T191 PolarHBondContact O-OG1 3.03Å; T191-E193 WeakPolarHBondContact CB-OE2 3.32Å; T191-E193 PolarHBondContact O-N 3.44Å; T191-E193 PolarHBondContact OG1-OE2 3.32Å; T191-F194 PolarHBondContact O-N 3.2Å; T191-F194 VanDerWaalsContact O-N 3.12Å; T191-F194 PolarHBondContact OG1-N 3.13Å; T191-L195 WeakPolarHBondContact O-CG 3.49Å; T191-L195 PolarHBondContact O-N 3.11Å
192	D	93.4	Very high	91.3	Very high	109 Å²	109	51 Å²	51	58%	0.583	27%	0.267	S	S	*	.	H	α-helix	trans	-60.6	-33.9	-179.7	-73.5	-34.3	0	0	0	111.5	F194 L195 N196	D192-F194 VanDerWaalsContact C-N 3.35Å; D192-F194 PolarHBondContact O-N 2.78Å; D192-L195 PolarHBondContact O-N 2.98Å; D192-N196 WeakPolarHBondContact O-CB 3.33Å; D192-N196 PolarHBondContact O-N 2.94Å; D192-N196 PolarHBondContact O-ND2 3.04Å
193	E	93.1	Very high	91.6	Very high	112 Å²	112	51.3 Å²	51.3	52%	0.523	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-41.3	176.8	-56.8	78.9	-172.9	0	0	111.6	L159 T191 L197	L159-E193 HydrophobicContact CB-CB 4.45Å; L159-E193 HydrophobicContact CD1-CB 4.09Å; T191-E193 WeakPolarHBondContact CB-OE2 3.32Å; T191-E193 PolarHBondContact O-N 3.44Å; T191-E193 PolarHBondContact OG1-OE2 3.32Å; E193-L197 PolarHBondContact O-N 2.76Å
194	F	95.3	Very high	92.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.6	-43.8	176.5	-175.9	-94.5	0	0	0	111.6	L159 L185 L188 H189 T191 D192 N196 L197 L202 A219 W223	L159-F194 HydrophobicContact CD1-CB 3.73Å; L159-F194 HydrophobicContact CD1-CD2 4.14Å; L159-F194 HydrophobicContact CD1-CG 4.46Å; L185-F194 HydrophobicContact CD1-CD2 4.2Å; L185-F194 HydrophobicContact CD1-CE2 3.36Å; L185-F194 HydrophobicContact CD1-CZ 3.77Å; L188-F194 HydrophobicContact CB-CD2 4.34Å; L188-F194 WeakPolarHBondContact O-CB 3.42Å; H189-F194 HydrophobicContact CB-CD1 4.36Å; H189-F194 HydrophobicContact CB-CE1 4.22Å; T191-F194 PolarHBondContact O-N 3.2Å; T191-F194 VanDerWaalsContact O-N 3.12Å; T191-F194 PolarHBondContact OG1-N 3.13Å; D192-F194 VanDerWaalsContact C-N 3.35Å; D192-F194 PolarHBondContact O-N 2.78Å; F194-N196 PolarHBondContact O-N 3.22Å; F194-L197 WeakPolarHBondContact O-CB 3.49Å; F194-L197 PolarHBondContact O-N 2.8Å; F194-L202 HydrophobicContact CE2-CD1 4.06Å; F194-L202 HydrophobicContact CZ-CD1 3.78Å; F194-A219 HydrophobicContact CE1-CB 4.28Å; F194-A219 HydrophobicContact CZ-CB 4.04Å; F194-W223 HydrophobicContact CE1-CB 4.04Å; F194-W223 VanDerWaalsContact O-CD1 3.31Å
195	L	94.6	Very high	92.6	Very high	22 Å²	22	47.3 Å²	47.3	12%	0.115	25%	0.25	C	S	.	.	H	α-helix	trans	-64.6	-27	-179	-63.3	177.4	0	0	0	112.3	T191 D192 H226 R231	T191-L195 WeakPolarHBondContact O-CG 3.49Å; T191-L195 PolarHBondContact O-N 3.11Å; D192-L195 PolarHBondContact O-N 2.98Å; L195-H226 HydrophobicContact CB-CB 4.23Å; L195-H226 HydrophobicContact CD2-CB 4.15Å; L195-R231 PolarHBondContact O-NH1 2.83Å; L195-R231 PolarHBondContact O-NH2 3.22Å
196	N	93.6	Very high	92.7	Very high	102 Å²	102	47.2 Å²	47.2	55%	0.545	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.7	175	-71.2	-67.2	0	0	0	114.3	D192 F194	D192-N196 WeakPolarHBondContact O-CB 3.33Å; D192-N196 PolarHBondContact O-N 2.94Å; D192-N196 PolarHBondContact O-ND2 3.04Å; F194-N196 PolarHBondContact O-N 3.22Å
197	L	93.6	Very high	92.8	Very high	8 Å²	8	48.7 Å²	48.7	4%	0.042	25%	0.252	C	S	.	.			trans	-62.4	135.2	-177.2	-156.1	82.9	0	0	0	111.6	L159 E193 F194 L201 L202 I205 W223	L159-L197 HydrophobicContact CB-CD1 4.41Å; L159-L197 HydrophobicContact CD2-CD1 4.12Å; E193-L197 PolarHBondContact O-N 2.76Å; F194-L197 WeakPolarHBondContact O-CB 3.49Å; F194-L197 PolarHBondContact O-N 2.8Å; L197-L201 HydrophobicContact CD1-CB 4.37Å; L197-L201 HydrophobicContact CD1-CD1 4.39Å; L197-L201 HydrophobicContact CD2-CB 3.87Å; L197-L201 HydrophobicContact CG-CB 3.92Å; L197-L202 HydrophobicContact CD2-CB 3.99Å; L197-I205 HydrophobicContact CD2-CD1 3.74Å; L197-W223 WeakPolarHBondContact O-CZ2 3.13Å; L197-W223 PolarHBondContact O-NE1 2.88Å
198	P	93.3	Very high	92.4	Very high	54 Å²	54	46.9 Å²	46.9	35%	0.351	25%	0.246	S	C	.	.			trans	-59.9	147.2	171	-25.2	34.4	0	0	0	112.8	C200 L201 L202	P198-C200 VanDerWaalsContact C-N 3.26Å; P198-C200 PolarHBondContact O-N 2.95Å; P198-L201 HydrophobicContact CB-CG 4.45Å; P198-L201 HydrophobicContact CG-CD1 4.34Å; P198-L201 PolarHBondContact O-N 2.83Å; P198-L201 VanDerWaalsContact O-N 3.14Å; P198-L202 PolarHBondContact O-N 3.43Å; P198-L202 VanDerWaalsContact O-N 3.09Å
199	L	93.3	Very high	91.7	Very high	49 Å²	49	46.9 Å²	46.9	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-55.5	-39.9	179.9	177.5	65.5	0	0	0	112.5	L201 L202 M203 W223 F234 L238	L199-L201 PolarHBondContact O-N 3.09Å; L199-L202 PolarHBondContact O-N 3.35Å; L199-M203 HydrophobicContact CD1-CE 4.28Å; L199-M203 VanDerWaalsContact O-CB 3.3Å; L199-M203 WeakPolarHBondContact O-CB 2.96Å; L199-M203 PolarHBondContact O-N 3.43Å; L199-W223 HydrophobicContact CB-CH2 4.17Å; L199-W223 HydrophobicContact CB-CZ2 4.42Å; L199-W223 HydrophobicContact CD1-CH2 3.95Å; L199-W223 HydrophobicContact CD1-CZ3 4.26Å; L199-F234 HydrophobicContact CD1-CB 4.15Å; L199-F234 HydrophobicContact CD1-CG 4.19Å; L199-F234 HydrophobicContact CD2-CB 4.48Å; L199-F234 HydrophobicContact CD2-CD1 3.51Å; L199-F234 HydrophobicContact CD2-CD2 4.11Å; L199-F234 HydrophobicContact CD2-CE1 3.68Å; L199-F234 HydrophobicContact CD2-CE2 4.27Å; L199-F234 HydrophobicContact CD2-CG 3.76Å; L199-F234 HydrophobicContact CD2-CZ 4.07Å; L199-L238 HydrophobicContact CD1-CD1 4.22Å; L199-L238 HydrophobicContact CD1-CD2 3.86Å; L199-L238 HydrophobicContact CD1-CG 4.18Å
200	C	92.6	Very high	91.1	Very high	77 Å²	77	45.8 Å²	45.8	52%	0.52	24%	0.242	S	C	.	.	H	α-helix	trans	-60.3	-43.7	179.2	52.7	0	0	0	0	112.3	P198 M203 D204	P198-C200 VanDerWaalsContact C-N 3.26Å; P198-C200 PolarHBondContact O-N 2.95Å; C200-M203 WeakPolarHBondContact O-CB 3.38Å; C200-M203 PolarHBondContact O-N 3.1Å; C200-D204 WeakPolarHBondContact O-CB 3.47Å; C200-D204 PolarHBondContact O-N 3.39Å
201	L	92.8	Very high	90.2	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-70.8	-39	179.6	-62.1	-169.7	0	0	0	111.4	M162 W163 D166 Y174 L197 P198 L199 D204 I205	M162-L201 HydrophobicContact CE-CB 3.99Å; M162-L201 HydrophobicContact CE-CD2 4.08Å; W163-L201 HydrophobicContact CB-CD1 4.21Å; D166-L201 HydrophobicContact CB-CD2 4.24Å; Y174-L201 HydrophobicContact CE2-CD2 3.87Å; L197-L201 HydrophobicContact CD1-CB 4.37Å; L197-L201 HydrophobicContact CD1-CD1 4.39Å; L197-L201 HydrophobicContact CD2-CB 3.87Å; L197-L201 HydrophobicContact CG-CB 3.92Å; P198-L201 HydrophobicContact CB-CG 4.45Å; P198-L201 HydrophobicContact CG-CD1 4.34Å; P198-L201 PolarHBondContact O-N 2.83Å; P198-L201 VanDerWaalsContact O-N 3.14Å; L199-L201 PolarHBondContact O-N 3.09Å; L201-D204 WeakPolarHBondContact O-CB 3.23Å; L201-D204 PolarHBondContact O-N 3.04Å; L201-I205 WeakPolarHBondContact O-CG1 3.44Å; L201-I205 PolarHBondContact O-N 2.86Å
202	L	94.6	Very high	89	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-62.2	-46.7	173.9	-179.8	58.6	0	0	0	111	F194 L197 P198 L199 D204 I205 I206 W223 L238	F194-L202 HydrophobicContact CE2-CD1 4.06Å; F194-L202 HydrophobicContact CZ-CD1 3.78Å; L197-L202 HydrophobicContact CD2-CB 3.99Å; P198-L202 PolarHBondContact O-N 3.43Å; P198-L202 VanDerWaalsContact O-N 3.09Å; L199-L202 PolarHBondContact O-N 3.35Å; L202-D204 PolarHBondContact O-N 3.25Å; L202-I205 WeakPolarHBondContact O-CB 3.27Å; L202-I205 PolarHBondContact O-N 2.92Å; L202-I205 VanDerWaalsContact O-N 3.12Å; L202-I206 HydrophobicContact CD1-CG2 4.3Å; L202-I206 WeakPolarHBondContact O-CG1 3.16Å; L202-I206 PolarHBondContact O-N 3.22Å; L202-I206 VanDerWaalsContact O-N 3.08Å; L202-W223 HydrophobicContact CD2-CB 4.18Å; L202-W223 HydrophobicContact CD2-CD2 3.56Å; L202-W223 HydrophobicContact CD2-CE3 3.81Å; L202-W223 HydrophobicContact CD2-CG 3.73Å; L202-W223 HydrophobicContact CD2-CZ3 4.43Å; L202-L238 HydrophobicContact CD2-CD1 4.22Å; L202-L238 HydrophobicContact CD2-CD2 3.98Å; L202-L238 HydrophobicContact CG-CD2 4.16Å
203	M	94.3	Very high	87.8	Confident	30 Å²	30	37.3 Å²	37.3	15%	0.148	21%	0.207	C	C	.	.	H	α-helix	trans	-56.2	-42.8	176.6	-165.9	63.7	65.3	0	0	110.6	L199 C200 I205 I206 K207 V237 L238 N241	L199-M203 HydrophobicContact CD1-CE 4.28Å; L199-M203 VanDerWaalsContact O-CB 3.3Å; L199-M203 WeakPolarHBondContact O-CB 2.96Å; L199-M203 PolarHBondContact O-N 3.43Å; C200-M203 WeakPolarHBondContact O-CB 3.38Å; C200-M203 PolarHBondContact O-N 3.1Å; M203-I205 PolarHBondContact O-N 3.36Å; M203-I206 WeakPolarHBondContact O-CG1 3.31Å; M203-I206 PolarHBondContact O-N 3.01Å; M203-I206 HydrophobicContact SD-CD1 4.24Å; M203-I206 HydrophobicContact SD-CG1 4.39Å; M203-K207 WeakPolarHBondContact O-CB 3.43Å; M203-K207 WeakPolarHBondContact O-CG 3.5Å; M203-K207 PolarHBondContact O-N 2.97Å; M203-V237 HydrophobicContact CE-CG1 3.75Å; M203-L238 HydrophobicContact CE-CD2 3.65Å; M203-L238 HydrophobicContact CE-CG 4.27Å; M203-L238 HydrophobicContact SD-CD2 4.34Å; M203-N241 HydrophobicContact SD-CB 3.49Å; M203-N241 WeakPolarHBondContact SD-CB 3.2Å
204	D	92.6	Very high	87.2	Confident	32 Å²	32	33.1 Å²	33.1	17%	0.171	19%	0.187	C	C	.	.	H	α-helix	trans	-61	-44.3	176.6	-101.4	38.5	0	0	0	113.1	M162 Y174 K178 C200 L201 L202 I206 K207	M162-D204 HydrophobicContact CE-CB 4.34Å; Y174-D204 VanDerWaalsContact OH-CB 3.31Å; Y174-D204 WeakPolarHBondContact OH-CB 3.48Å; Y174-D204 VanDerWaalsContact OH-CG 3.24Å; Y174-D204 PolarHBondContact OH-OD2 2.48Å; K178-D204 WeakPolarHBondContact CE-O 3.4Å; K178-D204 PolarHBondContact NZ-O 2.91Å; K178-D204 IonicContact NZ-OD2 2.86Å; K178-D204 PolarHBondContact NZ-OD2 2.84Å; C200-D204 WeakPolarHBondContact O-CB 3.47Å; C200-D204 PolarHBondContact O-N 3.39Å; L201-D204 WeakPolarHBondContact O-CB 3.23Å; L201-D204 PolarHBondContact O-N 3.04Å; L202-D204 PolarHBondContact O-N 3.25Å; D204-I206 VanDerWaalsContact C-N 3.29Å; D204-I206 PolarHBondContact O-N 3.25Å; D204-K207 VanDerWaalsContact OD1-CE 3.24Å; D204-K207 WeakPolarHBondContact OD1-CE 3.37Å; D204-K207 IonicContact OD1-NZ 2.88Å; D204-K207 PolarHBondContact OD1-NZ 3.17Å; D204-K207 IonicContact OD2-NZ 2.75Å
205	I	92.8	Very high	86.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-40.9	176.8	-67.7	165.9	0	0	0	110.4	L159 M162 A181 K182 L185 L197 L201 L202 M203 V210	L159-I205 HydrophobicContact CD2-CD1 4.27Å; M162-I205 HydrophobicContact CE-CD1 4.22Å; M162-I205 HydrophobicContact CE-CG1 3.83Å; M162-I205 HydrophobicContact SD-CD1 4.12Å; M162-I205 HydrophobicContact SD-CG1 4.11Å; A181-I205 HydrophobicContact CB-CD1 4.07Å; A181-I205 HydrophobicContact CB-CG1 4.37Å; K182-I205 WeakPolarHBondContact CE-O 3.13Å; K182-I205 HydrophobicContact CG-CG2 3.9Å; K182-I205 WeakPolarHBondContact CG-O 3.44Å; L185-I205 HydrophobicContact CD1-CG2 4.44Å; L197-I205 HydrophobicContact CD2-CD1 3.74Å; L201-I205 WeakPolarHBondContact O-CG1 3.44Å; L201-I205 PolarHBondContact O-N 2.86Å; L202-I205 WeakPolarHBondContact O-CB 3.27Å; L202-I205 PolarHBondContact O-N 2.92Å; L202-I205 VanDerWaalsContact O-N 3.12Å; M203-I205 PolarHBondContact O-N 3.36Å; I205-V210 HydrophobicContact CG2-CG2 4.42Å; I205-V210 VanDerWaalsContact O-CG2 3.25Å; I205-V210 WeakPolarHBondContact O-CG2 2.89Å
206	I	92.2	Very high	86.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-88.6	-27.5	-173.4	68.9	176.4	0	0	0	114.7	L202 M203 D204 G209 V210 I220 L238 L242 K243	L202-I206 HydrophobicContact CD1-CG2 4.3Å; L202-I206 WeakPolarHBondContact O-CG1 3.16Å; L202-I206 PolarHBondContact O-N 3.22Å; L202-I206 VanDerWaalsContact O-N 3.08Å; M203-I206 WeakPolarHBondContact O-CG1 3.31Å; M203-I206 PolarHBondContact O-N 3.01Å; M203-I206 HydrophobicContact SD-CD1 4.24Å; M203-I206 HydrophobicContact SD-CG1 4.39Å; D204-I206 VanDerWaalsContact C-N 3.29Å; D204-I206 PolarHBondContact O-N 3.25Å; I206-G209 WeakPolarHBondContact O-CA 3.33Å; I206-G209 PolarHBondContact O-N 3.35Å; I206-V210 HydrophobicContact CB-CG2 4.48Å; I206-V210 HydrophobicContact CG2-CG2 4.34Å; I206-I220 HydrophobicContact CD1-CD1 3.99Å; I206-I220 HydrophobicContact CG2-CD1 4.4Å; I206-L238 HydrophobicContact CD1-CB 4.29Å; I206-L238 HydrophobicContact CD1-CD2 3.58Å; I206-L238 WeakPolarHBondContact CD1-O 3.37Å; I206-L242 HydrophobicContact CB-CD1 4.06Å; I206-L242 HydrophobicContact CG2-CD1 4.4Å; I206-K243 PolarHBondContact O-N 3.26Å
207	K	87.9	Confident	85.9	Confident	88 Å²	88	34.6 Å²	34.6	38%	0.383	20%	0.198	S	C	.	.	H	α-helix	trans	-71.5	-40.1	-170.2	76.9	-172.3	-172.9	-173.2	0	114.5	M203 D204 G209	M203-K207 WeakPolarHBondContact O-CB 3.43Å; M203-K207 WeakPolarHBondContact O-CG 3.5Å; M203-K207 PolarHBondContact O-N 2.97Å; D204-K207 VanDerWaalsContact OD1-CE 3.24Å; D204-K207 WeakPolarHBondContact OD1-CE 3.37Å; D204-K207 IonicContact OD1-NZ 2.88Å; D204-K207 PolarHBondContact OD1-NZ 3.17Å; D204-K207 IonicContact OD2-NZ 2.75Å; K207-G209 PolarHBondContact O-N 3.48Å
208	D	78.8	Confident	85.7	Confident	80 Å²	80	37.8 Å²	37.8	43%	0.428	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	10.4	175.1	-8.6	-64.5	0	0	0	112.2	K178 K182 I245	K178-D208 WeakPolarHBondContact CE-OD2 3.44Å; K178-D208 IonicContact NZ-OD1 2.85Å; K178-D208 IonicContact NZ-OD2 3.51Å; K178-D208 PolarHBondContact NZ-OD2 2.97Å; K182-D208 VanDerWaalsContact NZ-CB 3.32Å; K182-D208 IonicContact NZ-OD2 3.31Å; K182-D208 PolarHBondContact NZ-OD2 3.42Å; D208-I245 VanDerWaalsContact O-CD1 3.3Å; D208-I245 WeakPolarHBondContact O-CD1 3.2Å
209	G	78.7	Confident	85.7	Confident	6 Å²	6	35.3 Å²	35.3	6%	0.062	20%	0.202	C	C	.	.			trans	84.1	148.7	167.8	0	0	0	0	0	117	I206 K207 K243 I245	I206-G209 WeakPolarHBondContact O-CA 3.33Å; I206-G209 PolarHBondContact O-N 3.35Å; K207-G209 PolarHBondContact O-N 3.48Å; G209-K243 CarbonylContact C-O 3.57Å; G209-K243 WeakPolarHBondContact CA-O 3.36Å; G209-I245 VanDerWaalsContact CA-CD1 3.43Å
210	V	80.7	Confident	85.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.1	-168.7	-178.5	0	0	0	0	108.7	K182 L185 I205 I206 T212 Q214 P216 K243 I245	K182-V210 HydrophobicContact CG-CG2 4.5Å; L185-V210 HydrophobicContact CD2-CG1 3.87Å; I205-V210 HydrophobicContact CG2-CG2 4.42Å; I205-V210 VanDerWaalsContact O-CG2 3.25Å; I205-V210 WeakPolarHBondContact O-CG2 2.89Å; I206-V210 HydrophobicContact CB-CG2 4.48Å; I206-V210 HydrophobicContact CG2-CG2 4.34Å; V210-T212 PolarHBondContact O-N 3.2Å; V210-Q214 HydrophobicContact CG1-CB 4.05Å; V210-P216 HydrophobicContact CB-CB 4.08Å; V210-P216 HydrophobicContact CB-CG 4.25Å; V210-P216 HydrophobicContact CG1-CB 3.95Å; V210-P216 HydrophobicContact CG1-CG 4.21Å; V210-K243 PolarHBondContact N-O 3.07Å; V210-I245 PolarHBondContact O-N 3.36Å
211	P	71.1	Confident	85.7	Confident	21 Å²	21	33.3 Å²	33.3	14%	0.136	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	132.2	173.1	-30.5	38.3	0	0	0	113.5	S213 Q214 I245 E247	P211-S213 PolarHBondContact O-N 3.18Å; P211-S213 VanDerWaalsContact O-N 3.12Å; P211-Q214 HydrophobicContact CB-CG 3.94Å; P211-Q214 HydrophobicContact CG-CG 4.31Å; P211-Q214 WeakPolarHBondContact O-CB 3.5Å; P211-Q214 PolarHBondContact O-N 3.38Å; P211-I245 VanDerWaalsContact CA-O 3.3Å; P211-I245 WeakPolarHBondContact CA-O 3.39Å; P211-E247 HydrophobicContact CB-CG 3.61Å; P211-E247 WeakPolarHBondContact CB-OE1 3.26Å; P211-E247 HydrophobicContact CG-CG 4.18Å
212	T	69.4	Low	85.8	Confident	58 Å²	58	34.7 Å²	34.7	36%	0.356	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-56.6	-29.7	174.4	-54.4	0	0	0	0	112.2	V210 Q214 N215 E244 I245	V210-T212 PolarHBondContact O-N 3.2Å; T212-Q214 PolarHBondContact O-N 3.5Å; T212-Q214 VanDerWaalsContact O-N 3.15Å; T212-N215 PolarHBondContact O-N 3.38Å; T212-E244 WeakPolarHBondContact CG2-OE2 2.92Å; T212-E244 PolarHBondContact OG1-OE2 2.91Å; T212-I245 PolarHBondContact N-O 3.28Å
213	S	68.7	Low	85.9	Confident	42 Å²	42	34.9 Å²	34.9	29%	0.294	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-59.3	-24.6	175.9	75.7	0	0	0	0	113.6	P211 N215 E247	P211-S213 PolarHBondContact O-N 3.18Å; P211-S213 VanDerWaalsContact O-N 3.12Å; S213-N215 VanDerWaalsContact C-N 3.29Å; S213-N215 PolarHBondContact O-N 2.85Å; S213-E247 VanDerWaalsContact CB-OE1 3.25Å; S213-E247 WeakPolarHBondContact CB-OE1 3.44Å; S213-E247 PolarHBondContact OG-OE1 2.89Å
214	Q	81.1	Confident	85.9	Confident	24 Å²	24	33.5 Å²	33.5	11%	0.112	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-88.9	4.9	-176.3	-61	-58.9	-55	0	0	113.2	I183 H184 L185 V186 V210 P211 T212	I183-Q214 PolarHBondContact O-NE2 2.72Å; I183-Q214 PolarHBondContact O-OE1 3.19Å; H184-Q214 VanDerWaalsContact C-OE1 3.32Å; L185-Q214 HydrophobicContact CB-CB 4.01Å; L185-Q214 VanDerWaalsContact N-OE1 3.13Å; V186-Q214 VanDerWaalsContact N-OE1 3.15Å; V210-Q214 HydrophobicContact CG1-CB 4.05Å; P211-Q214 HydrophobicContact CB-CG 3.94Å; P211-Q214 HydrophobicContact CG-CG 4.31Å; P211-Q214 WeakPolarHBondContact O-CB 3.5Å; P211-Q214 PolarHBondContact O-N 3.38Å; T212-Q214 PolarHBondContact O-N 3.5Å; T212-Q214 VanDerWaalsContact O-N 3.15Å
215	N	80.9	Confident	86	Confident	83 Å²	83	36.1 Å²	36.1	44%	0.444	20%	0.201	S	C	.	.			trans	48.3	54.3	176.9	-60.5	-49.3	0	0	0	113.6	T212 S213 T217 V218 A219	T212-N215 PolarHBondContact O-N 3.38Å; S213-N215 VanDerWaalsContact C-N 3.29Å; S213-N215 PolarHBondContact O-N 2.85Å; N215-T217 PolarHBondContact O-N 2.6Å; N215-T217 VanDerWaalsContact O-N 3.17Å; N215-V218 HydrophobicContact CB-CB 4.11Å; N215-V218 HydrophobicContact CB-CG2 4.07Å; N215-V218 WeakPolarHBondContact O-CB 3.34Å; N215-V218 PolarHBondContact O-N 3.23Å; N215-A219 PolarHBondContact O-N 3.31Å; N215-A219 VanDerWaalsContact O-N 3.17Å
216	P	87.5	Confident	86.2	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-33	-174	23.8	-33.6	0	0	0	113.5	L185 V210 V218 A219 I220 L242 E244	L185-P216 HydrophobicContact CD2-CB 3.99Å; V210-P216 HydrophobicContact CB-CB 4.08Å; V210-P216 HydrophobicContact CB-CG 4.25Å; V210-P216 HydrophobicContact CG1-CB 3.95Å; V210-P216 HydrophobicContact CG1-CG 4.21Å; P216-V218 VanDerWaalsContact C-N 3.33Å; P216-V218 PolarHBondContact O-N 3.41Å; P216-A219 PolarHBondContact O-N 2.82Å; P216-I220 WeakPolarHBondContact O-CG1 3.08Å; P216-I220 PolarHBondContact O-N 2.89Å; P216-L242 HydrophobicContact CB-CD1 3.65Å; P216-L242 HydrophobicContact CB-CD2 4.43Å; P216-L242 HydrophobicContact CG-CD1 3.91Å; P216-L242 HydrophobicContact CG-CD2 4.36Å; P216-E244 HydrophobicContact CG-CG 3.86Å
217	T	87.9	Confident	86.2	Confident	71 Å²	71	42.8 Å²	42.8	44%	0.436	23%	0.234	S	C	.	.	H	α-helix	trans	-59.9	-40.8	174	-62.3	0	0	0	0	112.3	N215 Q221 E244	N215-T217 PolarHBondContact O-N 2.6Å; N215-T217 VanDerWaalsContact O-N 3.17Å; T217-Q221 PolarHBondContact O-N 3.3Å; T217-Q221 VanDerWaalsContact O-N 3.09Å; T217-E244 PolarHBondContact OG1-OE1 2.96Å
218	V	89.6	Confident	86.4	Confident	75 Å²	75	44 Å²	44	46%	0.455	24%	0.239	S	C	.	.	H	α-helix	trans	-68.4	-37.9	176.5	177.5	0	0	0	0	110.8	N215 P216 Q221 S222	N215-V218 HydrophobicContact CB-CB 4.11Å; N215-V218 HydrophobicContact CB-CG2 4.07Å; N215-V218 WeakPolarHBondContact O-CB 3.34Å; N215-V218 PolarHBondContact O-N 3.23Å; P216-V218 VanDerWaalsContact C-N 3.33Å; P216-V218 PolarHBondContact O-N 3.41Å; V218-Q221 PolarHBondContact O-N 3.09Å; V218-S222 WeakPolarHBondContact O-CB 3.39Å; V218-S222 PolarHBondContact O-N 3.42Å; V218-S222 PolarHBondContact O-OG 2.69Å
219	A	91.9	Very high	87.1	Confident	2 Å²	2	47 Å²	47	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-45.6	177.8	0	0	0	0	0	112.1	L185 H189 F194 N215 P216 Q221 S222 W223	L185-A219 HydrophobicContact CD1-CB 4.13Å; L185-A219 HydrophobicContact CD2-CB 3.76Å; L185-A219 HydrophobicContact CG-CB 3.73Å; H189-A219 HydrophobicContact CB-CB 3.61Å; F194-A219 HydrophobicContact CE1-CB 4.28Å; F194-A219 HydrophobicContact CZ-CB 4.04Å; N215-A219 PolarHBondContact O-N 3.31Å; N215-A219 VanDerWaalsContact O-N 3.17Å; P216-A219 PolarHBondContact O-N 2.82Å; A219-Q221 VanDerWaalsContact C-N 3.32Å; A219-Q221 PolarHBondContact O-N 2.94Å; A219-S222 WeakPolarHBondContact O-CB 3.44Å; A219-S222 PolarHBondContact O-N 2.73Å; A219-W223 PolarHBondContact O-N 3.12Å
220	I	94.1	Very high	87.8	Confident	5 Å²	5	52.6 Å²	52.6	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-57.4	-47	174.1	-70.6	165.6	0	0	0	110.4	I206 P216 S222 W223 I224 L238 L242	I206-I220 HydrophobicContact CD1-CD1 3.99Å; I206-I220 HydrophobicContact CG2-CD1 4.4Å; P216-I220 WeakPolarHBondContact O-CG1 3.08Å; P216-I220 PolarHBondContact O-N 2.89Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 3.46Å; I220-W223 PolarHBondContact O-N 3.11Å; I220-I224 HydrophobicContact CG2-CD1 3.69Å; I220-I224 HydrophobicContact CG2-CG1 4.4Å; I220-I224 WeakPolarHBondContact O-CG1 3.37Å; I220-I224 PolarHBondContact O-N 3.33Å; I220-L238 HydrophobicContact CD1-CB 4.45Å; I220-L238 HydrophobicContact CG2-CB 3.97Å; I220-L238 HydrophobicContact CG2-CD1 4.02Å; I220-L242 HydrophobicContact CD1-CB 4.31Å; I220-L242 HydrophobicContact CD1-CD1 4.31Å; I220-L242 HydrophobicContact CD1-CD2 4.02Å; I220-L242 HydrophobicContact CD1-CG 4.44Å
221	Q	93	Very high	88.4	Confident	79 Å²	79	53.9 Å²	53.9	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-63	-38.1	179	-167.5	64	48.3	0	0	112.3	T217 V218 A219 I224 N225	T217-Q221 PolarHBondContact O-N 3.3Å; T217-Q221 VanDerWaalsContact O-N 3.09Å; V218-Q221 PolarHBondContact O-N 3.09Å; A219-Q221 VanDerWaalsContact C-N 3.32Å; A219-Q221 PolarHBondContact O-N 2.94Å; Q221-I224 PolarHBondContact O-N 2.96Å; Q221-N225 PolarHBondContact NE2-OD1 3.49Å; Q221-N225 VanDerWaalsContact O-CB 3.26Å; Q221-N225 WeakPolarHBondContact O-CB 3.26Å; Q221-N225 PolarHBondContact O-N 2.95Å; Q221-N225 PolarHBondContact O-ND2 3.4Å
222	S	94.1	Very high	89.5	Confident	30 Å²	30	57.6 Å²	57.6	21%	0.21	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-44.8	176.5	-56.4	0	0	0	0	111	H189 V218 A219 I220 N225 H226	H189-S222 PolarHBondContact ND1-OG 2.9Å; H189-S222 VanDerWaalsContact ND1-OG 3.11Å; V218-S222 WeakPolarHBondContact O-CB 3.39Å; V218-S222 PolarHBondContact O-N 3.42Å; V218-S222 PolarHBondContact O-OG 2.69Å; A219-S222 WeakPolarHBondContact O-CB 3.44Å; A219-S222 PolarHBondContact O-N 2.73Å; I220-S222 VanDerWaalsContact C-N 3.3Å; I220-S222 PolarHBondContact O-N 3.46Å; S222-N225 PolarHBondContact O-N 3.25Å; S222-H226 PolarHBondContact O-N 3.29Å
223	W	96.7	Very high	90.6	Very high	5 Å²	5	61.5 Å²	61.5	2%	0.019	32%	0.319	C	S	.	.	H	α-helix	trans	-65.1	-42.5	177.3	-175.8	90.6	0	0	0	112.9	F194 L197 L199 L202 A219 I220 H226 R231 F234 L238	F194-W223 HydrophobicContact CE1-CB 4.04Å; F194-W223 VanDerWaalsContact O-CD1 3.31Å; L197-W223 WeakPolarHBondContact O-CZ2 3.13Å; L197-W223 PolarHBondContact O-NE1 2.88Å; L199-W223 HydrophobicContact CB-CH2 4.17Å; L199-W223 HydrophobicContact CB-CZ2 4.42Å; L199-W223 HydrophobicContact CD1-CH2 3.95Å; L199-W223 HydrophobicContact CD1-CZ3 4.26Å; L202-W223 HydrophobicContact CD2-CB 4.18Å; L202-W223 HydrophobicContact CD2-CD2 3.56Å; L202-W223 HydrophobicContact CD2-CE3 3.81Å; L202-W223 HydrophobicContact CD2-CG 3.73Å; L202-W223 HydrophobicContact CD2-CZ3 4.43Å; A219-W223 PolarHBondContact O-N 3.12Å; I220-W223 PolarHBondContact O-N 3.11Å; W223-H226 PolarHBondContact O-N 2.88Å; W223-R231 VanDerWaalsContact CE2-CZ 3.4Å; W223-R231 VanDerWaalsContact CE2-NH1 3.33Å; W223-R231 HydrophobicContact CE3-CB 4.35Å; W223-R231 HydrophobicContact CE3-CG 4.32Å; W223-R231 HydrophobicContact CH2-CB 4.33Å; W223-R231 HydrophobicContact CH2-CG 3.73Å; W223-R231 HydrophobicContact CZ2-CG 4.4Å; W223-R231 HydrophobicContact CZ3-CB 3.81Å; W223-R231 HydrophobicContact CZ3-CG 3.69Å; W223-R231 WeakPolarHBondContact O-CD 3.21Å; W223-R231 PolarHBondContact O-NH1 3.13Å; W223-F234 HydrophobicContact CH2-CD2 4.31Å; W223-F234 HydrophobicContact CZ3-CD2 4.41Å; W223-L238 HydrophobicContact CE3-CD1 4.09Å; W223-L238 HydrophobicContact CZ3-CD1 3.96Å
224	I	95.2	Very high	91.7	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-63.6	-48.1	176.5	-66.9	167.7	0	0	0	110.2	I220 Q221 H226 N227 K228 R231 L238	I220-I224 HydrophobicContact CG2-CD1 3.69Å; I220-I224 HydrophobicContact CG2-CG1 4.4Å; I220-I224 WeakPolarHBondContact O-CG1 3.37Å; I220-I224 PolarHBondContact O-N 3.33Å; Q221-I224 PolarHBondContact O-N 2.96Å; I224-H226 PolarHBondContact O-N 2.89Å; I224-N227 CarbonylContact O-C 3.51Å; I224-N227 PolarHBondContact O-N 3Å; I224-K228 VanDerWaalsContact O-CA 3.28Å; I224-K228 WeakPolarHBondContact O-CA 3.42Å; I224-K228 PolarHBondContact O-N 3.1Å; I224-K228 VanDerWaalsContact O-N 3.11Å; I224-R231 HydrophobicContact CG2-CB 4.38Å; I224-L238 HydrophobicContact CD1-CD1 4.31Å; I224-L238 HydrophobicContact CG1-CD1 4.34Å
225	N	94.4	Very high	92.2	Very high	88 Å²	88	62.2 Å²	62.2	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-27.3	-176.4	-73.4	-14.5	0	0	0	113.3	Q221 S222 N227	Q221-N225 PolarHBondContact NE2-OD1 3.49Å; Q221-N225 VanDerWaalsContact O-CB 3.26Å; Q221-N225 WeakPolarHBondContact O-CB 3.26Å; Q221-N225 PolarHBondContact O-N 2.95Å; Q221-N225 PolarHBondContact O-ND2 3.4Å; S222-N225 PolarHBondContact O-N 3.25Å; N225-N227 VanDerWaalsContact C-N 3.34Å; N225-N227 PolarHBondContact O-N 3.39Å
226	H	95.3	Very high	92.6	Very high	89 Å²	89	62.4 Å²	62.4	41%	0.412	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-37.1	178.7	-174.2	76.8	0	0	0	113.2	L195 S222 W223 I224	L195-H226 HydrophobicContact CB-CB 4.23Å; L195-H226 HydrophobicContact CD2-CB 4.15Å; S222-H226 PolarHBondContact O-N 3.29Å; W223-H226 PolarHBondContact O-N 2.88Å; I224-H226 PolarHBondContact O-N 2.89Å
227	N	93.6	Very high	92.9	Very high	50 Å²	50	65.2 Å²	65.2	27%	0.267	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	68.4	172.3	-176.2	-2.2	0	0	0	109.5	I224 N225 V229 E230 R231	I224-N227 CarbonylContact O-C 3.51Å; I224-N227 PolarHBondContact O-N 3Å; N225-N227 VanDerWaalsContact C-N 3.34Å; N225-N227 PolarHBondContact O-N 3.39Å; N227-V229 PolarHBondContact O-N 2.98Å; N227-E230 PolarHBondContact ND2-OE2 3.03Å; N227-E230 PolarHBondContact O-N 3.45Å; N227-R231 HydrophobicContact CB-CG 4.25Å; N227-R231 VanDerWaalsContact O-CB 3.24Å; N227-R231 WeakPolarHBondContact O-CB 3.45Å; N227-R231 WeakPolarHBondContact O-CG 3.34Å; N227-R231 PolarHBondContact O-N 3.26Å
228	K	92.3	Very high	93.1	Very high	115 Å²	115	61.8 Å²	61.8	50%	0.5	32%	0.32	S	S	.	.	H	α-helix	trans	-55.9	-38.9	-172	-166.2	177.2	-179.2	175.4	0	112.9	I224 E230 E232	I224-K228 VanDerWaalsContact O-CA 3.28Å; I224-K228 WeakPolarHBondContact O-CA 3.42Å; I224-K228 PolarHBondContact O-N 3.1Å; I224-K228 VanDerWaalsContact O-N 3.11Å; K228-E230 PolarHBondContact O-N 2.79Å; K228-E232 VanDerWaalsContact CE-CD 3.5Å; K228-E232 WeakPolarHBondContact CE-OE1 3.4Å; K228-E232 WeakPolarHBondContact CE-OE2 3.46Å; K228-E232 WeakPolarHBondContact CG-OE2 3.2Å; K228-E232 IonicContact NZ-OE1 3.77Å; K228-E232 WeakPolarHBondContact O-CB 3.25Å; K228-E232 PolarHBondContact O-N 3.42Å; K228-E232 VanDerWaalsContact O-N 3.13Å
229	V	93.8	Very high	93	Very high	141 Å²	141	63.6 Å²	63.6	86%	0.855	32%	0.323	S	S	*	.	H	α-helix	trans	-62.4	-44	-174.7	-179.8	0	0	0	0	111.8	N227	N227-V229 PolarHBondContact O-N 2.98Å
230	E	92.3	Very high	92.9	Very high	124 Å²	124	71.1 Å²	71.1	58%	0.579	36%	0.358	S	S	*	.	H	α-helix	trans	-91.6	-22.6	-177.6	-64.9	179	168.6	0	0	112.8	N227 K228 F234	N227-E230 PolarHBondContact ND2-OE2 3.03Å; N227-E230 PolarHBondContact O-N 3.45Å; K228-E230 PolarHBondContact O-N 2.79Å; E230-F234 WeakPolarHBondContact O-CE2 3.41Å
231	R	94.3	Very high	92.7	Very high	28 Å²	28	74.2 Å²	74.2	11%	0.106	38%	0.375	C	S	.	.	H	α-helix	trans	-101.9	-12.9	-170.3	-62.6	176.8	176.6	-178.3	-1.2	115	L195 W223 I224 N227 E233 F234	L195-R231 PolarHBondContact O-NH1 2.83Å; L195-R231 PolarHBondContact O-NH2 3.22Å; W223-R231 VanDerWaalsContact CE2-CZ 3.4Å; W223-R231 VanDerWaalsContact CE2-NH1 3.33Å; W223-R231 HydrophobicContact CE3-CB 4.35Å; W223-R231 HydrophobicContact CE3-CG 4.32Å; W223-R231 HydrophobicContact CH2-CB 4.33Å; W223-R231 HydrophobicContact CH2-CG 3.73Å; W223-R231 HydrophobicContact CZ2-CG 4.4Å; W223-R231 HydrophobicContact CZ3-CB 3.81Å; W223-R231 HydrophobicContact CZ3-CG 3.69Å; W223-R231 WeakPolarHBondContact O-CD 3.21Å; W223-R231 PolarHBondContact O-NH1 3.13Å; I224-R231 HydrophobicContact CG2-CB 4.38Å; N227-R231 HydrophobicContact CB-CG 4.25Å; N227-R231 VanDerWaalsContact O-CB 3.24Å; N227-R231 WeakPolarHBondContact O-CB 3.45Å; N227-R231 WeakPolarHBondContact O-CG 3.34Å; N227-R231 PolarHBondContact O-N 3.26Å; R231-E233 PolarHBondContact O-N 2.91Å; R231-F234 HydrophobicContact CB-CD2 4.42Å; R231-F234 PolarHBondContact O-N 3.29Å; R231-F234 VanDerWaalsContact O-N 3.07Å
232	E	92.6	Very high	92.5	Very high	99 Å²	99	72 Å²	72	46%	0.463	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-56.7	-36.1	178.7	-158.3	92.7	167	0	0	111.5	K228 F234 S235	K228-E232 VanDerWaalsContact CE-CD 3.5Å; K228-E232 WeakPolarHBondContact CE-OE1 3.4Å; K228-E232 WeakPolarHBondContact CE-OE2 3.46Å; K228-E232 WeakPolarHBondContact CG-OE2 3.2Å; K228-E232 IonicContact NZ-OE1 3.77Å; K228-E232 WeakPolarHBondContact O-CB 3.25Å; K228-E232 PolarHBondContact O-N 3.42Å; K228-E232 VanDerWaalsContact O-N 3.13Å; E232-F234 PolarHBondContact O-N 2.68Å; E232-S235 VanDerWaalsContact O-CB 3.26Å; E232-S235 WeakPolarHBondContact O-CB 3.19Å; E232-S235 PolarHBondContact O-N 2.88Å; E232-S235 VanDerWaalsContact O-N 3.13Å
233	E	93	Very high	91.8	Very high	139 Å²	139	74.6 Å²	74.6	65%	0.65	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-64	-25.4	-180	65.6	176.2	-177.5	0	0	113.6	R231 S235	R231-E233 PolarHBondContact O-N 2.91Å; E233-S235 VanDerWaalsContact C-N 3.33Å
234	F	92.8	Very high	90.6	Very high	57 Å²	57	78.3 Å²	78.3	25%	0.25	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-85.6	-5.8	178.8	-54.7	-55.4	0	0	0	113.2	L199 W223 E230 R231 E232 T236 V237 L238	L199-F234 HydrophobicContact CD1-CB 4.15Å; L199-F234 HydrophobicContact CD1-CG 4.19Å; L199-F234 HydrophobicContact CD2-CB 4.48Å; L199-F234 HydrophobicContact CD2-CD1 3.51Å; L199-F234 HydrophobicContact CD2-CD2 4.11Å; L199-F234 HydrophobicContact CD2-CE1 3.68Å; L199-F234 HydrophobicContact CD2-CE2 4.27Å; L199-F234 HydrophobicContact CD2-CG 3.76Å; L199-F234 HydrophobicContact CD2-CZ 4.07Å; W223-F234 HydrophobicContact CH2-CD2 4.31Å; W223-F234 HydrophobicContact CZ3-CD2 4.41Å; E230-F234 WeakPolarHBondContact O-CE2 3.41Å; R231-F234 HydrophobicContact CB-CD2 4.42Å; R231-F234 PolarHBondContact O-N 3.29Å; R231-F234 VanDerWaalsContact O-N 3.07Å; E232-F234 PolarHBondContact O-N 2.68Å; F234-T236 VanDerWaalsContact C-N 3.32Å; F234-T236 PolarHBondContact O-N 2.83Å; F234-V237 PolarHBondContact O-N 3.37Å; F234-L238 HydrophobicContact CB-CD1 4.13Å; F234-L238 HydrophobicContact CB-CG 4.46Å; F234-L238 WeakPolarHBondContact O-CB 3.38Å; F234-L238 WeakPolarHBondContact O-CG 3.42Å; F234-L238 PolarHBondContact O-N 3.05Å
235	S	90.1	Very high	89.1	Confident	25 Å²	25	80 Å²	80	18%	0.175	40%	0.399	C	S	.	.	H	α-helix	trans	-58.3	-43	-175.7	-174.6	0	0	0	0	112.6	E232 E233 Q239	E232-S235 VanDerWaalsContact O-CB 3.26Å; E232-S235 WeakPolarHBondContact O-CB 3.19Å; E232-S235 PolarHBondContact O-N 2.88Å; E232-S235 VanDerWaalsContact O-N 3.13Å; E233-S235 VanDerWaalsContact C-N 3.33Å; S235-Q239 WeakPolarHBondContact O-CB 2.96Å; S235-Q239 VanDerWaalsContact O-CG 3.32Å; S235-Q239 WeakPolarHBondContact O-CG 3.41Å; S235-Q239 PolarHBondContact O-N 3.36Å; S235-Q239 VanDerWaalsContact O-N 3.13Å
236	T	90.3	Very high	87.1	Confident	86 Å²	86	77.2 Å²	77.2	53%	0.528	39%	0.391	S	S	.	.	H	α-helix	trans	-67.1	-47.3	179.7	49.4	0	0	0	0	110.9	F234 L238 Q239 E240	F234-T236 VanDerWaalsContact C-N 3.32Å; F234-T236 PolarHBondContact O-N 2.83Å; T236-L238 VanDerWaalsContact C-N 3.34Å; T236-L238 PolarHBondContact O-N 3.3Å; T236-Q239 PolarHBondContact O-N 3.4Å; T236-E240 WeakPolarHBondContact O-CB 2.95Å; T236-E240 WeakPolarHBondContact O-CG 3.22Å; T236-E240 PolarHBondContact O-N 2.73Å
237	V	93.3	Very high	85	Confident	60 Å²	60	76.2 Å²	76.2	36%	0.364	39%	0.386	S	S	.	.	H	α-helix	trans	-61.5	-42.6	-179.9	-175.4	0	0	0	0	111.3	M203 F234 E240 N241	M203-V237 HydrophobicContact CE-CG1 3.75Å; F234-V237 PolarHBondContact O-N 3.37Å; V237-E240 PolarHBondContact O-N 3.5Å; V237-N241 WeakPolarHBondContact O-CB 3.29Å; V237-N241 PolarHBondContact O-N 3.38Å; V237-N241 VanDerWaalsContact O-N 3.1Å; V237-N241 PolarHBondContact O-ND2 3.13Å
238	L	92.4	Very high	82.7	Confident	0 Å²	0	80.5 Å²	80.5	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-65.7	-38.6	177.9	-72.4	167.1	0	0	0	112	L199 L202 M203 I206 I220 W223 I224 F234 T236 L242	L199-L238 HydrophobicContact CD1-CD1 4.22Å; L199-L238 HydrophobicContact CD1-CD2 3.86Å; L199-L238 HydrophobicContact CD1-CG 4.18Å; L202-L238 HydrophobicContact CD2-CD1 4.22Å; L202-L238 HydrophobicContact CD2-CD2 3.98Å; L202-L238 HydrophobicContact CG-CD2 4.16Å; M203-L238 HydrophobicContact CE-CD2 3.65Å; M203-L238 HydrophobicContact CE-CG 4.27Å; M203-L238 HydrophobicContact SD-CD2 4.34Å; I206-L238 HydrophobicContact CD1-CB 4.29Å; I206-L238 HydrophobicContact CD1-CD2 3.58Å; I206-L238 WeakPolarHBondContact CD1-O 3.37Å; I220-L238 HydrophobicContact CD1-CB 4.45Å; I220-L238 HydrophobicContact CG2-CB 3.97Å; I220-L238 HydrophobicContact CG2-CD1 4.02Å; W223-L238 HydrophobicContact CE3-CD1 4.09Å; W223-L238 HydrophobicContact CZ3-CD1 3.96Å; I224-L238 HydrophobicContact CD1-CD1 4.31Å; I224-L238 HydrophobicContact CG1-CD1 4.34Å; F234-L238 HydrophobicContact CB-CD1 4.13Å; F234-L238 HydrophobicContact CB-CG 4.46Å; F234-L238 WeakPolarHBondContact O-CB 3.38Å; F234-L238 WeakPolarHBondContact O-CG 3.42Å; F234-L238 PolarHBondContact O-N 3.05Å; T236-L238 VanDerWaalsContact C-N 3.34Å; T236-L238 PolarHBondContact O-N 3.3Å; L238-L242 WeakPolarHBondContact O-CB 3.42Å; L238-L242 PolarHBondContact O-N 3.35Å
239	Q	88.1	Confident	80.6	Confident	112 Å²	112	75.3 Å²	75.3	52%	0.523	38%	0.381	S	S	.	.	H	α-helix	trans	-71.6	-39.2	177	-73.6	-177.6	8.2	0	0	112.7	S235 T236 N241 L242	S235-Q239 WeakPolarHBondContact O-CB 2.96Å; S235-Q239 VanDerWaalsContact O-CG 3.32Å; S235-Q239 WeakPolarHBondContact O-CG 3.41Å; S235-Q239 PolarHBondContact O-N 3.36Å; S235-Q239 VanDerWaalsContact O-N 3.13Å; T236-Q239 PolarHBondContact O-N 3.4Å; Q239-N241 VanDerWaalsContact C-N 3.31Å; Q239-N241 PolarHBondContact O-N 3.21Å; Q239-L242 PolarHBondContact O-N 3.01Å
240	E	89.4	Confident	78.5	Confident	160 Å²	160	71.3 Å²	71.3	75%	0.748	35%	0.353	S	S	*	.	H	α-helix	trans	-66.6	-32.3	177.6	-74.2	176.3	174.7	0	0	112.6	T236 V237	T236-E240 WeakPolarHBondContact O-CB 2.95Å; T236-E240 WeakPolarHBondContact O-CG 3.22Å; T236-E240 PolarHBondContact O-N 2.73Å; V237-E240 PolarHBondContact O-N 3.5Å
241	N	89.4	Confident	76.6	Confident	71 Å²	71	65.6 Å²	65.6	38%	0.38	33%	0.326	S	S	.	.	H	α-helix	trans	-93.5	-6.4	179.2	-72.7	-87.9	0	0	0	113.6	M203 V237 Q239 K243	M203-N241 HydrophobicContact SD-CB 3.49Å; M203-N241 WeakPolarHBondContact SD-CB 3.2Å; V237-N241 WeakPolarHBondContact O-CB 3.29Å; V237-N241 PolarHBondContact O-N 3.38Å; V237-N241 VanDerWaalsContact O-N 3.1Å; V237-N241 PolarHBondContact O-ND2 3.13Å; Q239-N241 VanDerWaalsContact C-N 3.31Å; Q239-N241 PolarHBondContact O-N 3.21Å; N241-K243 PolarHBondContact O-N 3.22Å; N241-K243 VanDerWaalsContact O-N 3.11Å
242	L	88.4	Confident	74.7	Confident	31 Å²	31	64.5 Å²	64.5	16%	0.162	32%	0.322	C	S	.	.			trans	-68.8	110.1	176.1	173.5	60.4	0	0	0	109.5	I206 P216 I220 L238 Q239 E244	I206-L242 HydrophobicContact CB-CD1 4.06Å; I206-L242 HydrophobicContact CG2-CD1 4.4Å; P216-L242 HydrophobicContact CB-CD1 3.65Å; P216-L242 HydrophobicContact CB-CD2 4.43Å; P216-L242 HydrophobicContact CG-CD1 3.91Å; P216-L242 HydrophobicContact CG-CD2 4.36Å; I220-L242 HydrophobicContact CD1-CB 4.31Å; I220-L242 HydrophobicContact CD1-CD1 4.31Å; I220-L242 HydrophobicContact CD1-CD2 4.02Å; I220-L242 HydrophobicContact CD1-CG 4.44Å; L238-L242 WeakPolarHBondContact O-CB 3.42Å; L238-L242 PolarHBondContact O-N 3.35Å; Q239-L242 PolarHBondContact O-N 3.01Å; L242-E244 HydrophobicContact CD1-CG 4.23Å; L242-E244 HydrophobicContact CD2-CG 4.05Å; L242-E244 HydrophobicContact CG-CG 4Å
243	K	80.7	Confident	72.9	Confident	85 Å²	85	59.8 Å²	59.8	37%	0.37	30%	0.3	S	S	.	.			trans	-95.3	102.4	166.5	-170.3	-177	-177	-163.9	0	108.8	I206 G209 V210 N241 I245 E272	I206-K243 PolarHBondContact O-N 3.26Å; G209-K243 CarbonylContact C-O 3.57Å; G209-K243 WeakPolarHBondContact CA-O 3.36Å; V210-K243 PolarHBondContact N-O 3.07Å; N241-K243 PolarHBondContact O-N 3.22Å; N241-K243 VanDerWaalsContact O-N 3.11Å; K243-I245 HydrophobicContact CD-CD1 4.24Å; K243-I245 HydrophobicContact CD-CG1 4.11Å; K243-I245 HydrophobicContact CG-CG1 4.06Å; K243-I245 PolarHBondContact O-N 3.33Å; K243-E272 VanDerWaalsContact NZ-CD 3.25Å; K243-E272 IonicContact NZ-OE1 3.11Å; K243-E272 PolarHBondContact NZ-OE1 3.27Å; K243-E272 IonicContact NZ-OE2 2.62Å; K243-E272 PolarHBondContact NZ-OE2 2.96Å
244	E	71.8	Confident	71.3	Confident	84 Å²	84	53.3 Å²	53.3	39%	0.393	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.9	166.1	-64.2	-164.6	-169.9	0	0	109	T212 P216 T217 L242	T212-E244 WeakPolarHBondContact CG2-OE2 2.92Å; T212-E244 PolarHBondContact OG1-OE2 2.91Å; P216-E244 HydrophobicContact CG-CG 3.86Å; T217-E244 PolarHBondContact OG1-OE1 2.96Å; L242-E244 HydrophobicContact CD1-CG 4.23Å; L242-E244 HydrophobicContact CD2-CG 4.05Å; L242-E244 HydrophobicContact CG-CG 4Å
245	I	63.4	Low	69.5	Low	37 Å²	37	50.7 Å²	50.7	19%	0.19	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.7	177.4	-61.7	178.7	0	0	0	107.5	D208 G209 V210 P211 T212 K243 E247 E272	D208-I245 VanDerWaalsContact O-CD1 3.3Å; D208-I245 WeakPolarHBondContact O-CD1 3.2Å; G209-I245 VanDerWaalsContact CA-CD1 3.43Å; V210-I245 PolarHBondContact O-N 3.36Å; P211-I245 VanDerWaalsContact CA-O 3.3Å; P211-I245 WeakPolarHBondContact CA-O 3.39Å; T212-I245 PolarHBondContact N-O 3.28Å; K243-I245 HydrophobicContact CD-CD1 4.24Å; K243-I245 HydrophobicContact CD-CG1 4.11Å; K243-I245 HydrophobicContact CG-CG1 4.06Å; K243-I245 PolarHBondContact O-N 3.33Å; I245-E247 PolarHBondContact O-N 3.13Å; I245-E272 HydrophobicContact CG2-CG 4.37Å
246	G	51.1	Low	67.8	Low	29 Å²	29	53.6 Å²	53.6	30%	0.299	27%	0.268	S	S	.	.			trans	-64.6	125.6	163.7	0	0	0	0	0	108.7	K248	G246-K248 PolarHBondContact O-N 3.14Å
247	E	51.3	Low	66	Low	67 Å²	67	51.7 Å²	51.7	31%	0.313	25%	0.253	S	S	.	.			trans	-55.8	141.8	175.3	-52.4	178.9	160	0	0	109.5	P211 S213 I245 V249 N484	P211-E247 HydrophobicContact CB-CG 3.61Å; P211-E247 WeakPolarHBondContact CB-OE1 3.26Å; P211-E247 HydrophobicContact CG-CG 4.18Å; S213-E247 VanDerWaalsContact CB-OE1 3.25Å; S213-E247 WeakPolarHBondContact CB-OE1 3.44Å; S213-E247 PolarHBondContact OG-OE1 2.89Å; I245-E247 PolarHBondContact O-N 3.13Å; E247-V249 WeakPolarHBondContact O-CG2 3.39Å; E247-V249 PolarHBondContact O-N 3.2Å; E247-N484 WeakPolarHBondContact CA-ND2 3.31Å; E247-N484 VanDerWaalsContact CB-ND2 3.31Å; E247-N484 WeakPolarHBondContact CB-ND2 3.45Å; E247-N484 WeakPolarHBondContact CB-OD1 3.46Å; E247-N484 PolarHBondContact N-ND2 3.5Å; E247-N484 PolarHBondContact O-ND2 3.44Å; E247-N484 PolarHBondContact OE2-OD1 3.3Å
248	K	46.7	Very low	64	Low	141 Å²	141	55.8 Å²	55.8	61%	0.613	27%	0.269	S	S	*	.			trans	-63.1	88.2	163.5	-77.4	-174.7	177.4	-179.2	0	108	G246 H250	G246-K248 PolarHBondContact O-N 3.14Å; K248-H250 PolarHBondContact O-CD2 3.09Å; K248-H250 PolarHBondContact O-N 3.24Å
249	V	47.6	Very low	62	Low	6 Å²	6	61.4 Å²	61.4	4%	0.036	30%	0.303	C	S	.	.			trans	-76	125.6	172.2	-177.3	0	0	0	0	106.5	E247 I251 H269 C270 C483 N484	E247-V249 WeakPolarHBondContact O-CG2 3.39Å; E247-V249 PolarHBondContact O-N 3.2Å; V249-I251 HydrophobicContact CG1-CG1 3.79Å; V249-H269 VanDerWaalsContact O-CA 3.28Å; V249-H269 WeakPolarHBondContact O-CA 3.25Å; V249-C270 HydrophobicContact CB-CB 4.37Å; V249-C270 PolarHBondContact O-N 2.93Å; V249-C483 HydrophobicContact CB-CB 4.38Å; V249-C483 HydrophobicContact CG1-CB 3.66Å; V249-C483 WeakPolarHBondContact CG1-SG 3.38Å; V249-C483 HydrophobicContact CG2-CB 3.89Å; V249-C483 WeakPolarHBondContact CG2-SG 3.17Å; V249-N484 HydrophobicContact CG2-CB 4.37Å; V249-N484 WeakPolarHBondContact CG2-ND2 3.49Å; V249-N484 WeakPolarHBondContact CG2-OD1 3.39Å
250	H	49.5	Very low	60.3	Low	57 Å²	57	61 Å²	61	26%	0.264	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	104.8	170.2	-68.5	-108.5	0	0	0	109	K248 Y252 S267 L268 H269	K248-H250 PolarHBondContact O-CD2 3.09Å; K248-H250 PolarHBondContact O-N 3.24Å; H250-Y252 HydrophobicContact CB-CD2 4.15Å; H250-Y252 HydrophobicContact CB-CE2 3.26Å; H250-Y252 WeakPolarHBondContact O-CD2 3.44Å; H250-S267 PolarHBondContact ND1-OG 3.32Å; H250-L268 CarbonylContact C-O 3.53Å; H250-L268 VanDerWaalsContact CA-O 3.24Å; H250-L268 WeakPolarHBondContact CA-O 3.28Å; H250-H269 AromaticContact CE1-CE1 2.98Å; H250-H269 PolarHBondContact CE1-CE1 3.08Å; H250-H269 AromaticContact CE1-ND1 3.39Å; H250-H269 PolarHBondContact CE1-ND1 3.28Å; H250-H269 AromaticContact CG-ND1 4Å; H250-H269 AromaticContact ND1-CE1 3.45Å; H250-H269 PolarHBondContact ND1-CE1 3.12Å; H250-H269 AromaticContact ND1-ND1 3.55Å; H250-H269 AromaticContact NE2-CE1 3.53Å; H250-H269 AromaticContact NE2-ND1 3.64Å
251	I	51.6	Low	58.3	Low	4 Å²	4	58.4 Å²	58.4	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.2	173.2	-51.7	177.5	0	0	0	107.7	V249 L253 S267 L268 F490 F526	V249-I251 HydrophobicContact CG1-CG1 3.79Å; I251-L253 HydrophobicContact CG2-CD2 3.96Å; I251-S267 CarbonylContact O-C 3.53Å; I251-S267 WeakPolarHBondContact O-CA 3.32Å; I251-L268 HydrophobicContact CB-CB 4.03Å; I251-L268 HydrophobicContact CB-CD1 4.25Å; I251-L268 HydrophobicContact CB-CG 4.4Å; I251-L268 PolarHBondContact N-O 3.34Å; I251-L268 PolarHBondContact O-N 3.18Å; I251-F490 HydrophobicContact CD1-CE1 4.41Å; I251-F490 HydrophobicContact CD1-CE2 4Å; I251-F490 HydrophobicContact CD1-CZ 3.41Å; I251-F490 VanDerWaalsContact CD1-CZ 3.41Å; I251-F490 HydrophobicContact CG2-CE2 4.43Å; I251-F490 HydrophobicContact CG2-CZ 4.4Å; I251-F526 HydrophobicContact CG2-CD1 4.28Å; I251-F526 HydrophobicContact CG2-CE1 3.85Å
252	Y	55.4	Low	56.4	Low	5 Å²	5	58.1 Å²	58.1	2%	0.02	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118	180	-68.3	-101.3	0	0	0	110.5	H250 A265 I266 L298 M314 V527 A529	H250-Y252 HydrophobicContact CB-CD2 4.15Å; H250-Y252 HydrophobicContact CB-CE2 3.26Å; H250-Y252 WeakPolarHBondContact O-CD2 3.44Å; Y252-A265 HydrophobicContact CD1-CB 4.41Å; Y252-I266 CarbonylContact C-O 3.57Å; Y252-I266 VanDerWaalsContact CA-O 3.28Å; Y252-I266 WeakPolarHBondContact CA-O 2.93Å; Y252-L298 HydrophobicContact CD1-CD2 4.05Å; Y252-L298 HydrophobicContact CG-CD2 4.21Å; Y252-M314 HydrophobicContact CD1-CE 4.27Å; Y252-M314 HydrophobicContact CD2-CE 3.47Å; Y252-M314 VanDerWaalsContact CD2-CE 3.47Å; Y252-M314 HydrophobicContact CE1-CE 3.76Å; Y252-M314 HydrophobicContact CE1-SD 4.01Å; Y252-M314 HydrophobicContact CE2-CE 2.88Å; Y252-M314 HydrophobicContact CE2-SD 4.08Å; Y252-M314 HydrophobicContact CG-CE 4.13Å; Y252-M314 VanDerWaalsContact CZ-SD 3.6Å; Y252-M314 VanDerWaalsContact OH-CE 3.25Å; Y252-M314 WeakPolarHBondContact OH-CE 3.09Å; Y252-M314 PolarHBondContact OH-SD 3.37Å; Y252-V527 PolarHBondContact N-O 2.93Å; Y252-V527 PolarHBondContact O-N 2.74Å; Y252-V527 VanDerWaalsContact O-N 3.15Å; Y252-V527 VanDerWaalsContact O-O 3.11Å; Y252-A529 HydrophobicContact CD2-CB 3.44Å; Y252-A529 VanDerWaalsContact CD2-CB 3.44Å; Y252-A529 HydrophobicContact CE2-CB 3.72Å
253	L	54.7	Low	54.8	Low	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	109.4	177.2	-52.7	170.7	0	0	0	106.6	I251 A265 I266 L268 I519 W524 F526	I251-L253 HydrophobicContact CG2-CD2 3.96Å; L253-A265 CarbonylContact O-C 3.59Å; L253-A265 VanDerWaalsContact O-CA 3.32Å; L253-A265 WeakPolarHBondContact O-CA 3.44Å; L253-I266 HydrophobicContact CB-CB 4.23Å; L253-I266 HydrophobicContact CD1-CB 4.44Å; L253-I266 HydrophobicContact CD1-CG2 4.46Å; L253-I266 PolarHBondContact N-O 3.39Å; L253-I266 PolarHBondContact O-N 3.46Å; L253-L268 HydrophobicContact CD1-CD1 3.43Å; L253-L268 VanDerWaalsContact CD1-CD1 3.43Å; L253-L268 HydrophobicContact CD1-CD2 3.93Å; L253-L268 HydrophobicContact CD1-CG 3.64Å; L253-L268 HydrophobicContact CD2-CD1 4.32Å; L253-L268 HydrophobicContact CG-CD1 4.05Å; L253-L268 HydrophobicContact CG-CG 4.21Å; L253-I519 HydrophobicContact CD1-CD1 3.09Å; L253-W524 HydrophobicContact CB-CE3 3.61Å; L253-W524 HydrophobicContact CB-CH2 4.38Å; L253-W524 HydrophobicContact CB-CZ3 3.51Å; L253-W524 HydrophobicContact CD1-CE3 4.06Å; L253-W524 HydrophobicContact CD1-CH2 3.61Å; L253-W524 HydrophobicContact CD1-CZ3 3.1Å; L253-W524 HydrophobicContact CD2-CE3 3.66Å; L253-W524 HydrophobicContact CD2-CZ3 3.39Å; L253-W524 HydrophobicContact CG-CE3 3.93Å; L253-W524 HydrophobicContact CG-CH2 4.38Å; L253-W524 HydrophobicContact CG-CZ3 3.45Å; L253-W524 VanDerWaalsContact CG-CZ3 3.45Å; L253-F526 HydrophobicContact CD2-CD1 4.08Å; L253-F526 HydrophobicContact CD2-CD2 4.35Å; L253-F526 HydrophobicContact CD2-CE1 3.39Å; L253-F526 HydrophobicContact CD2-CE2 3.69Å; L253-F526 HydrophobicContact CD2-CZ 3.18Å
254	I	58.9	Low	53.3	Low	2 Å²	2	53 Å²	53	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	111.6	176.4	-58.2	-176.6	0	0	0	107.6	L264 A265 L284 I288 A291 V300 W524 Q525 V527	I254-L264 VanDerWaalsContact CA-O 3.25Å; I254-L264 WeakPolarHBondContact CA-O 3.41Å; I254-A265 HydrophobicContact CG1-CB 4.34Å; I254-L284 HydrophobicContact CD1-CD1 4.44Å; I254-L284 HydrophobicContact CG1-CD1 4.45Å; I254-L284 HydrophobicContact CG2-CD1 4.12Å; I254-I288 HydrophobicContact CD1-CD1 4.39Å; I254-I288 HydrophobicContact CG2-CB 3.87Å; I254-I288 HydrophobicContact CG2-CD1 3.25Å; I254-I288 HydrophobicContact CG2-CG1 4.12Å; I254-I288 HydrophobicContact CG2-CG2 3.97Å; I254-A291 HydrophobicContact CD1-CB 3.88Å; I254-V300 HydrophobicContact CD1-CG2 3.91Å; I254-W524 CarbonylContact O-C 3.47Å; I254-W524 WeakPolarHBondContact O-CA 3.25Å; I254-Q525 WeakPolarHBondContact CB-O 2.91Å; I254-Q525 PolarHBondContact N-O 2.91Å; I254-Q525 PolarHBondContact O-N 2.97Å; I254-Q525 VanDerWaalsContact O-O 3.09Å; I254-V527 HydrophobicContact CD1-CG2 3.6Å; I254-V527 HydrophobicContact CG1-CG2 4.26Å
255	G	56.3	Low	52.4	Low	3 Å²	3	49.3 Å²	49.3	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	163.2	-178.7	0	0	0	0	0	112.9	S263 L264	G255-S263 CarbonylContact O-C 3.49Å; G255-S263 VanDerWaalsContact O-CA 3.22Å; G255-S263 WeakPolarHBondContact O-CA 3.32Å; G255-L264 PolarHBondContact N-O 3.28Å; G255-L264 VanDerWaalsContact N-O 3.08Å; G255-L264 PolarHBondContact O-N 3.49Å
256	K	54.4	Low	51.7	Low	85 Å²	85	47.9 Å²	47.9	37%	0.37	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120	173.4	-172.8	-178.6	178.1	-175.4	0	108.9	R260 T522	K256-R260 WeakPolarHBondContact CE-O 3.39Å; K256-T522 CarbonylContact C-O 3.5Å; K256-T522 PolarHBondContact N-O 3.12Å; K256-T522 CarbonylContact O-C 3.57Å; K256-T522 PolarHBondContact O-N 3.19Å; K256-T522 PolarHBondContact O-OG1 3.05Å
257	E	52.1	Low	51.8	Low	46 Å²	46	46.6 Å²	46.6	22%	0.215	23%	0.228	C	C	.	.			trans	-70.4	135	170.4	-166.8	176.7	-174.4	0	0	109.1	T259 R260 L264 L521	E257-T259 WeakPolarHBondContact CG-OG1 3.39Å; E257-T259 PolarHBondContact O-N 3.04Å; E257-T259 PolarHBondContact OE1-OG1 3.35Å; E257-R260 HydrophobicContact CB-CB 4.08Å; E257-R260 HydrophobicContact CB-CG 4.1Å; E257-R260 PolarHBondContact O-N 3Å; E257-R260 VanDerWaalsContact O-O 3.14Å; E257-R260 WeakPolarHBondContact OE2-CD 3.33Å; E257-R260 WeakPolarHBondContact OE2-CG 3.3Å; E257-R260 IonicContact OE2-CZ 3.68Å; E257-R260 IonicContact OE2-NE 2.65Å; E257-R260 PolarHBondContact OE2-NE 3.43Å; E257-R260 IonicContact OE2-NH2 3.76Å; E257-L264 HydrophobicContact CB-CD1 4.18Å; E257-L521 HydrophobicContact CB-CD2 3.91Å; E257-L521 HydrophobicContact CG-CD2 4.5Å
258	E	50.6	Low	51.7	Low	147 Å²	147	43.5 Å²	43.5	69%	0.687	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-30.7	-178.9	-75.3	-177.6	171.3	0	0	112.7	T522	E258-T522 HydrophobicContact CG-CG2 3.82Å; E258-T522 WeakPolarHBondContact CG-OG1 3.02Å
259	T	49.7	Very low	51.9	Low	118 Å²	118	38.3 Å²	38.3	72%	0.724	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-9.4	-178.1	60	0	0	0	0	114	E257	E257-T259 WeakPolarHBondContact CG-OG1 3.39Å; E257-T259 PolarHBondContact O-N 3.04Å; E257-T259 PolarHBondContact OE1-OG1 3.35Å
260	R	52.4	Low	52.1	Low	104 Å²	104	38.4 Å²	38.4	39%	0.392	19%	0.192	S	C	.	.			trans	-113.9	149.3	-176.8	-62.5	-167.7	-168.7	-165.7	-3.1	112.9	K256 E257 H262	K256-R260 WeakPolarHBondContact CE-O 3.39Å; E257-R260 HydrophobicContact CB-CB 4.08Å; E257-R260 HydrophobicContact CB-CG 4.1Å; E257-R260 PolarHBondContact O-N 3Å; E257-R260 VanDerWaalsContact O-O 3.14Å; E257-R260 WeakPolarHBondContact OE2-CD 3.33Å; E257-R260 WeakPolarHBondContact OE2-CG 3.3Å; E257-R260 IonicContact OE2-CZ 3.68Å; E257-R260 IonicContact OE2-NE 2.65Å; E257-R260 PolarHBondContact OE2-NE 3.43Å; E257-R260 IonicContact OE2-NH2 3.76Å; R260-H262 VanDerWaalsContact C-N 3.29Å
261	T	47.6	Very low	52.1	Low	105 Å²	105	38.5 Å²	38.5	64%	0.644	20%	0.195	S	C	*	.	S	Bend	trans	-80.9	-10.7	172.6	50.8	0	0	0	0	113.2
262	H	51.2	Low	52	Low	65 Å²	65	43.7 Å²	43.7	30%	0.301	22%	0.219	S	C	.	.	S	Bend	trans	-113.8	147.4	-169.7	-57.9	133.7	0	0	0	111	R260 L284 C285	R260-H262 VanDerWaalsContact C-N 3.29Å; H262-L284 WeakPolarHBondContact CB-O 3.34Å; H262-C285 VanDerWaalsContact CD2-C 3.45Å; H262-C285 PolarHBondContact CD2-O 3.06Å
263	S	54.2	Low	51.8	Low	4 Å²	4	50.5 Å²	50.5	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	150.8	170.6	-49.6	0	0	0	0	109	G255 L284 H286 I288	G255-S263 CarbonylContact O-C 3.49Å; G255-S263 VanDerWaalsContact O-CA 3.22Å; G255-S263 WeakPolarHBondContact O-CA 3.32Å; S263-L284 PolarHBondContact N-O 3.29Å; S263-L284 WeakPolarHBondContact O-CA 3.22Å; S263-L284 WeakPolarHBondContact O-CB 3.42Å; S263-L284 PolarHBondContact O-N 3.02Å; S263-L284 VanDerWaalsContact O-O 3.08Å; S263-H286 WeakPolarHBondContact CB-O 3.4Å; S263-H286 PolarHBondContact OG-O 3.12Å; S263-I288 PolarHBondContact OG-N 3.23Å
264	L	49.4	Very low	51.5	Low	5 Å²	5	52.9 Å²	52.9	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.2	176.6	-84.4	145	0	0	0	108.1	I254 G255 E257 Q281 N282 L521	I254-L264 VanDerWaalsContact CA-O 3.25Å; I254-L264 WeakPolarHBondContact CA-O 3.41Å; G255-L264 PolarHBondContact N-O 3.28Å; G255-L264 VanDerWaalsContact N-O 3.08Å; G255-L264 PolarHBondContact O-N 3.49Å; E257-L264 HydrophobicContact CB-CD1 4.18Å; L264-Q281 HydrophobicContact CD2-CB 4.07Å; L264-Q281 HydrophobicContact CD2-CG 4.46Å; L264-N282 WeakPolarHBondContact CA-O 3.35Å; L264-L521 HydrophobicContact CB-CD1 4.07Å; L264-L521 HydrophobicContact CB-CD2 3.95Å; L264-L521 HydrophobicContact CD1-CD2 3.56Å; L264-L521 HydrophobicContact CG-CD2 4.38Å
265	A	53	Low	50.9	Low	5 Å²	5	55 Å²	55	4%	0.041	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	119.7	159.1	0	0	0	0	0	108.3	Y252 L253 I254 N282 L284	Y252-A265 HydrophobicContact CD1-CB 4.41Å; L253-A265 CarbonylContact O-C 3.59Å; L253-A265 VanDerWaalsContact O-CA 3.32Å; L253-A265 WeakPolarHBondContact O-CA 3.44Å; I254-A265 HydrophobicContact CG1-CB 4.34Å; A265-N282 PolarHBondContact N-O 2.83Å; A265-N282 PolarHBondContact O-N 3.43Å; A265-L284 HydrophobicContact CB-CD1 3.67Å; A265-L284 HydrophobicContact CB-CG 4.31Å
266	I	48.6	Very low	50.6	Low	7 Å²	7	55.8 Å²	55.8	4%	0.036	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123	170.3	-63.2	178.2	0	0	0	107.9	Y252 L253 L268 V278 I519 L521	Y252-I266 CarbonylContact C-O 3.57Å; Y252-I266 VanDerWaalsContact CA-O 3.28Å; Y252-I266 WeakPolarHBondContact CA-O 2.93Å; L253-I266 HydrophobicContact CB-CB 4.23Å; L253-I266 HydrophobicContact CD1-CB 4.44Å; L253-I266 HydrophobicContact CD1-CG2 4.46Å; L253-I266 PolarHBondContact N-O 3.39Å; L253-I266 PolarHBondContact O-N 3.46Å; I266-L268 HydrophobicContact CG2-CD2 3.97Å; I266-V278 HydrophobicContact CG2-CB 4.44Å; I266-V278 HydrophobicContact CG2-CG1 3.53Å; I266-V278 HydrophobicContact CG2-CG2 4.32Å; I266-I519 HydrophobicContact CD1-CG2 3.59Å; I266-L521 HydrophobicContact CD1-CD1 3.38Å; I266-L521 HydrophobicContact CD1-CG 4.01Å; I266-L521 HydrophobicContact CG1-CD1 3.96Å
267	S	51.9	Low	50.1	Low	3 Å²	3	53.8 Å²	53.8	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.8	168.3	163.6	0	0	0	0	109.1	H250 I251 S279	H250-S267 PolarHBondContact ND1-OG 3.32Å; I251-S267 CarbonylContact O-C 3.53Å; I251-S267 WeakPolarHBondContact O-CA 3.32Å; S267-S279 WeakPolarHBondContact CB-O 3.34Å; S267-S279 WeakPolarHBondContact CB-OG 3.02Å; S267-S279 PolarHBondContact N-O 3.26Å; S267-S279 PolarHBondContact O-N 2.95Å; S267-S279 VanDerWaalsContact O-O 3.11Å; S267-S279 PolarHBondContact O-OG 3.46Å; S267-S279 PolarHBondContact OG-OG 3.4Å; S267-S279 VanDerWaalsContact OG-OG 3.13Å
268	L	49.4	Very low	50	Low	1 Å²	1	54.8 Å²	54.8	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	124.8	168.5	-55.5	179.3	0	0	0	109.3	H250 I251 L253 I266 I276 S277 V278 F490 I517 I519	H250-L268 CarbonylContact C-O 3.53Å; H250-L268 VanDerWaalsContact CA-O 3.24Å; H250-L268 WeakPolarHBondContact CA-O 3.28Å; I251-L268 HydrophobicContact CB-CB 4.03Å; I251-L268 HydrophobicContact CB-CD1 4.25Å; I251-L268 HydrophobicContact CB-CG 4.4Å; I251-L268 PolarHBondContact N-O 3.34Å; I251-L268 PolarHBondContact O-N 3.18Å; L253-L268 HydrophobicContact CD1-CD1 3.43Å; L253-L268 VanDerWaalsContact CD1-CD1 3.43Å; L253-L268 HydrophobicContact CD1-CD2 3.93Å; L253-L268 HydrophobicContact CD1-CG 3.64Å; L253-L268 HydrophobicContact CD2-CD1 4.32Å; L253-L268 HydrophobicContact CG-CD1 4.05Å; L253-L268 HydrophobicContact CG-CG 4.21Å; I266-L268 HydrophobicContact CG2-CD2 3.97Å; L268-I276 HydrophobicContact CB-CG2 3.64Å; L268-I276 HydrophobicContact CD1-CG2 4.15Å; L268-I276 HydrophobicContact CD2-CG2 4.12Å; L268-I276 HydrophobicContact CG-CG2 4.19Å; L268-S277 CarbonylContact C-O 3.52Å; L268-S277 WeakPolarHBondContact CA-O 3.39Å; L268-V278 HydrophobicContact CD2-CG2 3.6Å; L268-F490 HydrophobicContact CD1-CE1 3.99Å; L268-I517 HydrophobicContact CD1-CD1 4.17Å; L268-I517 HydrophobicContact CD2-CG2 4.06Å; L268-I519 HydrophobicContact CD1-CD1 4.22Å; L268-I519 HydrophobicContact CD2-CD1 3.62Å; L268-I519 HydrophobicContact CG-CD1 4.4Å
269	H	52.1	Low	49.7	Very low	32 Å²	32	49.3 Å²	49.3	15%	0.148	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	131.1	169.2	-61.4	-75.3	0	0	0	110.1	V249 H250 I276 S277 S279	V249-H269 VanDerWaalsContact O-CA 3.28Å; V249-H269 WeakPolarHBondContact O-CA 3.25Å; H250-H269 AromaticContact CE1-CE1 2.98Å; H250-H269 PolarHBondContact CE1-CE1 3.08Å; H250-H269 AromaticContact CE1-ND1 3.39Å; H250-H269 PolarHBondContact CE1-ND1 3.28Å; H250-H269 AromaticContact CG-ND1 4Å; H250-H269 AromaticContact ND1-CE1 3.45Å; H250-H269 PolarHBondContact ND1-CE1 3.12Å; H250-H269 AromaticContact ND1-ND1 3.55Å; H250-H269 AromaticContact NE2-CE1 3.53Å; H250-H269 AromaticContact NE2-ND1 3.64Å; H269-I276 CarbonylContact O-C 3.49Å; H269-I276 WeakPolarHBondContact O-CA 3.28Å; H269-S277 PolarHBondContact N-O 2.83Å; H269-S277 PolarHBondContact O-N 2.84Å; H269-S279 WeakPolarHBondContact CD2-CB 3.24Å; H269-S279 PolarHBondContact CD2-OG 2.86Å; H269-S279 WeakPolarHBondContact NE2-CB 3.35Å; H269-S279 PolarHBondContact NE2-OG 3.19Å
270	C	51	Low	49.5	Very low	8 Å²	8	45.8 Å²	45.8	5%	0.054	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	108.1	161.4	-162.1	0	0	0	0	108.2	V249 Y488	V249-C270 HydrophobicContact CB-CB 4.37Å; V249-C270 PolarHBondContact O-N 2.93Å; C270-Y488 PolarHBondContact SG-OH 3.46Å
271	D	49.6	Very low	49.5	Very low	59 Å²	59	46.4 Å²	46.4	32%	0.316	27%	0.268	S	S	.	.			trans	-82.4	171.8	175.9	-77.9	-48.7	0	0	0	111.7	D273 D274 A275 S277	D271-D273 PolarHBondContact O-N 2.99Å; D271-D274 PolarHBondContact O-N 3.28Å; D271-A275 PolarHBondContact N-O 3.32Å; D271-S277 PolarHBondContact OD2-OG 2.91Å
272	E	49.7	Very low	49.7	Very low	114 Å²	114	43.4 Å²	43.4	53%	0.533	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-27.5	-173.7	-61	-170.8	167.5	0	0	114.1	K243 I245	K243-E272 VanDerWaalsContact NZ-CD 3.25Å; K243-E272 IonicContact NZ-OE1 3.11Å; K243-E272 PolarHBondContact NZ-OE1 3.27Å; K243-E272 IonicContact NZ-OE2 2.62Å; K243-E272 PolarHBondContact NZ-OE2 2.96Å; I245-E272 HydrophobicContact CG2-CG 4.37Å
273	D	51.2	Low	49.7	Very low	148 Å²	148	43.6 Å²	43.6	79%	0.791	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	17.9	-177.7	-65.6	-34.6	0	0	0	114.5	D271 A275	D271-D273 PolarHBondContact O-N 2.99Å; D273-A275 HydrophobicContact CB-CB 4.42Å; D273-A275 PolarHBondContact O-N 3.09Å
274	D	47.6	Very low	49.8	Very low	50 Å²	50	44.1 Å²	44.1	27%	0.267	26%	0.259	S	S	.	.	S	Bend	trans	58	13.4	-165.8	-75.3	-27.1	0	0	0	113.3	D271 I276 K503 I514	D271-D274 PolarHBondContact O-N 3.28Å; D274-I276 PolarHBondContact O-N 3.34Å; D274-K503 IonicContact OD1-NZ 3.99Å; D274-K503 PolarHBondContact OD1-NZ 2.97Å; D274-K503 IonicContact OD2-NZ 3.01Å; D274-K503 PolarHBondContact OD2-NZ 3.28Å; D274-I514 HydrophobicContact CB-CD1 4.43Å; D274-I514 VanDerWaalsContact O-CG2 3.25Å; D274-I514 WeakPolarHBondContact O-CG2 3.32Å
275	A	46.3	Very low	49.6	Very low	47 Å²	47	47 Å²	47	39%	0.388	28%	0.278	S	S	.	.			trans	-72.6	122.2	173.3	0	0	0	0	0	108.6	D271 D273	D271-A275 PolarHBondContact N-O 3.32Å; D273-A275 HydrophobicContact CB-CB 4.42Å; D273-A275 PolarHBondContact O-N 3.09Å
276	I	49.7	Very low	49.9	Very low	19 Å²	19	49.9 Å²	49.9	10%	0.097	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	113.5	176.3	-62.7	169.9	0	0	0	109.5	L268 H269 D274 T501 I514 I517	L268-I276 HydrophobicContact CB-CG2 3.64Å; L268-I276 HydrophobicContact CD1-CG2 4.15Å; L268-I276 HydrophobicContact CD2-CG2 4.12Å; L268-I276 HydrophobicContact CG-CG2 4.19Å; H269-I276 CarbonylContact O-C 3.49Å; H269-I276 WeakPolarHBondContact O-CA 3.28Å; D274-I276 PolarHBondContact O-N 3.34Å; I276-T501 HydrophobicContact CD1-CG2 3.74Å; I276-I514 HydrophobicContact CD1-CB 4.46Å; I276-I514 HydrophobicContact CD1-CD1 3.73Å; I276-I514 HydrophobicContact CD1-CG2 3.98Å; I276-I514 HydrophobicContact CG1-CD1 4.31Å; I276-I514 HydrophobicContact CG1-CG2 4.1Å; I276-I517 HydrophobicContact CB-CD1 3.45Å; I276-I517 VanDerWaalsContact CB-CD1 3.45Å; I276-I517 HydrophobicContact CB-CG1 3.71Å; I276-I517 HydrophobicContact CD1-CD1 3.67Å; I276-I517 HydrophobicContact CG1-CD1 4.13Å; I276-I517 HydrophobicContact CG2-CD1 3.23Å; I276-I517 HydrophobicContact CG2-CG1 3.8Å
277	S	45.5	Very low	50.6	Low	43 Å²	43	56 Å²	56	30%	0.301	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	144.4	177.3	63.8	0	0	0	0	111.3	L268 H269 D271	L268-S277 CarbonylContact C-O 3.52Å; L268-S277 WeakPolarHBondContact CA-O 3.39Å; H269-S277 PolarHBondContact N-O 2.83Å; H269-S277 PolarHBondContact O-N 2.84Å; D271-S277 PolarHBondContact OD2-OG 2.91Å
278	V	48.8	Very low	51.5	Low	67 Å²	67	56.6 Å²	56.6	41%	0.406	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	119.5	177.5	170.7	0	0	0	0	108.7	I266 L268 I517	I266-V278 HydrophobicContact CG2-CB 4.44Å; I266-V278 HydrophobicContact CG2-CG1 3.53Å; I266-V278 HydrophobicContact CG2-CG2 4.32Å; L268-V278 HydrophobicContact CD2-CG2 3.6Å; V278-I517 HydrophobicContact CG2-CG2 3.97Å
279	S	45.7	Very low	52.6	Low	31 Å²	31	56.9 Å²	56.9	22%	0.217	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135	176.7	62.8	0	0	0	0	111.2	S267 H269	S267-S279 WeakPolarHBondContact CB-O 3.34Å; S267-S279 WeakPolarHBondContact CB-OG 3.02Å; S267-S279 PolarHBondContact N-O 3.26Å; S267-S279 PolarHBondContact O-N 2.95Å; S267-S279 VanDerWaalsContact O-O 3.11Å; S267-S279 PolarHBondContact O-OG 3.46Å; S267-S279 PolarHBondContact OG-OG 3.4Å; S267-S279 VanDerWaalsContact OG-OG 3.13Å; H269-S279 WeakPolarHBondContact CD2-CB 3.24Å; H269-S279 PolarHBondContact CD2-OG 2.86Å; H269-S279 WeakPolarHBondContact NE2-CB 3.35Å; H269-S279 PolarHBondContact NE2-OG 3.19Å
280	G	45	Very low	53.9	Low	44 Å²	44	55.7 Å²	55.7	45%	0.454	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	70.5	135.9	173.6	0	0	0	0	0	113.2
281	Q	51.8	Low	55.2	Low	118 Å²	118	55.9 Å²	55.9	55%	0.551	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.3	104.3	169.6	-75.2	-174.4	-9.9	0	0	107.1	L264	L264-Q281 HydrophobicContact CD2-CB 4.07Å; L264-Q281 HydrophobicContact CD2-CG 4.46Å
282	N	51.8	Low	56.8	Low	41 Å²	41	53.5 Å²	53.5	22%	0.219	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	118.1	174	-75.1	-6.7	0	0	0	108.3	L264 A265 L284 M317 W319	L264-N282 WeakPolarHBondContact CA-O 3.35Å; A265-N282 PolarHBondContact N-O 2.83Å; A265-N282 PolarHBondContact O-N 3.43Å; N282-L284 VanDerWaalsContact C-N 3.35Å; N282-L284 PolarHBondContact O-N 3.45Å; N282-M317 VanDerWaalsContact ND2-CE 3.28Å; N282-M317 WeakPolarHBondContact ND2-CE 3.26Å; N282-W319 PolarHBondContact ND2-NE1 3.49Å
283	S	51.2	Low	58.2	Low	69 Å²	69	51.4 Å²	51.4	48%	0.483	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	95.5	168.6	-178.7	0	0	0	0	108	C285	S283-C285 PolarHBondContact O-N 3.01Å
284	L	56.3	Low	59.7	Low	16 Å²	16	44.8 Å²	44.8	8%	0.084	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	114.9	171.9	-58.2	170.8	0	0	0	106.7	I254 H262 S263 A265 N282 H286 I288 W319	I254-L284 HydrophobicContact CD1-CD1 4.44Å; I254-L284 HydrophobicContact CG1-CD1 4.45Å; I254-L284 HydrophobicContact CG2-CD1 4.12Å; H262-L284 WeakPolarHBondContact CB-O 3.34Å; S263-L284 PolarHBondContact N-O 3.29Å; S263-L284 WeakPolarHBondContact O-CA 3.22Å; S263-L284 WeakPolarHBondContact O-CB 3.42Å; S263-L284 PolarHBondContact O-N 3.02Å; S263-L284 VanDerWaalsContact O-O 3.08Å; A265-L284 HydrophobicContact CB-CD1 3.67Å; A265-L284 HydrophobicContact CB-CG 4.31Å; N282-L284 VanDerWaalsContact C-N 3.35Å; N282-L284 PolarHBondContact O-N 3.45Å; L284-H286 PolarHBondContact O-N 3.04Å; L284-I288 HydrophobicContact CB-CD1 3.81Å; L284-I288 HydrophobicContact CD1-CD1 3.18Å; L284-I288 HydrophobicContact CG-CD1 4.05Å; L284-W319 HydrophobicContact CD1-CH2 4.5Å; L284-W319 HydrophobicContact CD2-CD2 4.49Å; L284-W319 HydrophobicContact CD2-CE3 4.5Å; L284-W319 HydrophobicContact CD2-CH2 3.26Å; L284-W319 HydrophobicContact CD2-CZ2 3.23Å; L284-W319 HydrophobicContact CD2-CZ3 3.93Å
285	C	45.6	Very low	61.2	Low	64 Å²	64	44.4 Å²	44.4	43%	0.432	27%	0.271	S	S	.	.	S	Bend	trans	-60.1	-2.1	-162.2	41.3	0	0	0	0	115.6	H262 S283	H262-C285 VanDerWaalsContact CD2-C 3.45Å; H262-C285 PolarHBondContact CD2-O 3.06Å; S283-C285 PolarHBondContact O-N 3.01Å
286	H	58.3	Low	62.5	Low	67 Å²	67	45.9 Å²	45.9	31%	0.31	28%	0.277	S	S	.	.	S	Bend	trans	-163.3	179.8	-176.2	-61.5	-67.5	0	0	0	113.9	S263 L284 I288 S304	S263-H286 WeakPolarHBondContact CB-O 3.4Å; S263-H286 PolarHBondContact OG-O 3.12Å; L284-H286 PolarHBondContact O-N 3.04Å; H286-I288 PolarHBondContact O-N 3.34Å; H286-S304 PolarHBondContact CD2-N 2.88Å; H286-S304 PolarHBondContact CD2-OG 3.4Å; H286-S304 VanDerWaalsContact CE1-CB 3.5Å; H286-S304 WeakPolarHBondContact CE1-CB 3.24Å; H286-S304 PolarHBondContact CE1-OG 3.49Å; H286-S304 WeakPolarHBondContact ND1-CB 3.48Å; H286-S304 PolarHBondContact ND1-OG 2.8Å; H286-S304 PolarHBondContact NE2-OG 2.88Å
287	Q	63.2	Low	63.9	Low	134 Å²	134	45.6 Å²	45.6	63%	0.626	28%	0.275	S	S	*	.			trans	-70	120.1	-178	-170.9	173.1	-4.3	0	0	112.5	G303	Q287-G303 WeakPolarHBondContact O-CA 3.48Å; Q287-G303 PolarHBondContact O-N 2.94Å
288	I	71.4	Confident	65.5	Low	16 Å²	16	43.6 Å²	43.6	8%	0.082	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	140.6	-178.9	-69.5	164.3	0	0	0	109.9	I254 S263 L284 H286 A291 V300 V301 Q525	I254-I288 HydrophobicContact CD1-CD1 4.39Å; I254-I288 HydrophobicContact CG2-CB 3.87Å; I254-I288 HydrophobicContact CG2-CD1 3.25Å; I254-I288 HydrophobicContact CG2-CG1 4.12Å; I254-I288 HydrophobicContact CG2-CG2 3.97Å; S263-I288 PolarHBondContact OG-N 3.23Å; L284-I288 HydrophobicContact CB-CD1 3.81Å; L284-I288 HydrophobicContact CD1-CD1 3.18Å; L284-I288 HydrophobicContact CG-CD1 4.05Å; H286-I288 PolarHBondContact O-N 3.34Å; I288-A291 HydrophobicContact CG2-CB 4.46Å; I288-V300 HydrophobicContact CB-CG1 4.19Å; I288-V300 HydrophobicContact CD1-CG1 3.49Å; I288-V300 VanDerWaalsContact CD1-CG1 3.49Å; I288-V300 HydrophobicContact CG1-CG1 3.58Å; I288-V300 HydrophobicContact CG2-CG1 3.52Å; I288-V301 WeakPolarHBondContact CG2-O 3.39Å; I288-Q525 PolarHBondContact O-OE1 2.8Å
289	T	72.9	Confident	67.1	Low	8 Å²	8	40.5 Å²	40.5	5%	0.049	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-29.6	-172.2	60.1	0	0	0	0	112.7	V301 P306 L330 H332 Q525	T289-V301 PolarHBondContact N-O 3.29Å; T289-V301 PolarHBondContact OG1-O 3.39Å; T289-V301 VanDerWaalsContact OG1-O 3.05Å; T289-P306 HydrophobicContact CG2-CB 4.29Å; T289-L330 HydrophobicContact CG2-CD2 3.53Å; T289-H332 PolarHBondContact OG1-CE1 3.26Å; T289-Q525 VanDerWaalsContact C-NE2 3.32Å; T289-Q525 PolarHBondContact O-NE2 3.49Å; T289-Q525 PolarHBondContact O-OE1 3.07Å
290	A	78.6	Confident	68.8	Low	6 Å²	6	39.1 Å²	39.1	5%	0.05	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	165.1	165.9	0	0	0	0	0	110.1	V301 H332 M334 Q525	A290-V301 PolarHBondContact N-O 3.31Å; A290-V301 PolarHBondContact O-N 2.96Å; A290-V301 VanDerWaalsContact O-O 3.08Å; A290-H332 VanDerWaalsContact CB-CE1 3.46Å; A290-H332 WeakPolarHBondContact CB-CE1 3.16Å; A290-H332 VanDerWaalsContact CB-NE2 3.26Å; A290-H332 WeakPolarHBondContact CB-NE2 3.36Å; A290-H332 WeakPolarHBondContact CB-O 3.5Å; A290-M334 HydrophobicContact CB-CB 4.14Å; A290-M334 HydrophobicContact CB-CG 3.56Å; A290-M334 HydrophobicContact CB-SD 3.66Å; A290-Q525 VanDerWaalsContact N-OE1 3.1Å
291	A	79.9	Confident	70.5	Confident	12 Å²	12	37 Å²	37	10%	0.099	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	160.2	173.1	0	0	0	0	0	111.8	I254 I288 Y299 V300 V527	I254-A291 HydrophobicContact CD1-CB 3.88Å; I288-A291 HydrophobicContact CG2-CB 4.46Å; A291-Y299 CarbonylContact C-O 3.58Å; A291-Y299 WeakPolarHBondContact CA-O 3.5Å; A291-Y299 WeakPolarHBondContact CB-O 3.08Å; A291-V300 HydrophobicContact CB-CB 4.23Å; A291-V300 HydrophobicContact CB-CG1 4.29Å; A291-V300 HydrophobicContact CB-CG2 3.96Å; A291-V527 HydrophobicContact CB-CB 4.38Å; A291-V527 HydrophobicContact CB-CG2 3.06Å
292	C	81.9	Confident	71.5	Confident	9 Å²	9	31.5 Å²	31.5	6%	0.061	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	155	177.3	68.7	0	0	0	0	111.2	Y299 M334 V343	C292-Y299 PolarHBondContact N-O 2.89Å; C292-Y299 PolarHBondContact O-N 3.47Å; C292-M334 HydrophobicContact CB-CB 4.01Å; C292-V343 WeakPolarHBondContact SG-CG1 3.38Å
293	K	78.9	Confident	72.1	Confident	70 Å²	70	30.3 Å²	30.3	30%	0.304	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	141.2	164.7	175.1	-173.3	-179.5	175.4	0	111.3	G295 D297 S336 A529	K293-G295 WeakPolarHBondContact CE-O 3.17Å; K293-G295 WeakPolarHBondContact CG-O 3.38Å; K293-D297 WeakPolarHBondContact CA-O 3.33Å; K293-D297 WeakPolarHBondContact CG-O 3.3Å; K293-S336 WeakPolarHBondContact O-CB 3.47Å; K293-S336 PolarHBondContact O-OG 2.73Å; K293-S336 VanDerWaalsContact O-OG 3.11Å; K293-A529 VanDerWaalsContact CB-CA 3.48Å; K293-A529 HydrophobicContact CB-CB 3.77Å; K293-A529 HydrophobicContact CD-CB 3.59Å; K293-A529 WeakPolarHBondContact CD-OXT 3.45Å; K293-A529 WeakPolarHBondContact CE-OXT 3.24Å; K293-A529 HydrophobicContact CG-CB 4.1Å; K293-A529 PolarHBondContact NZ-O 3.05Å; K293-A529 PolarHBondContact NZ-OXT 3.15Å
294	H	83.6	Confident	72.4	Confident	9 Å²	9	30 Å²	30	4%	0.042	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	120.9	167.9	-174.7	91.7	0	0	0	110	D297 Y299 S336 D341 A342 V343	H294-D297 PolarHBondContact N-O 2.9Å; H294-D297 PolarHBondContact O-N 2.71Å; H294-D297 VanDerWaalsContact O-N 3.14Å; H294-D297 VanDerWaalsContact O-O 3.12Å; H294-Y299 HydrophobicContact CB-CD2 3.77Å; H294-Y299 HydrophobicContact CB-CE2 3.71Å; H294-S336 PolarHBondContact ND1-OG 3.18Å; H294-D341 IonicContact CD2-OD1 2.77Å; H294-D341 IonicContact CE1-OD1 3.71Å; H294-D341 IonicContact NE2-OD1 3.85Å; H294-D341 PolarHBondContact NE2-OD1 3.44Å; H294-A342 PolarHBondContact CE1-N 2.96Å; H294-V343 HydrophobicContact CB-CG2 3.74Å
295	G	78.3	Confident	73	Confident	42 Å²	42	32 Å²	32	43%	0.433	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	-133.4	-174	0	0	0	0	0	111.8	K293 D297	K293-G295 WeakPolarHBondContact CE-O 3.17Å; K293-G295 WeakPolarHBondContact CG-O 3.38Å; G295-D297 PolarHBondContact O-N 3.47Å
296	P	73.3	Confident	74.4	Confident	79 Å²	79	30.1 Å²	30.1	51%	0.513	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-0.6	177	35.1	-35.2	0	0	0	113.4	M314	P296-M314 WeakPolarHBondContact O-CB 3.46Å; P296-M314 WeakPolarHBondContact O-CG 3.48Å
297	D	80.3	Confident	75.6	Confident	13 Å²	13	32.1 Å²	32.1	7%	0.07	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	146.4	-166.2	-59.4	-50.3	0	0	0	112.7	K293 H294 G295 Y299 K311 C312 N313	K293-D297 WeakPolarHBondContact CA-O 3.33Å; K293-D297 WeakPolarHBondContact CG-O 3.3Å; H294-D297 PolarHBondContact N-O 2.9Å; H294-D297 PolarHBondContact O-N 2.71Å; H294-D297 VanDerWaalsContact O-N 3.14Å; H294-D297 VanDerWaalsContact O-O 3.12Å; G295-D297 PolarHBondContact O-N 3.47Å; D297-Y299 HydrophobicContact CB-CE2 3.84Å; D297-K311 HydrophobicContact CB-CG 4.09Å; D297-K311 WeakPolarHBondContact OD2-CE 3.46Å; D297-K311 IonicContact OD2-NZ 2.75Å; D297-K311 PolarHBondContact OD2-NZ 3.35Å; D297-C312 WeakPolarHBondContact CA-O 3.45Å; D297-N313 WeakPolarHBondContact OD1-CA 3.3Å
298	L	79.1	Confident	76.6	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.9	172.5	174.8	69.1	0	0	0	110.5	Y252 V300 K311 C312 M314 W319 V527	Y252-L298 HydrophobicContact CD1-CD2 4.05Å; Y252-L298 HydrophobicContact CG-CD2 4.21Å; L298-V300 HydrophobicContact CD2-CG2 4.09Å; L298-V300 HydrophobicContact CG-CG2 3.9Å; L298-K311 CarbonylContact O-C 3.58Å; L298-K311 WeakPolarHBondContact O-CA 3.49Å; L298-C312 HydrophobicContact CB-CB 4.19Å; L298-C312 PolarHBondContact N-O 3.39Å; L298-C312 PolarHBondContact O-N 3.44Å; L298-M314 HydrophobicContact CB-CE 3.55Å; L298-M314 HydrophobicContact CB-CG 4.39Å; L298-M314 HydrophobicContact CB-SD 3.41Å; L298-M314 WeakPolarHBondContact CB-SD 3.4Å; L298-M314 HydrophobicContact CD2-CE 4.36Å; L298-M314 HydrophobicContact CD2-SD 4.37Å; L298-M314 HydrophobicContact CG-CE 4.38Å; L298-M314 HydrophobicContact CG-SD 4.49Å; L298-W319 HydrophobicContact CD2-CH2 4.46Å; L298-V527 HydrophobicContact CD1-CB 3.72Å; L298-V527 HydrophobicContact CD1-CG1 3.17Å; L298-V527 HydrophobicContact CD1-CG2 4.06Å
299	Y	82.4	Confident	77.2	Confident	1 Å²	1	29.1 Å²	29.1	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.1	176	-70.4	-89.3	0	0	0	110.5	A291 C292 H294 D297 M309 W310 K311 V343 Y362 V364	A291-Y299 CarbonylContact C-O 3.58Å; A291-Y299 WeakPolarHBondContact CA-O 3.5Å; A291-Y299 WeakPolarHBondContact CB-O 3.08Å; C292-Y299 PolarHBondContact N-O 2.89Å; C292-Y299 PolarHBondContact O-N 3.47Å; H294-Y299 HydrophobicContact CB-CD2 3.77Å; H294-Y299 HydrophobicContact CB-CE2 3.71Å; D297-Y299 HydrophobicContact CB-CE2 3.84Å; Y299-M309 HydrophobicContact CD1-CE 3.39Å; Y299-M309 HydrophobicContact CE1-CE 4.22Å; Y299-M309 HydrophobicContact CG-CE 3.95Å; Y299-W310 WeakPolarHBondContact CA-O 3.46Å; Y299-K311 HydrophobicContact CD1-CB 4.1Å; Y299-K311 HydrophobicContact CE1-CB 3.84Å; Y299-K311 HydrophobicContact CE1-CD 4.1Å; Y299-K311 HydrophobicContact CE1-CG 3.99Å; Y299-V343 HydrophobicContact CD2-CG2 4.5Å; Y299-Y362 HydrophobicContact CD1-CE1 4.43Å; Y299-Y362 AromaticContact CE1-CE1 3.87Å; Y299-Y362 HydrophobicContact CE1-CE1 3.87Å; Y299-V364 VanDerWaalsContact OH-CG1 3.28Å; Y299-V364 WeakPolarHBondContact OH-CG1 3.38Å
300	V	80.8	Confident	77.6	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.1	-176.3	-178.8	0	0	0	0	109.4	I254 I288 A291 L298 M309 W310 W319	I254-V300 HydrophobicContact CD1-CG2 3.91Å; I288-V300 HydrophobicContact CB-CG1 4.19Å; I288-V300 HydrophobicContact CD1-CG1 3.49Å; I288-V300 VanDerWaalsContact CD1-CG1 3.49Å; I288-V300 HydrophobicContact CG1-CG1 3.58Å; I288-V300 HydrophobicContact CG2-CG1 3.52Å; A291-V300 HydrophobicContact CB-CB 4.23Å; A291-V300 HydrophobicContact CB-CG1 4.29Å; A291-V300 HydrophobicContact CB-CG2 3.96Å; L298-V300 HydrophobicContact CD2-CG2 4.09Å; L298-V300 HydrophobicContact CG-CG2 3.9Å; V300-M309 CarbonylContact O-C 3.57Å; V300-M309 VanDerWaalsContact O-CA 3.31Å; V300-M309 WeakPolarHBondContact O-CA 3.31Å; V300-W310 PolarHBondContact N-O 2.89Å; V300-W310 PolarHBondContact O-N 3.32Å; V300-W319 HydrophobicContact CB-CZ3 4.35Å; V300-W319 HydrophobicContact CG2-CH2 3.98Å; V300-W319 HydrophobicContact CG2-CZ3 4.05Å
301	V	81.1	Confident	77.9	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.9	173.1	177.1	0	0	0	0	109.8	I288 T289 A290 P306 R308 M309 L325 M334	I288-V301 WeakPolarHBondContact CG2-O 3.39Å; T289-V301 PolarHBondContact N-O 3.29Å; T289-V301 PolarHBondContact OG1-O 3.39Å; T289-V301 VanDerWaalsContact OG1-O 3.05Å; A290-V301 PolarHBondContact N-O 3.31Å; A290-V301 PolarHBondContact O-N 2.96Å; A290-V301 VanDerWaalsContact O-O 3.08Å; V301-P306 WeakPolarHBondContact CG1-O 3.25Å; V301-R308 CarbonylContact C-O 3.56Å; V301-R308 VanDerWaalsContact CA-O 3.28Å; V301-R308 WeakPolarHBondContact CA-O 3.41Å; V301-M309 HydrophobicContact CG2-CB 4.1Å; V301-M309 HydrophobicContact CG2-CG 3.86Å; V301-L325 HydrophobicContact CG1-CD1 3.43Å; V301-L325 VanDerWaalsContact CG1-CD1 3.43Å; V301-L325 HydrophobicContact CG1-CG 3.9Å; V301-M334 HydrophobicContact CB-SD 3.8Å; V301-M334 HydrophobicContact CG2-CE 3.75Å; V301-M334 HydrophobicContact CG2-SD 3.41Å; V301-M334 WeakPolarHBondContact CG2-SD 3.49Å
302	G	73.6	Confident	77.6	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	132.7	-167.8	176.6	0	0	0	0	0	112.8	I305 P306 R308	G302-I305 CarbonylContact C-O 3.55Å; G302-P306 WeakPolarHBondContact CA-O 3.28Å; G302-R308 PolarHBondContact N-O 3.11Å
303	G	63.8	Low	77.2	Confident	16 Å²	16	35.3 Å²	35.3	17%	0.165	19%	0.187	C	C	.	.	S	Bend	trans	128.8	-143.1	172.3	0	0	0	0	0	112.6	Q287 I305	Q287-G303 WeakPolarHBondContact O-CA 3.48Å; Q287-G303 PolarHBondContact O-N 2.94Å; G303-I305 PolarHBondContact O-N 3.27Å
304	S	58.3	Low	76.4	Confident	64 Å²	64	33.3 Å²	33.3	45%	0.448	18%	0.179	S	C	.	.	S	Bend	trans	-68.3	-16.8	175.5	22.9	0	0	0	0	111.4	H286 R308	H286-S304 PolarHBondContact CD2-N 2.88Å; H286-S304 PolarHBondContact CD2-OG 3.4Å; H286-S304 VanDerWaalsContact CE1-CB 3.5Å; H286-S304 WeakPolarHBondContact CE1-CB 3.24Å; H286-S304 PolarHBondContact CE1-OG 3.49Å; H286-S304 WeakPolarHBondContact ND1-CB 3.48Å; H286-S304 PolarHBondContact ND1-OG 2.8Å; H286-S304 PolarHBondContact NE2-OG 2.88Å; S304-R308 PolarHBondContact OG-NH1 3.31Å
305	I	68.9	Low	75.4	Confident	57 Å²	57	41 Å²	41	29%	0.292	22%	0.215	S	C	.	.	S	Bend	trans	-127.6	120.2	168.7	-55.9	-173.8	0	0	0	107.1	G302 G303 R307 R308	G302-I305 CarbonylContact C-O 3.55Å; G303-I305 PolarHBondContact O-N 3.27Å; I305-R307 HydrophobicContact CG2-CG 3.62Å; I305-R307 PolarHBondContact O-N 3.37Å; I305-R307 VanDerWaalsContact O-N 3.16Å; I305-R308 HydrophobicContact CB-CG 3.97Å; I305-R308 PolarHBondContact O-N 3.31Å
306	P	74.4	Confident	74.7	Confident	25 Å²	25	42.6 Å²	42.6	16%	0.162	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.6	-174.9	-28.1	34.9	0	0	0	115.4	T289 V301 G302 D328 L330 L351	T289-P306 HydrophobicContact CG2-CB 4.29Å; V301-P306 WeakPolarHBondContact CG1-O 3.25Å; G302-P306 WeakPolarHBondContact CA-O 3.28Å; P306-D328 HydrophobicContact CB-CB 4.18Å; P306-L330 HydrophobicContact CB-CD2 3.99Å; P306-L330 HydrophobicContact CG-CD2 4.23Å; P306-L351 HydrophobicContact CG-CD2 4.01Å
307	R	83.6	Confident	74.3	Confident	108 Å²	108	41.7 Å²	41.7	41%	0.408	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-7	177.2	64.5	173.5	-177.1	162.1	1.7	116.3	I305 P324 L325 D328	I305-R307 HydrophobicContact CG2-CG 3.62Å; I305-R307 PolarHBondContact O-N 3.37Å; I305-R307 VanDerWaalsContact O-N 3.16Å; R307-P324 HydrophobicContact CG-CB 4.33Å; R307-P324 CarbonylContact O-C 3.58Å; R307-P324 WeakPolarHBondContact O-CA 3.42Å; R307-P324 VanDerWaalsContact O-CB 3.26Å; R307-P324 WeakPolarHBondContact O-CB 3.32Å; R307-L325 HydrophobicContact CB-CB 3.84Å; R307-L325 PolarHBondContact O-N 3.46Å; R307-D328 VanDerWaalsContact CB-OD1 3.28Å; R307-D328 WeakPolarHBondContact CB-OD1 3.41Å; R307-D328 VanDerWaalsContact CG-OD1 3.28Å; R307-D328 WeakPolarHBondContact CG-OD1 3.44Å; R307-D328 PolarHBondContact N-OD1 2.94Å; R307-D328 VanDerWaalsContact N-OD1 3.09Å
308	R	82.9	Confident	73.5	Confident	87 Å²	87	45.7 Å²	45.7	33%	0.328	23%	0.228	S	C	.	.			trans	-69.5	141	-177	-79.1	176	-171.2	175.9	6	110.7	V301 G302 S304 I305	V301-R308 CarbonylContact C-O 3.56Å; V301-R308 VanDerWaalsContact CA-O 3.28Å; V301-R308 WeakPolarHBondContact CA-O 3.41Å; G302-R308 PolarHBondContact N-O 3.11Å; S304-R308 PolarHBondContact OG-NH1 3.31Å; I305-R308 HydrophobicContact CB-CG 3.97Å; I305-R308 PolarHBondContact O-N 3.31Å
309	M	84.9	Confident	73.2	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	141	176.3	-172	-178.7	-168.6	0	0	110.2	Y299 V300 V301 C322 A323 M334 Y362 W369	Y299-M309 HydrophobicContact CD1-CE 3.39Å; Y299-M309 HydrophobicContact CE1-CE 4.22Å; Y299-M309 HydrophobicContact CG-CE 3.95Å; V300-M309 CarbonylContact O-C 3.57Å; V300-M309 VanDerWaalsContact O-CA 3.31Å; V300-M309 WeakPolarHBondContact O-CA 3.31Å; V301-M309 HydrophobicContact CG2-CB 4.1Å; V301-M309 HydrophobicContact CG2-CG 3.86Å; M309-C322 HydrophobicContact CB-CB 3.99Å; M309-C322 HydrophobicContact CG-CB 3.82Å; M309-C322 PolarHBondContact O-N 3.1Å; M309-C322 HydrophobicContact SD-CB 3.86Å; M309-A323 WeakPolarHBondContact CB-O 3.5Å; M309-M334 HydrophobicContact CE-CE 4.21Å; M309-Y362 HydrophobicContact CE-CD1 3.73Å; M309-Y362 HydrophobicContact CE-CD2 4.42Å; M309-Y362 HydrophobicContact CE-CE1 4.01Å; M309-Y362 HydrophobicContact CE-CG 3.94Å; M309-Y362 HydrophobicContact SD-CD1 4.4Å; M309-Y362 HydrophobicContact SD-CD2 4.06Å; M309-Y362 HydrophobicContact SD-CE1 4.5Å; M309-Y362 HydrophobicContact SD-CE2 4.17Å; M309-Y362 HydrophobicContact SD-CG 4.17Å; M309-W369 HydrophobicContact CE-CZ2 3.92Å; M309-W369 HydrophobicContact SD-CZ2 3.45Å; M309-W369 WeakPolarHBondContact SD-CZ2 3.44Å
310	W	81.8	Confident	73.1	Confident	72 Å²	72	55 Å²	55	27%	0.273	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	148.1	178.7	-55.7	87.3	0	0	0	109.7	Y299 V300 W319 E320 R321	Y299-W310 WeakPolarHBondContact CA-O 3.46Å; V300-W310 PolarHBondContact N-O 2.89Å; V300-W310 PolarHBondContact O-N 3.32Å; W310-W319 HydrophobicContact CB-CE3 3.78Å; W310-W319 HydrophobicContact CB-CZ3 3.88Å; W310-E320 CarbonylContact C-O 3.52Å; W310-E320 WeakPolarHBondContact CA-O 3.37Å; W310-R321 HydrophobicContact CE3-CB 4.14Å; W310-R321 HydrophobicContact CE3-CG 4.49Å; W310-R321 HydrophobicContact CZ3-CB 4.04Å; W310-R321 HydrophobicContact CZ3-CG 4.39Å
311	K	84.6	Confident	73.2	Confident	44 Å²	44	64.2 Å²	64.2	19%	0.191	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.8	173.9	169	-176	168.9	156.2	0	107.8	D297 L298 Y299 W319 E320 C322	D297-K311 HydrophobicContact CB-CG 4.09Å; D297-K311 WeakPolarHBondContact OD2-CE 3.46Å; D297-K311 IonicContact OD2-NZ 2.75Å; D297-K311 PolarHBondContact OD2-NZ 3.35Å; L298-K311 CarbonylContact O-C 3.58Å; L298-K311 WeakPolarHBondContact O-CA 3.49Å; Y299-K311 HydrophobicContact CD1-CB 4.1Å; Y299-K311 HydrophobicContact CE1-CB 3.84Å; Y299-K311 HydrophobicContact CE1-CD 4.1Å; Y299-K311 HydrophobicContact CE1-CG 3.99Å; K311-W319 CarbonylContact O-C 3.52Å; K311-W319 WeakPolarHBondContact O-CA 3.48Å; K311-E320 HydrophobicContact CB-CB 4.45Å; K311-E320 PolarHBondContact N-O 3.24Å; K311-E320 PolarHBondContact O-N 2.89Å; K311-C322 WeakPolarHBondContact CB-SG 3.32Å
312	C	73.7	Confident	73.6	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.007	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	120.5	174.1	176.4	0	0	0	0	108.9	D297 L298 M314 D318 W319	D297-C312 WeakPolarHBondContact CA-O 3.45Å; L298-C312 HydrophobicContact CB-CB 4.19Å; L298-C312 PolarHBondContact N-O 3.39Å; L298-C312 PolarHBondContact O-N 3.44Å; C312-M314 PolarHBondContact O-N 2.98Å; C312-D318 CarbonylContact C-O 3.47Å; C312-D318 VanDerWaalsContact CA-O 3.3Å; C312-D318 WeakPolarHBondContact CA-O 3.33Å; C312-W319 HydrophobicContact CB-CD2 3.8Å; C312-W319 HydrophobicContact CB-CE3 3.81Å; C312-W319 HydrophobicContact CB-CH2 3.55Å; C312-W319 HydrophobicContact CB-CZ2 3.5Å; C312-W319 HydrophobicContact CB-CZ3 3.71Å
313	N	72.6	Confident	74.4	Confident	47 Å²	47	65.8 Å²	65.8	25%	0.251	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	125.4	169.4	-177.4	-55.3	0	0	0	108.5	D297 Q315 T316 M317 D318	D297-N313 WeakPolarHBondContact OD1-CA 3.3Å; N313-Q315 WeakPolarHBondContact OD1-CA 3.28Å; N313-Q315 WeakPolarHBondContact OD1-CB 3.5Å; N313-Q315 PolarHBondContact OD1-N 2.83Å; N313-T316 WeakPolarHBondContact CB-OG1 3.36Å; N313-T316 PolarHBondContact OD1-N 3.45Å; N313-M317 WeakPolarHBondContact O-CA 3.44Å; N313-M317 PolarHBondContact O-N 3.4Å; N313-D318 PolarHBondContact N-O 2.89Å
314	M	62	Low	75.7	Confident	28 Å²	28	68 Å²	68	14%	0.138	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-16.9	-170.3	-56.9	-67.4	-107.1	0	0	113.4	Y252 P296 L298 C312 A529	Y252-M314 HydrophobicContact CD1-CE 4.27Å; Y252-M314 HydrophobicContact CD2-CE 3.47Å; Y252-M314 VanDerWaalsContact CD2-CE 3.47Å; Y252-M314 HydrophobicContact CE1-CE 3.76Å; Y252-M314 HydrophobicContact CE1-SD 4.01Å; Y252-M314 HydrophobicContact CE2-CE 2.88Å; Y252-M314 HydrophobicContact CE2-SD 4.08Å; Y252-M314 HydrophobicContact CG-CE 4.13Å; Y252-M314 VanDerWaalsContact CZ-SD 3.6Å; Y252-M314 VanDerWaalsContact OH-CE 3.25Å; Y252-M314 WeakPolarHBondContact OH-CE 3.09Å; Y252-M314 PolarHBondContact OH-SD 3.37Å; P296-M314 WeakPolarHBondContact O-CB 3.46Å; P296-M314 WeakPolarHBondContact O-CG 3.48Å; L298-M314 HydrophobicContact CB-CE 3.55Å; L298-M314 HydrophobicContact CB-CG 4.39Å; L298-M314 HydrophobicContact CB-SD 3.41Å; L298-M314 WeakPolarHBondContact CB-SD 3.4Å; L298-M314 HydrophobicContact CD2-CE 4.36Å; L298-M314 HydrophobicContact CD2-SD 4.37Å; L298-M314 HydrophobicContact CG-CE 4.38Å; L298-M314 HydrophobicContact CG-SD 4.49Å; C312-M314 PolarHBondContact O-N 2.98Å; M314-A529 HydrophobicContact CE-CB 3.6Å
315	Q	63.8	Low	77.2	Confident	171 Å²	171	64.9 Å²	64.9	80%	0.799	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-44.1	176.4	-62.9	-179.4	-10.3	0	0	111	N313	N313-Q315 WeakPolarHBondContact OD1-CA 3.28Å; N313-Q315 WeakPolarHBondContact OD1-CB 3.5Å; N313-Q315 PolarHBondContact OD1-N 2.83Å
316	T	63.3	Low	78.2	Confident	76 Å²	76	65 Å²	65	47%	0.466	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-16.5	-177	68.9	0	0	0	0	113.4	N313 D318	N313-T316 WeakPolarHBondContact CB-OG1 3.36Å; N313-T316 PolarHBondContact OD1-N 3.45Å; T316-D318 WeakPolarHBondContact CB-OD2 3.18Å; T316-D318 PolarHBondContact O-N 2.82Å; T316-D318 WeakPolarHBondContact OG1-CB 3.48Å; T316-D318 VanDerWaalsContact OG1-CG 3.24Å; T316-D318 PolarHBondContact OG1-N 2.84Å; T316-D318 PolarHBondContact OG1-OD2 3.04Å
317	M	63.6	Low	78.7	Confident	60 Å²	60	72 Å²	72	30%	0.296	33%	0.332	S	S	.	.			trans	62.2	21.3	-172.3	-61.1	-70.8	-87.1	0	0	113.8	N282 N313	N282-M317 VanDerWaalsContact ND2-CE 3.28Å; N282-M317 WeakPolarHBondContact ND2-CE 3.26Å; N313-M317 WeakPolarHBondContact O-CA 3.44Å; N313-M317 PolarHBondContact O-N 3.4Å
318	D	64.4	Low	78.8	Confident	97 Å²	97	69.3 Å²	69.3	52%	0.519	33%	0.325	S	S	.	.			trans	-80	141	176.7	-66.5	-44.3	0	0	0	111.9	C312 N313 T316	C312-D318 CarbonylContact C-O 3.47Å; C312-D318 VanDerWaalsContact CA-O 3.3Å; C312-D318 WeakPolarHBondContact CA-O 3.33Å; N313-D318 PolarHBondContact N-O 2.89Å; T316-D318 WeakPolarHBondContact CB-OD2 3.18Å; T316-D318 PolarHBondContact O-N 2.82Å; T316-D318 WeakPolarHBondContact OG1-CB 3.48Å; T316-D318 VanDerWaalsContact OG1-CG 3.24Å; T316-D318 PolarHBondContact OG1-N 2.84Å; T316-D318 PolarHBondContact OG1-OD2 3.04Å
319	W	72.8	Confident	78.9	Confident	81 Å²	81	65.7 Å²	65.7	31%	0.307	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.3	-179.5	-71.2	80.6	0	0	0	111.8	N282 L284 L298 V300 W310 K311 C312	N282-W319 PolarHBondContact ND2-NE1 3.49Å; L284-W319 HydrophobicContact CD1-CH2 4.5Å; L284-W319 HydrophobicContact CD2-CD2 4.49Å; L284-W319 HydrophobicContact CD2-CE3 4.5Å; L284-W319 HydrophobicContact CD2-CH2 3.26Å; L284-W319 HydrophobicContact CD2-CZ2 3.23Å; L284-W319 HydrophobicContact CD2-CZ3 3.93Å; L298-W319 HydrophobicContact CD2-CH2 4.46Å; V300-W319 HydrophobicContact CB-CZ3 4.35Å; V300-W319 HydrophobicContact CG2-CH2 3.98Å; V300-W319 HydrophobicContact CG2-CZ3 4.05Å; W310-W319 HydrophobicContact CB-CE3 3.78Å; W310-W319 HydrophobicContact CB-CZ3 3.88Å; K311-W319 CarbonylContact O-C 3.52Å; K311-W319 WeakPolarHBondContact O-CA 3.48Å; C312-W319 HydrophobicContact CB-CD2 3.8Å; C312-W319 HydrophobicContact CB-CE3 3.81Å; C312-W319 HydrophobicContact CB-CH2 3.55Å; C312-W319 HydrophobicContact CB-CZ2 3.5Å; C312-W319 HydrophobicContact CB-CZ3 3.71Å
320	E	79.4	Confident	78.9	Confident	117 Å²	117	68.4 Å²	68.4	55%	0.547	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	149	177.4	-64.1	-177	170.2	0	0	110.5	W310 K311	W310-E320 CarbonylContact C-O 3.52Å; W310-E320 WeakPolarHBondContact CA-O 3.37Å; K311-E320 HydrophobicContact CB-CB 4.45Å; K311-E320 PolarHBondContact N-O 3.24Å; K311-E320 PolarHBondContact O-N 2.89Å
321	R	83.4	Confident	79	Confident	196 Å²	196	67.9 Å²	67.9	74%	0.74	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.4	178.9	-170.4	178.6	66.4	177.1	0.1	110.3	W310	W310-R321 HydrophobicContact CE3-CB 4.14Å; W310-R321 HydrophobicContact CE3-CG 4.49Å; W310-R321 HydrophobicContact CZ3-CB 4.04Å; W310-R321 HydrophobicContact CZ3-CG 4.39Å
322	C	89	Confident	79.1	Confident	12 Å²	12	66.2 Å²	66.2	8%	0.081	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	174.3	176	-60.1	0	0	0	0	111.7	M309 K311 Y362	M309-C322 HydrophobicContact CB-CB 3.99Å; M309-C322 HydrophobicContact CG-CB 3.82Å; M309-C322 PolarHBondContact O-N 3.1Å; M309-C322 HydrophobicContact SD-CB 3.86Å; K311-C322 WeakPolarHBondContact CB-SG 3.32Å; C322-Y362 HydrophobicContact CB-CE2 4.39Å
323	A	90.9	Very high	79.9	Confident	22 Å²	22	66.9 Å²	66.9	18%	0.182	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-58.2	130	170.6	0	0	0	0	0	110	M309 Y362 N367 W369	M309-A323 WeakPolarHBondContact CB-O 3.5Å; A323-Y362 HydrophobicContact CB-CE2 4.26Å; A323-N367 WeakPolarHBondContact CB-O 3.38Å; A323-N367 WeakPolarHBondContact CB-OD1 3.35Å; A323-N367 PolarHBondContact N-OD1 3.34Å; A323-W369 PolarHBondContact O-NE1 3.42Å
324	P	90.9	Very high	80.7	Confident	61 Å²	61	65.5 Å²	65.5	40%	0.396	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-71.2	156.9	179.3	31.1	-35.2	0	0	0	110.9	R307	R307-P324 HydrophobicContact CG-CB 4.33Å; R307-P324 CarbonylContact O-C 3.58Å; R307-P324 WeakPolarHBondContact O-CA 3.42Å; R307-P324 VanDerWaalsContact O-CB 3.26Å; R307-P324 WeakPolarHBondContact O-CB 3.32Å
325	L	90.3	Very high	82	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-53.9	144	169.8	-65	172.2	0	0	0	110.2	V301 R307 R327 R329 I360 W369	V301-L325 HydrophobicContact CG1-CD1 3.43Å; V301-L325 VanDerWaalsContact CG1-CD1 3.43Å; V301-L325 HydrophobicContact CG1-CG 3.9Å; R307-L325 HydrophobicContact CB-CB 3.84Å; R307-L325 PolarHBondContact O-N 3.46Å; L325-R327 WeakPolarHBondContact CB-O 3.49Å; L325-R327 PolarHBondContact O-N 3.44Å; L325-R329 HydrophobicContact CD1-CB 4.26Å; L325-I360 HydrophobicContact CD2-CD1 3.57Å; L325-W369 HydrophobicContact CD2-CD2 4.06Å; L325-W369 HydrophobicContact CD2-CE3 4.12Å; L325-W369 HydrophobicContact CD2-CH2 3.48Å; L325-W369 VanDerWaalsContact CD2-CH2 3.48Å; L325-W369 HydrophobicContact CD2-CZ2 3.36Å; L325-W369 HydrophobicContact CD2-CZ3 3.86Å; L325-W369 HydrophobicContact CG-CZ2 4.29Å
326	P	89.9	Confident	83.3	Confident	60 Å²	60	57.5 Å²	57.5	39%	0.39	29%	0.288	S	S	.	.	S	Bend	trans	-58.8	-33	175.8	-25.5	34.7	0	0	0	113.2	W369	P326-W369 HydrophobicContact CG-CB 3.84Å; P326-W369 HydrophobicContact CG-CG 4.47Å
327	R	85.4	Confident	84.6	Confident	172 Å²	172	53.9 Å²	53.9	65%	0.649	27%	0.265	S	S	*	.	S	Bend	trans	-137.5	150.9	179.2	-61.3	-174.5	-171.9	172.7	5.4	110.7	L325	L325-R327 WeakPolarHBondContact CB-O 3.49Å; L325-R327 PolarHBondContact O-N 3.44Å
328	D	84.3	Confident	85.6	Confident	50 Å²	50	55.2 Å²	55.2	27%	0.267	28%	0.281	S	S	.	.			trans	-64.5	133.4	175.1	-66.6	-52.3	0	0	0	110.9	P306 R307 L351	P306-D328 HydrophobicContact CB-CB 4.18Å; R307-D328 VanDerWaalsContact CB-OD1 3.28Å; R307-D328 WeakPolarHBondContact CB-OD1 3.41Å; R307-D328 VanDerWaalsContact CG-OD1 3.28Å; R307-D328 WeakPolarHBondContact CG-OD1 3.44Å; R307-D328 PolarHBondContact N-OD1 2.94Å; R307-D328 VanDerWaalsContact N-OD1 3.09Å; D328-L351 HydrophobicContact CB-CD1 3.87Å; D328-L351 HydrophobicContact CB-CG 3.92Å
329	R	86	Confident	86.6	Confident	12 Å²	12	57.1 Å²	57.1	5%	0.045	29%	0.29	C	S	.	.			trans	-142.2	132.1	-179.9	-65.6	-177.4	-176.1	-129.4	10.5	111.2	L325 H332 G347 K349 A358	L325-R329 HydrophobicContact CD1-CB 4.26Å; R329-H332 HydrophobicContact CB-CB 4.14Å; R329-H332 PolarHBondContact O-ND1 3.11Å; R329-G347 PolarHBondContact NH1-O 2.86Å; R329-K349 WeakPolarHBondContact CA-O 3.41Å; R329-A358 PolarHBondContact NH1-O 3.49Å
330	L	84.2	Confident	87.2	Confident	58 Å²	58	56.6 Å²	56.6	30%	0.304	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-111.9	151.5	174.2	-56.2	-179.1	0	0	0	109.7	T289 P306 H332 G348 K349 L351	T289-L330 HydrophobicContact CG2-CD2 3.53Å; P306-L330 HydrophobicContact CB-CD2 3.99Å; P306-L330 HydrophobicContact CG-CD2 4.23Å; L330-H332 PolarHBondContact O-N 2.98Å; L330-G348 CarbonylContact O-C 3.54Å; L330-G348 VanDerWaalsContact O-CA 3.23Å; L330-G348 WeakPolarHBondContact O-CA 3.48Å; L330-K349 PolarHBondContact N-O 3.4Å; L330-K349 PolarHBondContact O-N 3.36Å; L330-L351 HydrophobicContact CD1-CD2 4.04Å; L330-L351 HydrophobicContact CG-CD2 4.36Å
331	S	83.6	Confident	87.8	Confident	60 Å²	60	54.2 Å²	54.2	42%	0.42	28%	0.282	S	S	.	.	S	Bend	trans	48	33.7	176.9	-54.9	0	0	0	0	113.9	G381	S331-G381 PolarHBondContact O-N 2.95Å
332	H	88.5	Confident	88.2	Confident	9 Å²	9	45 Å²	45	4%	0.042	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-88.7	158.6	176.6	68.7	-89.6	0	0	0	109.2	T289 A290 R329 L330 S345	T289-H332 PolarHBondContact OG1-CE1 3.26Å; A290-H332 VanDerWaalsContact CB-CE1 3.46Å; A290-H332 WeakPolarHBondContact CB-CE1 3.16Å; A290-H332 VanDerWaalsContact CB-NE2 3.26Å; A290-H332 WeakPolarHBondContact CB-NE2 3.36Å; A290-H332 WeakPolarHBondContact CB-O 3.5Å; R329-H332 HydrophobicContact CB-CB 4.14Å; R329-H332 PolarHBondContact O-ND1 3.11Å; L330-H332 PolarHBondContact O-N 2.98Å; H332-S345 PolarHBondContact CD2-OG 3.44Å; H332-S345 PolarHBondContact NE2-OG 3.02Å
333	T	89	Confident	88.5	Confident	16 Å²	16	44.4 Å²	44.4	10%	0.098	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	121.9	-174.8	-50.3	0	0	0	0	109.3	V335 S345 L346 A382 G384 I393	T333-V335 HydrophobicContact CG2-CG2 4.01Å; T333-S345 CarbonylContact O-C 3.58Å; T333-S345 WeakPolarHBondContact O-CA 3.25Å; T333-L346 PolarHBondContact N-O 3.03Å; T333-L346 PolarHBondContact O-N 2.91Å; T333-A382 PolarHBondContact OG1-O 3.02Å; T333-G384 VanDerWaalsContact CG2-N 3.25Å; T333-I393 HydrophobicContact CG2-CD1 4.34Å
334	M	89.6	Confident	88.6	Confident	17 Å²	17	43.4 Å²	43.4	8%	0.084	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.8	173.6	-77.7	-177.4	74.6	0	0	110.9	A290 C292 V301 M309 V343 Y344	A290-M334 HydrophobicContact CB-CB 4.14Å; A290-M334 HydrophobicContact CB-CG 3.56Å; A290-M334 HydrophobicContact CB-SD 3.66Å; C292-M334 HydrophobicContact CB-CB 4.01Å; V301-M334 HydrophobicContact CB-SD 3.8Å; V301-M334 HydrophobicContact CG2-CE 3.75Å; V301-M334 HydrophobicContact CG2-SD 3.41Å; V301-M334 WeakPolarHBondContact CG2-SD 3.49Å; M309-M334 HydrophobicContact CE-CE 4.21Å; M334-V343 HydrophobicContact CE-CG1 3.49Å; M334-V343 VanDerWaalsContact CE-CG1 3.49Å; M334-Y344 CarbonylContact C-O 3.58Å; M334-Y344 VanDerWaalsContact CA-O 3.23Å; M334-Y344 WeakPolarHBondContact CA-O 3.27Å
335	V	90.4	Very high	88.8	Confident	8 Å²	8	40.5 Å²	40.5	5%	0.048	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	130.3	-177.4	-175	0	0	0	0	110.1	T333 Y344 L346 N386 I391	T333-V335 HydrophobicContact CG2-CG2 4.01Å; V335-Y344 PolarHBondContact N-O 2.85Å; V335-Y344 PolarHBondContact O-N 2.96Å; V335-L346 HydrophobicContact CB-CD1 4.38Å; V335-L346 HydrophobicContact CG2-CD1 4.1Å; V335-N386 HydrophobicContact CG1-CB 3.51Å; V335-I391 HydrophobicContact CB-CD1 4.44Å; V335-I391 HydrophobicContact CB-CG2 4.27Å; V335-I391 HydrophobicContact CG1-CD1 4.45Å; V335-I391 HydrophobicContact CG1-CG1 4.24Å; V335-I391 HydrophobicContact CG1-CG2 4.21Å; V335-I391 HydrophobicContact CG2-CG2 4.01Å
336	S	90.1	Very high	88.9	Confident	23 Å²	23	40.6 Å²	40.6	16%	0.161	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	135.5	177.5	177.8	0	0	0	0	111.9	K293 H294 N386	K293-S336 WeakPolarHBondContact O-CB 3.47Å; K293-S336 PolarHBondContact O-OG 2.73Å; K293-S336 VanDerWaalsContact O-OG 3.11Å; H294-S336 PolarHBondContact ND1-OG 3.18Å; S336-N386 WeakPolarHBondContact O-CB 3.4Å; S336-N386 PolarHBondContact O-ND2 2.84Å; S336-N386 VanDerWaalsContact O-ND2 3.08Å
337	V	90.6	Very high	89	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	85.5	177.4	-174.8	0	0	0	0	108.8	L339 Q340 D341 A342 Y344 N386 I391 T416	V337-L339 PolarHBondContact O-N 2.71Å; V337-Q340 HydrophobicContact CG1-CB 4.26Å; V337-Q340 HydrophobicContact CG1-CG 4.13Å; V337-Q340 PolarHBondContact O-N 3.32Å; V337-Q340 VanDerWaalsContact O-N 3.1Å; V337-D341 PolarHBondContact O-N 3.28Å; V337-A342 PolarHBondContact N-O 3.27Å; V337-A342 PolarHBondContact O-N 3.04Å; V337-Y344 HydrophobicContact CB-CD2 4.2Å; V337-Y344 HydrophobicContact CB-CE2 4.03Å; V337-Y344 HydrophobicContact CG2-CD2 3.53Å; V337-Y344 HydrophobicContact CG2-CE2 3.69Å; V337-N386 HydrophobicContact CG2-CB 4.48Å; V337-I391 HydrophobicContact CG2-CD1 3.93Å; V337-I391 HydrophobicContact CG2-CG1 4.2Å; V337-T416 HydrophobicContact CG1-CG2 4.34Å; V337-T416 HydrophobicContact CG2-CG2 4.02Å
338	S	85.4	Confident	89.2	Confident	88 Å²	88	29.5 Å²	29.5	62%	0.615	17%	0.167	S	C	*	.	G	3₁₀ helix	trans	-59.5	-31.9	-175.1	-46.4	0	0	0	0	113.7	Q340 D341	S338-Q340 PolarHBondContact O-N 2.64Å; S338-D341 PolarHBondContact O-N 3.47Å
339	L	84.1	Confident	89.4	Confident	137 Å²	137	28.5 Å²	28.5	72%	0.717	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-62.9	-21.4	178.5	-68	173.8	0	0	0	113.7	V337	V337-L339 PolarHBondContact O-N 2.71Å
340	Q	86.3	Confident	89.4	Confident	71 Å²	71	29.7 Å²	29.7	33%	0.332	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-117.2	6.9	-178.4	-60	-172.6	10.5	0	0	112.7	V337 S338 A342 Y344 T416	V337-Q340 HydrophobicContact CG1-CB 4.26Å; V337-Q340 HydrophobicContact CG1-CG 4.13Å; V337-Q340 PolarHBondContact O-N 3.32Å; V337-Q340 VanDerWaalsContact O-N 3.1Å; S338-Q340 PolarHBondContact O-N 2.64Å; Q340-A342 HydrophobicContact CB-CB 4.23Å; Q340-A342 PolarHBondContact O-N 2.77Å; Q340-Y344 PolarHBondContact OE1-OH 3.3Å; Q340-Y344 VanDerWaalsContact OE1-OH 3.11Å; Q340-T416 PolarHBondContact NE2-O 2.85Å; Q340-T416 PolarHBondContact NE2-OG1 2.86Å
341	D	91	Very high	89.3	Confident	67 Å²	67	31.3 Å²	31.3	36%	0.358	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	41.6	-174.3	-163.3	47.7	0	0	0	112.6	H294 V337 S338 V364 K365	H294-D341 IonicContact CD2-OD1 2.77Å; H294-D341 IonicContact CE1-OD1 3.71Å; H294-D341 IonicContact NE2-OD1 3.85Å; H294-D341 PolarHBondContact NE2-OD1 3.44Å; V337-D341 PolarHBondContact O-N 3.28Å; S338-D341 PolarHBondContact O-N 3.47Å; D341-V364 WeakPolarHBondContact O-CB 3.42Å; D341-V364 WeakPolarHBondContact O-CG2 3.37Å; D341-V364 PolarHBondContact O-N 2.95Å; D341-K365 PolarHBondContact OD2-N 3.46Å
342	A	93.4	Very high	89.3	Confident	2 Å²	2	35.7 Å²	35.7	2%	0.017	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	150.6	-171	0	0	0	0	0	113.9	H294 V337 Q340 Y344 Y361 Y362	H294-A342 PolarHBondContact CE1-N 2.96Å; V337-A342 PolarHBondContact N-O 3.27Å; V337-A342 PolarHBondContact O-N 3.04Å; Q340-A342 HydrophobicContact CB-CB 4.23Å; Q340-A342 PolarHBondContact O-N 2.77Å; A342-Y344 HydrophobicContact CB-CE2 4.01Å; A342-Y361 HydrophobicContact CB-CD2 4.32Å; A342-Y362 CarbonylContact C-O 3.53Å; A342-Y362 VanDerWaalsContact CA-O 3.25Å; A342-Y362 WeakPolarHBondContact CA-O 3.36Å
343	V	93.9	Very high	89	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	120	175.1	171.6	0	0	0	0	109.8	C292 H294 Y299 M334 Y361 Y362 V364	C292-V343 WeakPolarHBondContact SG-CG1 3.38Å; H294-V343 HydrophobicContact CB-CG2 3.74Å; Y299-V343 HydrophobicContact CD2-CG2 4.5Å; M334-V343 HydrophobicContact CE-CG1 3.49Å; M334-V343 VanDerWaalsContact CE-CG1 3.49Å; V343-Y361 CarbonylContact O-C 3.51Å; V343-Y361 VanDerWaalsContact O-CA 3.29Å; V343-Y361 WeakPolarHBondContact O-CA 3.42Å; V343-Y362 HydrophobicContact CB-CD1 4.44Å; V343-Y362 PolarHBondContact N-O 3.44Å; V343-Y362 PolarHBondContact O-N 2.57Å; V343-V364 HydrophobicContact CG2-CG2 4.35Å
344	Y	94.3	Very high	89	Confident	1 Å²	1	43.6 Å²	43.6	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	143.3	-179.9	-73.9	-107.9	0	0	0	111.1	M334 V335 V337 Q340 A342 V359 I360 Y361 I391 F414 T416	M334-Y344 CarbonylContact C-O 3.58Å; M334-Y344 VanDerWaalsContact CA-O 3.23Å; M334-Y344 WeakPolarHBondContact CA-O 3.27Å; V335-Y344 PolarHBondContact N-O 2.85Å; V335-Y344 PolarHBondContact O-N 2.96Å; V337-Y344 HydrophobicContact CB-CD2 4.2Å; V337-Y344 HydrophobicContact CB-CE2 4.03Å; V337-Y344 HydrophobicContact CG2-CD2 3.53Å; V337-Y344 HydrophobicContact CG2-CE2 3.69Å; Q340-Y344 PolarHBondContact OE1-OH 3.3Å; Q340-Y344 VanDerWaalsContact OE1-OH 3.11Å; A342-Y344 HydrophobicContact CB-CE2 4.01Å; Y344-V359 HydrophobicContact CD1-CG1 3.93Å; Y344-I360 CarbonylContact C-O 3.59Å; Y344-I360 WeakPolarHBondContact CA-O 3.43Å; Y344-Y361 HydrophobicContact CE1-CD1 4.09Å; Y344-Y361 HydrophobicContact CE1-CG 4.04Å; Y344-Y361 HydrophobicContact CE2-CG 4.49Å; Y344-I391 HydrophobicContact CD1-CD1 3.91Å; Y344-I391 HydrophobicContact CD2-CD1 3.93Å; Y344-I391 HydrophobicContact CG-CD1 3.57Å; Y344-F414 HydrophobicContact CD1-CE1 4.34Å; Y344-F414 AromaticContact CE1-CE1 3.91Å; Y344-F414 HydrophobicContact CE1-CE1 3.91Å; Y344-T416 HydrophobicContact CE1-CG2 4.34Å; Y344-T416 HydrophobicContact CE2-CG2 4.12Å
345	S	93.5	Very high	89	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117.9	169.5	171.8	0	0	0	0	108.2	H332 T333 I360	H332-S345 PolarHBondContact CD2-OG 3.44Å; H332-S345 PolarHBondContact NE2-OG 3.02Å; T333-S345 CarbonylContact O-C 3.58Å; T333-S345 WeakPolarHBondContact O-CA 3.25Å; S345-I360 PolarHBondContact N-O 3.18Å; S345-I360 PolarHBondContact O-N 2.79Å
346	L	93.7	Very high	89	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	135.1	-172.3	-53.9	99	0	0	0	110.7	T333 V335 V359 L375 I391 I393 F414	T333-L346 PolarHBondContact N-O 3.03Å; T333-L346 PolarHBondContact O-N 2.91Å; V335-L346 HydrophobicContact CB-CD1 4.38Å; V335-L346 HydrophobicContact CG2-CD1 4.1Å; L346-V359 HydrophobicContact CD2-CB 4.49Å; L346-V359 HydrophobicContact CD2-CG1 3.83Å; L346-V359 HydrophobicContact CD2-CG2 3.89Å; L346-V359 HydrophobicContact CG-CG1 3.98Å; L346-V359 HydrophobicContact CG-CG2 4.32Å; L346-L375 HydrophobicContact CB-CD1 4.39Å; L346-L375 HydrophobicContact CD2-CD2 4.22Å; L346-I391 HydrophobicContact CD1-CD1 4.26Å; L346-I391 HydrophobicContact CD1-CG2 4.08Å; L346-I391 HydrophobicContact CD2-CG2 4.18Å; L346-I393 HydrophobicContact CB-CD1 4.02Å; L346-I393 HydrophobicContact CD1-CD1 4.16Å; L346-I393 HydrophobicContact CD2-CD1 4.02Å; L346-I393 HydrophobicContact CD2-CG1 4.15Å; L346-I393 HydrophobicContact CG-CD1 4.27Å; L346-F414 HydrophobicContact CD2-CB 4.4Å; L346-F414 HydrophobicContact CD2-CG 4.41Å
347	G	91.8	Very high	89.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.246	C	C	.	.			trans	63.5	-140	174.4	0	0	0	0	0	114.3	R329 S356 A358	R329-G347 PolarHBondContact NH1-O 2.86Å; G347-S356 WeakPolarHBondContact CA-O 3.07Å; G347-A358 PolarHBondContact N-O 3.35Å
348	G	89.5	Confident	89.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.254	C	S	.	.			trans	95.6	-169.2	-178.1	0	0	0	0	0	113.8	L330 S356 V379	L330-G348 CarbonylContact O-C 3.54Å; L330-G348 VanDerWaalsContact O-CA 3.23Å; L330-G348 WeakPolarHBondContact O-CA 3.48Å; G348-S356 PolarHBondContact O-N 2.81Å; G348-V379 PolarHBondContact N-O 3.23Å
349	K	87.5	Confident	89.6	Confident	28 Å²	28	42.3 Å²	42.3	12%	0.122	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-118.6	146.4	173.7	-62.8	-169.5	-165.2	-175.6	0	110.6	R329 L330 D353 T354 L355 S380 E397	R329-K349 WeakPolarHBondContact CA-O 3.41Å; L330-K349 PolarHBondContact N-O 3.4Å; L330-K349 PolarHBondContact O-N 3.36Å; K349-D353 WeakPolarHBondContact CD-OD1 3.49Å; K349-D353 IonicContact NZ-OD1 2.73Å; K349-T354 CarbonylContact C-O 3.59Å; K349-T354 WeakPolarHBondContact CA-O 2.93Å; K349-L355 HydrophobicContact CD-CD2 4.22Å; K349-L355 HydrophobicContact CG-CD2 3.83Å; K349-S380 WeakPolarHBondContact CE-OG 3.33Å; K349-E397 WeakPolarHBondContact CE-OE2 3.5Å; K349-E397 IonicContact NZ-OE2 3.57Å; K349-E397 PolarHBondContact NZ-OE2 3.29Å
350	T	86.3	Confident	90.1	Very high	38 Å²	38	35.8 Å²	35.8	23%	0.233	19%	0.191	C	C	.	.			trans	-72.6	173.1	167.3	69.4	0	0	0	0	110.4	Q352 D353 T354	T350-Q352 PolarHBondContact O-N 3.2Å; T350-Q352 PolarHBondContact OG1-N 3.5Å; T350-D353 PolarHBondContact O-N 3.43Å; T350-D353 VanDerWaalsContact O-N 3.12Å; T350-T354 PolarHBondContact N-O 2.86Å; T350-T354 PolarHBondContact OG1-N 2.65Å; T350-T354 PolarHBondContact OG1-OG1 2.88Å
351	L	82.1	Confident	90.5	Very high	92 Å²	92	34.5 Å²	34.5	48%	0.482	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.8	171.7	-71.7	177.4	0	0	0	113.4	P306 D328 L330 D353	P306-L351 HydrophobicContact CG-CD2 4.01Å; D328-L351 HydrophobicContact CB-CD1 3.87Å; D328-L351 HydrophobicContact CB-CG 3.92Å; L330-L351 HydrophobicContact CD1-CD2 4.04Å; L330-L351 HydrophobicContact CG-CD2 4.36Å; L351-D353 VanDerWaalsContact C-N 3.28Å
352	Q	84.3	Confident	90.7	Very high	152 Å²	152	31.6 Å²	31.6	71%	0.71	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	18.2	175.9	-62.4	78	17.9	0	0	112.1	T350 T354	T350-Q352 PolarHBondContact O-N 3.2Å; T350-Q352 PolarHBondContact OG1-N 3.5Å; Q352-T354 PolarHBondContact O-N 2.75Å; Q352-T354 VanDerWaalsContact O-N 3.16Å
353	D	82.6	Confident	90.7	Very high	111 Å²	111	33 Å²	33	59%	0.594	18%	0.176	S	C	*	.	S	Bend	trans	60.3	23	177.8	-155.5	34.9	0	0	0	114.8	K349 T350 L351	K349-D353 WeakPolarHBondContact CD-OD1 3.49Å; K349-D353 IonicContact NZ-OD1 2.73Å; T350-D353 PolarHBondContact O-N 3.43Å; T350-D353 VanDerWaalsContact O-N 3.12Å; L351-D353 VanDerWaalsContact C-N 3.28Å
354	T	87.7	Confident	90.6	Very high	79 Å²	79	34.2 Å²	34.2	49%	0.485	18%	0.184	S	C	.	.			trans	-88.8	125.5	174.7	10	0	0	0	0	110.1	K349 T350 Q352	K349-T354 CarbonylContact C-O 3.59Å; K349-T354 WeakPolarHBondContact CA-O 2.93Å; T350-T354 PolarHBondContact N-O 2.86Å; T350-T354 PolarHBondContact OG1-N 2.65Å; T350-T354 PolarHBondContact OG1-OG1 2.88Å; Q352-T354 PolarHBondContact O-N 2.75Å; Q352-T354 VanDerWaalsContact O-N 3.16Å
355	L	89.8	Confident	90.4	Very high	21 Å²	21	42.5 Å²	42.5	11%	0.11	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-60	141.2	172.6	-69	177.1	0	0	0	110.7	K349 A378 S380 N399 T405	K349-L355 HydrophobicContact CD-CD2 4.22Å; K349-L355 HydrophobicContact CG-CD2 3.83Å; L355-A378 HydrophobicContact CB-CB 3.78Å; L355-S380 VanDerWaalsContact CD2-CB 3.44Å; L355-S380 WeakPolarHBondContact CD2-OG 3.3Å; L355-N399 HydrophobicContact CD1-CB 4.15Å; L355-N399 VanDerWaalsContact CD1-CG 3.44Å; L355-N399 WeakPolarHBondContact CD1-OD1 3.31Å; L355-T405 HydrophobicContact CD1-CG2 4.49Å
356	S	90.3	Very high	90.3	Very high	21 Å²	21	47.6 Å²	47.6	15%	0.147	25%	0.247	C	C	.	.			trans	-114.5	142.2	176.1	-167	0	0	0	0	110.7	G347 G348 A358 A378 V379	G347-S356 WeakPolarHBondContact CA-O 3.07Å; G348-S356 PolarHBondContact O-N 2.81Å; S356-A358 WeakPolarHBondContact OG-CB 3.18Å; S356-A358 PolarHBondContact OG-N 3.28Å; S356-A378 WeakPolarHBondContact O-CA 3.39Å; S356-V379 PolarHBondContact O-N 3.33Å
357	N	92.2	Very high	90.3	Very high	46 Å²	46	50.9 Å²	50.9	25%	0.246	26%	0.264	C	S	.	.			trans	-103.3	3.4	167.1	69	-26.5	0	0	0	112	Q374 L375 A378	N357-Q374 WeakPolarHBondContact ND2-CB 3.26Å; N357-Q374 PolarHBondContact ND2-OE1 2.98Å; N357-Q374 PolarHBondContact OD1-OE1 2.88Å; N357-L375 HydrophobicContact CB-CB 4.09Å; N357-L375 WeakPolarHBondContact CB-O 3.32Å; N357-L375 PolarHBondContact ND2-O 3.4Å; N357-L375 VanDerWaalsContact ND2-O 3.11Å; N357-L375 WeakPolarHBondContact O-CB 3.37Å; N357-L375 PolarHBondContact O-N 3.39Å; N357-A378 HydrophobicContact CB-CB 3.95Å
358	A	92	Very high	90.4	Very high	20 Å²	20	54.3 Å²	54.3	17%	0.165	29%	0.285	C	S	.	.			trans	-73.5	139.5	-172.5	0	0	0	0	0	111.3	R329 G347 S356	R329-A358 PolarHBondContact NH1-O 3.49Å; G347-A358 PolarHBondContact N-O 3.35Å; S356-A358 WeakPolarHBondContact OG-CB 3.18Å; S356-A358 PolarHBondContact OG-N 3.28Å
359	V	94.6	Very high	90.7	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.1	175	-177.6	0	0	0	0	108.2	Y344 L346 T372 S373 L375 F414	Y344-V359 HydrophobicContact CD1-CG1 3.93Å; L346-V359 HydrophobicContact CD2-CB 4.49Å; L346-V359 HydrophobicContact CD2-CG1 3.83Å; L346-V359 HydrophobicContact CD2-CG2 3.89Å; L346-V359 HydrophobicContact CG-CG1 3.98Å; L346-V359 HydrophobicContact CG-CG2 4.32Å; V359-T372 HydrophobicContact CB-CG2 3.76Å; V359-T372 HydrophobicContact CG1-CG2 3.51Å; V359-T372 WeakPolarHBondContact O-CG2 3.37Å; V359-T372 PolarHBondContact O-N 3.19Å; V359-T372 VanDerWaalsContact O-N 3.15Å; V359-S373 VanDerWaalsContact CB-O 3.31Å; V359-S373 WeakPolarHBondContact CB-O 3.45Å; V359-L375 HydrophobicContact CG2-CD2 3.97Å; V359-L375 HydrophobicContact CG2-CG 3.74Å; V359-F414 HydrophobicContact CB-CE2 4.3Å; V359-F414 HydrophobicContact CB-CZ 4.44Å; V359-F414 HydrophobicContact CG1-CE1 4.19Å; V359-F414 HydrophobicContact CG1-CE2 4.16Å; V359-F414 HydrophobicContact CG1-CZ 3.93Å; V359-F414 HydrophobicContact CG2-CD2 4.25Å; V359-F414 HydrophobicContact CG2-CE2 4.07Å
360	I	94.6	Very high	91.1	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	148.4	176.5	60.5	-178.6	0	0	0	108.3	L325 Y344 S345 W369 T370 E371	L325-I360 HydrophobicContact CD2-CD1 3.57Å; Y344-I360 CarbonylContact C-O 3.59Å; Y344-I360 WeakPolarHBondContact CA-O 3.43Å; S345-I360 PolarHBondContact N-O 3.18Å; S345-I360 PolarHBondContact O-N 2.79Å; I360-W369 HydrophobicContact CB-CE3 4.17Å; I360-W369 HydrophobicContact CD1-CE3 3.99Å; I360-W369 HydrophobicContact CD1-CZ3 4.18Å; I360-W369 HydrophobicContact CG1-CE3 3.84Å; I360-W369 HydrophobicContact CG1-CZ3 3.86Å; I360-T370 CarbonylContact C-O 3.59Å; I360-T370 VanDerWaalsContact CA-O 3.29Å; I360-T370 WeakPolarHBondContact CA-O 3.38Å; I360-E371 HydrophobicContact CG2-CB 4.31Å; I360-E371 HydrophobicContact CG2-CG 3.84Å
361	Y	95.1	Very high	91.4	Very high	44 Å²	44	60.3 Å²	60.3	17%	0.173	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	149.4	176.7	70.2	-87.6	0	0	0	111.2	A342 V343 Y344 W369 T370 T372	A342-Y361 HydrophobicContact CB-CD2 4.32Å; V343-Y361 CarbonylContact O-C 3.51Å; V343-Y361 VanDerWaalsContact O-CA 3.29Å; V343-Y361 WeakPolarHBondContact O-CA 3.42Å; Y344-Y361 HydrophobicContact CE1-CD1 4.09Å; Y344-Y361 HydrophobicContact CE1-CG 4.04Å; Y344-Y361 HydrophobicContact CE2-CG 4.49Å; Y361-W369 VanDerWaalsContact C-CE3 3.43Å; Y361-W369 CarbonylContact O-C 3.52Å; Y361-W369 WeakPolarHBondContact O-CA 3.3Å; Y361-T370 HydrophobicContact CE1-CG2 3.81Å; Y361-T370 PolarHBondContact N-O 2.89Å; Y361-T370 PolarHBondContact O-N 2.8Å; Y361-T370 WeakPolarHBondContact OH-CG2 3.38Å; Y361-T372 HydrophobicContact CD1-CG2 4.19Å
362	Y	95.5	Very high	91.9	Very high	6 Å²	6	57 Å²	57	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.3	179.7	173.2	-101.3	0	0	0	108.4	Y299 M309 C322 A323 A342 V343 V364 N367 V368 W369	Y299-Y362 HydrophobicContact CD1-CE1 4.43Å; Y299-Y362 AromaticContact CE1-CE1 3.87Å; Y299-Y362 HydrophobicContact CE1-CE1 3.87Å; M309-Y362 HydrophobicContact CE-CD1 3.73Å; M309-Y362 HydrophobicContact CE-CD2 4.42Å; M309-Y362 HydrophobicContact CE-CE1 4.01Å; M309-Y362 HydrophobicContact CE-CG 3.94Å; M309-Y362 HydrophobicContact SD-CD1 4.4Å; M309-Y362 HydrophobicContact SD-CD2 4.06Å; M309-Y362 HydrophobicContact SD-CE1 4.5Å; M309-Y362 HydrophobicContact SD-CE2 4.17Å; M309-Y362 HydrophobicContact SD-CG 4.17Å; C322-Y362 HydrophobicContact CB-CE2 4.39Å; A323-Y362 HydrophobicContact CB-CE2 4.26Å; A342-Y362 CarbonylContact C-O 3.53Å; A342-Y362 VanDerWaalsContact CA-O 3.25Å; A342-Y362 WeakPolarHBondContact CA-O 3.36Å; V343-Y362 HydrophobicContact CB-CD1 4.44Å; V343-Y362 PolarHBondContact N-O 3.44Å; V343-Y362 PolarHBondContact O-N 2.57Å; Y362-V364 HydrophobicContact CD1-CG2 3.98Å; Y362-V364 HydrophobicContact CE1-CB 4.37Å; Y362-V364 HydrophobicContact CE1-CG2 3.94Å; Y362-N367 HydrophobicContact CE2-CB 4.39Å; Y362-N367 VanDerWaalsContact CE2-OD1 3.3Å; Y362-N367 WeakPolarHBondContact CE2-OD1 3.08Å; Y362-N367 WeakPolarHBondContact OH-CA 3.31Å; Y362-N367 PolarHBondContact OH-OD1 3Å; Y362-V368 WeakPolarHBondContact CA-O 3.35Å; Y362-W369 AromaticContact CD2-CD1 3.93Å; Y362-W369 HydrophobicContact CD2-CD2 4.19Å; Y362-W369 AromaticContact CD2-CE2 3.86Å; Y362-W369 HydrophobicContact CD2-CG 4.25Å; Y362-W369 HydrophobicContact CD2-CZ2 4.4Å; Y362-W369 AromaticContact CD2-NE1 3.67Å; Y362-W369 HydrophobicContact CG-CD2 4.45Å; Y362-W369 HydrophobicContact CG-CZ2 4.27Å
363	T	94.1	Very high	92.4	Very high	30 Å²	30	51.7 Å²	51.7	18%	0.184	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	117.3	174.4	-53.4	0	0	0	0	108.2	D366 N367 V368	T363-D366 HydrophobicContact CG2-CB 4.15Å; T363-D366 PolarHBondContact O-N 3.1Å; T363-N367 PolarHBondContact O-N 3.4Å; T363-V368 PolarHBondContact N-O 3.44Å
364	V	92.3	Very high	92.9	Very high	27 Å²	27	51.8 Å²	51.8	16%	0.164	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-46.9	-168.8	170.3	0	0	0	0	111.7	Y299 D341 V343 Y362 D366 N367	Y299-V364 VanDerWaalsContact OH-CG1 3.28Å; Y299-V364 WeakPolarHBondContact OH-CG1 3.38Å; D341-V364 WeakPolarHBondContact O-CB 3.42Å; D341-V364 WeakPolarHBondContact O-CG2 3.37Å; D341-V364 PolarHBondContact O-N 2.95Å; V343-V364 HydrophobicContact CG2-CG2 4.35Å; Y362-V364 HydrophobicContact CD1-CG2 3.98Å; Y362-V364 HydrophobicContact CE1-CB 4.37Å; Y362-V364 HydrophobicContact CE1-CG2 3.94Å; V364-D366 VanDerWaalsContact C-N 3.32Å; V364-D366 PolarHBondContact O-N 2.92Å; V364-N367 PolarHBondContact O-N 3.13Å
365	K	89.9	Confident	93.2	Very high	175 Å²	175	48.2 Å²	48.2	76%	0.761	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-40.8	176.8	-172.1	178.8	179.6	-178.9	0	113.9	D341	D341-K365 PolarHBondContact OD2-N 3.46Å
366	D	90.9	Very high	93.3	Very high	107 Å²	107	51.5 Å²	51.5	57%	0.572	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-13.3	-172.1	-62.3	-30.3	0	0	0	113.1	T363 V364 V368	T363-D366 HydrophobicContact CG2-CB 4.15Å; T363-D366 PolarHBondContact O-N 3.1Å; V364-D366 VanDerWaalsContact C-N 3.32Å; V364-D366 PolarHBondContact O-N 2.92Å; D366-V368 VanDerWaalsContact C-N 3.33Å; D366-V368 HydrophobicContact CB-CG2 4.46Å; D366-V368 WeakPolarHBondContact O-CG2 3.47Å; D366-V368 PolarHBondContact O-N 2.66Å
367	N	93.4	Very high	93.3	Very high	69 Å²	69	52.2 Å²	52.2	37%	0.369	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	45.8	-175.6	-173	24.1	0	0	0	112.5	A323 Y362 T363 V364	A323-N367 WeakPolarHBondContact CB-O 3.38Å; A323-N367 WeakPolarHBondContact CB-OD1 3.35Å; A323-N367 PolarHBondContact N-OD1 3.34Å; Y362-N367 HydrophobicContact CE2-CB 4.39Å; Y362-N367 VanDerWaalsContact CE2-OD1 3.3Å; Y362-N367 WeakPolarHBondContact CE2-OD1 3.08Å; Y362-N367 WeakPolarHBondContact OH-CA 3.31Å; Y362-N367 PolarHBondContact OH-OD1 3Å; T363-N367 PolarHBondContact O-N 3.4Å; V364-N367 PolarHBondContact O-N 3.13Å
368	V	94.9	Very high	93.3	Very high	72 Å²	72	51.3 Å²	51.3	44%	0.436	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137	-176.3	173.1	0	0	0	0	111.2	Y362 T363 D366	Y362-V368 WeakPolarHBondContact CA-O 3.35Å; T363-V368 PolarHBondContact N-O 3.44Å; D366-V368 VanDerWaalsContact C-N 3.33Å; D366-V368 HydrophobicContact CB-CG2 4.46Å; D366-V368 WeakPolarHBondContact O-CG2 3.47Å; D366-V368 PolarHBondContact O-N 2.66Å
369	W	95.3	Very high	93.3	Very high	27 Å²	27	50.5 Å²	50.5	10%	0.102	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	136.5	168.6	-73.8	96.6	0	0	0	111.3	M309 A323 L325 P326 I360 Y361 Y362	M309-W369 HydrophobicContact CE-CZ2 3.92Å; M309-W369 HydrophobicContact SD-CZ2 3.45Å; M309-W369 WeakPolarHBondContact SD-CZ2 3.44Å; A323-W369 PolarHBondContact O-NE1 3.42Å; L325-W369 HydrophobicContact CD2-CD2 4.06Å; L325-W369 HydrophobicContact CD2-CE3 4.12Å; L325-W369 HydrophobicContact CD2-CH2 3.48Å; L325-W369 VanDerWaalsContact CD2-CH2 3.48Å; L325-W369 HydrophobicContact CD2-CZ2 3.36Å; L325-W369 HydrophobicContact CD2-CZ3 3.86Å; L325-W369 HydrophobicContact CG-CZ2 4.29Å; P326-W369 HydrophobicContact CG-CB 3.84Å; P326-W369 HydrophobicContact CG-CG 4.47Å; I360-W369 HydrophobicContact CB-CE3 4.17Å; I360-W369 HydrophobicContact CD1-CE3 3.99Å; I360-W369 HydrophobicContact CD1-CZ3 4.18Å; I360-W369 HydrophobicContact CG1-CE3 3.84Å; I360-W369 HydrophobicContact CG1-CZ3 3.86Å; Y361-W369 VanDerWaalsContact C-CE3 3.43Å; Y361-W369 CarbonylContact O-C 3.52Å; Y361-W369 WeakPolarHBondContact O-CA 3.3Å; Y362-W369 AromaticContact CD2-CD1 3.93Å; Y362-W369 HydrophobicContact CD2-CD2 4.19Å; Y362-W369 AromaticContact CD2-CE2 3.86Å; Y362-W369 HydrophobicContact CD2-CG 4.25Å; Y362-W369 HydrophobicContact CD2-CZ2 4.4Å; Y362-W369 AromaticContact CD2-NE1 3.67Å; Y362-W369 HydrophobicContact CG-CD2 4.45Å; Y362-W369 HydrophobicContact CG-CZ2 4.27Å
370	T	94.8	Very high	93.1	Very high	51 Å²	51	50.5 Å²	50.5	31%	0.313	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.1	177.8	-56.5	0	0	0	0	110	I360 Y361	I360-T370 CarbonylContact C-O 3.59Å; I360-T370 VanDerWaalsContact CA-O 3.29Å; I360-T370 WeakPolarHBondContact CA-O 3.38Å; Y361-T370 HydrophobicContact CE1-CG2 3.81Å; Y361-T370 PolarHBondContact N-O 2.89Å; Y361-T370 PolarHBondContact O-N 2.8Å; Y361-T370 WeakPolarHBondContact OH-CG2 3.38Å
371	E	93.2	Very high	92.6	Very high	115 Å²	115	51.4 Å²	51.4	54%	0.537	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	142.3	174	-58.3	-166.4	160.9	0	0	110.5	I360	I360-E371 HydrophobicContact CG2-CB 4.31Å; I360-E371 HydrophobicContact CG2-CG 3.84Å
372	T	93.4	Very high	92.3	Very high	22 Å²	22	49.6 Å²	49.6	14%	0.135	27%	0.268	C	S	.	.			trans	-131.1	-172.5	177.8	-176.3	0	0	0	0	110.2	V359 Y361 F414 Q419	V359-T372 HydrophobicContact CB-CG2 3.76Å; V359-T372 HydrophobicContact CG1-CG2 3.51Å; V359-T372 WeakPolarHBondContact O-CG2 3.37Å; V359-T372 PolarHBondContact O-N 3.19Å; V359-T372 VanDerWaalsContact O-N 3.15Å; Y361-T372 HydrophobicContact CD1-CG2 4.19Å; T372-F414 HydrophobicContact CG2-CZ 3.79Å; T372-Q419 PolarHBondContact OG1-OE1 3.37Å
373	S	93.3	Very high	91.9	Very high	41 Å²	41	49.5 Å²	49.5	29%	0.287	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-51.8	151.1	173.4	56.4	0	0	0	0	112	V359 F414 Q419	V359-S373 VanDerWaalsContact CB-O 3.31Å; V359-S373 WeakPolarHBondContact CB-O 3.45Å; S373-F414 WeakPolarHBondContact OG-CE2 3.42Å; S373-F414 WeakPolarHBondContact OG-CZ 3.47Å; S373-Q419 WeakPolarHBondContact CB-O 3.12Å; S373-Q419 PolarHBondContact OG-O 2.86Å
374	Q	94	Very high	91.7	Very high	113 Å²	113	49 Å²	49	53%	0.528	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-92	163.4	-175	-58	176.7	-3.7	0	0	112	N357 C421	N357-Q374 WeakPolarHBondContact ND2-CB 3.26Å; N357-Q374 PolarHBondContact ND2-OE1 2.98Å; N357-Q374 PolarHBondContact OD1-OE1 2.88Å; Q374-C421 WeakPolarHBondContact O-CB 3.49Å
375	L	92.9	Very high	91.6	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-68.3	151.6	165.4	-62.8	177.8	0	0	0	110.3	L346 N357 V359 T377 V379 I393 F414	L346-L375 HydrophobicContact CB-CD1 4.39Å; L346-L375 HydrophobicContact CD2-CD2 4.22Å; N357-L375 HydrophobicContact CB-CB 4.09Å; N357-L375 WeakPolarHBondContact CB-O 3.32Å; N357-L375 PolarHBondContact ND2-O 3.4Å; N357-L375 VanDerWaalsContact ND2-O 3.11Å; N357-L375 WeakPolarHBondContact O-CB 3.37Å; N357-L375 PolarHBondContact O-N 3.39Å; V359-L375 HydrophobicContact CG2-CD2 3.97Å; V359-L375 HydrophobicContact CG2-CG 3.74Å; L375-T377 VanDerWaalsContact C-N 3.29Å; L375-T377 PolarHBondContact O-N 2.96Å; L375-V379 HydrophobicContact CD1-CG2 3.92Å; L375-I393 HydrophobicContact CD2-CG1 4.34Å; L375-F414 HydrophobicContact CD2-CD2 4.43Å
376	D	92.4	Very high	91.6	Very high	90 Å²	90	41.6 Å²	41.6	48%	0.481	24%	0.238	S	C	.	.	S	Bend	trans	-67.5	-34.3	177.4	-66	-30.2	0	0	0	111.3	Q412 C421 L423	D376-Q412 VanDerWaalsContact N-OE1 3.12Å; D376-C421 PolarHBondContact N-SG 2.94Å; D376-C421 PolarHBondContact OD2-SG 3.19Å; D376-L423 PolarHBondContact OD2-N 3.1Å; D376-L423 VanDerWaalsContact OD2-N 3.16Å
377	T	91.1	Very high	91.5	Very high	37 Å²	37	38 Å²	38	23%	0.227	22%	0.219	C	C	.	.	S	Bend	trans	-129	131.6	179	-56.1	0	0	0	0	110.6	L375 V379 E398 L410 Q412	L375-T377 VanDerWaalsContact C-N 3.29Å; L375-T377 PolarHBondContact O-N 2.96Å; T377-V379 HydrophobicContact CG2-CG1 4.42Å; T377-V379 PolarHBondContact O-N 2.85Å; T377-E398 HydrophobicContact CG2-CB 4.13Å; T377-L410 HydrophobicContact CG2-CD1 4.02Å; T377-Q412 PolarHBondContact O-NE2 3.25Å; T377-Q412 PolarHBondContact O-OE1 3.04Å
378	A	92.3	Very high	91.1	Very high	27 Å²	27	38.1 Å²	38.1	22%	0.223	24%	0.235	C	C	.	.			trans	-67.6	126.6	174.8	0	0	0	0	0	110	L355 S356 N357	L355-A378 HydrophobicContact CB-CB 3.78Å; S356-A378 WeakPolarHBondContact O-CA 3.39Å; N357-A378 HydrophobicContact CB-CB 3.95Å
379	V	92	Very high	90.7	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	22%	0.216	C	C	.	.			trans	-138.9	151.5	-174.1	-68	0	0	0	0	111.6	G348 S356 L375 T377 A382 I393 E397 E398	G348-V379 PolarHBondContact N-O 3.23Å; S356-V379 PolarHBondContact O-N 3.33Å; L375-V379 HydrophobicContact CD1-CG2 3.92Å; T377-V379 HydrophobicContact CG2-CG1 4.42Å; T377-V379 PolarHBondContact O-N 2.85Å; V379-A382 HydrophobicContact CB-CB 4.3Å; V379-A382 HydrophobicContact CG2-CB 4.06Å; V379-I393 HydrophobicContact CG2-CG2 3.84Å; V379-E397 VanDerWaalsContact CA-O 3.27Å; V379-E397 WeakPolarHBondContact CA-O 3.48Å; V379-E398 HydrophobicContact CG1-CB 4.5Å
380	S	90.2	Very high	90.6	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.014	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-139.1	151.2	172.3	69.9	0	0	0	0	111.5	K349 L355 A382 G396 E397	K349-S380 WeakPolarHBondContact CE-OG 3.33Å; L355-S380 VanDerWaalsContact CD2-CB 3.44Å; L355-S380 WeakPolarHBondContact CD2-OG 3.3Å; S380-A382 PolarHBondContact O-N 3.18Å; S380-A382 VanDerWaalsContact O-N 3.16Å; S380-G396 CarbonylContact O-C 3.47Å; S380-G396 VanDerWaalsContact O-CA 3.29Å; S380-G396 WeakPolarHBondContact O-CA 3.44Å; S380-E397 PolarHBondContact N-O 3.38Å; S380-E397 PolarHBondContact O-N 3.16Å
381	G	83.1	Confident	90.5	Very high	19 Å²	19	32.9 Å²	32.9	20%	0.196	21%	0.207	C	C	.	.	S	Bend	trans	62.8	19.3	-175.4	0	0	0	0	0	113.7	S331 M434	S331-G381 PolarHBondContact O-N 2.95Å; G381-M434 PolarHBondContact O-N 2.58Å
382	A	88.6	Confident	90.5	Very high	6 Å²	6	28.6 Å²	28.6	5%	0.05	19%	0.186	C	C	.	.			trans	-76.7	146.8	176.3	0	0	0	0	0	110.5	T333 V379 S380 I393 G395	T333-A382 PolarHBondContact OG1-O 3.02Å; V379-A382 HydrophobicContact CB-CB 4.3Å; V379-A382 HydrophobicContact CG2-CB 4.06Å; S380-A382 PolarHBondContact O-N 3.18Å; S380-A382 VanDerWaalsContact O-N 3.16Å; A382-I393 HydrophobicContact CB-CG2 3.61Å; A382-G395 VanDerWaalsContact CB-O 3.31Å; A382-G395 WeakPolarHBondContact CB-O 3.49Å
383	A	88	Confident	90.5	Very high	5 Å²	5	27.6 Å²	27.6	4%	0.041	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	132.8	172.1	0	0	0	0	0	110.2	I393 L394 M434 A436	A383-I393 CarbonylContact O-C 3.56Å; A383-I393 WeakPolarHBondContact O-CA 3.13Å; A383-L394 HydrophobicContact CB-CB 4.28Å; A383-L394 PolarHBondContact N-O 3.01Å; A383-L394 PolarHBondContact O-N 3.28Å; A383-M434 HydrophobicContact CB-CB 3.97Å; A383-A436 HydrophobicContact CB-CB 3.68Å
384	G	89.7	Confident	90.4	Very high	19 Å²	19	25.7 Å²	25.7	20%	0.196	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.8	178.7	0	0	0	0	0	111.5	T333 Y392	T333-G384 VanDerWaalsContact CG2-N 3.25Å; G384-Y392 VanDerWaalsContact CA-O 3.29Å; G384-Y392 WeakPolarHBondContact CA-O 3.04Å
385	V	90.2	Very high	90.2	Very high	9 Å²	9	20.4 Å²	20.4	6%	0.055	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	131.5	179.7	-178.9	0	0	0	0	109.9	I391 Y392 A436 A438 L443	V385-I391 CarbonylContact O-C 3.54Å; V385-I391 WeakPolarHBondContact O-CA 3.18Å; V385-Y392 PolarHBondContact N-O 3.19Å; V385-Y392 PolarHBondContact O-N 2.87Å; V385-A436 VanDerWaalsContact CG2-C 3.4Å; V385-A436 HydrophobicContact CG2-CB 3.47Å; V385-A436 VanDerWaalsContact CG2-CB 3.47Å; V385-A436 WeakPolarHBondContact CG2-O 3.5Å; V385-A438 HydrophobicContact CG1-CB 3.27Å; V385-L443 HydrophobicContact CB-CD2 4.25Å; V385-L443 HydrophobicContact CG1-CD2 3.66Å
386	N	90.8	Very high	90	Very high	38 Å²	38	20.2 Å²	20.2	20%	0.203	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.2	171.2	171.9	34.8	0	0	0	109.9	V335 S336 V337 G389 I391	V335-N386 HydrophobicContact CG1-CB 3.51Å; S336-N386 WeakPolarHBondContact O-CB 3.4Å; S336-N386 PolarHBondContact O-ND2 2.84Å; S336-N386 VanDerWaalsContact O-ND2 3.08Å; V337-N386 HydrophobicContact CG2-CB 4.48Å; N386-G389 VanDerWaalsContact OD1-CA 3.32Å; N386-G389 WeakPolarHBondContact OD1-CA 3.41Å; N386-G389 PolarHBondContact OD1-N 3.15Å; N386-G389 VanDerWaalsContact OD1-N 3.08Å; N386-I391 HydrophobicContact CB-CG1 4.46Å
387	L	88.6	Confident	89.8	Confident	32 Å²	32	18.8 Å²	18.8	17%	0.168	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	113.4	171.4	-179.2	69.3	0	0	0	108.9	G389 T390 Y392 A438 M440 L443 P457	L387-G389 PolarHBondContact O-N 2.65Å; L387-T390 PolarHBondContact N-O 3.38Å; L387-T390 PolarHBondContact O-N 3.02Å; L387-Y392 HydrophobicContact CB-CD2 4.2Å; L387-Y392 HydrophobicContact CB-CE2 3.94Å; L387-Y392 HydrophobicContact CD2-CE2 4.33Å; L387-A438 HydrophobicContact CD1-CB 4.5Å; L387-M440 WeakPolarHBondContact CD1-O 3.32Å; L387-L443 HydrophobicContact CB-CD2 4.34Å; L387-L443 HydrophobicContact CD2-CD2 4.3Å; L387-P457 HydrophobicContact CD2-CG 3.79Å
388	G	83.9	Confident	89.8	Confident	70 Å²	70	17.9 Å²	17.9	72%	0.722	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.4	24.9	176.6	0	0	0	0	0	115.3
389	G	87.1	Confident	89.6	Confident	3 Å²	3	19.1 Å²	19.1	3%	0.031	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	4.8	-175.2	0	0	0	0	0	114.2	N386 L387 T416	N386-G389 VanDerWaalsContact OD1-CA 3.32Å; N386-G389 WeakPolarHBondContact OD1-CA 3.41Å; N386-G389 PolarHBondContact OD1-N 3.15Å; N386-G389 VanDerWaalsContact OD1-N 3.08Å; L387-G389 PolarHBondContact O-N 2.65Å; G389-T416 WeakPolarHBondContact O-CB 3.16Å; G389-T416 VanDerWaalsContact O-CG2 3.28Å; G389-T416 WeakPolarHBondContact O-CG2 3.05Å; G389-T416 PolarHBondContact O-N 2.89Å; G389-T416 VanDerWaalsContact O-N 3.15Å; G389-T416 PolarHBondContact O-OG1 3.01Å
390	T	92.3	Very high	89.2	Confident	37 Å²	37	21.5 Å²	21.5	23%	0.227	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.5	167.3	-56.7	0	0	0	0	109.1	L387 Y392 C413	L387-T390 PolarHBondContact N-O 3.38Å; L387-T390 PolarHBondContact O-N 3.02Å; T390-Y392 HydrophobicContact CG2-CD2 4.29Å; T390-Y392 HydrophobicContact CG2-CE2 3.79Å; T390-Y392 WeakPolarHBondContact O-CD2 3.23Å; T390-C413 HydrophobicContact CG2-CB 4.03Å
391	I	94.3	Very high	88.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.5	176.3	-57.8	173	0	0	0	108.6	V335 V337 Y344 L346 V385 N386 I393 F414 T416	V335-I391 HydrophobicContact CB-CD1 4.44Å; V335-I391 HydrophobicContact CB-CG2 4.27Å; V335-I391 HydrophobicContact CG1-CD1 4.45Å; V335-I391 HydrophobicContact CG1-CG1 4.24Å; V335-I391 HydrophobicContact CG1-CG2 4.21Å; V335-I391 HydrophobicContact CG2-CG2 4.01Å; V337-I391 HydrophobicContact CG2-CD1 3.93Å; V337-I391 HydrophobicContact CG2-CG1 4.2Å; Y344-I391 HydrophobicContact CD1-CD1 3.91Å; Y344-I391 HydrophobicContact CD2-CD1 3.93Å; Y344-I391 HydrophobicContact CG-CD1 3.57Å; L346-I391 HydrophobicContact CD1-CD1 4.26Å; L346-I391 HydrophobicContact CD1-CG2 4.08Å; L346-I391 HydrophobicContact CD2-CG2 4.18Å; V385-I391 CarbonylContact O-C 3.54Å; V385-I391 WeakPolarHBondContact O-CA 3.18Å; N386-I391 HydrophobicContact CB-CG1 4.46Å; I391-I393 HydrophobicContact CG2-CD1 3.85Å; I391-I393 HydrophobicContact CG2-CG1 4.33Å; I391-F414 HydrophobicContact CB-CB 4.28Å; I391-F414 HydrophobicContact CD1-CD1 4.46Å; I391-F414 PolarHBondContact N-O 3.24Å; I391-F414 PolarHBondContact O-N 3.37Å; I391-T416 HydrophobicContact CD1-CG2 3.75Å; I391-T416 HydrophobicContact CG1-CG2 3.86Å
392	Y	92.9	Very high	88.5	Confident	25 Å²	25	34.5 Å²	34.5	10%	0.098	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	119.6	174.4	-68.6	-99.9	0	0	0	109.2	G384 V385 L387 T390 I411 C413 L443 Y455 P457	G384-Y392 VanDerWaalsContact CA-O 3.29Å; G384-Y392 WeakPolarHBondContact CA-O 3.04Å; V385-Y392 PolarHBondContact N-O 3.19Å; V385-Y392 PolarHBondContact O-N 2.87Å; L387-Y392 HydrophobicContact CB-CD2 4.2Å; L387-Y392 HydrophobicContact CB-CE2 3.94Å; L387-Y392 HydrophobicContact CD2-CE2 4.33Å; T390-Y392 HydrophobicContact CG2-CD2 4.29Å; T390-Y392 HydrophobicContact CG2-CE2 3.79Å; T390-Y392 WeakPolarHBondContact O-CD2 3.23Å; Y392-I411 HydrophobicContact CD1-CG2 4.4Å; Y392-C413 WeakPolarHBondContact CD1-SG 3.19Å; Y392-C413 WeakPolarHBondContact CE1-SG 3.49Å; Y392-L443 HydrophobicContact CD1-CD1 3.88Å; Y392-L443 HydrophobicContact CD2-CD1 3.9Å; Y392-L443 HydrophobicContact CE1-CD1 4.45Å; Y392-L443 HydrophobicContact CE2-CD1 4.48Å; Y392-L443 HydrophobicContact CG-CD1 3.57Å; Y392-Y455 HydrophobicContact CD1-CE1 4.35Å; Y392-Y455 HydrophobicContact CE1-CE1 4.26Å; Y392-P457 HydrophobicContact CE1-CB 4.14Å; Y392-P457 HydrophobicContact CE1-CG 4.36Å; Y392-P457 WeakPolarHBondContact OH-CB 3.43Å
393	I	93.2	Very high	88	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	118.7	173.2	-57.1	-60.7	0	0	0	108.2	T333 L346 L375 V379 A382 A383 I391 I411 Q412	T333-I393 HydrophobicContact CG2-CD1 4.34Å; L346-I393 HydrophobicContact CB-CD1 4.02Å; L346-I393 HydrophobicContact CD1-CD1 4.16Å; L346-I393 HydrophobicContact CD2-CD1 4.02Å; L346-I393 HydrophobicContact CD2-CG1 4.15Å; L346-I393 HydrophobicContact CG-CD1 4.27Å; L375-I393 HydrophobicContact CD2-CG1 4.34Å; V379-I393 HydrophobicContact CG2-CG2 3.84Å; A382-I393 HydrophobicContact CB-CG2 3.61Å; A383-I393 CarbonylContact O-C 3.56Å; A383-I393 WeakPolarHBondContact O-CA 3.13Å; I391-I393 HydrophobicContact CG2-CD1 3.85Å; I391-I393 HydrophobicContact CG2-CG1 4.33Å; I393-I411 WeakPolarHBondContact O-CA 3.13Å; I393-Q412 HydrophobicContact CB-CB 4.21Å; I393-Q412 PolarHBondContact N-O 2.99Å; I393-Q412 PolarHBondContact O-N 2.89Å
394	L	91.3	Very high	87.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	117	-165.3	-55.9	167.8	0	0	0	110	A383 I411 L428 A436 L443 I445	A383-L394 HydrophobicContact CB-CB 4.28Å; A383-L394 PolarHBondContact N-O 3.01Å; A383-L394 PolarHBondContact O-N 3.28Å; L394-I411 HydrophobicContact CD2-CB 4.21Å; L394-I411 HydrophobicContact CD2-CD1 4.43Å; L394-I411 HydrophobicContact CD2-CG1 3.83Å; L394-I411 HydrophobicContact CD2-CG2 3.74Å; L394-L428 HydrophobicContact CB-CD1 4Å; L394-L428 HydrophobicContact CD2-CD2 4.46Å; L394-A436 HydrophobicContact CD1-CB 3.78Å; L394-L443 HydrophobicContact CD1-CD1 4.45Å; L394-I445 HydrophobicContact CD1-CD1 3.72Å; L394-I445 HydrophobicContact CD1-CG1 3.88Å; L394-I445 HydrophobicContact CD2-CD1 4.44Å
395	G	89.8	Confident	87.5	Confident	2 Å²	2	51.6 Å²	51.6	2%	0.021	28%	0.276	C	S	.	.			trans	62.8	-136.7	175.4	0	0	0	0	0	114.1	A382 S408 L410	A382-G395 VanDerWaalsContact CB-O 3.31Å; A382-G395 WeakPolarHBondContact CB-O 3.49Å; G395-S408 WeakPolarHBondContact CA-O 3.37Å; G395-L410 PolarHBondContact N-O 2.99Å
396	G	87.7	Confident	87.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	93.4	-150.9	-172.3	0	0	0	0	0	112.6	S380 S408 G432	S380-G396 CarbonylContact O-C 3.47Å; S380-G396 VanDerWaalsContact O-CA 3.29Å; S380-G396 WeakPolarHBondContact O-CA 3.44Å; G396-S408 PolarHBondContact O-N 3.3Å; G396-G432 VanDerWaalsContact CA-O 3.25Å; G396-G432 WeakPolarHBondContact CA-O 3.45Å; G396-G432 PolarHBondContact N-O 3.43Å; G396-G432 CarbonylContact O-C 3.56Å; G396-G432 WeakPolarHBondContact O-CA 3.36Å
397	E	89.1	Confident	87.2	Confident	59 Å²	59	57.2 Å²	57.2	28%	0.276	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.2	171.9	-63.2	177.6	172.5	0	0	109.4	K349 V379 S380 K406	K349-E397 WeakPolarHBondContact CE-OE2 3.5Å; K349-E397 IonicContact NZ-OE2 3.57Å; K349-E397 PolarHBondContact NZ-OE2 3.29Å; V379-E397 VanDerWaalsContact CA-O 3.27Å; V379-E397 WeakPolarHBondContact CA-O 3.48Å; S380-E397 PolarHBondContact N-O 3.38Å; S380-E397 PolarHBondContact O-N 3.16Å; E397-K406 WeakPolarHBondContact CA-O 3.18Å
398	E	90.9	Very high	87.2	Confident	18 Å²	18	55.7 Å²	55.7	8%	0.084	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	165	173.4	70.9	-173.8	-155.3	0	0	110	T377 V379 T405 K406 S408 L410	T377-E398 HydrophobicContact CG2-CB 4.13Å; V379-E398 HydrophobicContact CG1-CB 4.5Å; E398-T405 CarbonylContact O-C 3.54Å; E398-T405 WeakPolarHBondContact O-CA 3.3Å; E398-K406 HydrophobicContact CG-CD 4.37Å; E398-K406 HydrophobicContact CG-CG 3.88Å; E398-K406 PolarHBondContact N-O 2.74Å; E398-K406 PolarHBondContact O-N 2.9Å; E398-K406 WeakPolarHBondContact OE1-CE 3.44Å; E398-K406 IonicContact OE1-NZ 3.32Å; E398-K406 PolarHBondContact OE1-NZ 3.48Å; E398-S408 VanDerWaalsContact OE2-CB 3.24Å; E398-S408 WeakPolarHBondContact OE2-CB 2.81Å; E398-S408 PolarHBondContact OE2-OG 3.35Å; E398-L410 WeakPolarHBondContact OE2-CD1 3.35Å; E398-L410 VanDerWaalsContact OE2-CG 3.3Å; E398-L410 WeakPolarHBondContact OE2-CG 3.27Å
399	N	88.1	Confident	87.5	Confident	53 Å²	53	57.3 Å²	57.3	28%	0.283	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	141.5	171.3	-76	-13.2	0	0	0	110.5	L355 F404 T405	L355-N399 HydrophobicContact CD1-CB 4.15Å; L355-N399 VanDerWaalsContact CD1-CG 3.44Å; L355-N399 WeakPolarHBondContact CD1-OD1 3.31Å; N399-F404 CarbonylContact C-O 3.46Å; N399-F404 WeakPolarHBondContact CA-O 3.49Å; N399-T405 WeakPolarHBondContact OD1-CG2 3.38Å
400	D	83.2	Confident	87.6	Confident	52 Å²	52	58.8 Å²	58.8	28%	0.278	29%	0.29	S	S	.	.			trans	-78.8	-176.7	163.8	71.2	12	0	0	0	112.1	D402 F403 F404 K406	D400-D402 PolarHBondContact O-N 3.19Å; D400-D402 VanDerWaalsContact OD1-C 3.31Å; D400-D402 WeakPolarHBondContact OD1-CA 3.24Å; D400-D402 PolarHBondContact OD1-N 3.39Å; D400-F403 PolarHBondContact O-N 3.31Å; D400-F403 VanDerWaalsContact O-N 3.11Å; D400-F403 PolarHBondContact OD1-N 2.84Å; D400-F403 VanDerWaalsContact OD1-N 3.07Å; D400-F404 PolarHBondContact N-O 3.31Å; D400-F404 PolarHBondContact OD1-N 2.85Å; D400-K406 HydrophobicContact CB-CD 3.89Å; D400-K406 HydrophobicContact CB-CG 4.28Å
401	M	78.8	Confident	87.6	Confident	175 Å²	175	57 Å²	57	86%	0.862	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.4	-179.1	-66.5	-62.8	-62.6	0	0	113
402	D	80.9	Confident	87.6	Confident	120 Å²	120	57.1 Å²	57.1	64%	0.642	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	12	-179.2	-65.4	-39.4	0	0	0	111.9	D400 F404	D400-D402 PolarHBondContact O-N 3.19Å; D400-D402 VanDerWaalsContact OD1-C 3.31Å; D400-D402 WeakPolarHBondContact OD1-CA 3.24Å; D400-D402 PolarHBondContact OD1-N 3.39Å; D402-F404 HydrophobicContact CB-CD2 3.7Å; D402-F404 HydrophobicContact CB-CE2 3.94Å; D402-F404 PolarHBondContact O-N 2.84Å
403	F	77.3	Confident	87.7	Confident	170 Å²	170	56.5 Å²	56.5	75%	0.746	28%	0.278	S	S	*	.	S	Bend	trans	63.4	19.2	-177.9	-59.3	-88.9	0	0	0	115.1	D400	D400-F403 PolarHBondContact O-N 3.31Å; D400-F403 VanDerWaalsContact O-N 3.11Å; D400-F403 PolarHBondContact OD1-N 2.84Å; D400-F403 VanDerWaalsContact OD1-N 3.07Å
404	F	83.4	Confident	87.8	Confident	143 Å²	143	56.4 Å²	56.4	63%	0.627	28%	0.278	S	S	*	.			trans	-82.8	137.5	168.5	-66.1	-75.6	0	0	0	110.5	N399 D400 D402 K406	N399-F404 CarbonylContact C-O 3.46Å; N399-F404 WeakPolarHBondContact CA-O 3.49Å; D400-F404 PolarHBondContact N-O 3.31Å; D400-F404 PolarHBondContact OD1-N 2.85Å; D402-F404 HydrophobicContact CB-CD2 3.7Å; D402-F404 HydrophobicContact CB-CE2 3.94Å; D402-F404 PolarHBondContact O-N 2.84Å; F404-K406 PolarHBondContact O-N 2.85Å
405	T	84	Confident	87.9	Confident	75 Å²	75	58.6 Å²	58.6	46%	0.46	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.7	176	44.7	0	0	0	0	110.5	L355 E398 N399	L355-T405 HydrophobicContact CD1-CG2 4.49Å; E398-T405 CarbonylContact O-C 3.54Å; E398-T405 WeakPolarHBondContact O-CA 3.3Å; N399-T405 WeakPolarHBondContact OD1-CG2 3.38Å
406	K	87.3	Confident	88	Confident	84 Å²	84	58.7 Å²	58.7	37%	0.365	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	155.6	174.7	62.1	167.9	176.6	156.9	0	111.4	E397 E398 D400 F404 S408	E397-K406 WeakPolarHBondContact CA-O 3.18Å; E398-K406 HydrophobicContact CG-CD 4.37Å; E398-K406 HydrophobicContact CG-CG 3.88Å; E398-K406 PolarHBondContact N-O 2.74Å; E398-K406 PolarHBondContact O-N 2.9Å; E398-K406 WeakPolarHBondContact OE1-CE 3.44Å; E398-K406 IonicContact OE1-NZ 3.32Å; E398-K406 PolarHBondContact OE1-NZ 3.48Å; D400-K406 HydrophobicContact CB-CD 3.89Å; D400-K406 HydrophobicContact CB-CG 4.28Å; F404-K406 PolarHBondContact O-N 2.85Å; K406-S408 PolarHBondContact O-N 3.44Å
407	P	87.4	Confident	88.1	Confident	82 Å²	82	66.4 Å²	66.4	53%	0.532	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	122.9	171.6	-26.1	36.5	0	0	0	111.9	A431	P407-A431 HydrophobicContact CB-CB 3.8Å
408	S	88.3	Confident	88.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.332	C	S	.	.			trans	-83.8	145.8	175.3	-172	0	0	0	0	111	G395 G396 E398 K406 L410 G432	G395-S408 WeakPolarHBondContact CA-O 3.37Å; G396-S408 PolarHBondContact O-N 3.3Å; E398-S408 VanDerWaalsContact OE2-CB 3.24Å; E398-S408 WeakPolarHBondContact OE2-CB 2.81Å; E398-S408 PolarHBondContact OE2-OG 3.35Å; K406-S408 PolarHBondContact O-N 3.44Å; S408-L410 WeakPolarHBondContact OG-CB 3.33Å; S408-L410 WeakPolarHBondContact OG-CG 3.28Å; S408-L410 PolarHBondContact OG-N 3.09Å; S408-L410 VanDerWaalsContact OG-N 3.17Å; S408-G432 PolarHBondContact O-N 2.8Å
409	R	89.7	Confident	88.3	Confident	103 Å²	103	70.3 Å²	70.3	39%	0.389	35%	0.347	S	S	.	.			trans	-118.7	10.9	170.3	-56.8	179.3	71.8	126.3	-4.2	111.3	V427 L428 P429 A431	R409-V427 HydrophobicContact CB-CB 3.98Å; R409-V427 WeakPolarHBondContact O-CA 3.5Å; R409-L428 HydrophobicContact CB-CB 4.42Å; R409-L428 PolarHBondContact NE-O 2.79Å; R409-L428 PolarHBondContact NH2-O 3.19Å; R409-L428 PolarHBondContact O-N 3.41Å; R409-P429 PolarHBondContact NH2-O 2.9Å; R409-A431 HydrophobicContact CG-CB 3.51Å
410	L	90.6	Very high	88.4	Confident	35 Å²	35	74.3 Å²	74.3	18%	0.183	36%	0.362	C	S	.	.			trans	-76.3	153.8	-172.9	-61.3	-175.9	0	0	0	111.4	T377 G395 E398 S408 L423	T377-L410 HydrophobicContact CG2-CD1 4.02Å; G395-L410 PolarHBondContact N-O 2.99Å; E398-L410 WeakPolarHBondContact OE2-CD1 3.35Å; E398-L410 VanDerWaalsContact OE2-CG 3.3Å; E398-L410 WeakPolarHBondContact OE2-CG 3.27Å; S408-L410 WeakPolarHBondContact OG-CB 3.33Å; S408-L410 WeakPolarHBondContact OG-CG 3.28Å; S408-L410 PolarHBondContact OG-N 3.09Å; S408-L410 VanDerWaalsContact OG-N 3.17Å; L410-L423 HydrophobicContact CB-CD1 3.95Å; L410-L423 HydrophobicContact CD1-CD1 4.07Å; L410-L423 HydrophobicContact CD2-CD1 4.2Å; L410-L423 HydrophobicContact CG-CD1 4.29Å
411	I	92.5	Very high	88.9	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	110.5	172	-59.5	172.3	0	0	0	106.6	Y392 I393 L394 K424 Y426 L428 F462	Y392-I411 HydrophobicContact CD1-CG2 4.4Å; I393-I411 WeakPolarHBondContact O-CA 3.13Å; L394-I411 HydrophobicContact CD2-CB 4.21Å; L394-I411 HydrophobicContact CD2-CD1 4.43Å; L394-I411 HydrophobicContact CD2-CG1 3.83Å; L394-I411 HydrophobicContact CD2-CG2 3.74Å; I411-K424 HydrophobicContact CB-CB 4.1Å; I411-K424 HydrophobicContact CB-CG 4.3Å; I411-K424 HydrophobicContact CG2-CB 4.25Å; I411-K424 HydrophobicContact CG2-CG 3.89Å; I411-K424 PolarHBondContact O-N 2.87Å; I411-Y426 HydrophobicContact CD1-CD2 4.04Å; I411-Y426 HydrophobicContact CD1-CE2 3.96Å; I411-L428 HydrophobicContact CD1-CD2 3.77Å; I411-L428 HydrophobicContact CD1-CG 3.84Å; I411-L428 HydrophobicContact CG1-CD1 4.02Å; I411-L428 HydrophobicContact CG1-CD2 3.96Å; I411-L428 HydrophobicContact CG1-CG 3.62Å; I411-F462 HydrophobicContact CD1-CE1 4.19Å; I411-F462 HydrophobicContact CD1-CZ 3.66Å
412	Q	94	Very high	89.6	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.009	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.4	176.5	-60.9	-177.5	82.9	0	0	108.8	D376 T377 I393 L423	D376-Q412 VanDerWaalsContact N-OE1 3.12Å; T377-Q412 PolarHBondContact O-NE2 3.25Å; T377-Q412 PolarHBondContact O-OE1 3.04Å; I393-Q412 HydrophobicContact CB-CB 4.21Å; I393-Q412 PolarHBondContact N-O 2.99Å; I393-Q412 PolarHBondContact O-N 2.89Å; Q412-L423 HydrophobicContact CG-CD1 3.73Å
413	C	93.7	Very high	90.1	Very high	11 Å²	11	68.5 Å²	68.5	7%	0.074	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	116	177.9	-63.3	0	0	0	0	108.8	T390 Y392 C421 Q422	T390-C413 HydrophobicContact CG2-CB 4.03Å; Y392-C413 WeakPolarHBondContact CD1-SG 3.19Å; Y392-C413 WeakPolarHBondContact CE1-SG 3.49Å; C413-C421 CarbonylContact O-C 3.52Å; C413-C421 WeakPolarHBondContact O-CA 3.37Å; C413-Q422 PolarHBondContact N-O 3.39Å; C413-Q422 PolarHBondContact O-N 3.25Å
414	F	95.3	Very high	90.7	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	109.6	176.2	-173.5	-89.2	0	0	0	109.7	Y344 L346 V359 T372 S373 L375 I391 T416 C421	Y344-F414 HydrophobicContact CD1-CE1 4.34Å; Y344-F414 AromaticContact CE1-CE1 3.91Å; Y344-F414 HydrophobicContact CE1-CE1 3.91Å; L346-F414 HydrophobicContact CD2-CB 4.4Å; L346-F414 HydrophobicContact CD2-CG 4.41Å; V359-F414 HydrophobicContact CB-CE2 4.3Å; V359-F414 HydrophobicContact CB-CZ 4.44Å; V359-F414 HydrophobicContact CG1-CE1 4.19Å; V359-F414 HydrophobicContact CG1-CE2 4.16Å; V359-F414 HydrophobicContact CG1-CZ 3.93Å; V359-F414 HydrophobicContact CG2-CD2 4.25Å; V359-F414 HydrophobicContact CG2-CE2 4.07Å; T372-F414 HydrophobicContact CG2-CZ 3.79Å; S373-F414 WeakPolarHBondContact OG-CE2 3.42Å; S373-F414 WeakPolarHBondContact OG-CZ 3.47Å; L375-F414 HydrophobicContact CD2-CD2 4.43Å; I391-F414 HydrophobicContact CB-CB 4.28Å; I391-F414 HydrophobicContact CD1-CD1 4.46Å; I391-F414 PolarHBondContact N-O 3.24Å; I391-F414 PolarHBondContact O-N 3.37Å; F414-T416 HydrophobicContact CD1-CG2 4.36Å; F414-T416 PolarHBondContact O-N 3.27Å; F414-C421 HydrophobicContact CD2-CB 4.29Å
415	D	93.4	Very high	90.7	Very high	47 Å²	47	61.5 Å²	61.5	25%	0.251	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	117.3	175.3	175.8	-3.8	0	0	0	109.7	K417 T418 Q419 K420	D415-K417 VanDerWaalsContact C-N 3.29Å; D415-K417 PolarHBondContact O-N 3.29Å; D415-K417 WeakPolarHBondContact OD1-CB 3.5Å; D415-K417 PolarHBondContact OD1-N 2.83Å; D415-T418 VanDerWaalsContact CB-OG1 3.3Å; D415-T418 WeakPolarHBondContact CB-OG1 3.14Å; D415-T418 PolarHBondContact OD1-N 3.23Å; D415-T418 WeakPolarHBondContact OD2-CB 3.45Å; D415-T418 VanDerWaalsContact OD2-CG2 3.23Å; D415-T418 WeakPolarHBondContact OD2-CG2 3.39Å; D415-T418 PolarHBondContact OD2-OG1 3.47Å; D415-Q419 VanDerWaalsContact O-CA 3.24Å; D415-Q419 WeakPolarHBondContact O-CA 3.4Å; D415-Q419 PolarHBondContact O-N 3.41Å; D415-K420 PolarHBondContact N-O 3.05Å
416	T	92.1	Very high	90.7	Very high	3 Å²	3	60 Å²	60	2%	0.018	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-20.9	-176.4	61	0	0	0	0	113.5	V337 Q340 Y344 G389 I391 F414	V337-T416 HydrophobicContact CG1-CG2 4.34Å; V337-T416 HydrophobicContact CG2-CG2 4.02Å; Q340-T416 PolarHBondContact NE2-O 2.85Å; Q340-T416 PolarHBondContact NE2-OG1 2.86Å; Y344-T416 HydrophobicContact CE1-CG2 4.34Å; Y344-T416 HydrophobicContact CE2-CG2 4.12Å; G389-T416 WeakPolarHBondContact O-CB 3.16Å; G389-T416 VanDerWaalsContact O-CG2 3.28Å; G389-T416 WeakPolarHBondContact O-CG2 3.05Å; G389-T416 PolarHBondContact O-N 2.89Å; G389-T416 VanDerWaalsContact O-N 3.15Å; G389-T416 PolarHBondContact O-OG1 3.01Å; I391-T416 HydrophobicContact CD1-CG2 3.75Å; I391-T416 HydrophobicContact CG1-CG2 3.86Å; F414-T416 HydrophobicContact CD1-CG2 4.36Å; F414-T416 PolarHBondContact O-N 3.27Å
417	K	91	Very high	90.8	Very high	163 Å²	163	59.8 Å²	59.8	71%	0.709	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-47.1	177.7	-68.3	-178.1	179.3	177.1	0	111.2	D415	D415-K417 VanDerWaalsContact C-N 3.29Å; D415-K417 PolarHBondContact O-N 3.29Å; D415-K417 WeakPolarHBondContact OD1-CB 3.5Å; D415-K417 PolarHBondContact OD1-N 2.83Å
418	T	91.1	Very high	90.7	Very high	76 Å²	76	56 Å²	56	47%	0.466	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.6	-178.9	61.8	0	0	0	0	113.2	D415 K420	D415-T418 VanDerWaalsContact CB-OG1 3.3Å; D415-T418 WeakPolarHBondContact CB-OG1 3.14Å; D415-T418 PolarHBondContact OD1-N 3.23Å; D415-T418 WeakPolarHBondContact OD2-CB 3.45Å; D415-T418 VanDerWaalsContact OD2-CG2 3.23Å; D415-T418 WeakPolarHBondContact OD2-CG2 3.39Å; D415-T418 PolarHBondContact OD2-OG1 3.47Å; T418-K420 VanDerWaalsContact C-N 3.31Å; T418-K420 PolarHBondContact O-N 3.36Å
419	Q	91.4	Very high	90.5	Very high	83 Å²	83	58.8 Å²	58.8	39%	0.388	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	53	-174.3	-57.9	-175.4	12.2	0	0	110.5	T372 S373 D415	T372-Q419 PolarHBondContact OG1-OE1 3.37Å; S373-Q419 WeakPolarHBondContact CB-O 3.12Å; S373-Q419 PolarHBondContact OG-O 2.86Å; D415-Q419 VanDerWaalsContact O-CA 3.24Å; D415-Q419 WeakPolarHBondContact O-CA 3.4Å; D415-Q419 PolarHBondContact O-N 3.41Å
420	K	92	Very high	90.1	Very high	136 Å²	136	55.1 Å²	55.1	59%	0.591	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.3	177.3	-70.9	-174.8	179.6	-178.1	0	109.7	D415 T418	D415-K420 PolarHBondContact N-O 3.05Å; T418-K420 VanDerWaalsContact C-N 3.31Å; T418-K420 PolarHBondContact O-N 3.36Å
421	C	93.3	Very high	89.7	Confident	18 Å²	18	55.2 Å²	55.2	12%	0.122	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	142	167.9	-172.2	0	0	0	0	109.4	Q374 D376 C413 F414	Q374-C421 WeakPolarHBondContact O-CB 3.49Å; D376-C421 PolarHBondContact N-SG 2.94Å; D376-C421 PolarHBondContact OD2-SG 3.19Å; C413-C421 CarbonylContact O-C 3.52Å; C413-C421 WeakPolarHBondContact O-CA 3.37Å; F414-C421 HydrophobicContact CD2-CB 4.29Å
422	Q	92.6	Very high	89	Confident	129 Å²	129	55.7 Å²	55.7	60%	0.603	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	125.3	169.8	-66.2	-177.6	0.1	0	0	109.6	C413	C413-Q422 PolarHBondContact N-O 3.39Å; C413-Q422 PolarHBondContact O-N 3.25Å
423	L	92.1	Very high	88.2	Confident	78 Å²	78	57.6 Å²	57.6	41%	0.408	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	128.6	169	-170.6	69.7	0	0	0	110.9	D376 L410 Q412	D376-L423 PolarHBondContact OD2-N 3.1Å; D376-L423 VanDerWaalsContact OD2-N 3.16Å; L410-L423 HydrophobicContact CB-CD1 3.95Å; L410-L423 HydrophobicContact CD1-CD1 4.07Å; L410-L423 HydrophobicContact CD2-CD1 4.2Å; L410-L423 HydrophobicContact CG-CD1 4.29Å; Q412-L423 HydrophobicContact CG-CD1 3.73Å
424	K	90	Very high	87.7	Confident	44 Å²	44	57.2 Å²	57.2	19%	0.191	31%	0.305	C	S	.	.			trans	-74.9	144.9	172.9	-70.4	-64.9	-163.2	163.3	0	111.1	I411 Y426 E460	I411-K424 HydrophobicContact CB-CB 4.1Å; I411-K424 HydrophobicContact CB-CG 4.3Å; I411-K424 HydrophobicContact CG2-CB 4.25Å; I411-K424 HydrophobicContact CG2-CG 3.89Å; I411-K424 PolarHBondContact O-N 2.87Å; K424-Y426 VanDerWaalsContact C-N 3.27Å; K424-Y426 HydrophobicContact CB-CD2 4.36Å; K424-Y426 HydrophobicContact CB-CE1 4.22Å; K424-Y426 HydrophobicContact CB-CE2 3.97Å; K424-Y426 HydrophobicContact CD-CE1 4.2Å; K424-Y426 WeakPolarHBondContact CD-OH 3.16Å; K424-Y426 WeakPolarHBondContact CE-OH 3.32Å; K424-Y426 HydrophobicContact CG-CE2 4.23Å; K424-Y426 PolarHBondContact NZ-OH 2.97Å; K424-Y426 PolarHBondContact O-N 3.48Å; K424-E460 IonicContact NZ-OE1 2.64Å; K424-E460 PolarHBondContact NZ-OE1 2.73Å
425	P	83.3	Confident	87	Confident	122 Å²	122	59.2 Å²	59.2	79%	0.792	31%	0.314	S	S	*	.	S	Bend	trans	-75.2	-14	-175.7	29.7	-34.8	0	0	0	113.9
426	Y	84.8	Confident	86.6	Confident	43 Å²	43	57.9 Å²	57.9	17%	0.169	31%	0.31	C	S	.	.	S	Bend	trans	-106.2	155.2	177.9	45.7	-94.3	0	0	0	111.1	I411 K424 Y455 E460 F462	I411-Y426 HydrophobicContact CD1-CD2 4.04Å; I411-Y426 HydrophobicContact CD1-CE2 3.96Å; K424-Y426 VanDerWaalsContact C-N 3.27Å; K424-Y426 HydrophobicContact CB-CD2 4.36Å; K424-Y426 HydrophobicContact CB-CE1 4.22Å; K424-Y426 HydrophobicContact CB-CE2 3.97Å; K424-Y426 HydrophobicContact CD-CE1 4.2Å; K424-Y426 WeakPolarHBondContact CD-OH 3.16Å; K424-Y426 WeakPolarHBondContact CE-OH 3.32Å; K424-Y426 HydrophobicContact CG-CE2 4.23Å; K424-Y426 PolarHBondContact NZ-OH 2.97Å; K424-Y426 PolarHBondContact O-N 3.48Å; Y426-Y455 AromaticContact CE2-CE2 3.85Å; Y426-Y455 HydrophobicContact CE2-CE2 3.85Å; Y426-Y455 AromaticContact CE2-CZ 3.98Å; Y426-Y455 WeakPolarHBondContact CE2-OH 3.42Å; Y426-Y455 PolarHBondContact OH-OH 3.41Å; Y426-E460 HydrophobicContact CE1-CB 3.85Å; Y426-E460 HydrophobicContact CE1-CG 4.06Å; Y426-E460 WeakPolarHBondContact CE1-OE2 3.19Å; Y426-E460 VanDerWaalsContact OH-CD 3.29Å; Y426-E460 VanDerWaalsContact OH-CG 3.31Å; Y426-E460 WeakPolarHBondContact OH-CG 3.5Å; Y426-E460 PolarHBondContact OH-OE1 3.45Å; Y426-F462 AromaticContact CD2-CE2 3.99Å; Y426-F462 HydrophobicContact CD2-CE2 3.99Å; Y426-F462 HydrophobicContact CD2-CZ 4.06Å; Y426-F462 HydrophobicContact CE2-CZ 4.32Å
427	V	87.6	Confident	86.2	Confident	81 Å²	81	58.2 Å²	58.2	49%	0.491	31%	0.313	S	S	.	.			trans	-109.8	152.8	-174.7	-63.8	0	0	0	0	111.5	R409	R409-V427 HydrophobicContact CB-CB 3.98Å; R409-V427 WeakPolarHBondContact O-CA 3.5Å
428	L	85.8	Confident	85.8	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	29%	0.291	C	S	.	.			trans	-60.3	146.3	174.2	-72.1	162.5	0	0	0	110.8	L394 R409 I411 L430 M434 I445 F462	L394-L428 HydrophobicContact CB-CD1 4Å; L394-L428 HydrophobicContact CD2-CD2 4.46Å; R409-L428 HydrophobicContact CB-CB 4.42Å; R409-L428 PolarHBondContact NE-O 2.79Å; R409-L428 PolarHBondContact NH2-O 3.19Å; R409-L428 PolarHBondContact O-N 3.41Å; I411-L428 HydrophobicContact CD1-CD2 3.77Å; I411-L428 HydrophobicContact CD1-CG 3.84Å; I411-L428 HydrophobicContact CG1-CD1 4.02Å; I411-L428 HydrophobicContact CG1-CD2 3.96Å; I411-L428 HydrophobicContact CG1-CG 3.62Å; L428-L430 WeakPolarHBondContact CB-O 3.2Å; L428-L430 PolarHBondContact O-N 3.24Å; L428-M434 HydrophobicContact CD1-CE 4.25Å; L428-M434 HydrophobicContact CD1-SD 3.68Å; L428-I445 HydrophobicContact CD2-CD1 3.73Å; L428-F462 HydrophobicContact CD2-CE1 3.75Å; L428-F462 HydrophobicContact CD2-CZ 4.28Å
429	P	83.7	Confident	85.3	Confident	60 Å²	60	49.3 Å²	49.3	39%	0.39	27%	0.273	S	S	.	.	S	Bend	trans	-70.4	-11.7	172.1	28.9	-34.3	0	0	0	112.8	R409 V453 F462	R409-P429 PolarHBondContact NH2-O 2.9Å; P429-V453 HydrophobicContact CG-CB 4.48Å; P429-V453 HydrophobicContact CG-CG1 3.89Å; P429-V453 HydrophobicContact CG-CG2 3.95Å; P429-F462 HydrophobicContact CG-CD1 4.29Å; P429-F462 HydrophobicContact CG-CG 4.34Å
430	L	81.4	Confident	84.8	Confident	26 Å²	26	52.5 Å²	52.5	14%	0.136	29%	0.29	C	S	.	.	S	Bend	trans	-119.1	158.6	-178.7	-60.5	167.1	0	0	0	109.7	L428 M434 A447 V453	L428-L430 WeakPolarHBondContact CB-O 3.2Å; L428-L430 PolarHBondContact O-N 3.24Å; L430-M434 HydrophobicContact CB-CE 3.47Å; L430-M434 VanDerWaalsContact CB-CE 3.47Å; L430-M434 HydrophobicContact CD1-CE 4Å; L430-M434 HydrophobicContact CG-CE 4.38Å; L430-A447 HydrophobicContact CB-CB 3.79Å; L430-A447 HydrophobicContact CD1-CB 3.86Å; L430-A447 HydrophobicContact CD2-CB 4.41Å; L430-A447 HydrophobicContact CG-CB 4.23Å; L430-V453 HydrophobicContact CD1-CB 4.24Å; L430-V453 HydrophobicContact CD1-CG2 3.6Å; L430-V453 HydrophobicContact CG-CG2 4.15Å
431	A	82.5	Confident	84.4	Confident	37 Å²	37	50.9 Å²	50.9	31%	0.306	29%	0.288	S	S	.	.			trans	-135.9	153.8	179.4	0	0	0	0	0	110.8	P407 R409	P407-A431 HydrophobicContact CB-CB 3.8Å; R409-A431 HydrophobicContact CG-CB 3.51Å
432	G	78.4	Confident	84.1	Confident	9 Å²	9	52.3 Å²	52.3	9%	0.093	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	101.6	-158.5	173	0	0	0	0	0	113	G396 S408 M434	G396-G432 VanDerWaalsContact CA-O 3.25Å; G396-G432 WeakPolarHBondContact CA-O 3.45Å; G396-G432 PolarHBondContact N-O 3.43Å; G396-G432 CarbonylContact O-C 3.56Å; G396-G432 WeakPolarHBondContact O-CA 3.36Å; S408-G432 PolarHBondContact O-N 2.8Å; G432-M434 WeakPolarHBondContact O-CG 3.44Å; G432-M434 PolarHBondContact O-N 3.1Å
433	V	77.4	Confident	83.9	Confident	42 Å²	42	46.1 Å²	46.1	26%	0.255	27%	0.265	S	S	.	.	S	Bend	trans	-67.7	129.4	179.6	-180	0	0	0	0	109.8
434	M	81.8	Confident	83.6	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.015	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	162.7	-172.8	-42.5	-173.8	86.7	0	0	111.7	G381 A383 L428 L430 G432 I445 V446 A447	G381-M434 PolarHBondContact O-N 2.58Å; A383-M434 HydrophobicContact CB-CB 3.97Å; L428-M434 HydrophobicContact CD1-CE 4.25Å; L428-M434 HydrophobicContact CD1-SD 3.68Å; L430-M434 HydrophobicContact CB-CE 3.47Å; L430-M434 VanDerWaalsContact CB-CE 3.47Å; L430-M434 HydrophobicContact CD1-CE 4Å; L430-M434 HydrophobicContact CG-CE 4.38Å; G432-M434 WeakPolarHBondContact O-CG 3.44Å; G432-M434 PolarHBondContact O-N 3.1Å; M434-I445 HydrophobicContact CE-CG2 3.45Å; M434-I445 VanDerWaalsContact CE-CG2 3.45Å; M434-I445 HydrophobicContact SD-CG2 4.22Å; M434-V446 CarbonylContact C-O 3.57Å; M434-V446 WeakPolarHBondContact CA-O 3.28Å; M434-A447 HydrophobicContact CE-CB 3.65Å; M434-A447 HydrophobicContact CG-CB 4.2Å
435	H	81.9	Confident	83.5	Confident	43 Å²	43	40.5 Å²	40.5	20%	0.199	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144.5	166.4	-64.1	71.7	0	0	0	108.7	V446 K479 V480	H435-V446 PolarHBondContact N-O 3.45Å; H435-V446 PolarHBondContact O-N 3.35Å; H435-K479 HydrophobicContact CB-CD 4.5Å; H435-K479 WeakPolarHBondContact CD2-CD 3.45Å; H435-K479 VanDerWaalsContact CE1-CD 3.44Å; H435-K479 WeakPolarHBondContact CE1-CD 3.45Å; H435-K479 PolarHBondContact CE1-NZ 2.97Å; H435-K479 VanDerWaalsContact CG-CD 3.49Å; H435-K479 WeakPolarHBondContact ND1-CD 3.29Å; H435-K479 VanDerWaalsContact NE2-CD 3.3Å; H435-K479 WeakPolarHBondContact NE2-CD 3.24Å; H435-K479 PolarHBondContact NE2-NZ 3.49Å; H435-V480 HydrophobicContact CB-CG1 4.18Å; H435-V480 WeakPolarHBondContact O-CG1 3.32Å
436	A	84.5	Confident	83.3	Confident	19 Å²	19	34.7 Å²	34.7	16%	0.157	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153.5	178.7	0	0	0	0	0	111.3	A383 V385 L394 F444 I445 V480	A383-A436 HydrophobicContact CB-CB 3.68Å; V385-A436 VanDerWaalsContact CG2-C 3.4Å; V385-A436 HydrophobicContact CG2-CB 3.47Å; V385-A436 VanDerWaalsContact CG2-CB 3.47Å; V385-A436 WeakPolarHBondContact CG2-O 3.5Å; L394-A436 HydrophobicContact CD1-CB 3.78Å; A436-F444 CarbonylContact C-O 3.58Å; A436-F444 WeakPolarHBondContact CA-O 3.28Å; A436-F444 WeakPolarHBondContact CB-O 3.39Å; A436-I445 HydrophobicContact CB-CG1 4.11Å; A436-V480 VanDerWaalsContact CA-CG1 3.49Å
437	A	83.3	Confident	82.9	Confident	10 Å²	10	32.8 Å²	32.8	8%	0.083	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	142.1	175.1	0	0	0	0	0	110	F444 V480	A437-F444 PolarHBondContact N-O 3.47Å; A437-F444 PolarHBondContact O-N 2.56Å; A437-V480 HydrophobicContact CB-CG1 4.26Å; A437-V480 HydrophobicContact CB-CG2 4.21Å
438	A	83.6	Confident	81.8	Confident	30 Å²	30	34 Å²	34	25%	0.248	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	136.2	171.2	0	0	0	0	0	109.7	V385 L387 L443 S482	V385-A438 HydrophobicContact CG1-CB 3.27Å; L387-A438 HydrophobicContact CD1-CB 4.5Å; A438-L443 HydrophobicContact CB-CD2 3.86Å; A438-S482 WeakPolarHBondContact O-CB 3.48Å; A438-S482 PolarHBondContact O-OG 2.82Å
439	H	81.1	Confident	80.6	Confident	22 Å²	22	34.9 Å²	34.9	10%	0.102	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	112.4	171.5	-175.6	78.8	0	0	0	108.7	D441 L442 F444 S482 G485 V487	H439-D441 PolarHBondContact O-N 3.15Å; H439-L442 PolarHBondContact N-O 3.19Å; H439-L442 PolarHBondContact O-N 3.27Å; H439-F444 HydrophobicContact CB-CD2 3.78Å; H439-F444 HydrophobicContact CB-CE2 3.67Å; H439-S482 WeakPolarHBondContact CA-OG 3.35Å; H439-S482 VanDerWaalsContact CB-OG 3.31Å; H439-S482 WeakPolarHBondContact CB-OG 3.3Å; H439-S482 PolarHBondContact ND1-OG 3.11Å; H439-G485 VanDerWaalsContact CE1-CA 3.46Å; H439-G485 WeakPolarHBondContact CE1-CA 3.49Å; H439-G485 PolarHBondContact CE1-O 2.76Å; H439-V487 HydrophobicContact CB-CG2 3.95Å
440	M	80.5	Confident	79.4	Confident	149 Å²	149	35 Å²	35	73%	0.734	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	-121.3	-170.1	-57.6	-70.4	-76.7	0	0	109.3	L387	L387-M440 WeakPolarHBondContact CD1-O 3.32Å
441	D	83.8	Confident	78.7	Confident	102 Å²	102	34.1 Å²	34.1	55%	0.545	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	8.2	179.8	-57.6	-47.6	0	0	0	114.2	H439 P457	H439-D441 PolarHBondContact O-N 3.15Å; D441-P457 VanDerWaalsContact O-CD 3.32Å; D441-P457 WeakPolarHBondContact O-CD 3.43Å
442	L	87	Confident	78.6	Confident	48 Å²	48	32.3 Å²	32.3	25%	0.251	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	146.7	-174.1	-61.1	176.7	0	0	0	111.9	H439 F444 N456	H439-L442 PolarHBondContact N-O 3.19Å; H439-L442 PolarHBondContact O-N 3.27Å; L442-F444 HydrophobicContact CB-CE2 3.89Å; L442-N456 HydrophobicContact CD2-CB 3.63Å
443	L	87.6	Confident	78.9	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	122.9	176.1	-58.5	-171	0	0	0	110.1	V385 L387 Y392 L394 A438 C454 Y455 P457	V385-L443 HydrophobicContact CB-CD2 4.25Å; V385-L443 HydrophobicContact CG1-CD2 3.66Å; L387-L443 HydrophobicContact CB-CD2 4.34Å; L387-L443 HydrophobicContact CD2-CD2 4.3Å; Y392-L443 HydrophobicContact CD1-CD1 3.88Å; Y392-L443 HydrophobicContact CD2-CD1 3.9Å; Y392-L443 HydrophobicContact CE1-CD1 4.45Å; Y392-L443 HydrophobicContact CE2-CD1 4.48Å; Y392-L443 HydrophobicContact CG-CD1 3.57Å; L394-L443 HydrophobicContact CD1-CD1 4.45Å; A438-L443 HydrophobicContact CB-CD2 3.86Å; L443-C454 CarbonylContact O-C 3.57Å; L443-C454 WeakPolarHBondContact O-CA 3.17Å; L443-Y455 HydrophobicContact CB-CD1 4.16Å; L443-Y455 HydrophobicContact CD1-CD1 3.89Å; L443-Y455 HydrophobicContact CD1-CE1 4.26Å; L443-Y455 HydrophobicContact CG-CD1 4.29Å; L443-Y455 PolarHBondContact N-O 3.01Å; L443-Y455 PolarHBondContact O-N 3.44Å; L443-P457 HydrophobicContact CD1-CG 4.12Å; L443-P457 HydrophobicContact CG-CG 4.04Å
444	F	86.3	Confident	79.4	Confident	3 Å²	3	30.7 Å²	30.7	1%	0.013	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.7	177.5	-73.8	-90.7	0	0	0	109.1	A436 A437 H439 L442 L452 C454 L465 V480 V487 F504 P506	A436-F444 CarbonylContact C-O 3.58Å; A436-F444 WeakPolarHBondContact CA-O 3.28Å; A436-F444 WeakPolarHBondContact CB-O 3.39Å; A437-F444 PolarHBondContact N-O 3.47Å; A437-F444 PolarHBondContact O-N 2.56Å; H439-F444 HydrophobicContact CB-CD2 3.78Å; H439-F444 HydrophobicContact CB-CE2 3.67Å; L442-F444 HydrophobicContact CB-CE2 3.89Å; F444-L452 HydrophobicContact CB-CD1 4.17Å; F444-L452 HydrophobicContact CD1-CD1 4.25Å; F444-L452 HydrophobicContact CD1-CD2 4.17Å; F444-L452 HydrophobicContact CD1-CG 4.42Å; F444-C454 HydrophobicContact CD1-CB 4.27Å; F444-C454 HydrophobicContact CE1-CB 3.99Å; F444-C454 HydrophobicContact CZ-CB 4.46Å; F444-L465 HydrophobicContact CD1-CD1 4.31Å; F444-L465 HydrophobicContact CE1-CD1 3.82Å; F444-V480 HydrophobicContact CB-CG2 4.17Å; F444-V487 HydrophobicContact CB-CG1 4.11Å; F444-V487 HydrophobicContact CD1-CG1 4.3Å; F444-V487 HydrophobicContact CD1-CG2 4.28Å; F444-V487 HydrophobicContact CD2-CG2 3.75Å; F444-V487 HydrophobicContact CE1-CG2 4.4Å; F444-V487 HydrophobicContact CE2-CG2 3.92Å; F444-V487 HydrophobicContact CG-CG1 4.11Å; F444-V487 HydrophobicContact CG-CG2 3.94Å; F444-V487 HydrophobicContact CZ-CG2 4.23Å; F444-F504 AromaticContact CE1-CD1 3.91Å; F444-F504 HydrophobicContact CE1-CD1 3.91Å; F444-F504 AromaticContact CE1-CE1 3.54Å; F444-F504 HydrophobicContact CE1-CE1 3.54Å; F444-F504 HydrophobicContact CZ-CD1 4.4Å; F444-F504 AromaticContact CZ-CE1 3.9Å; F444-F504 HydrophobicContact CZ-CE1 3.9Å; F444-P506 HydrophobicContact CE2-CG 4.28Å; F444-P506 HydrophobicContact CZ-CB 4.14Å; F444-P506 HydrophobicContact CZ-CG 3.91Å
445	I	86.5	Confident	79.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132	-168.8	-49.7	170.4	0	0	0	109.5	L394 L428 M434 A436 V453	L394-I445 HydrophobicContact CD1-CD1 3.72Å; L394-I445 HydrophobicContact CD1-CG1 3.88Å; L394-I445 HydrophobicContact CD2-CD1 4.44Å; L428-I445 HydrophobicContact CD2-CD1 3.73Å; M434-I445 HydrophobicContact CE-CG2 3.45Å; M434-I445 VanDerWaalsContact CE-CG2 3.45Å; M434-I445 HydrophobicContact SD-CG2 4.22Å; A436-I445 HydrophobicContact CB-CG1 4.11Å; I445-V453 PolarHBondContact N-O 3.3Å; I445-V453 PolarHBondContact O-N 3.25Å
446	V	80.8	Confident	79.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	139.2	172.3	-156.8	0	0	0	0	109.8	M434 H435 L452 W478 V480	M434-V446 CarbonylContact C-O 3.57Å; M434-V446 WeakPolarHBondContact CA-O 3.28Å; H435-V446 PolarHBondContact N-O 3.45Å; H435-V446 PolarHBondContact O-N 3.35Å; V446-L452 HydrophobicContact CG2-CD1 3.45Å; V446-L452 VanDerWaalsContact CG2-CD1 3.45Å; V446-W478 HydrophobicContact CB-CB 4.19Å; V446-W478 HydrophobicContact CG1-CB 3.34Å; V446-W478 HydrophobicContact CG1-CG 4.01Å; V446-V480 HydrophobicContact CG2-CB 3.7Å; V446-V480 HydrophobicContact CG2-CG1 3.97Å; V446-V480 HydrophobicContact CG2-CG2 4.32Å
447	A	74.5	Confident	80	Confident	4 Å²	4	29.7 Å²	29.7	3%	0.033	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	179.5	177.4	0	0	0	0	0	110.5	L430 M434 G449	L430-A447 HydrophobicContact CB-CB 3.79Å; L430-A447 HydrophobicContact CD1-CB 3.86Å; L430-A447 HydrophobicContact CD2-CB 4.41Å; L430-A447 HydrophobicContact CG-CB 4.23Å; M434-A447 HydrophobicContact CE-CB 3.65Å; M434-A447 HydrophobicContact CG-CB 4.2Å; A447-G449 PolarHBondContact O-N 2.86Å
448	E	65.8	Low	80	Confident	106 Å²	106	35.9 Å²	35.9	50%	0.495	20%	0.195	S	C	.	.	S	Bend	trans	-56.5	110.9	165.5	-73.3	179	-153	0	0	110.4	F477	E448-F477 VanDerWaalsContact CD-CE1 3.49Å; E448-F477 HydrophobicContact CG-CD1 3.8Å; E448-F477 HydrophobicContact CG-CE1 3.61Å; E448-F477 HydrophobicContact CG-CZ 4.33Å; E448-F477 WeakPolarHBondContact OE1-CE1 3.27Å
449	G	59.8	Low	80.1	Confident	19 Å²	19	40.4 Å²	40.4	20%	0.196	21%	0.214	C	C	.	.	S	Bend	trans	127.4	170.7	-178	0	0	0	0	0	114.1	A447 S451	A447-G449 PolarHBondContact O-N 2.86Å; G449-S451 VanDerWaalsContact C-N 3.25Å; G449-S451 PolarHBondContact O-N 3.43Å
450	D	58.7	Low	80.3	Confident	64 Å²	64	43.6 Å²	43.6	34%	0.342	23%	0.229	S	C	.	.	S	Bend	trans	-82.8	55.4	-172.4	-57.1	-21.9	0	0	0	111.9	W471	D450-W471 HydrophobicContact CB-CB 4.44Å; D450-W471 HydrophobicContact CB-CD2 4.48Å; D450-W471 HydrophobicContact CB-CE3 3.8Å; D450-W471 HydrophobicContact CB-CZ3 4.43Å; D450-W471 VanDerWaalsContact O-CE3 3.23Å; D450-W471 WeakPolarHBondContact O-CZ3 3.46Å
451	S	67.3	Low	80.6	Confident	6 Å²	6	38.6 Å²	38.6	4%	0.042	21%	0.209	C	C	.	.			trans	-146.7	114.6	-177.1	-69.9	0	0	0	0	114.7	G449 R464 W471	G449-S451 VanDerWaalsContact C-N 3.25Å; G449-S451 PolarHBondContact O-N 3.43Å; S451-R464 PolarHBondContact OG-NE 3.48Å; S451-R464 PolarHBondContact OG-NH2 2.87Å; S451-W471 VanDerWaalsContact CA-CZ3 3.45Å
452	L	79.1	Confident	80.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128	162.5	174.6	70.8	0	0	0	108	F444 V446 L465 F467 W471 V480 V489	F444-L452 HydrophobicContact CB-CD1 4.17Å; F444-L452 HydrophobicContact CD1-CD1 4.25Å; F444-L452 HydrophobicContact CD1-CD2 4.17Å; F444-L452 HydrophobicContact CD1-CG 4.42Å; V446-L452 HydrophobicContact CG2-CD1 3.45Å; V446-L452 VanDerWaalsContact CG2-CD1 3.45Å; L452-L465 HydrophobicContact CB-CB 4.48Å; L452-L465 HydrophobicContact CD2-CB 4.28Å; L452-L465 HydrophobicContact CD2-CD1 3.76Å; L452-L465 HydrophobicContact CG-CB 4.46Å; L452-L465 HydrophobicContact CG-CD1 4.25Å; L452-L465 PolarHBondContact O-N 3.39Å; L452-F467 HydrophobicContact CB-CD2 4.34Å; L452-F467 HydrophobicContact CB-CE2 3.48Å; L452-F467 VanDerWaalsContact CB-CE2 3.48Å; L452-F467 HydrophobicContact CB-CZ 4.3Å; L452-F467 HydrophobicContact CD2-CE2 3.4Å; L452-F467 HydrophobicContact CD2-CZ 3.3Å; L452-F467 HydrophobicContact CG-CE2 4.06Å; L452-F467 HydrophobicContact CG-CZ 4.41Å; L452-W471 HydrophobicContact CB-CH2 3.89Å; L452-W471 VanDerWaalsContact N-CH2 3.32Å; L452-V480 HydrophobicContact CD1-CG2 4.48Å; L452-V489 HydrophobicContact CD2-CG2 4.44Å
453	V	85.6	Confident	80.8	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.024	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	122.3	179.3	175.5	0	0	0	0	107.9	P429 L430 I445 F462	P429-V453 HydrophobicContact CG-CB 4.48Å; P429-V453 HydrophobicContact CG-CG1 3.89Å; P429-V453 HydrophobicContact CG-CG2 3.95Å; L430-V453 HydrophobicContact CD1-CB 4.24Å; L430-V453 HydrophobicContact CD1-CG2 3.6Å; L430-V453 HydrophobicContact CG-CG2 4.15Å; I445-V453 PolarHBondContact N-O 3.3Å; I445-V453 PolarHBondContact O-N 3.25Å; V453-F462 HydrophobicContact CG1-CB 4.02Å; V453-F462 HydrophobicContact CG1-CD1 3.73Å; V453-F462 HydrophobicContact CG1-CG 4.32Å
454	C	87.6	Confident	80.4	Confident	12 Å²	12	46.3 Å²	46.3	8%	0.081	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124	165.9	-179.4	0	0	0	0	108	L443 F444 F462 T463 L465	L443-C454 CarbonylContact O-C 3.57Å; L443-C454 WeakPolarHBondContact O-CA 3.17Å; F444-C454 HydrophobicContact CD1-CB 4.27Å; F444-C454 HydrophobicContact CE1-CB 3.99Å; F444-C454 HydrophobicContact CZ-CB 4.46Å; C454-F462 CarbonylContact O-C 3.56Å; C454-F462 WeakPolarHBondContact O-CA 3.45Å; C454-T463 PolarHBondContact N-O 2.94Å; C454-T463 PolarHBondContact O-N 3.25Å; C454-L465 HydrophobicContact CB-CD1 4.3Å
455	Y	87.7	Confident	79.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.9	173.2	170.6	-119.7	0	0	0	108.8	Y392 Y426 L443 P457 F462	Y392-Y455 HydrophobicContact CD1-CE1 4.35Å; Y392-Y455 HydrophobicContact CE1-CE1 4.26Å; Y426-Y455 AromaticContact CE2-CE2 3.85Å; Y426-Y455 HydrophobicContact CE2-CE2 3.85Å; Y426-Y455 AromaticContact CE2-CZ 3.98Å; Y426-Y455 WeakPolarHBondContact CE2-OH 3.42Å; Y426-Y455 PolarHBondContact OH-OH 3.41Å; L443-Y455 HydrophobicContact CB-CD1 4.16Å; L443-Y455 HydrophobicContact CD1-CD1 3.89Å; L443-Y455 HydrophobicContact CD1-CE1 4.26Å; L443-Y455 HydrophobicContact CG-CD1 4.29Å; L443-Y455 PolarHBondContact N-O 3.01Å; L443-Y455 PolarHBondContact O-N 3.44Å; Y455-P457 HydrophobicContact CD1-CG 4.04Å; Y455-P457 HydrophobicContact CE1-CB 4.03Å; Y455-P457 HydrophobicContact CE1-CG 3.75Å; Y455-P457 WeakPolarHBondContact O-CD 3.5Å; Y455-F462 AromaticContact CD2-CD1 3.63Å; Y455-F462 HydrophobicContact CD2-CD1 3.63Å; Y455-F462 AromaticContact CD2-CE1 3.2Å; Y455-F462 HydrophobicContact CD2-CE1 3.2Å; Y455-F462 HydrophobicContact CD2-CE2 4.24Å; Y455-F462 HydrophobicContact CD2-CG 4.31Å; Y455-F462 AromaticContact CD2-CZ 3.54Å; Y455-F462 HydrophobicContact CD2-CZ 3.54Å; Y455-F462 AromaticContact CE2-CE1 3.92Å; Y455-F462 HydrophobicContact CE2-CE1 3.92Å; Y455-F462 HydrophobicContact CE2-CE2 4.38Å; Y455-F462 AromaticContact CE2-CZ 3.78Å; Y455-F462 HydrophobicContact CE2-CZ 3.78Å; Y455-F462 HydrophobicContact CG-CD1 4.07Å; Y455-F462 AromaticContact CG-CE1 3.64Å; Y455-F462 HydrophobicContact CG-CE1 3.64Å; Y455-F462 HydrophobicContact CG-CZ 4.33Å
456	N	87.4	Confident	78.8	Confident	30 Å²	30	59 Å²	59	16%	0.16	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	108.3	174	-175.9	-29.9	0	0	0	108.6	L442 L458 L459 E460 S461	L442-N456 HydrophobicContact CD2-CB 3.63Å; N456-L458 VanDerWaalsContact C-N 3.29Å; N456-L458 PolarHBondContact O-N 3.1Å; N456-L458 WeakPolarHBondContact OD1-CA 3.48Å; N456-L458 WeakPolarHBondContact OD1-CB 3.43Å; N456-L458 PolarHBondContact OD1-N 3.4Å; N456-L459 HydrophobicContact CB-CB 4.29Å; N456-L459 WeakPolarHBondContact ND2-CD1 3.34Å; N456-L459 PolarHBondContact O-N 2.97Å; N456-L459 PolarHBondContact OD1-N 3.17Å; N456-L459 VanDerWaalsContact OD1-N 3.12Å; N456-E460 WeakPolarHBondContact O-CA 3.49Å; N456-E460 PolarHBondContact O-N 2.92Å; N456-S461 PolarHBondContact N-O 3.3Å; N456-S461 PolarHBondContact O-N 2.88Å
457	P	85.8	Confident	78	Confident	14 Å²	14	60 Å²	60	9%	0.091	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.3	-179.6	-20.6	34.7	0	0	0	114.2	L387 Y392 D441 L443 Y455	L387-P457 HydrophobicContact CD2-CG 3.79Å; Y392-P457 HydrophobicContact CE1-CB 4.14Å; Y392-P457 HydrophobicContact CE1-CG 4.36Å; Y392-P457 WeakPolarHBondContact OH-CB 3.43Å; D441-P457 VanDerWaalsContact O-CD 3.32Å; D441-P457 WeakPolarHBondContact O-CD 3.43Å; L443-P457 HydrophobicContact CD1-CG 4.12Å; L443-P457 HydrophobicContact CG-CG 4.04Å; Y455-P457 HydrophobicContact CD1-CG 4.04Å; Y455-P457 HydrophobicContact CE1-CB 4.03Å; Y455-P457 HydrophobicContact CE1-CG 3.75Å; Y455-P457 WeakPolarHBondContact O-CD 3.5Å
458	L	84.5	Confident	77	Confident	140 Å²	140	63.1 Å²	63.1	73%	0.733	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-39.3	178.4	-64.6	172.6	0	0	0	112	N456	N456-L458 VanDerWaalsContact C-N 3.29Å; N456-L458 PolarHBondContact O-N 3.1Å; N456-L458 WeakPolarHBondContact OD1-CA 3.48Å; N456-L458 WeakPolarHBondContact OD1-CB 3.43Å; N456-L458 PolarHBondContact OD1-N 3.4Å
459	L	85.4	Confident	76.4	Confident	125 Å²	125	66.6 Å²	66.6	65%	0.654	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-5.5	179.4	-61.5	-179	0	0	0	113.2	N456 S461	N456-L459 HydrophobicContact CB-CB 4.29Å; N456-L459 WeakPolarHBondContact ND2-CD1 3.34Å; N456-L459 PolarHBondContact O-N 2.97Å; N456-L459 PolarHBondContact OD1-N 3.17Å; N456-L459 VanDerWaalsContact OD1-N 3.12Å; L459-S461 PolarHBondContact O-N 3.3Å
460	E	85.3	Confident	76	Confident	89 Å²	89	70.3 Å²	70.3	42%	0.416	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	37.9	-174.6	-56	-165.8	146.3	0	0	112.8	K424 Y426 N456	K424-E460 IonicContact NZ-OE1 2.64Å; K424-E460 PolarHBondContact NZ-OE1 2.73Å; Y426-E460 HydrophobicContact CE1-CB 3.85Å; Y426-E460 HydrophobicContact CE1-CG 4.06Å; Y426-E460 WeakPolarHBondContact CE1-OE2 3.19Å; Y426-E460 VanDerWaalsContact OH-CD 3.29Å; Y426-E460 VanDerWaalsContact OH-CG 3.31Å; Y426-E460 WeakPolarHBondContact OH-CG 3.5Å; Y426-E460 PolarHBondContact OH-OE1 3.45Å; N456-E460 WeakPolarHBondContact O-CA 3.49Å; N456-E460 PolarHBondContact O-N 2.92Å
461	S	87.1	Confident	75.8	Confident	44 Å²	44	68.1 Å²	68.1	31%	0.308	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147.7	-170.8	70.7	0	0	0	0	112.6	N456 L459	N456-S461 PolarHBondContact N-O 3.3Å; N456-S461 PolarHBondContact O-N 2.88Å; L459-S461 PolarHBondContact O-N 3.3Å
462	F	87.5	Confident	74.8	Confident	65 Å²	65	72 Å²	72	29%	0.285	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.6	175.8	-58.5	-82.9	0	0	0	111.4	I411 Y426 L428 P429 V453 C454 Y455	I411-F462 HydrophobicContact CD1-CE1 4.19Å; I411-F462 HydrophobicContact CD1-CZ 3.66Å; Y426-F462 AromaticContact CD2-CE2 3.99Å; Y426-F462 HydrophobicContact CD2-CE2 3.99Å; Y426-F462 HydrophobicContact CD2-CZ 4.06Å; Y426-F462 HydrophobicContact CE2-CZ 4.32Å; L428-F462 HydrophobicContact CD2-CE1 3.75Å; L428-F462 HydrophobicContact CD2-CZ 4.28Å; P429-F462 HydrophobicContact CG-CD1 4.29Å; P429-F462 HydrophobicContact CG-CG 4.34Å; V453-F462 HydrophobicContact CG1-CB 4.02Å; V453-F462 HydrophobicContact CG1-CD1 3.73Å; V453-F462 HydrophobicContact CG1-CG 4.32Å; C454-F462 CarbonylContact O-C 3.56Å; C454-F462 WeakPolarHBondContact O-CA 3.45Å; Y455-F462 AromaticContact CD2-CD1 3.63Å; Y455-F462 HydrophobicContact CD2-CD1 3.63Å; Y455-F462 AromaticContact CD2-CE1 3.2Å; Y455-F462 HydrophobicContact CD2-CE1 3.2Å; Y455-F462 HydrophobicContact CD2-CE2 4.24Å; Y455-F462 HydrophobicContact CD2-CG 4.31Å; Y455-F462 AromaticContact CD2-CZ 3.54Å; Y455-F462 HydrophobicContact CD2-CZ 3.54Å; Y455-F462 AromaticContact CE2-CE1 3.92Å; Y455-F462 HydrophobicContact CE2-CE1 3.92Å; Y455-F462 HydrophobicContact CE2-CE2 4.38Å; Y455-F462 AromaticContact CE2-CZ 3.78Å; Y455-F462 HydrophobicContact CE2-CZ 3.78Å; Y455-F462 HydrophobicContact CG-CD1 4.07Å; Y455-F462 AromaticContact CG-CE1 3.64Å; Y455-F462 HydrophobicContact CG-CE1 3.64Å; Y455-F462 HydrophobicContact CG-CZ 4.33Å
463	T	85.7	Confident	73.3	Confident	78 Å²	78	76.1 Å²	76.1	48%	0.479	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.3	172.4	-52.4	0	0	0	0	108.9	C454 L465	C454-T463 PolarHBondContact N-O 2.94Å; C454-T463 PolarHBondContact O-N 3.25Å; T463-L465 HydrophobicContact CG2-CD2 4.44Å
464	R	80.3	Confident	71.5	Confident	170 Å²	170	81 Å²	81	64%	0.642	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	118.6	175.7	-169.9	175.7	-174.4	-170.2	1	109.3	S451	S451-R464 PolarHBondContact OG-NE 3.48Å; S451-R464 PolarHBondContact OG-NH2 2.87Å
465	L	74.9	Confident	69.9	Low	40 Å²	40	85.4 Å²	85.4	21%	0.209	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.5	175	-62.4	174	0	0	0	108.1	F444 L452 C454 T463 F504	F444-L465 HydrophobicContact CD1-CD1 4.31Å; F444-L465 HydrophobicContact CE1-CD1 3.82Å; L452-L465 HydrophobicContact CB-CB 4.48Å; L452-L465 HydrophobicContact CD2-CB 4.28Å; L452-L465 HydrophobicContact CD2-CD1 3.76Å; L452-L465 HydrophobicContact CG-CB 4.46Å; L452-L465 HydrophobicContact CG-CD1 4.25Å; L452-L465 PolarHBondContact O-N 3.39Å; C454-L465 HydrophobicContact CB-CD1 4.3Å; T463-L465 HydrophobicContact CG2-CD2 4.44Å; L465-F504 HydrophobicContact CD1-CD1 4.45Å; L465-F504 HydrophobicContact CD1-CE1 3.85Å; L465-F504 HydrophobicContact CD1-CE2 4.4Å; L465-F504 HydrophobicContact CD1-CZ 3.81Å; L465-F504 HydrophobicContact CD2-CZ 4.47Å
466	R	63.2	Low	68.4	Low	230 Å²	230	85.9 Å²	85.9	87%	0.868	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-93.1	124.6	172.3	-63.1	-169.3	-148.6	-176.8	7	108.3
467	F	64.1	Low	67.1	Low	20 Å²	20	89 Å²	89	9%	0.088	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-88.6	163.6	172	-71.1	-79.3	0	0	0	111.2	L452 W471 L502 F504 V511	L452-F467 HydrophobicContact CB-CD2 4.34Å; L452-F467 HydrophobicContact CB-CE2 3.48Å; L452-F467 VanDerWaalsContact CB-CE2 3.48Å; L452-F467 HydrophobicContact CB-CZ 4.3Å; L452-F467 HydrophobicContact CD2-CE2 3.4Å; L452-F467 HydrophobicContact CD2-CZ 3.3Å; L452-F467 HydrophobicContact CG-CE2 4.06Å; L452-F467 HydrophobicContact CG-CZ 4.41Å; F467-W471 HydrophobicContact CB-CD2 3.8Å; F467-W471 HydrophobicContact CB-CE3 4.24Å; F467-W471 HydrophobicContact CB-CG 4.06Å; F467-W471 HydrophobicContact CB-CZ2 4.35Å; F467-W471 AromaticContact CD2-CD2 3.97Å; F467-W471 HydrophobicContact CD2-CD2 3.97Å; F467-W471 AromaticContact CD2-CE2 3.41Å; F467-W471 VanDerWaalsContact CD2-CE2 3.41Å; F467-W471 HydrophobicContact CD2-CE3 4.03Å; F467-W471 AromaticContact CD2-CH2 3.24Å; F467-W471 HydrophobicContact CD2-CH2 3.24Å; F467-W471 AromaticContact CD2-CZ2 3.08Å; F467-W471 HydrophobicContact CD2-CZ2 3.08Å; F467-W471 AromaticContact CD2-CZ3 3.63Å; F467-W471 HydrophobicContact CD2-CZ3 3.63Å; F467-W471 AromaticContact CE2-CH2 3.55Å; F467-W471 HydrophobicContact CE2-CH2 3.55Å; F467-W471 AromaticContact CE2-CZ2 3.42Å; F467-W471 HydrophobicContact CE2-CZ2 3.42Å; F467-W471 VanDerWaalsContact CE2-CZ2 3.42Å; F467-W471 HydrophobicContact CE2-CZ3 4.32Å; F467-W471 HydrophobicContact CG-CD2 4.31Å; F467-W471 AromaticContact CG-CE2 3.85Å; F467-W471 HydrophobicContact CG-CH2 4.38Å; F467-W471 AromaticContact CG-CZ2 3.96Å; F467-W471 HydrophobicContact CG-CZ2 3.96Å; F467-L502 HydrophobicContact CB-CD1 4.49Å; F467-L502 HydrophobicContact CD1-CD1 4Å; F467-L502 HydrophobicContact CE1-CD1 4.35Å; F467-L502 HydrophobicContact CG-CD1 4.18Å; F467-F504 HydrophobicContact CE1-CB 4.39Å; F467-V511 HydrophobicContact CD1-CB 4.42Å; F467-V511 HydrophobicContact CD1-CG1 3.77Å; F467-V511 HydrophobicContact CD1-CG2 3.74Å; F467-V511 HydrophobicContact CE1-CG1 3.99Å; F467-V511 HydrophobicContact CE1-CG2 3.72Å
468	P	54.6	Low	66.4	Low	70 Å²	70	89.1 Å²	89.1	46%	0.455	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-53.8	160	177	-24.1	33.8	0	0	0	112.7	V470 W471	P468-V470 PolarHBondContact O-N 2.92Å; P468-W471 PolarHBondContact O-N 3.47Å
469	E	52	Low	65.7	Low	179 Å²	179	83 Å²	83	84%	0.836	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-48.5	-13.6	-173.7	-67.6	179.3	161	0	0	116.3	W471 S472	E469-W471 PolarHBondContact O-N 2.91Å; E469-S472 PolarHBondContact O-N 3.06Å; E469-S472 VanDerWaalsContact O-N 3.14Å; E469-S472 PolarHBondContact O-OG 2.72Å; E469-S472 VanDerWaalsContact O-OG 3.12Å
470	V	51.5	Low	65.2	Low	97 Å²	97	77.5 Å²	77.5	59%	0.588	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-57.7	-16.3	174.5	-167.1	0	0	0	0	113.5	P468	P468-V470 PolarHBondContact O-N 2.92Å
471	W	55.2	Low	64.5	Low	17 Å²	17	73.3 Å²	73.3	6%	0.064	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-73	-19.6	174.9	-88.5	22.8	0	0	0	114.9	D450 S451 L452 F467 P468 E469 C473 W478	D450-W471 HydrophobicContact CB-CB 4.44Å; D450-W471 HydrophobicContact CB-CD2 4.48Å; D450-W471 HydrophobicContact CB-CE3 3.8Å; D450-W471 HydrophobicContact CB-CZ3 4.43Å; D450-W471 VanDerWaalsContact O-CE3 3.23Å; D450-W471 WeakPolarHBondContact O-CZ3 3.46Å; S451-W471 VanDerWaalsContact CA-CZ3 3.45Å; L452-W471 HydrophobicContact CB-CH2 3.89Å; L452-W471 VanDerWaalsContact N-CH2 3.32Å; F467-W471 HydrophobicContact CB-CD2 3.8Å; F467-W471 HydrophobicContact CB-CE3 4.24Å; F467-W471 HydrophobicContact CB-CG 4.06Å; F467-W471 HydrophobicContact CB-CZ2 4.35Å; F467-W471 AromaticContact CD2-CD2 3.97Å; F467-W471 HydrophobicContact CD2-CD2 3.97Å; F467-W471 AromaticContact CD2-CE2 3.41Å; F467-W471 VanDerWaalsContact CD2-CE2 3.41Å; F467-W471 HydrophobicContact CD2-CE3 4.03Å; F467-W471 AromaticContact CD2-CH2 3.24Å; F467-W471 HydrophobicContact CD2-CH2 3.24Å; F467-W471 AromaticContact CD2-CZ2 3.08Å; F467-W471 HydrophobicContact CD2-CZ2 3.08Å; F467-W471 AromaticContact CD2-CZ3 3.63Å; F467-W471 HydrophobicContact CD2-CZ3 3.63Å; F467-W471 AromaticContact CE2-CH2 3.55Å; F467-W471 HydrophobicContact CE2-CH2 3.55Å; F467-W471 AromaticContact CE2-CZ2 3.42Å; F467-W471 HydrophobicContact CE2-CZ2 3.42Å; F467-W471 VanDerWaalsContact CE2-CZ2 3.42Å; F467-W471 HydrophobicContact CE2-CZ3 4.32Å; F467-W471 HydrophobicContact CG-CD2 4.31Å; F467-W471 AromaticContact CG-CE2 3.85Å; F467-W471 HydrophobicContact CG-CH2 4.38Å; F467-W471 AromaticContact CG-CZ2 3.96Å; F467-W471 HydrophobicContact CG-CZ2 3.96Å; P468-W471 PolarHBondContact O-N 3.47Å; E469-W471 PolarHBondContact O-N 2.91Å; W471-C473 VanDerWaalsContact C-N 3.33Å; W471-C473 PolarHBondContact O-N 3.35Å; W471-C473 VanDerWaalsContact O-N 3.08Å; W471-W478 AromaticContact CD1-CH2 3.88Å; W471-W478 AromaticContact CD1-CZ2 4Å; W471-W478 HydrophobicContact CG-CZ2 4.37Å; W471-W478 AromaticContact NE1-CH2 3.62Å; W471-W478 AromaticContact NE1-CZ2 3.87Å
472	S	46.8	Very low	63.7	Low	87 Å²	87	71.9 Å²	71.9	61%	0.608	37%	0.372	S	S	*	.			trans	-82.6	14.2	-158.9	71.6	0	0	0	0	117.5	E469	E469-S472 PolarHBondContact O-N 3.06Å; E469-S472 VanDerWaalsContact O-N 3.14Å; E469-S472 PolarHBondContact O-OG 2.72Å; E469-S472 VanDerWaalsContact O-OG 3.12Å
473	C	47.5	Very low	62.5	Low	88 Å²	88	69.8 Å²	69.8	60%	0.595	37%	0.365	S	S	*	.	S	Bend	trans	-123.2	90.3	-176.9	-78.6	0	0	0	0	111.3	W471 R491	W471-C473 VanDerWaalsContact C-N 3.33Å; W471-C473 PolarHBondContact O-N 3.35Å; W471-C473 VanDerWaalsContact O-N 3.08Å; C473-R491 PolarHBondContact O-NH2 2.9Å
474	V	48.6	Very low	61.3	Low	106 Å²	106	67.2 Å²	67.2	64%	0.642	35%	0.348	S	S	*	.	S	Bend	trans	85.5	126	170.6	-166.1	0	0	0	0	114.9	S476 R491	V474-S476 PolarHBondContact O-N 3.06Å; V474-R491 PolarHBondContact O-NH2 2.93Å
475	P	52.7	Low	60.5	Low	104 Å²	104	61 Å²	61	68%	0.675	34%	0.337	S	S	*	.			trans	-56.6	115.7	172.9	22.3	-31.6	0	0	0	109.5
476	S	56.6	Low	60.2	Low	10 Å²	10	59.3 Å²	59.3	7%	0.07	33%	0.328	C	S	.	.			trans	-117.4	150.9	179	51.7	0	0	0	0	110.5	V474 W478 R491	V474-S476 PolarHBondContact O-N 3.06Å; S476-W478 PolarHBondContact O-N 3.11Å; S476-W478 PolarHBondContact O-NE1 3.37Å; S476-W478 VanDerWaalsContact OG-CE2 3.23Å; S476-W478 PolarHBondContact OG-NE1 2.72Å; S476-R491 VanDerWaalsContact CB-NE 3.29Å; S476-R491 WeakPolarHBondContact OG-CG 3.37Å; S476-R491 PolarHBondContact OG-NE 3.37Å
477	F	61.1	Low	60.7	Low	96 Å²	96	48.3 Å²	48.3	42%	0.421	29%	0.287	S	S	.	.			trans	-68.5	117.4	167.1	-64.4	-88.9	0	0	0	108.9	E448 E492	E448-F477 VanDerWaalsContact CD-CE1 3.49Å; E448-F477 HydrophobicContact CG-CD1 3.8Å; E448-F477 HydrophobicContact CG-CE1 3.61Å; E448-F477 HydrophobicContact CG-CZ 4.33Å; E448-F477 WeakPolarHBondContact OE1-CE1 3.27Å; F477-E492 HydrophobicContact CB-CB 3.79Å; F477-E492 HydrophobicContact CB-CG 4.28Å; F477-E492 WeakPolarHBondContact CB-OE2 3.32Å; F477-E492 WeakPolarHBondContact O-CB 3.25Å; F477-E492 PolarHBondContact O-N 2.94Å
478	W	69.1	Low	61.2	Low	16 Å²	16	47.5 Å²	47.5	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	149	177	-64.3	100.3	0	0	0	109.9	V446 W471 S476 V489 F490 R491	V446-W478 HydrophobicContact CB-CB 4.19Å; V446-W478 HydrophobicContact CG1-CB 3.34Å; V446-W478 HydrophobicContact CG1-CG 4.01Å; W471-W478 AromaticContact CD1-CH2 3.88Å; W471-W478 AromaticContact CD1-CZ2 4Å; W471-W478 HydrophobicContact CG-CZ2 4.37Å; W471-W478 AromaticContact NE1-CH2 3.62Å; W471-W478 AromaticContact NE1-CZ2 3.87Å; S476-W478 PolarHBondContact O-N 3.11Å; S476-W478 PolarHBondContact O-NE1 3.37Å; S476-W478 VanDerWaalsContact OG-CE2 3.23Å; S476-W478 PolarHBondContact OG-NE1 2.72Å; W478-V489 HydrophobicContact CD2-CG1 4.49Å; W478-V489 HydrophobicContact CE3-CG1 3.8Å; W478-V489 HydrophobicContact CZ3-CG1 4.45Å; W478-F490 CarbonylContact C-O 3.47Å; W478-F490 WeakPolarHBondContact CA-O 3.42Å; W478-R491 HydrophobicContact CD2-CG 4.42Å; W478-R491 HydrophobicContact CE3-CB 3.91Å; W478-R491 HydrophobicContact CE3-CG 4.12Å; W478-R491 HydrophobicContact CH2-CB 4.14Å; W478-R491 HydrophobicContact CH2-CG 3.98Å; W478-R491 HydrophobicContact CZ2-CG 4.26Å; W478-R491 HydrophobicContact CZ3-CB 3.63Å; W478-R491 HydrophobicContact CZ3-CG 3.91Å
479	K	71.4	Confident	62.2	Low	13 Å²	13	44.1 Å²	44.1	6%	0.057	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	146.3	179.4	-52.4	-73.8	-168.4	178.8	0	108.4	H435 V489 F490 E492 W524 F526	H435-K479 HydrophobicContact CB-CD 4.5Å; H435-K479 WeakPolarHBondContact CD2-CD 3.45Å; H435-K479 VanDerWaalsContact CE1-CD 3.44Å; H435-K479 WeakPolarHBondContact CE1-CD 3.45Å; H435-K479 PolarHBondContact CE1-NZ 2.97Å; H435-K479 VanDerWaalsContact CG-CD 3.49Å; H435-K479 WeakPolarHBondContact ND1-CD 3.29Å; H435-K479 VanDerWaalsContact NE2-CD 3.3Å; H435-K479 WeakPolarHBondContact NE2-CD 3.24Å; H435-K479 PolarHBondContact NE2-NZ 3.49Å; K479-V489 CarbonylContact O-C 3.5Å; K479-V489 WeakPolarHBondContact O-CA 3.37Å; K479-F490 HydrophobicContact CB-CB 4.42Å; K479-F490 PolarHBondContact N-O 3.23Å; K479-F490 PolarHBondContact O-N 3.34Å; K479-E492 VanDerWaalsContact CE-OE2 3.27Å; K479-E492 WeakPolarHBondContact CE-OE2 3.37Å; K479-E492 IonicContact NZ-OE2 2.73Å; K479-W524 VanDerWaalsContact CE-O 3.23Å; K479-W524 WeakPolarHBondContact CE-O 3.41Å; K479-W524 PolarHBondContact NZ-O 2.8Å; K479-F526 HydrophobicContact CB-CD1 4.35Å; K479-F526 HydrophobicContact CB-CD2 3.34Å; K479-F526 HydrophobicContact CB-CE1 4.25Å; K479-F526 HydrophobicContact CB-CE2 3.23Å; K479-F526 HydrophobicContact CB-CG 3.91Å; K479-F526 HydrophobicContact CB-CZ 3.71Å; K479-F526 HydrophobicContact CD-CD2 3.78Å; K479-F526 HydrophobicContact CD-CE2 4.25Å; K479-F526 HydrophobicContact CG-CD2 3.36Å; K479-F526 HydrophobicContact CG-CE2 3.33Å; K479-F526 HydrophobicContact CG-CG 4.34Å; K479-F526 HydrophobicContact CG-CZ 4.27Å
480	V	74.9	Confident	63.1	Low	9 Å²	9	36 Å²	36	6%	0.055	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	145.9	-176.6	64	0	0	0	0	110.9	H435 A436 A437 F444 V446 L452 V487 Y488 V489	H435-V480 HydrophobicContact CB-CG1 4.18Å; H435-V480 WeakPolarHBondContact O-CG1 3.32Å; A436-V480 VanDerWaalsContact CA-CG1 3.49Å; A437-V480 HydrophobicContact CB-CG1 4.26Å; A437-V480 HydrophobicContact CB-CG2 4.21Å; F444-V480 HydrophobicContact CB-CG2 4.17Å; V446-V480 HydrophobicContact CG2-CB 3.7Å; V446-V480 HydrophobicContact CG2-CG1 3.97Å; V446-V480 HydrophobicContact CG2-CG2 4.32Å; L452-V480 HydrophobicContact CD1-CG2 4.48Å; V480-V487 HydrophobicContact CG2-CG1 3.47Å; V480-V487 VanDerWaalsContact CG2-CG1 3.47Å; V480-Y488 WeakPolarHBondContact CA-O 3.45Å; V480-V489 HydrophobicContact CG2-CG2 4.12Å
481	A	70.4	Confident	63.8	Low	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	143.1	-173.2	0	0	0	0	0	107.9	V487 Y488 F490 L528	A481-V487 CarbonylContact O-C 3.22Å; A481-V487 WeakPolarHBondContact O-CA 3.33Å; A481-Y488 PolarHBondContact N-O 2.91Å; A481-Y488 PolarHBondContact O-N 3.26Å; A481-F490 HydrophobicContact CB-CE2 4.03Å; A481-L528 HydrophobicContact CB-CD1 3.14Å; A481-L528 HydrophobicContact CB-CG 4.45Å
482	S	68.9	Low	63.7	Low	15 Å²	15	34.1 Å²	34.1	11%	0.105	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.4	176.9	170.8	0	0	0	0	108.5	A438 H439 S486 L528	A438-S482 WeakPolarHBondContact O-CB 3.48Å; A438-S482 PolarHBondContact O-OG 2.82Å; H439-S482 WeakPolarHBondContact CA-OG 3.35Å; H439-S482 VanDerWaalsContact CB-OG 3.31Å; H439-S482 WeakPolarHBondContact CB-OG 3.3Å; H439-S482 PolarHBondContact ND1-OG 3.11Å; S482-S486 CarbonylContact C-O 3.57Å; S482-S486 WeakPolarHBondContact CA-O 3.36Å; S482-L528 WeakPolarHBondContact O-CD2 3.44Å
483	C	63.2	Low	63.9	Low	21 Å²	21	38.6 Å²	38.6	14%	0.142	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	150.2	176.3	-152.6	0	0	0	0	112.8	V249 G485 S486 Y488	V249-C483 HydrophobicContact CB-CB 4.38Å; V249-C483 HydrophobicContact CG1-CB 3.66Å; V249-C483 WeakPolarHBondContact CG1-SG 3.38Å; V249-C483 HydrophobicContact CG2-CB 3.89Å; V249-C483 WeakPolarHBondContact CG2-SG 3.17Å; C483-G485 PolarHBondContact O-N 2.87Å; C483-S486 PolarHBondContact N-O 3.48Å; C483-S486 CarbonylContact O-C 3.45Å; C483-S486 WeakPolarHBondContact O-CA 3.29Å; C483-S486 PolarHBondContact O-N 3.03Å; C483-Y488 HydrophobicContact CB-CD2 4.47Å; C483-Y488 HydrophobicContact CB-CE2 4.23Å
484	N	60.4	Low	63.8	Low	24 Å²	24	36.9 Å²	36.9	13%	0.128	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	48.4	174.8	-62.3	6.6	0	0	0	114.5	E247 V249 S486	E247-N484 WeakPolarHBondContact CA-ND2 3.31Å; E247-N484 VanDerWaalsContact CB-ND2 3.31Å; E247-N484 WeakPolarHBondContact CB-ND2 3.45Å; E247-N484 WeakPolarHBondContact CB-OD1 3.46Å; E247-N484 PolarHBondContact N-ND2 3.5Å; E247-N484 PolarHBondContact O-ND2 3.44Å; E247-N484 PolarHBondContact OE2-OD1 3.3Å; V249-N484 HydrophobicContact CG2-CB 4.37Å; V249-N484 WeakPolarHBondContact CG2-ND2 3.49Å; V249-N484 WeakPolarHBondContact CG2-OD1 3.39Å; N484-S486 PolarHBondContact O-N 3.49Å; N484-S486 VanDerWaalsContact O-N 3.13Å
485	G	64.1	Low	63.3	Low	39 Å²	39	37.6 Å²	37.6	40%	0.402	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	2.9	-179.2	0	0	0	0	0	114.1	H439 C483 P506	H439-G485 VanDerWaalsContact CE1-CA 3.46Å; H439-G485 WeakPolarHBondContact CE1-CA 3.49Å; H439-G485 PolarHBondContact CE1-O 2.76Å; C483-G485 PolarHBondContact O-N 2.87Å; G485-P506 WeakPolarHBondContact O-CD 3.46Å
486	S	68.3	Low	62.4	Low	4 Å²	4	42 Å²	42	3%	0.028	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	160.8	-174.9	-60.2	0	0	0	0	112.4	S482 C483 N484 K503 F504	S482-S486 CarbonylContact C-O 3.57Å; S482-S486 WeakPolarHBondContact CA-O 3.36Å; C483-S486 PolarHBondContact N-O 3.48Å; C483-S486 CarbonylContact O-C 3.45Å; C483-S486 WeakPolarHBondContact O-CA 3.29Å; C483-S486 PolarHBondContact O-N 3.03Å; N484-S486 PolarHBondContact O-N 3.49Å; N484-S486 VanDerWaalsContact O-N 3.13Å; S486-K503 WeakPolarHBondContact OG-CE 3.36Å; S486-F504 CarbonylContact C-O 3.51Å; S486-F504 WeakPolarHBondContact CA-O 3.02Å
487	V	74.4	Confident	61.4	Low	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	124.1	175.3	178.2	0	0	0	0	108.5	H439 F444 V480 A481 F504 P506	H439-V487 HydrophobicContact CB-CG2 3.95Å; F444-V487 HydrophobicContact CB-CG1 4.11Å; F444-V487 HydrophobicContact CD1-CG1 4.3Å; F444-V487 HydrophobicContact CD1-CG2 4.28Å; F444-V487 HydrophobicContact CD2-CG2 3.75Å; F444-V487 HydrophobicContact CE1-CG2 4.4Å; F444-V487 HydrophobicContact CE2-CG2 3.92Å; F444-V487 HydrophobicContact CG-CG1 4.11Å; F444-V487 HydrophobicContact CG-CG2 3.94Å; F444-V487 HydrophobicContact CZ-CG2 4.23Å; V480-V487 HydrophobicContact CG2-CG1 3.47Å; V480-V487 VanDerWaalsContact CG2-CG1 3.47Å; A481-V487 CarbonylContact O-C 3.22Å; A481-V487 WeakPolarHBondContact O-CA 3.33Å; V487-F504 HydrophobicContact CB-CB 4.39Å; V487-F504 HydrophobicContact CB-CD1 4.22Å; V487-F504 PolarHBondContact N-O 3.42Å; V487-F504 PolarHBondContact O-N 3.5Å; V487-P506 HydrophobicContact CG2-CG 3.86Å
488	Y	73.8	Confident	60.5	Low	2 Å²	2	44.5 Å²	44.5	1%	0.008	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.3	179.4	-63.8	-96.9	0	0	0	110.1	C270 V480 A481 C483 F490 T501 L502 K503 I514	C270-Y488 PolarHBondContact SG-OH 3.46Å; V480-Y488 WeakPolarHBondContact CA-O 3.45Å; A481-Y488 PolarHBondContact N-O 2.91Å; A481-Y488 PolarHBondContact O-N 3.26Å; C483-Y488 HydrophobicContact CB-CD2 4.47Å; C483-Y488 HydrophobicContact CB-CE2 4.23Å; Y488-F490 HydrophobicContact CG-CZ 4.44Å; Y488-T501 HydrophobicContact CD1-CG2 4.19Å; Y488-L502 CarbonylContact C-O 3.47Å; Y488-L502 VanDerWaalsContact CA-O 3.29Å; Y488-L502 WeakPolarHBondContact CA-O 3.46Å; Y488-K503 HydrophobicContact CD1-CB 4.06Å; Y488-K503 HydrophobicContact CD1-CG 4.39Å; Y488-K503 HydrophobicContact CE1-CB 3.87Å; Y488-K503 HydrophobicContact CE1-CD 4.01Å; Y488-K503 HydrophobicContact CE1-CG 3.87Å; Y488-I514 HydrophobicContact CD1-CD1 4.36Å; Y488-I514 HydrophobicContact CE1-CD1 3.98Å
489	V	74.8	Confident	59.3	Low	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.5	177.4	-176.3	0	0	0	0	109.5	L452 W478 K479 V480 L502	L452-V489 HydrophobicContact CD2-CG2 4.44Å; W478-V489 HydrophobicContact CD2-CG1 4.49Å; W478-V489 HydrophobicContact CE3-CG1 3.8Å; W478-V489 HydrophobicContact CZ3-CG1 4.45Å; K479-V489 CarbonylContact O-C 3.5Å; K479-V489 WeakPolarHBondContact O-CA 3.37Å; V480-V489 HydrophobicContact CG2-CG2 4.12Å; V489-L502 HydrophobicContact CB-CB 4.47Å; V489-L502 PolarHBondContact N-O 3.08Å; V489-L502 PolarHBondContact O-N 2.81Å
490	F	70.6	Confident	58.8	Low	9 Å²	9	46.6 Å²	46.6	4%	0.039	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146	-174.4	-57.7	-89.8	0	0	0	111.5	I251 L268 W478 K479 A481 Y488 T501 F526	I251-F490 HydrophobicContact CD1-CE1 4.41Å; I251-F490 HydrophobicContact CD1-CE2 4Å; I251-F490 HydrophobicContact CD1-CZ 3.41Å; I251-F490 VanDerWaalsContact CD1-CZ 3.41Å; I251-F490 HydrophobicContact CG2-CE2 4.43Å; I251-F490 HydrophobicContact CG2-CZ 4.4Å; L268-F490 HydrophobicContact CD1-CE1 3.99Å; W478-F490 CarbonylContact C-O 3.47Å; W478-F490 WeakPolarHBondContact CA-O 3.42Å; K479-F490 HydrophobicContact CB-CB 4.42Å; K479-F490 PolarHBondContact N-O 3.23Å; K479-F490 PolarHBondContact O-N 3.34Å; A481-F490 HydrophobicContact CB-CE2 4.03Å; Y488-F490 HydrophobicContact CG-CZ 4.44Å; F490-T501 HydrophobicContact CD1-CG2 3.79Å; F490-T501 WeakPolarHBondContact CD1-OG1 3.46Å; F490-T501 HydrophobicContact CE1-CG2 3.32Å; F490-T501 WeakPolarHBondContact CE1-OG1 3.45Å; F490-T501 HydrophobicContact CZ-CG2 3.78Å; F490-F526 HydrophobicContact CB-CE2 4.35Å; F490-F526 HydrophobicContact CB-CZ 3.67Å; F490-F526 HydrophobicContact CD1-CZ 4.35Å; F490-F526 AromaticContact CD2-CE1 3.4Å; F490-F526 HydrophobicContact CD2-CE1 3.4Å; F490-F526 VanDerWaalsContact CD2-CE1 3.4Å; F490-F526 AromaticContact CD2-CZ 3.42Å; F490-F526 HydrophobicContact CD2-CZ 3.42Å; F490-F526 VanDerWaalsContact CD2-CZ 3.42Å; F490-F526 AromaticContact CE2-CE1 3.76Å; F490-F526 HydrophobicContact CE2-CE1 3.76Å; F490-F526 HydrophobicContact CE2-CZ 4.17Å; F490-F526 HydrophobicContact CG-CE1 4.01Å; F490-F526 AromaticContact CG-CZ 3.54Å; F490-F526 HydrophobicContact CG-CZ 3.54Å
491	R	67.3	Low	58.4	Low	51 Å²	51	46.2 Å²	46.2	19%	0.192	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	131.4	175.8	-158	178	-172	-165.6	-0.9	110.9	C473 V474 S476 W478	C473-R491 PolarHBondContact O-NH2 2.9Å; V474-R491 PolarHBondContact O-NH2 2.93Å; S476-R491 VanDerWaalsContact CB-NE 3.29Å; S476-R491 WeakPolarHBondContact OG-CG 3.37Å; S476-R491 PolarHBondContact OG-NE 3.37Å; W478-R491 HydrophobicContact CD2-CG 4.42Å; W478-R491 HydrophobicContact CE3-CB 3.91Å; W478-R491 HydrophobicContact CE3-CG 4.12Å; W478-R491 HydrophobicContact CH2-CB 4.14Å; W478-R491 HydrophobicContact CH2-CG 3.98Å; W478-R491 HydrophobicContact CZ2-CG 4.26Å; W478-R491 HydrophobicContact CZ3-CB 3.63Å; W478-R491 HydrophobicContact CZ3-CG 3.91Å
492	E	53.7	Low	58.3	Low	22 Å²	22	47 Å²	47	10%	0.103	26%	0.264	C	S	.	.	S	Bend	trans	-76.4	-24.9	-173.1	-179.5	157.2	-170.4	0	0	115.5	F477 K479 N523 W524	F477-E492 HydrophobicContact CB-CB 3.79Å; F477-E492 HydrophobicContact CB-CG 4.28Å; F477-E492 WeakPolarHBondContact CB-OE2 3.32Å; F477-E492 WeakPolarHBondContact O-CB 3.25Å; F477-E492 PolarHBondContact O-N 2.94Å; K479-E492 VanDerWaalsContact CE-OE2 3.27Å; K479-E492 WeakPolarHBondContact CE-OE2 3.37Å; K479-E492 IonicContact NZ-OE2 2.73Å; E492-N523 WeakPolarHBondContact OE1-CA 3.29Å; E492-N523 PolarHBondContact OE1-N 3.45Å; E492-W524 HydrophobicContact CG-CG 4.33Å; E492-W524 PolarHBondContact OE1-N 3.29Å
493	R	50.7	Low	58.5	Low	182 Å²	182	48 Å²	48	69%	0.687	27%	0.267	S	S	*	.			trans	-129.8	121.9	-178.6	-111.7	-179.1	179.4	163.2	1.1	110.3
494	C	44.6	Very low	59	Low	51 Å²	51	47.6 Å²	47.6	35%	0.345	26%	0.262	S	S	.	.			trans	-150.5	137.6	164	-91.1	0	0	0	0	113.5
495	T	37.8	Very low	59.6	Low	121 Å²	121	48.7 Å²	48.7	74%	0.742	27%	0.268	S	S	*	.			trans	-73.5	165.1	159	41.5	0	0	0	0	110.5	G497	T495-G497 PolarHBondContact O-N 2.97Å
496	K	34.6	Very low	59.9	Low	197 Å²	197	48.2 Å²	48.2	86%	0.857	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	124.2	-177.3	-85.2	179.7	174.4	175.4	0	112.8
497	G	35.5	Very low	59.9	Low	72 Å²	72	52.5 Å²	52.5	74%	0.742	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.6	-9.8	154.7	0	0	0	0	0	117.7	T495	T495-G497 PolarHBondContact O-N 2.97Å
498	D	41.8	Very low	59.6	Low	87 Å²	87	56.8 Å²	56.8	47%	0.465	32%	0.32	S	S	.	.	S	Bend	trans	-81.7	161.3	-178.8	-66.8	-28.7	0	0	0	112.9	H500	D498-H500 PolarHBondContact O-CD2 2.74Å; D498-H500 PolarHBondContact O-CE1 3.23Å; D498-H500 VanDerWaalsContact O-CG 3.28Å; D498-H500 PolarHBondContact O-ND1 2.9Å; D498-H500 PolarHBondContact O-NE2 2.81Å
499	A	45.1	Very low	59.4	Low	37 Å²	37	60.9 Å²	60.9	31%	0.306	35%	0.349	S	S	.	.			trans	-80.7	125.4	171.1	0	0	0	0	0	110.2	V513 K515	A499-V513 HydrophobicContact CB-CG1 3.24Å; A499-K515 HydrophobicContact CB-CG 4.49Å
500	H	60.4	Low	59	Low	35 Å²	35	63 Å²	63	16%	0.162	37%	0.367	C	S	.	.			trans	-110.7	-13.9	-155.2	-61.7	-54.1	0	0	0	115.6	D498 I517	D498-H500 PolarHBondContact O-CD2 2.74Å; D498-H500 PolarHBondContact O-CE1 3.23Å; D498-H500 VanDerWaalsContact O-CG 3.28Å; D498-H500 PolarHBondContact O-ND1 2.9Å; D498-H500 PolarHBondContact O-NE2 2.81Å; H500-I517 PolarHBondContact CD2-O 2.66Å
501	T	65.5	Low	59	Low	2 Å²	2	65 Å²	65	1%	0.012	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	130.2	-178	-56.4	0	0	0	0	109.6	I276 Y488 F490 I514 I517	I276-T501 HydrophobicContact CD1-CG2 3.74Å; Y488-T501 HydrophobicContact CD1-CG2 4.19Å; F490-T501 HydrophobicContact CD1-CG2 3.79Å; F490-T501 WeakPolarHBondContact CD1-OG1 3.46Å; F490-T501 HydrophobicContact CE1-CG2 3.32Å; F490-T501 WeakPolarHBondContact CE1-OG1 3.45Å; F490-T501 HydrophobicContact CZ-CG2 3.78Å; T501-I514 HydrophobicContact CG2-CD1 4.45Å; T501-I514 PolarHBondContact O-N 3.02Å; T501-I517 WeakPolarHBondContact OG1-CD1 3.43Å
502	L	69.6	Low	59	Low	16 Å²	16	65.5 Å²	65.5	8%	0.084	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.9	174.7	-61.5	174.4	0	0	0	108.2	F467 Y488 V489 V511 V513	F467-L502 HydrophobicContact CB-CD1 4.49Å; F467-L502 HydrophobicContact CD1-CD1 4Å; F467-L502 HydrophobicContact CE1-CD1 4.35Å; F467-L502 HydrophobicContact CG-CD1 4.18Å; Y488-L502 CarbonylContact C-O 3.47Å; Y488-L502 VanDerWaalsContact CA-O 3.29Å; Y488-L502 WeakPolarHBondContact CA-O 3.46Å; V489-L502 HydrophobicContact CB-CB 4.47Å; V489-L502 PolarHBondContact N-O 3.08Å; V489-L502 PolarHBondContact O-N 2.81Å; L502-V511 HydrophobicContact CD2-CG1 4.3Å; L502-V513 HydrophobicContact CD2-CB 4.35Å; L502-V513 HydrophobicContact CD2-CG1 4.45Å; L502-V513 HydrophobicContact CD2-CG2 3.77Å
503	K	72.7	Confident	59.6	Low	36 Å²	36	67.6 Å²	67.6	16%	0.157	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.3	167.7	174.4	-174.4	178.1	-172	0	107.3	D274 S486 Y488 V511 T512 I514	D274-K503 IonicContact OD1-NZ 3.99Å; D274-K503 PolarHBondContact OD1-NZ 2.97Å; D274-K503 IonicContact OD2-NZ 3.01Å; D274-K503 PolarHBondContact OD2-NZ 3.28Å; S486-K503 WeakPolarHBondContact OG-CE 3.36Å; Y488-K503 HydrophobicContact CD1-CB 4.06Å; Y488-K503 HydrophobicContact CD1-CG 4.39Å; Y488-K503 HydrophobicContact CE1-CB 3.87Å; Y488-K503 HydrophobicContact CE1-CD 4.01Å; Y488-K503 HydrophobicContact CE1-CG 3.87Å; K503-V511 WeakPolarHBondContact O-CA 3.28Å; K503-T512 WeakPolarHBondContact CB-OG1 3.41Å; K503-T512 PolarHBondContact N-O 3.3Å; K503-T512 PolarHBondContact O-N 3.31Å; K503-I514 HydrophobicContact CB-CD1 3.79Å; K503-I514 HydrophobicContact CB-CG1 4.38Å; K503-I514 HydrophobicContact CD-CD1 4.45Å
504	F	73.6	Confident	60.1	Low	12 Å²	12	59.4 Å²	59.4	5%	0.053	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	124.4	173.5	173.6	-111	0	0	0	107.9	F444 L465 F467 S486 V487 P506 V511	F444-F504 AromaticContact CE1-CD1 3.91Å; F444-F504 HydrophobicContact CE1-CD1 3.91Å; F444-F504 AromaticContact CE1-CE1 3.54Å; F444-F504 HydrophobicContact CE1-CE1 3.54Å; F444-F504 HydrophobicContact CZ-CD1 4.4Å; F444-F504 AromaticContact CZ-CE1 3.9Å; F444-F504 HydrophobicContact CZ-CE1 3.9Å; L465-F504 HydrophobicContact CD1-CD1 4.45Å; L465-F504 HydrophobicContact CD1-CE1 3.85Å; L465-F504 HydrophobicContact CD1-CE2 4.4Å; L465-F504 HydrophobicContact CD1-CZ 3.81Å; L465-F504 HydrophobicContact CD2-CZ 4.47Å; F467-F504 HydrophobicContact CE1-CB 4.39Å; S486-F504 CarbonylContact C-O 3.51Å; S486-F504 WeakPolarHBondContact CA-O 3.02Å; V487-F504 HydrophobicContact CB-CB 4.39Å; V487-F504 HydrophobicContact CB-CD1 4.22Å; V487-F504 PolarHBondContact N-O 3.42Å; V487-F504 PolarHBondContact O-N 3.5Å; F504-P506 HydrophobicContact CD1-CG 3.9Å; F504-P506 HydrophobicContact CE1-CB 3.94Å; F504-P506 HydrophobicContact CE1-CG 3.78Å; F504-P506 WeakPolarHBondContact O-CD 3.41Å; F504-V511 HydrophobicContact CD2-CG2 3.9Å
505	N	73.1	Confident	60.4	Low	47 Å²	47	65.4 Å²	65.4	25%	0.251	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	109.6	171.3	-178.8	-30.3	0	0	0	108.5	A507 T508 S509 A510	N505-A507 PolarHBondContact O-N 3.44Å; N505-A507 WeakPolarHBondContact OD1-CA 3.43Å; N505-A507 WeakPolarHBondContact OD1-CB 3.41Å; N505-A507 PolarHBondContact OD1-N 3.44Å; N505-T508 WeakPolarHBondContact CB-OG1 3.17Å; N505-T508 VanDerWaalsContact CG-OG1 3.3Å; N505-T508 PolarHBondContact O-N 3.34Å; N505-T508 PolarHBondContact OD1-N 3.32Å; N505-S509 VanDerWaalsContact O-CA 3.25Å; N505-S509 WeakPolarHBondContact O-CA 3.25Å; N505-S509 PolarHBondContact O-N 3.36Å; N505-A510 PolarHBondContact N-O 2.88Å
506	P	70	Confident	60.7	Low	30 Å²	30	62.7 Å²	62.7	20%	0.195	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-27.5	-179.3	-24.9	37.6	0	0	0	114	F444 G485 V487 F504	F444-P506 HydrophobicContact CE2-CG 4.28Å; F444-P506 HydrophobicContact CZ-CB 4.14Å; F444-P506 HydrophobicContact CZ-CG 3.91Å; G485-P506 WeakPolarHBondContact O-CD 3.46Å; V487-P506 HydrophobicContact CG2-CG 3.86Å; F504-P506 HydrophobicContact CD1-CG 3.9Å; F504-P506 HydrophobicContact CE1-CB 3.94Å; F504-P506 HydrophobicContact CE1-CG 3.78Å; F504-P506 WeakPolarHBondContact O-CD 3.41Å
507	A	68	Low	61.1	Low	93 Å²	93	53.7 Å²	53.7	77%	0.769	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-38.5	-179.5	0	0	0	0	0	112.5	N505	N505-A507 PolarHBondContact O-N 3.44Å; N505-A507 WeakPolarHBondContact OD1-CA 3.43Å; N505-A507 WeakPolarHBondContact OD1-CB 3.41Å; N505-A507 PolarHBondContact OD1-N 3.44Å
508	T	69	Low	61.3	Low	91 Å²	91	58.4 Å²	58.4	56%	0.558	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-8.3	-178.8	61.6	0	0	0	0	113.5	N505 A510	N505-T508 WeakPolarHBondContact CB-OG1 3.17Å; N505-T508 VanDerWaalsContact CG-OG1 3.3Å; N505-T508 PolarHBondContact O-N 3.34Å; N505-T508 PolarHBondContact OD1-N 3.32Å; T508-A510 PolarHBondContact O-N 2.62Å; T508-A510 VanDerWaalsContact OG1-CB 3.26Å; T508-A510 WeakPolarHBondContact OG1-CB 3.29Å; T508-A510 PolarHBondContact OG1-N 3.11Å
509	S	69.6	Low	61.4	Low	87 Å²	87	56 Å²	56	61%	0.608	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	15.6	-167	-60.3	0	0	0	0	114	N505	N505-S509 VanDerWaalsContact O-CA 3.25Å; N505-S509 WeakPolarHBondContact O-CA 3.25Å; N505-S509 PolarHBondContact O-N 3.36Å
510	A	66.1	Low	61	Low	45 Å²	45	61.3 Å²	61.3	37%	0.372	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	135.3	178.8	0	0	0	0	0	110.1	N505 T508	N505-A510 PolarHBondContact N-O 2.88Å; T508-A510 PolarHBondContact O-N 2.62Å; T508-A510 VanDerWaalsContact OG1-CB 3.26Å; T508-A510 WeakPolarHBondContact OG1-CB 3.29Å; T508-A510 PolarHBondContact OG1-N 3.11Å
511	V	70.4	Confident	60.1	Low	51 Å²	51	60 Å²	60	31%	0.309	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.9	171.5	179.4	0	0	0	0	107.7	F467 L502 K503 F504	F467-V511 HydrophobicContact CD1-CB 4.42Å; F467-V511 HydrophobicContact CD1-CG1 3.77Å; F467-V511 HydrophobicContact CD1-CG2 3.74Å; F467-V511 HydrophobicContact CE1-CG1 3.99Å; F467-V511 HydrophobicContact CE1-CG2 3.72Å; L502-V511 HydrophobicContact CD2-CG1 4.3Å; K503-V511 WeakPolarHBondContact O-CA 3.28Å; F504-V511 HydrophobicContact CD2-CG2 3.9Å
512	T	68.3	Low	58.8	Low	61 Å²	61	61.4 Å²	61.4	37%	0.374	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	136.4	171	57.7	0	0	0	0	110.2	K503	K503-T512 WeakPolarHBondContact CB-OG1 3.41Å; K503-T512 PolarHBondContact N-O 3.3Å; K503-T512 PolarHBondContact O-N 3.31Å
513	V	65.8	Low	57.5	Low	66 Å²	66	66.6 Å²	66.6	40%	0.4	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	111.9	178.3	179.1	0	0	0	0	107.9	A499 L502	A499-V513 HydrophobicContact CB-CG1 3.24Å; L502-V513 HydrophobicContact CD2-CB 4.35Å; L502-V513 HydrophobicContact CD2-CG1 4.45Å; L502-V513 HydrophobicContact CD2-CG2 3.77Å
514	I	61.1	Low	56.4	Low	11 Å²	11	65.6 Å²	65.6	6%	0.056	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.2	178.3	-56.7	174.4	0	0	0	108.2	D274 I276 Y488 T501 K503	D274-I514 HydrophobicContact CB-CD1 4.43Å; D274-I514 VanDerWaalsContact O-CG2 3.25Å; D274-I514 WeakPolarHBondContact O-CG2 3.32Å; I276-I514 HydrophobicContact CD1-CB 4.46Å; I276-I514 HydrophobicContact CD1-CD1 3.73Å; I276-I514 HydrophobicContact CD1-CG2 3.98Å; I276-I514 HydrophobicContact CG1-CD1 4.31Å; I276-I514 HydrophobicContact CG1-CG2 4.1Å; Y488-I514 HydrophobicContact CD1-CD1 4.36Å; Y488-I514 HydrophobicContact CE1-CD1 3.98Å; T501-I514 HydrophobicContact CG2-CD1 4.45Å; T501-I514 PolarHBondContact O-N 3.02Å; K503-I514 HydrophobicContact CB-CD1 3.79Å; K503-I514 HydrophobicContact CB-CG1 4.38Å; K503-I514 HydrophobicContact CD-CD1 4.45Å
515	K	51	Low	55.1	Low	176 Å²	176	67.5 Å²	67.5	77%	0.765	39%	0.394	S	S	*	.			trans	-93.2	134.4	174	-64.9	-176.2	-175	-179.8	0	108.7	A499	A499-K515 HydrophobicContact CB-CG 4.49Å
516	G	43.6	Very low	53.9	Low	64 Å²	64	66.8 Å²	66.8	66%	0.66	39%	0.388	S	S	*	.			trans	141.7	-8.8	161.4	0	0	0	0	0	118	K518	G516-K518 PolarHBondContact O-N 3.36Å
517	I	42.5	Very low	52.5	Low	9 Å²	9	65.4 Å²	65.4	5%	0.046	38%	0.38	C	S	.	.			trans	-95	108.9	-174.5	-38.1	175.6	0	0	0	111.6	L268 I276 V278 H500 T501 I519	L268-I517 HydrophobicContact CD1-CD1 4.17Å; L268-I517 HydrophobicContact CD2-CG2 4.06Å; I276-I517 HydrophobicContact CB-CD1 3.45Å; I276-I517 VanDerWaalsContact CB-CD1 3.45Å; I276-I517 HydrophobicContact CB-CG1 3.71Å; I276-I517 HydrophobicContact CD1-CD1 3.67Å; I276-I517 HydrophobicContact CG1-CD1 4.13Å; I276-I517 HydrophobicContact CG2-CD1 3.23Å; I276-I517 HydrophobicContact CG2-CG1 3.8Å; V278-I517 HydrophobicContact CG2-CG2 3.97Å; H500-I517 PolarHBondContact CD2-O 2.66Å; T501-I517 WeakPolarHBondContact OG1-CD1 3.43Å; I517-I519 HydrophobicContact CB-CG1 4.41Å; I517-I519 HydrophobicContact CG2-CD1 3.41Å; I517-I519 VanDerWaalsContact CG2-CD1 3.41Å; I517-I519 HydrophobicContact CG2-CG1 3.33Å
518	K	41.1	Very low	51.1	Low	171 Å²	171	64 Å²	64	74%	0.743	36%	0.359	S	S	*	.			trans	-87.7	105.8	166.9	-71.7	175.8	-178	166.4	0	108.7	G516	G516-K518 PolarHBondContact O-N 3.36Å
519	I	43	Very low	49.5	Very low	36 Å²	36	60.8 Å²	60.8	19%	0.185	34%	0.341	C	S	.	.			trans	-125.1	111.3	172	-44.9	-169	0	0	0	109.8	L253 I266 L268 I517 L521 W524	L253-I519 HydrophobicContact CD1-CD1 3.09Å; I266-I519 HydrophobicContact CD1-CG2 3.59Å; L268-I519 HydrophobicContact CD1-CD1 4.22Å; L268-I519 HydrophobicContact CD2-CD1 3.62Å; L268-I519 HydrophobicContact CG-CD1 4.4Å; I517-I519 HydrophobicContact CB-CG1 4.41Å; I517-I519 HydrophobicContact CG2-CD1 3.41Å; I517-I519 VanDerWaalsContact CG2-CD1 3.41Å; I517-I519 HydrophobicContact CG2-CG1 3.33Å; I519-L521 VanDerWaalsContact C-N 3.32Å; I519-L521 HydrophobicContact CG2-CB 4.17Å; I519-L521 HydrophobicContact CG2-CD1 4.05Å; I519-L521 HydrophobicContact CG2-CG 3.88Å; I519-L521 PolarHBondContact O-N 3.3Å; I519-W524 HydrophobicContact CB-CH2 3.5Å; I519-W524 HydrophobicContact CB-CZ2 3.77Å; I519-W524 HydrophobicContact CD1-CH2 3.75Å; I519-W524 HydrophobicContact CD1-CZ3 4.34Å; I519-W524 HydrophobicContact CG1-CH2 4.15Å; I519-W524 HydrophobicContact CG2-CH2 3.27Å; I519-W524 HydrophobicContact CG2-CZ2 3.4Å; I519-W524 HydrophobicContact CG2-CZ3 4.37Å
520	L	37.4	Very low	48.5	Very low	148 Å²	148	59.5 Å²	59.5	78%	0.775	33%	0.328	S	S	*	.			trans	-92.5	56.2	177.4	-86.1	139.3	0	0	0	110.3
521	L	41.3	Very low	47.6	Very low	9 Å²	9	60.2 Å²	60.2	5%	0.047	33%	0.326	C	S	.	.			trans	-112.7	154.5	171.3	-65	179	0	0	0	109.7	E257 L264 I266 I519 W524	E257-L521 HydrophobicContact CB-CD2 3.91Å; E257-L521 HydrophobicContact CG-CD2 4.5Å; L264-L521 HydrophobicContact CB-CD1 4.07Å; L264-L521 HydrophobicContact CB-CD2 3.95Å; L264-L521 HydrophobicContact CD1-CD2 3.56Å; L264-L521 HydrophobicContact CG-CD2 4.38Å; I266-L521 HydrophobicContact CD1-CD1 3.38Å; I266-L521 HydrophobicContact CD1-CG 4.01Å; I266-L521 HydrophobicContact CG1-CD1 3.96Å; I519-L521 VanDerWaalsContact C-N 3.32Å; I519-L521 HydrophobicContact CG2-CB 4.17Å; I519-L521 HydrophobicContact CG2-CD1 4.05Å; I519-L521 HydrophobicContact CG2-CG 3.88Å; I519-L521 PolarHBondContact O-N 3.3Å; L521-W524 HydrophobicContact CB-CD2 4.4Å; L521-W524 HydrophobicContact CB-CZ2 3.69Å; L521-W524 PolarHBondContact O-NE1 3.17Å
522	T	38.3	Very low	46.3	Very low	31 Å²	31	60.7 Å²	60.7	19%	0.19	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	156.8	174.6	51.7	0	0	0	0	109.6	K256 E258	K256-T522 CarbonylContact C-O 3.5Å; K256-T522 PolarHBondContact N-O 3.12Å; K256-T522 CarbonylContact O-C 3.57Å; K256-T522 PolarHBondContact O-N 3.19Å; K256-T522 PolarHBondContact O-OG1 3.05Å; E258-T522 HydrophobicContact CG-CG2 3.82Å; E258-T522 WeakPolarHBondContact CG-OG1 3.02Å
523	N	42.2	Very low	45.1	Very low	124 Å²	124	60.7 Å²	60.7	66%	0.663	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.6	70.6	-179.2	-76.8	-8.8	0	0	0	113.8	E492	E492-N523 WeakPolarHBondContact OE1-CA 3.29Å; E492-N523 PolarHBondContact OE1-N 3.45Å
524	W	48.6	Very low	43.8	Very low	15 Å²	15	60.4 Å²	60.4	6%	0.057	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.1	-173.1	-63.1	55	0	0	0	110.9	L253 I254 K479 E492 I519 L521 F526	L253-W524 HydrophobicContact CB-CE3 3.61Å; L253-W524 HydrophobicContact CB-CH2 4.38Å; L253-W524 HydrophobicContact CB-CZ3 3.51Å; L253-W524 HydrophobicContact CD1-CE3 4.06Å; L253-W524 HydrophobicContact CD1-CH2 3.61Å; L253-W524 HydrophobicContact CD1-CZ3 3.1Å; L253-W524 HydrophobicContact CD2-CE3 3.66Å; L253-W524 HydrophobicContact CD2-CZ3 3.39Å; L253-W524 HydrophobicContact CG-CE3 3.93Å; L253-W524 HydrophobicContact CG-CH2 4.38Å; L253-W524 HydrophobicContact CG-CZ3 3.45Å; L253-W524 VanDerWaalsContact CG-CZ3 3.45Å; I254-W524 CarbonylContact O-C 3.47Å; I254-W524 WeakPolarHBondContact O-CA 3.25Å; K479-W524 VanDerWaalsContact CE-O 3.23Å; K479-W524 WeakPolarHBondContact CE-O 3.41Å; K479-W524 PolarHBondContact NZ-O 2.8Å; E492-W524 HydrophobicContact CG-CG 4.33Å; E492-W524 PolarHBondContact OE1-N 3.29Å; I519-W524 HydrophobicContact CB-CH2 3.5Å; I519-W524 HydrophobicContact CB-CZ2 3.77Å; I519-W524 HydrophobicContact CD1-CH2 3.75Å; I519-W524 HydrophobicContact CD1-CZ3 4.34Å; I519-W524 HydrophobicContact CG1-CH2 4.15Å; I519-W524 HydrophobicContact CG2-CH2 3.27Å; I519-W524 HydrophobicContact CG2-CZ2 3.4Å; I519-W524 HydrophobicContact CG2-CZ3 4.37Å; L521-W524 HydrophobicContact CB-CD2 4.4Å; L521-W524 HydrophobicContact CB-CZ2 3.69Å; L521-W524 PolarHBondContact O-NE1 3.17Å; W524-F526 HydrophobicContact CB-CD2 4.41Å; W524-F526 HydrophobicContact CB-CE2 4.48Å; W524-F526 AromaticContact CE3-CE2 3.74Å; W524-F526 HydrophobicContact CE3-CE2 3.74Å; W524-F526 HydrophobicContact CE3-CZ 4.33Å; W524-F526 HydrophobicContact CZ3-CE2 4.29Å; W524-F526 HydrophobicContact CZ3-CZ 4.47Å
525	Q	47.8	Very low	42.6	Very low	53 Å²	53	63.7 Å²	63.7	25%	0.248	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	114.1	157.9	-65.1	-162.8	-24.7	0	0	107.8	I254 I288 T289 A290	I254-Q525 WeakPolarHBondContact CB-O 2.91Å; I254-Q525 PolarHBondContact N-O 2.91Å; I254-Q525 PolarHBondContact O-N 2.97Å; I254-Q525 VanDerWaalsContact O-O 3.09Å; I288-Q525 PolarHBondContact O-OE1 2.8Å; T289-Q525 VanDerWaalsContact C-NE2 3.32Å; T289-Q525 PolarHBondContact O-NE2 3.49Å; T289-Q525 PolarHBondContact O-OE1 3.07Å; A290-Q525 VanDerWaalsContact N-OE1 3.1Å
526	F	46.2	Very low	42	Very low	31 Å²	31	55.6 Å²	55.6	14%	0.136	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.3	177.6	-101.5	-106.6	0	0	0	109.8	I251 L253 K479 F490 W524	I251-F526 HydrophobicContact CG2-CD1 4.28Å; I251-F526 HydrophobicContact CG2-CE1 3.85Å; L253-F526 HydrophobicContact CD2-CD1 4.08Å; L253-F526 HydrophobicContact CD2-CD2 4.35Å; L253-F526 HydrophobicContact CD2-CE1 3.39Å; L253-F526 HydrophobicContact CD2-CE2 3.69Å; L253-F526 HydrophobicContact CD2-CZ 3.18Å; K479-F526 HydrophobicContact CB-CD1 4.35Å; K479-F526 HydrophobicContact CB-CD2 3.34Å; K479-F526 HydrophobicContact CB-CE1 4.25Å; K479-F526 HydrophobicContact CB-CE2 3.23Å; K479-F526 HydrophobicContact CB-CG 3.91Å; K479-F526 HydrophobicContact CB-CZ 3.71Å; K479-F526 HydrophobicContact CD-CD2 3.78Å; K479-F526 HydrophobicContact CD-CE2 4.25Å; K479-F526 HydrophobicContact CG-CD2 3.36Å; K479-F526 HydrophobicContact CG-CE2 3.33Å; K479-F526 HydrophobicContact CG-CG 4.34Å; K479-F526 HydrophobicContact CG-CZ 4.27Å; F490-F526 HydrophobicContact CB-CE2 4.35Å; F490-F526 HydrophobicContact CB-CZ 3.67Å; F490-F526 HydrophobicContact CD1-CZ 4.35Å; F490-F526 AromaticContact CD2-CE1 3.4Å; F490-F526 HydrophobicContact CD2-CE1 3.4Å; F490-F526 VanDerWaalsContact CD2-CE1 3.4Å; F490-F526 AromaticContact CD2-CZ 3.42Å; F490-F526 HydrophobicContact CD2-CZ 3.42Å; F490-F526 VanDerWaalsContact CD2-CZ 3.42Å; F490-F526 AromaticContact CE2-CE1 3.76Å; F490-F526 HydrophobicContact CE2-CE1 3.76Å; F490-F526 HydrophobicContact CE2-CZ 4.17Å; F490-F526 HydrophobicContact CG-CE1 4.01Å; F490-F526 AromaticContact CG-CZ 3.54Å; F490-F526 HydrophobicContact CG-CZ 3.54Å; W524-F526 HydrophobicContact CB-CD2 4.41Å; W524-F526 HydrophobicContact CB-CE2 4.48Å; W524-F526 AromaticContact CE3-CE2 3.74Å; W524-F526 HydrophobicContact CE3-CE2 3.74Å; W524-F526 HydrophobicContact CE3-CZ 4.33Å; W524-F526 HydrophobicContact CZ3-CE2 4.29Å; W524-F526 HydrophobicContact CZ3-CZ 4.47Å
527	V	42.3	Very low	41.9	Very low	2 Å²	2	55 Å²	55	1%	0.012	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	105	158.2	-171	0	0	0	0	107.2	Y252 I254 A291 L298 A529	Y252-V527 PolarHBondContact N-O 2.93Å; Y252-V527 PolarHBondContact O-N 2.74Å; Y252-V527 VanDerWaalsContact O-N 3.15Å; Y252-V527 VanDerWaalsContact O-O 3.11Å; I254-V527 HydrophobicContact CD1-CG2 3.6Å; I254-V527 HydrophobicContact CG1-CG2 4.26Å; A291-V527 HydrophobicContact CB-CB 4.38Å; A291-V527 HydrophobicContact CB-CG2 3.06Å; L298-V527 HydrophobicContact CD1-CB 3.72Å; L298-V527 HydrophobicContact CD1-CG1 3.17Å; L298-V527 HydrophobicContact CD1-CG2 4.06Å; V527-A529 PolarHBondContact O-N 3.21Å
528	L	38.7	Very low	41.8	Very low	63 Å²	63	58.8 Å²	58.8	33%	0.33	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	120.8	164	-171.1	99.2	0	0	0	107.2	A481 S482	A481-L528 HydrophobicContact CB-CD1 3.14Å; A481-L528 HydrophobicContact CB-CG 4.45Å; S482-L528 WeakPolarHBondContact O-CD2 3.44Å
529	A	35.3	Very low	41.9	Very low	23 Å²	23	48.6 Å²	48.6	19%	0.19	26%	0.257	C	S	.	.			trans	-109.9	0	172.7	0	0	0	0	0	110.9	Y252 K293 M314 V527	Y252-A529 HydrophobicContact CD2-CB 3.44Å; Y252-A529 VanDerWaalsContact CD2-CB 3.44Å; Y252-A529 HydrophobicContact CE2-CB 3.72Å; K293-A529 VanDerWaalsContact CB-CA 3.48Å; K293-A529 HydrophobicContact CB-CB 3.77Å; K293-A529 HydrophobicContact CD-CB 3.59Å; K293-A529 WeakPolarHBondContact CD-OXT 3.45Å; K293-A529 WeakPolarHBondContact CE-OXT 3.24Å; K293-A529 HydrophobicContact CG-CB 4.1Å; K293-A529 PolarHBondContact NZ-O 3.05Å; K293-A529 PolarHBondContact NZ-OXT 3.15Å; M314-A529 HydrophobicContact CE-CB 3.6Å; V527-A529 PolarHBondContact O-N 3.21Å

Retrieved 529 of 529 residues in 1768.7 ms (Link to these results)

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