A0AA82MZB2_SCHMA Loading...

N-acetyltransferase domain-containing protein

AlphaFold DB (A0A5K4F2M1), UniProt , Accession A0AA82MZB2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 259 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	43.2	Very low	42.3	Very low	225 Å²	225	151.2 Å²	151.2	100%	1.108	77%	0.771	S	S	*	*				0	55.6	0	-146.1	172.7	93.2	0	0	107.5
2	Y	40.2	Very low	41.7	Very low	230 Å²	230	151.2 Å²	151.2	90%	0.902	77%	0.773	S	S	*	*				51.2	87.8	96.5	-65.1	-66.7	0	0	0	111.8
3	A	38.1	Very low	41.2	Very low	79 Å²	79	156.8 Å²	156.8	65%	0.653	78%	0.779	S	S	*	*				80.5	106	83.7	0	0	0	0	0	112.6
4	Y	43.1	Very low	40.8	Very low	227 Å²	227	153.1 Å²	153.1	89%	0.89	77%	0.769	S	S	*	*			trans	-151.1	101.9	142.1	-99.1	-75.2	0	0	0	109.8
5	I	45.9	Very low	41	Very low	141 Å²	141	154.3 Å²	154.3	72%	0.723	78%	0.776	S	S	*	*			trans	-86	130.5	162.4	-74.1	159.6	0	0	0	106.7	I7	I5-I7 HydrophobicContact CG2-CD1 4.19Å; I5-I7 HydrophobicContact CG2-CG1 3.88Å
6	F	44.3	Very low	41	Very low	179 Å²	179	153.8 Å²	153.8	79%	0.785	77%	0.773	S	S	*	*			trans	-154.9	94.3	152.7	-108.2	-84.4	0	0	0	106.3
7	I	47.8	Very low	40.8	Very low	119 Å²	119	150.5 Å²	150.5	61%	0.61	77%	0.768	S	S	*	*				82.9	133.1	76.7	-70.3	164	0	0	0	112.1	I5	I5-I7 HydrophobicContact CG2-CD1 4.19Å; I5-I7 HydrophobicContact CG2-CG1 3.88Å
8	C	36.7	Very low	40.4	Very low	102 Å²	102	148.5 Å²	148.5	69%	0.689	77%	0.77	S	S	*	*			trans	85.8	93	173.7	-69.4	0	0	0	0	116.3
9	A	36.1	Very low	40.5	Very low	87 Å²	87	146.3 Å²	146.3	72%	0.719	77%	0.765	S	S	*	*			cis	43.5	105.1	33	0	0	0	0	0	112.5
10	I	45.8	Very low	40.3	Very low	144 Å²	144	148.6 Å²	148.6	74%	0.738	77%	0.769	S	S	*	*			trans	164.1	113	148.7	-86.1	156.3	0	0	0	108.7
11	I	44.1	Very low	40.1	Very low	130 Å²	130	150.7 Å²	150.7	67%	0.667	77%	0.772	S	S	*	*			trans	81.1	76	155.1	-52.2	163	0	0	0	115.4
12	L	35.4	Very low	39.9	Very low	151 Å²	151	145.3 Å²	145.3	79%	0.791	75%	0.752	S	S	*	*	S	Bend		1.7	115.2	82.6	-110	90.8	0	0	0	116.8
13	R	34.9	Very low	39.8	Very low	224 Å²	224	139.7 Å²	139.7	85%	0.845	74%	0.744	S	S	*	*	S	Bend	trans	55.1	94.3	149.4	-63	-177.7	177.6	-170.1	-1	116.4
14	T	36.1	Very low	39.7	Very low	105 Å²	105	141.4 Å²	141.4	64%	0.644	75%	0.746	S	S	*	*			trans	175.1	94.9	142.5	23	0	0	0	0	111.4	M16	T14-M16 HydrophobicContact CG2-CG 4.38Å
15	I	43.2	Very low	39.1	Very low	172 Å²	172	137.1 Å²	137.1	88%	0.882	74%	0.743	S	S	*	*			trans	-144.4	78.8	149.2	-55.2	-179.9	0	0	0	103.4
16	M	40.3	Very low	38.7	Very low	145 Å²	145	135.7 Å²	135.7	71%	0.714	74%	0.741	S	S	*	*				43.7	96.6	73.5	-74	-159	79.4	0	0	113.4	T14	T14-M16 HydrophobicContact CG2-CG 4.38Å
17	S	38.2	Very low	38	Very low	99 Å²	99	132 Å²	132	69%	0.692	74%	0.738	S	S	*	*			trans	75.7	105.1	132.7	-51.8	0	0	0	0	118.2
18	S	34.4	Very low	37.5	Very low	114 Å²	114	137.1 Å²	137.1	80%	0.797	75%	0.751	S	S	*	*			trans	-44	132.2	161.7	-43.5	0	0	0	0	113
19	P	42.4	Very low	37.4	Very low	106 Å²	106	136.8 Å²	136.8	69%	0.688	75%	0.75	S	S	*	*			trans	-86.4	114.4	151.4	25.9	-13.8	0	0	0	108.1	F21	P19-F21 PolarHBondContact O-N 3.18Å
20	K	35.3	Very low	37.3	Very low	193 Å²	193	140.1 Å²	140.1	84%	0.839	76%	0.755	S	S	*	*			trans	-58.6	105	162.7	-71.5	175.7	176.8	175.9	0	107.7	V22	K20-V22 PolarHBondContact O-N 3.44Å
21	F	37.1	Very low	36.5	Very low	192 Å²	192	136.3 Å²	136.3	84%	0.842	75%	0.752	S	S	*	*			trans	-76.3	102.8	165.5	-101.4	-88.4	0	0	0	108.4	P19	P19-F21 PolarHBondContact O-N 3.18Å
22	V	38.2	Very low	36.1	Very low	112 Å²	112	138.1 Å²	138.1	68%	0.679	76%	0.762	S	S	*	*			trans	-91.4	112.2	162.8	177.7	0	0	0	0	106.2	K20 V24	K20-V22 PolarHBondContact O-N 3.44Å; V22-V24 PolarHBondContact O-N 3.23Å
23	P	38.1	Very low	36	Very low	112 Å²	112	140 Å²	140	73%	0.727	76%	0.764	S	S	*	*			trans	-80.1	118.8	163.6	19	-5.1	0	0	0	107.7	V25	P23-V25 PolarHBondContact O-N 3.46Å
24	V	36.8	Very low	35.7	Very low	115 Å²	115	134.8 Å²	134.8	70%	0.697	76%	0.761	S	S	*	*			trans	-54.8	116	174.5	171.4	0	0	0	0	109.8	V22 T26	V22-V24 PolarHBondContact O-N 3.23Å; V24-T26 HydrophobicContact CG1-CG2 4.08Å; V24-T26 PolarHBondContact O-N 3.07Å
25	V	30.6	Very low	35.6	Very low	137 Å²	137	138 Å²	138	83%	0.83	77%	0.769	S	S	*	*			trans	-68.4	104.7	162.9	177.1	0	0	0	0	107	P23	P23-V25 PolarHBondContact O-N 3.46Å
26	T	36	Very low	34.9	Very low	111 Å²	111	137.2 Å²	137.2	68%	0.681	77%	0.767	S	S	*	*			trans	-102.2	103.3	160.6	28.2	0	0	0	0	107.4	V24 Y28	V24-T26 HydrophobicContact CG1-CG2 4.08Å; V24-T26 PolarHBondContact O-N 3.07Å; T26-Y28 PolarHBondContact O-N 3.22Å
27	S	30.9	Very low	34.5	Very low	103 Å²	103	135.5 Å²	135.5	72%	0.72	77%	0.765	S	S	*	*			trans	-71.7	119.4	168.7	61.8	0	0	0	0	108.9
28	Y	36.4	Very low	34.1	Very low	226 Å²	226	140.3 Å²	140.3	89%	0.886	77%	0.768	S	S	*	*			trans	-111.2	117.7	153	-86.2	-83.1	0	0	0	108.1	T26	T26-Y28 PolarHBondContact O-N 3.22Å
29	S	35.2	Very low	33.9	Very low	95 Å²	95	141.7 Å²	141.7	66%	0.664	77%	0.765	S	S	*	*			trans	-89.6	141.3	-177.7	-166.9	0	0	0	0	110.2
30	N	33.6	Very low	33.3	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	76%	0.76	S	S	*	*			trans	73.2	110.1	154.6	-66.4	-20.2	0	0	0	120.1
31	G	29.2	Very low	33.5	Very low	65 Å²	65	138.2 Å²	138.2	67%	0.67	75%	0.749	S	S	*	*				118.8	96.9	124	0	0	0	0	0	114.2
32	L	35.4	Very low	33.7	Very low	168 Å²	168	131.6 Å²	131.6	88%	0.88	73%	0.727	S	S	*	*				178.9	111.8	126.3	-106	121.8	0	0	0	110.5
33	K	32.8	Very low	33.8	Very low	191 Å²	191	132.5 Å²	132.5	83%	0.83	73%	0.728	S	S	*	*			trans	26.2	112.8	141.9	-68.7	175.1	174.6	177.9	0	118.7
34	S	30.3	Very low	34.1	Very low	113 Å²	113	133.7 Å²	133.7	79%	0.79	72%	0.724	S	S	*	*				44.2	98.1	122.6	168.5	0	0	0	0	117.6
35	E	33.7	Very low	34.6	Very low	174 Å²	174	130 Å²	130	81%	0.813	70%	0.703	S	S	*	*				-165.1	107.5	129.1	-113.7	173.1	179.6	0	0	110.8	T37	E35-T37 VanDerWaalsContact C-N 3.25Å; E35-T37 PolarHBondContact O-N 2.86Å
36	D	28.7	Very low	36	Very low	154 Å²	154	132.1 Å²	132.1	82%	0.824	71%	0.71	S	S	*	*			trans	-70.5	73.8	179.3	-140.5	-15.6	0	0	0	109.7	R38	D36-R38 PolarHBondContact O-N 3.31Å; D36-R38 VanDerWaalsContact O-N 3.09Å
37	T	31.1	Very low	37.7	Very low	110 Å²	110	132.6 Å²	132.6	68%	0.675	70%	0.703	S	S	*	*			trans	-86.2	63.3	173.3	-49.3	0	0	0	0	110	E35 L39	E35-T37 VanDerWaalsContact C-N 3.25Å; E35-T37 PolarHBondContact O-N 2.86Å; T37-L39 HydrophobicContact CG2-CG 4.49Å; T37-L39 PolarHBondContact O-N 3.03Å; T37-L39 VanDerWaalsContact O-N 3.14Å
38	R	29.4	Very low	40.4	Very low	199 Å²	199	129 Å²	129	75%	0.751	68%	0.682	S	S	*	*			trans	-68	101	152.4	-91.2	-179.3	165.6	173.2	-2.8	106.7	D36 N40	D36-R38 PolarHBondContact O-N 3.31Å; D36-R38 VanDerWaalsContact O-N 3.09Å; R38-N40 PolarHBondContact O-N 2.89Å
39	L	30.6	Very low	43.1	Very low	143 Å²	143	118.9 Å²	118.9	75%	0.749	64%	0.643	S	S	*	*			trans	-62.3	66.5	161.3	-97.6	152.5	0	0	0	109.8	T37 L41	T37-L39 HydrophobicContact CG2-CG 4.49Å; T37-L39 PolarHBondContact O-N 3.03Å; T37-L39 VanDerWaalsContact O-N 3.14Å; L39-L41 VanDerWaalsContact C-N 3.25Å; L39-L41 HydrophobicContact CD2-CD1 3.85Å; L39-L41 PolarHBondContact O-N 3.39Å; L39-L41 VanDerWaalsContact O-N 3.12Å
40	N	30	Very low	45.9	Very low	110 Å²	110	115.5 Å²	115.5	59%	0.588	62%	0.618	S	S	*	*			trans	-79.4	78.1	164	-94.9	-21.8	0	0	0	107.6	R38 S42	R38-N40 PolarHBondContact O-N 2.89Å; N40-S42 PolarHBondContact O-N 3.12Å
41	L	39.9	Very low	48.8	Very low	116 Å²	116	109.7 Å²	109.7	61%	0.607	59%	0.586	S	S	*	*			trans	-73	60.5	157.6	-96.3	138.8	0	0	0	108.8	L39	L39-L41 VanDerWaalsContact C-N 3.25Å; L39-L41 HydrophobicContact CD2-CD1 3.85Å; L39-L41 PolarHBondContact O-N 3.39Å; L39-L41 VanDerWaalsContact O-N 3.12Å
42	S	40.9	Very low	51.9	Low	54 Å²	54	109.3 Å²	109.3	38%	0.378	57%	0.566	S	S	.	*			trans	-88.7	92.5	155.7	54.3	0	0	0	0	106.7	N40 Q44	N40-S42 PolarHBondContact O-N 3.12Å; S42-Q44 PolarHBondContact O-N 3.21Å
43	N	41.2	Very low	54.6	Low	131 Å²	131	103.3 Å²	103.3	70%	0.701	54%	0.537	S	S	*	.			trans	-66.2	84.9	153.3	-89.1	-15.1	0	0	0	106.1	S45	N43-S45 PolarHBondContact O-N 2.69Å
44	Q	42.5	Very low	57.5	Low	136 Å²	136	94.3 Å²	94.3	64%	0.636	50%	0.497	S	S	*	.			trans	-67.5	84	163.2	-154.4	176.7	10.2	0	0	105	S42	S42-Q44 PolarHBondContact O-N 3.21Å
45	S	48.6	Very low	60.4	Low	38 Å²	38	92.5 Å²	92.5	27%	0.266	48%	0.482	S	S	.	.	B	Isolated β-bridge	trans	-78.3	143.9	176.6	73.9	0	0	0	0	107.5	N43 K47	N43-S45 PolarHBondContact O-N 2.69Å; S45-K47 PolarHBondContact O-N 2.86Å; S45-K47 VanDerWaalsContact OG-CB 3.28Å; S45-K47 WeakPolarHBondContact OG-CB 3.44Å; S45-K47 VanDerWaalsContact OG-CG 3.3Å; S45-K47 WeakPolarHBondContact OG-CG 3.33Å
46	N	58.9	Low	63.1	Low	182 Å²	182	87 Å²	87	97%	0.973	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	12.3	169.5	-86.7	-6.9	0	0	0	114.6
47	K	72.6	Confident	66.1	Low	121 Å²	121	80.2 Å²	80.2	53%	0.526	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	2.3	-176.2	-51.9	-177.1	169	-159.4	0	113.5	S45 Y49 E175	S45-K47 PolarHBondContact O-N 2.86Å; S45-K47 VanDerWaalsContact OG-CB 3.28Å; S45-K47 WeakPolarHBondContact OG-CB 3.44Å; S45-K47 VanDerWaalsContact OG-CG 3.3Å; S45-K47 WeakPolarHBondContact OG-CG 3.33Å; K47-Y49 VanDerWaalsContact C-N 3.3Å; K47-Y49 HydrophobicContact CB-CD1 3.89Å; K47-Y49 HydrophobicContact CB-CE1 3.44Å; K47-Y49 VanDerWaalsContact CB-CE1 3.44Å; K47-Y49 HydrophobicContact CD-CE1 4.05Å; K47-Y49 VanDerWaalsContact CD-OH 3.28Å; K47-Y49 WeakPolarHBondContact CD-OH 3.21Å; K47-Y49 HydrophobicContact CG-CE1 4.43Å; K47-Y49 VanDerWaalsContact O-CD1 3.23Å; K47-Y49 WeakPolarHBondContact O-CD1 3.39Å; K47-Y49 PolarHBondContact O-N 3.03Å; K47-E175 WeakPolarHBondContact CD-OE1 3.49Å; K47-E175 IonicContact NZ-OE1 2.62Å
48	G	88	Confident	69	Low	28 Å²	28	77.9 Å²	77.9	29%	0.289	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	17.1	178.6	0	0	0	0	0	114.5	Q108 A109	G48-Q108 PolarHBondContact O-NE2 3.28Å; G48-Q108 PolarHBondContact O-OE1 3.03Å; G48-A109 VanDerWaalsContact C-CB 3.49Å; G48-A109 PolarHBondContact O-N 3.11Å
49	Y	92.4	Very high	72	Confident	13 Å²	13	70.5 Å²	70.5	5%	0.051	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	159.5	172.9	63.4	-93.4	0	0	0	112.1	K47 I51 T106 L107 I176 A179	K47-Y49 VanDerWaalsContact C-N 3.3Å; K47-Y49 HydrophobicContact CB-CD1 3.89Å; K47-Y49 HydrophobicContact CB-CE1 3.44Å; K47-Y49 VanDerWaalsContact CB-CE1 3.44Å; K47-Y49 HydrophobicContact CD-CE1 4.05Å; K47-Y49 VanDerWaalsContact CD-OH 3.28Å; K47-Y49 WeakPolarHBondContact CD-OH 3.21Å; K47-Y49 HydrophobicContact CG-CE1 4.43Å; K47-Y49 VanDerWaalsContact O-CD1 3.23Å; K47-Y49 WeakPolarHBondContact O-CD1 3.39Å; K47-Y49 PolarHBondContact O-N 3.03Å; Y49-I51 HydrophobicContact CD2-CG1 4.42Å; Y49-I51 HydrophobicContact CE2-CG1 4.31Å; Y49-T106 HydrophobicContact CD2-CG2 4.41Å; Y49-L107 CarbonylContact C-O 3.55Å; Y49-L107 WeakPolarHBondContact CA-O 3.27Å; Y49-L107 WeakPolarHBondContact CB-O 3.34Å; Y49-I176 HydrophobicContact CD1-CG1 4.4Å; Y49-I176 HydrophobicContact CE1-CG1 4.32Å; Y49-A179 HydrophobicContact CE2-CB 3.89Å; Y49-A179 WeakPolarHBondContact OH-CB 3.34Å
50	V	93.4	Very high	75	Confident	23 Å²	23	70.9 Å²	70.9	14%	0.139	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	140.8	172.7	-63.5	0	0	0	0	110.2	K52 T106 L107	V50-K52 HydrophobicContact CG2-CG 4.24Å; V50-T106 CarbonylContact O-C 3.52Å; V50-T106 VanDerWaalsContact O-CA 3.29Å; V50-T106 WeakPolarHBondContact O-CA 3.44Å; V50-L107 HydrophobicContact CG2-CB 4.03Å; V50-L107 PolarHBondContact N-O 3.28Å; V50-L107 PolarHBondContact O-N 3.1Å
51	I	94.8	Very high	78	Confident	35 Å²	35	69 Å²	69	18%	0.179	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	132.4	171.9	-52.2	-176.6	0	0	0	108.4	Y49 I105 T106 A179 Y183	Y49-I51 HydrophobicContact CD2-CG1 4.42Å; Y49-I51 HydrophobicContact CE2-CG1 4.31Å; I51-I105 WeakPolarHBondContact CA-O 3.22Å; I51-T106 HydrophobicContact CG1-CG2 3.97Å; I51-A179 HydrophobicContact CD1-CB 4.04Å; I51-Y183 HydrophobicContact CB-CD2 4.35Å; I51-Y183 HydrophobicContact CD1-CD2 4.42Å; I51-Y183 HydrophobicContact CD1-CG 4.37Å; I51-Y183 HydrophobicContact CG2-CD1 4.04Å; I51-Y183 HydrophobicContact CG2-CD2 3.79Å; I51-Y183 HydrophobicContact CG2-CE1 4.33Å; I51-Y183 HydrophobicContact CG2-CE2 4.08Å; I51-Y183 HydrophobicContact CG2-CG 3.77Å
52	K	94.2	Very high	80.5	Confident	56 Å²	56	63.4 Å²	63.4	24%	0.243	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	167	-179.1	-65.5	-70.4	-173.9	174.4	0	110	V50 S104 I105 L107	V50-K52 HydrophobicContact CG2-CG 4.24Å; K52-S104 CarbonylContact O-C 3.57Å; K52-S104 VanDerWaalsContact O-CA 3.25Å; K52-S104 WeakPolarHBondContact O-CA 3.35Å; K52-S104 WeakPolarHBondContact O-CB 3Å; K52-I105 HydrophobicContact CB-CG1 4.09Å; K52-I105 PolarHBondContact N-O 3.04Å; K52-I105 PolarHBondContact O-N 3.32Å; K52-L107 HydrophobicContact CG-CD1 4.24Å
53	T	92.9	Very high	83.1	Confident	43 Å²	43	60.9 Å²	60.9	26%	0.264	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	159	172.6	60.1	0	0	0	0	110.8	T55 S56 I105	T53-T55 PolarHBondContact O-N 3.48Å; T53-T55 PolarHBondContact OG1-OG1 3.14Å; T53-S56 WeakPolarHBondContact O-CB 3.21Å; T53-S56 PolarHBondContact O-N 2.86Å; T53-S56 PolarHBondContact O-OG 2.86Å; T53-S56 PolarHBondContact OG1-OG 2.71Å; T53-I105 WeakPolarHBondContact O-CG1 3.48Å
54	I	92.8	Very high	85.6	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-6.1	177.5	60.3	171	0	0	0	114.9	I62 W95 A98 S103 I105 L121	I54-I62 WeakPolarHBondContact O-CD1 3.42Å; I54-W95 HydrophobicContact CD1-CD2 4.48Å; I54-W95 HydrophobicContact CD1-CZ2 4.39Å; I54-W95 HydrophobicContact CG1-CZ2 4.4Å; I54-W95 PolarHBondContact O-NE1 2.93Å; I54-A98 HydrophobicContact CD1-CB 4Å; I54-S103 VanDerWaalsContact CG2-CB 3.48Å; I54-I105 HydrophobicContact CG2-CG2 4.16Å; I54-L121 HydrophobicContact CD1-CD2 4.09Å; I54-L121 HydrophobicContact CG2-CD2 3.84Å
55	T	91.9	Very high	88	Confident	75 Å²	75	51.9 Å²	51.9	46%	0.46	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-4.3	175.4	53.7	0	0	0	0	112.9	T53 A57 W95	T53-T55 PolarHBondContact O-N 3.48Å; T53-T55 PolarHBondContact OG1-OG1 3.14Å; T55-A57 VanDerWaalsContact C-N 3.31Å; T55-A57 PolarHBondContact O-N 3.09Å; T55-W95 HydrophobicContact CG2-CH2 4.5Å; T55-W95 HydrophobicContact CG2-CZ2 4.26Å
56	S	91.4	Very high	90.1	Very high	59 Å²	59	50.1 Å²	50.1	41%	0.413	27%	0.265	S	S	.	.	S	Bend	trans	-84.3	-0.8	-175.7	-60.9	0	0	0	0	114.3	T53	T53-S56 WeakPolarHBondContact O-CB 3.21Å; T53-S56 PolarHBondContact O-N 2.86Å; T53-S56 PolarHBondContact O-OG 2.86Å; T53-S56 PolarHBondContact OG1-OG 2.71Å
57	A	90.3	Very high	91.6	Very high	12 Å²	12	41.4 Å²	41.4	10%	0.099	22%	0.218	C	C	.	.	S	Bend	trans	-136.8	152.8	172.7	0	0	0	0	0	110	T55 L59 I62 I105	T55-A57 VanDerWaalsContact C-N 3.31Å; T55-A57 PolarHBondContact O-N 3.09Å; A57-L59 PolarHBondContact O-N 3.11Å; A57-I62 HydrophobicContact CB-CD1 4.08Å; A57-I62 HydrophobicContact CB-CG1 4.04Å; A57-I62 WeakPolarHBondContact O-CD1 3.46Å; A57-I105 HydrophobicContact CB-CD1 3.68Å
58	P	92.5	Very high	92.5	Very high	61 Å²	61	38.7 Å²	38.7	40%	0.396	21%	0.209	S	C	.	.			trans	-54.1	133.2	176	-26.8	33.7	0	0	0	112.5	Y60 R61 I62	P58-Y60 VanDerWaalsContact C-N 3.3Å; P58-Y60 HydrophobicContact CB-CD1 3.71Å; P58-Y60 HydrophobicContact CB-CE1 3.39Å; P58-Y60 HydrophobicContact CG-CE1 4.24Å; P58-Y60 PolarHBondContact O-N 3.21Å; P58-R61 HydrophobicContact CB-CG 4.29Å; P58-R61 WeakPolarHBondContact O-CB 3.17Å; P58-R61 PolarHBondContact O-N 2.83Å; P58-I62 PolarHBondContact O-N 3.12Å
59	L	93.2	Very high	92.6	Very high	43 Å²	43	39.4 Å²	39.4	23%	0.225	21%	0.206	C	C	.	.	H	α-helix	trans	-51.4	-46.2	-174.8	175.7	57.1	0	0	0	113.1	A57 R61 I62 V63 Y92 W95	A57-L59 PolarHBondContact O-N 3.11Å; L59-R61 PolarHBondContact O-N 3.48Å; L59-I62 PolarHBondContact O-N 3.06Å; L59-I62 VanDerWaalsContact O-N 3.09Å; L59-V63 HydrophobicContact CD1-CG2 3.66Å; L59-V63 HydrophobicContact CG-CG2 4.15Å; L59-V63 WeakPolarHBondContact O-CG2 3.33Å; L59-V63 PolarHBondContact O-N 3.41Å; L59-Y92 HydrophobicContact CD2-CD2 3.92Å; L59-Y92 HydrophobicContact CD2-CE2 3.41Å; L59-Y92 VanDerWaalsContact CD2-CE2 3.41Å; L59-Y92 HydrophobicContact CG-CD2 4.23Å; L59-Y92 HydrophobicContact CG-CE2 4.11Å; L59-W95 HydrophobicContact CD1-CB 4.08Å; L59-W95 HydrophobicContact CD1-CD2 3.31Å; L59-W95 HydrophobicContact CD1-CE3 3.71Å; L59-W95 HydrophobicContact CD1-CG 3.45Å; L59-W95 VanDerWaalsContact CD1-CG 3.45Å; L59-W95 HydrophobicContact CD1-CZ2 4.24Å; L59-W95 HydrophobicContact CD1-CZ3 4.34Å; L59-W95 HydrophobicContact CD2-CE3 4.16Å; L59-W95 HydrophobicContact CD2-CZ3 4.34Å
60	Y	93	Very high	92.4	Very high	151 Å²	151	39.1 Å²	39.1	59%	0.592	21%	0.206	S	C	*	.	H	α-helix	trans	-60.2	-32.7	-178.8	76.3	-88.8	0	0	0	112.6	P58 S64	P58-Y60 VanDerWaalsContact C-N 3.3Å; P58-Y60 HydrophobicContact CB-CD1 3.71Å; P58-Y60 HydrophobicContact CB-CE1 3.39Å; P58-Y60 HydrophobicContact CG-CE1 4.24Å; P58-Y60 PolarHBondContact O-N 3.21Å; Y60-S64 WeakPolarHBondContact O-CB 3.16Å; Y60-S64 PolarHBondContact O-N 3.29Å
61	R	93	Very high	91.9	Very high	70 Å²	70	40.6 Å²	40.6	26%	0.264	21%	0.212	S	C	.	.	H	α-helix	trans	-69.2	-42.6	175.9	-66.4	-177.4	62.8	-172.8	-1.4	110.9	P58 L59 Y65 E113 S114 L116	P58-R61 HydrophobicContact CB-CG 4.29Å; P58-R61 WeakPolarHBondContact O-CB 3.17Å; P58-R61 PolarHBondContact O-N 2.83Å; L59-R61 PolarHBondContact O-N 3.48Å; R61-Y65 VanDerWaalsContact O-CB 3.22Å; R61-Y65 WeakPolarHBondContact O-CB 3.39Å; R61-Y65 PolarHBondContact O-N 2.86Å; R61-E113 VanDerWaalsContact CZ-O 3.29Å; R61-E113 PolarHBondContact NH1-O 3.18Å; R61-E113 PolarHBondContact NH2-O 2.96Å; R61-S114 PolarHBondContact NH2-O 2.84Å; R61-S114 VanDerWaalsContact NH2-O 3.11Å; R61-L116 HydrophobicContact CB-CD1 4.27Å
62	I	92.9	Very high	91.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-48.5	178.7	-61.7	173.8	0	0	0	110.3	I54 A57 P58 L59 Y65 F66 I105 L116	I54-I62 WeakPolarHBondContact O-CD1 3.42Å; A57-I62 HydrophobicContact CB-CD1 4.08Å; A57-I62 HydrophobicContact CB-CG1 4.04Å; A57-I62 WeakPolarHBondContact O-CD1 3.46Å; P58-I62 PolarHBondContact O-N 3.12Å; L59-I62 PolarHBondContact O-N 3.06Å; L59-I62 VanDerWaalsContact O-N 3.09Å; I62-Y65 PolarHBondContact O-N 2.68Å; I62-F66 HydrophobicContact CG2-CD2 3.71Å; I62-F66 HydrophobicContact CG2-CE2 3.63Å; I62-F66 VanDerWaalsContact O-CD2 3.3Å; I62-F66 WeakPolarHBondContact O-CD2 3.43Å; I62-F66 PolarHBondContact O-N 3.14Å; I62-I105 HydrophobicContact CD1-CD1 4.41Å; I62-I105 HydrophobicContact CD1-CG2 4.21Å; I62-I105 HydrophobicContact CG1-CG2 4.37Å; I62-I105 HydrophobicContact CG2-CG2 4.48Å; I62-L116 HydrophobicContact CG1-CD1 4.19Å
63	V	94	Very high	90.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-45	-179.9	177.5	0	0	0	0	111	L59 Y65 F66 T67 Y88 I91 Y92	L59-V63 HydrophobicContact CD1-CG2 3.66Å; L59-V63 HydrophobicContact CG-CG2 4.15Å; L59-V63 WeakPolarHBondContact O-CG2 3.33Å; L59-V63 PolarHBondContact O-N 3.41Å; V63-Y65 VanDerWaalsContact C-N 3.33Å; V63-Y65 PolarHBondContact O-N 3.02Å; V63-F66 PolarHBondContact O-N 3.36Å; V63-T67 WeakPolarHBondContact O-CB 3.29Å; V63-T67 PolarHBondContact O-N 2.77Å; V63-T67 PolarHBondContact O-OG1 2.92Å; V63-Y88 HydrophobicContact CB-CE2 4.21Å; V63-Y88 HydrophobicContact CG1-CD1 3.86Å; V63-Y88 HydrophobicContact CG1-CD2 3.72Å; V63-Y88 HydrophobicContact CG1-CE1 3.71Å; V63-Y88 HydrophobicContact CG1-CE2 3.59Å; V63-Y88 HydrophobicContact CG1-CG 3.85Å; V63-Y88 WeakPolarHBondContact CG1-O 3.42Å; V63-I91 HydrophobicContact CB-CG2 4.38Å; V63-I91 HydrophobicContact CG1-CB 4.25Å; V63-I91 HydrophobicContact CG1-CG2 4.02Å; V63-I91 HydrophobicContact CG2-CG2 4.32Å; V63-Y92 HydrophobicContact CG2-CD2 4.22Å
64	S	93.7	Very high	90.1	Very high	43 Å²	43	45.4 Å²	45.4	30%	0.301	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-42.5	176.3	179.6	0	0	0	0	111.7	Y60 T67 N68	Y60-S64 WeakPolarHBondContact O-CB 3.16Å; Y60-S64 PolarHBondContact O-N 3.29Å; S64-T67 PolarHBondContact O-N 2.97Å; S64-N68 WeakPolarHBondContact O-CB 3.26Å; S64-N68 PolarHBondContact O-N 3.22Å; S64-N68 PolarHBondContact O-OD1 3.1Å
65	Y	93.8	Very high	89.5	Confident	36 Å²	36	46.8 Å²	46.8	14%	0.141	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-46.3	176.9	-178.6	-100.7	0	0	0	112.7	R61 I62 V63 L69 L116 N117 G118 A119 V170	R61-Y65 VanDerWaalsContact O-CB 3.22Å; R61-Y65 WeakPolarHBondContact O-CB 3.39Å; R61-Y65 PolarHBondContact O-N 2.86Å; I62-Y65 PolarHBondContact O-N 2.68Å; V63-Y65 VanDerWaalsContact C-N 3.33Å; V63-Y65 PolarHBondContact O-N 3.02Å; Y65-L69 HydrophobicContact CE1-CD1 3.89Å; Y65-L69 HydrophobicContact CE2-CD1 3.86Å; Y65-L69 HydrophobicContact CE2-CG 4.2Å; Y65-L69 PolarHBondContact O-N 2.84Å; Y65-L69 VanDerWaalsContact O-N 3.14Å; Y65-L69 WeakPolarHBondContact OH-CD1 3.31Å; Y65-L116 HydrophobicContact CD1-CB 4.15Å; Y65-L116 HydrophobicContact CD1-CD1 4.49Å; Y65-L116 HydrophobicContact CD2-CB 3.78Å; Y65-L116 HydrophobicContact CE1-CB 4.36Å; Y65-L116 HydrophobicContact CE2-CB 4.04Å; Y65-L116 WeakPolarHBondContact CE2-O 3.24Å; Y65-L116 HydrophobicContact CG-CB 3.85Å; Y65-L116 HydrophobicContact CG-CD1 4.05Å; Y65-N117 WeakPolarHBondContact OH-CA 3.48Å; Y65-N117 PolarHBondContact OH-O 3.42Å; Y65-N117 VanDerWaalsContact OH-O 3.07Å; Y65-G118 PolarHBondContact OH-N 3.39Å; Y65-A119 HydrophobicContact CD1-CB 4.12Å; Y65-A119 HydrophobicContact CE1-CB 4.25Å; Y65-V170 HydrophobicContact CD1-CG2 3.95Å; Y65-V170 HydrophobicContact CE1-CG2 3.67Å
66	F	92.1	Very high	89.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-48.3	174.3	-89.7	-64.8	0	0	0	112.4	I62 V63 T70 I91 A119 L121 L168 V170	I62-F66 HydrophobicContact CG2-CD2 3.71Å; I62-F66 HydrophobicContact CG2-CE2 3.63Å; I62-F66 VanDerWaalsContact O-CD2 3.3Å; I62-F66 WeakPolarHBondContact O-CD2 3.43Å; I62-F66 PolarHBondContact O-N 3.14Å; V63-F66 PolarHBondContact O-N 3.36Å; F66-T70 WeakPolarHBondContact O-CB 3.34Å; F66-T70 PolarHBondContact O-N 2.88Å; F66-T70 PolarHBondContact O-OG1 3.47Å; F66-I91 HydrophobicContact CB-CD1 3.93Å; F66-I91 HydrophobicContact CB-CG1 4.49Å; F66-I91 HydrophobicContact CB-CG2 3.7Å; F66-I91 HydrophobicContact CD2-CG2 4.07Å; F66-I91 HydrophobicContact CG-CG2 4.09Å; F66-A119 HydrophobicContact CD1-CB 4.4Å; F66-A119 HydrophobicContact CD2-CB 4.14Å; F66-A119 HydrophobicContact CE1-CB 3.69Å; F66-A119 WeakPolarHBondContact CE1-O 3.21Å; F66-A119 HydrophobicContact CE2-CB 3.42Å; F66-A119 VanDerWaalsContact CE2-CB 3.42Å; F66-A119 VanDerWaalsContact CZ-C 3.45Å; F66-A119 HydrophobicContact CZ-CB 3.15Å; F66-L121 HydrophobicContact CD2-CD1 4.4Å; F66-L121 HydrophobicContact CE2-CD1 3.92Å; F66-L121 HydrophobicContact CE2-CD2 3.91Å; F66-L121 HydrophobicContact CE2-CG 3.61Å; F66-L121 HydrophobicContact CZ-CD1 4.23Å; F66-L121 HydrophobicContact CZ-CD2 4.18Å; F66-L121 HydrophobicContact CZ-CG 3.6Å; F66-L168 HydrophobicContact CD1-CB 4.47Å; F66-L168 HydrophobicContact CE1-CB 4.24Å; F66-L168 WeakPolarHBondContact CE1-O 3.42Å; F66-L168 WeakPolarHBondContact CZ-O 3.45Å; F66-V170 HydrophobicContact CD1-CB 4.41Å; F66-V170 HydrophobicContact CD1-CG1 4.16Å; F66-V170 HydrophobicContact CD1-CG2 3.53Å; F66-V170 HydrophobicContact CE1-CG2 3.83Å; F66-V170 HydrophobicContact CG-CG2 4.31Å
67	T	91.4	Very high	88.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-52.3	-175	-52.9	0	0	0	0	109.7	V63 S64 L69 T70 E71 H84 I91	V63-T67 WeakPolarHBondContact O-CB 3.29Å; V63-T67 PolarHBondContact O-N 2.77Å; V63-T67 PolarHBondContact O-OG1 2.92Å; S64-T67 PolarHBondContact O-N 2.97Å; T67-L69 PolarHBondContact O-N 3.34Å; T67-T70 PolarHBondContact O-N 3.12Å; T67-E71 WeakPolarHBondContact CG2-OE1 3.14Å; T67-E71 WeakPolarHBondContact O-CB 3.48Å; T67-E71 WeakPolarHBondContact O-CG 3.17Å; T67-E71 PolarHBondContact O-N 2.62Å; T67-H84 WeakPolarHBondContact CG2-CE1 3.46Å; T67-H84 WeakPolarHBondContact CG2-ND1 3.32Å; T67-I91 WeakPolarHBondContact OG1-CD1 3.26Å
68	N	91.9	Very high	88.1	Confident	63 Å²	63	46.3 Å²	46.3	34%	0.337	24%	0.242	S	C	.	.	H	α-helix	trans	-61.5	-49.2	-178.5	-63.4	-0.2	0	0	0	111.9	S64 T70 E71 E72	S64-N68 WeakPolarHBondContact O-CB 3.26Å; S64-N68 PolarHBondContact O-N 3.22Å; S64-N68 PolarHBondContact O-OD1 3.1Å; N68-T70 VanDerWaalsContact C-N 3.33Å; N68-T70 PolarHBondContact O-N 2.91Å; N68-E71 PolarHBondContact O-N 2.72Å; N68-E72 WeakPolarHBondContact O-CB 3.45Å; N68-E72 VanDerWaalsContact O-CG 3.24Å; N68-E72 WeakPolarHBondContact O-CG 3.43Å; N68-E72 PolarHBondContact O-N 2.86Å
69	L	90.4	Very high	87.5	Confident	43 Å²	43	47.9 Å²	47.9	23%	0.225	25%	0.247	C	C	.	.	H	α-helix	trans	-69.4	-30.6	-179.1	-75.1	-159.5	0	0	0	113.8	Y65 T67 E72 G73 V170	Y65-L69 HydrophobicContact CE1-CD1 3.89Å; Y65-L69 HydrophobicContact CE2-CD1 3.86Å; Y65-L69 HydrophobicContact CE2-CG 4.2Å; Y65-L69 PolarHBondContact O-N 2.84Å; Y65-L69 VanDerWaalsContact O-N 3.14Å; Y65-L69 WeakPolarHBondContact OH-CD1 3.31Å; T67-L69 PolarHBondContact O-N 3.34Å; L69-E72 PolarHBondContact O-N 3.18Å; L69-G73 PolarHBondContact O-N 2.88Å; L69-V170 HydrophobicContact CB-CB 3.79Å; L69-V170 HydrophobicContact CB-CG1 3.99Å; L69-V170 HydrophobicContact CB-CG2 4.01Å; L69-V170 HydrophobicContact CD1-CB 4.01Å; L69-V170 HydrophobicContact CD1-CG2 4.05Å
70	T	86.2	Confident	87	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.043	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-46.4	174.4	-59.2	0	0	0	0	109.7	F66 T67 N68 E72 E74 V77 Y87	F66-T70 WeakPolarHBondContact O-CB 3.34Å; F66-T70 PolarHBondContact O-N 2.88Å; F66-T70 PolarHBondContact O-OG1 3.47Å; T67-T70 PolarHBondContact O-N 3.12Å; N68-T70 VanDerWaalsContact C-N 3.33Å; N68-T70 PolarHBondContact O-N 2.91Å; T70-E72 VanDerWaalsContact C-N 3.33Å; T70-E72 PolarHBondContact O-N 3.02Å; T70-E74 HydrophobicContact CG2-CB 4.09Å; T70-E74 WeakPolarHBondContact O-CB 3.2Å; T70-E74 PolarHBondContact O-N 3.01Å; T70-V77 HydrophobicContact CG2-CG2 3.4Å; T70-V77 VanDerWaalsContact CG2-CG2 3.4Å; T70-Y87 HydrophobicContact CG2-CE1 4.38Å
71	E	84.7	Confident	86.6	Confident	55 Å²	55	46.1 Å²	46.1	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-67.7	-27.6	176.9	-74.7	173.8	-168.9	0	0	113.7	T67 N68 H78 H84 Y87	T67-E71 WeakPolarHBondContact CG2-OE1 3.14Å; T67-E71 WeakPolarHBondContact O-CB 3.48Å; T67-E71 WeakPolarHBondContact O-CG 3.17Å; T67-E71 PolarHBondContact O-N 2.62Å; N68-E71 PolarHBondContact O-N 2.72Å; E71-H78 PolarHBondContact O-CE1 3.32Å; E71-H78 PolarHBondContact O-ND1 2.84Å; E71-H84 WeakPolarHBondContact OE1-CA 2.91Å; E71-H84 WeakPolarHBondContact OE1-CB 3.4Å; E71-H84 IonicContact OE1-CE1 3.73Å; E71-H84 IonicContact OE1-CG 2.93Å; E71-H84 IonicContact OE1-ND1 2.87Å; E71-H84 PolarHBondContact OE1-ND1 2.86Å; E71-H84 IonicContact OE2-CE1 3.42Å; E71-H84 IonicContact OE2-CG 2.81Å; E71-H84 IonicContact OE2-ND1 2.68Å; E71-H84 PolarHBondContact OE2-ND1 3.44Å; E71-Y87 HydrophobicContact CG-CD2 3.91Å; E71-Y87 HydrophobicContact CG-CE2 4.22Å
72	E	83.9	Confident	86.3	Confident	136 Å²	136	43.4 Å²	43.4	64%	0.636	24%	0.239	S	C	*	.	H	α-helix	trans	-84	-26.7	-178.4	-77.5	171.9	-169.6	0	0	113.5	N68 L69 T70	N68-E72 WeakPolarHBondContact O-CB 3.45Å; N68-E72 VanDerWaalsContact O-CG 3.24Å; N68-E72 WeakPolarHBondContact O-CG 3.43Å; N68-E72 PolarHBondContact O-N 2.86Å; L69-E72 PolarHBondContact O-N 3.18Å; T70-E72 VanDerWaalsContact C-N 3.33Å; T70-E72 PolarHBondContact O-N 3.02Å
73	G	77.4	Confident	86.1	Confident	56 Å²	56	46.4 Å²	46.4	58%	0.577	26%	0.259	S	S	*	.	H	α-helix	trans	-168.2	8.8	-168.6	0	0	0	0	0	119	L69 A75	L69-G73 PolarHBondContact O-N 2.88Å; G73-A75 PolarHBondContact O-N 3.22Å; G73-A75 VanDerWaalsContact O-N 3.09Å
74	E	83.1	Confident	86	Confident	43 Å²	43	50.4 Å²	50.4	20%	0.201	28%	0.277	C	S	.	.			trans	-77.6	98.8	174.9	-179.4	49.3	-98	0	0	110.6	T70 K76 V77 H78	T70-E74 HydrophobicContact CG2-CB 4.09Å; T70-E74 WeakPolarHBondContact O-CB 3.2Å; T70-E74 PolarHBondContact O-N 3.01Å; E74-K76 HydrophobicContact CG-CB 4.49Å; E74-K76 PolarHBondContact O-N 3.44Å; E74-K76 PolarHBondContact OE1-N 3.3Å; E74-K76 IonicContact OE1-NZ 3.84Å; E74-K76 PolarHBondContact OE1-NZ 3.2Å; E74-K76 IonicContact OE2-NZ 3.75Å; E74-K76 PolarHBondContact OE2-NZ 3.12Å; E74-V77 HydrophobicContact CB-CG2 4.17Å; E74-V77 HydrophobicContact CG-CG2 3.94Å; E74-V77 PolarHBondContact O-N 3.16Å; E74-H78 WeakPolarHBondContact O-CB 3.35Å; E74-H78 PolarHBondContact O-N 2.84Å
75	A	79.8	Confident	85.9	Confident	30 Å²	30	52.1 Å²	52.1	25%	0.248	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-27.4	-173.2	0	0	0	0	0	114.7	G73 V77 L238	G73-A75 PolarHBondContact O-N 3.22Å; G73-A75 VanDerWaalsContact O-N 3.09Å; A75-V77 VanDerWaalsContact C-N 3.34Å; A75-L238 WeakPolarHBondContact O-CD1 3.32Å
76	K	82.4	Confident	85.8	Confident	30 Å²	30	53.6 Å²	53.6	13%	0.13	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-27	-179	-64.5	-178.7	-61.1	-70.3	0	113.6	E74 W201 W233 Q246	E74-K76 HydrophobicContact CG-CB 4.49Å; E74-K76 PolarHBondContact O-N 3.44Å; E74-K76 PolarHBondContact OE1-N 3.3Å; E74-K76 IonicContact OE1-NZ 3.84Å; E74-K76 PolarHBondContact OE1-NZ 3.2Å; E74-K76 IonicContact OE2-NZ 3.75Å; E74-K76 PolarHBondContact OE2-NZ 3.12Å; K76-W201 HydrophobicContact CD-CB 4.28Å; K76-W201 HydrophobicContact CD-CG 4.46Å; K76-W233 HydrophobicContact CB-CD2 4.31Å; K76-W233 HydrophobicContact CB-CE3 4.01Å; K76-W233 HydrophobicContact CB-CH2 3.88Å; K76-W233 HydrophobicContact CB-CZ2 4.17Å; K76-W233 HydrophobicContact CB-CZ3 3.79Å; K76-W233 HydrophobicContact CD-CD2 4.39Å; K76-W233 HydrophobicContact CD-CH2 4.02Å; K76-W233 HydrophobicContact CD-CZ2 3.5Å; K76-W233 VanDerWaalsContact CD-CZ2 3.5Å; K76-W233 HydrophobicContact CG-CD2 4.12Å; K76-W233 HydrophobicContact CG-CE3 4.35Å; K76-W233 HydrophobicContact CG-CH2 4.27Å; K76-W233 HydrophobicContact CG-CZ2 4.03Å; K76-W233 HydrophobicContact CG-CZ3 4.41Å; K76-Q246 HydrophobicContact CG-CG 4.49Å
77	V	80.7	Confident	85.7	Confident	19 Å²	19	54.3 Å²	54.3	12%	0.115	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.1	-12.5	-168	-53.5	0	0	0	0	114.6	T70 E74 A75 D79 L80 Y87 V140	T70-V77 HydrophobicContact CG2-CG2 3.4Å; T70-V77 VanDerWaalsContact CG2-CG2 3.4Å; E74-V77 HydrophobicContact CB-CG2 4.17Å; E74-V77 HydrophobicContact CG-CG2 3.94Å; E74-V77 PolarHBondContact O-N 3.16Å; A75-V77 VanDerWaalsContact C-N 3.34Å; V77-D79 VanDerWaalsContact C-N 3.34Å; V77-D79 PolarHBondContact O-N 2.81Å; V77-L80 HydrophobicContact CB-CD1 4.03Å; V77-L80 HydrophobicContact CG1-CD1 4.2Å; V77-L80 WeakPolarHBondContact O-CB 3.24Å; V77-L80 PolarHBondContact O-N 2.97Å; V77-Y87 WeakPolarHBondContact CB-OH 3.38Å; V77-Y87 HydrophobicContact CG2-CE1 4.39Å; V77-Y87 WeakPolarHBondContact CG2-OH 3.46Å; V77-Y87 PolarHBondContact O-OH 3.27Å; V77-V140 HydrophobicContact CG1-CG1 4.27Å; V77-V140 HydrophobicContact CG1-CG2 4.46Å
78	H	80.4	Confident	85.8	Confident	86 Å²	86	57.6 Å²	57.6	40%	0.398	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-54.3	-48.6	177	173.5	66.9	0	0	0	111.9	E71 E74 L80	E71-H78 PolarHBondContact O-CE1 3.32Å; E71-H78 PolarHBondContact O-ND1 2.84Å; E74-H78 WeakPolarHBondContact O-CB 3.35Å; E74-H78 PolarHBondContact O-N 2.84Å; H78-L80 PolarHBondContact O-N 3.45Å; H78-L80 VanDerWaalsContact O-N 3.13Å
79	D	80	Confident	85.9	Confident	94 Å²	94	57.1 Å²	57.1	50%	0.503	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-77	3.6	-175.4	-62.7	-30.3	0	0	0	113.2	V77 K242	V77-D79 VanDerWaalsContact C-N 3.34Å; V77-D79 PolarHBondContact O-N 2.81Å; D79-K242 IonicContact OD2-NZ 3.37Å; D79-K242 PolarHBondContact OD2-NZ 2.97Å
80	L	81.9	Confident	86.1	Confident	17 Å²	17	55.7 Å²	55.7	9%	0.089	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-85.2	-5.7	-178.6	-62.7	179.6	0	0	0	113.7	V77 H78 I82 R136 V140 M236	V77-L80 HydrophobicContact CB-CD1 4.03Å; V77-L80 HydrophobicContact CG1-CD1 4.2Å; V77-L80 WeakPolarHBondContact O-CB 3.24Å; V77-L80 PolarHBondContact O-N 2.97Å; H78-L80 PolarHBondContact O-N 3.45Å; H78-L80 VanDerWaalsContact O-N 3.13Å; L80-I82 VanDerWaalsContact C-N 3.33Å; L80-I82 HydrophobicContact CB-CD1 4.15Å; L80-I82 HydrophobicContact CB-CG1 3.81Å; L80-I82 HydrophobicContact CD1-CD1 4.29Å; L80-I82 PolarHBondContact O-N 3.3Å; L80-R136 WeakPolarHBondContact O-CD 3.07Å; L80-R136 PolarHBondContact O-NE 3.34Å; L80-R136 VanDerWaalsContact O-NE 3.14Å; L80-V140 HydrophobicContact CD1-CG2 3.3Å; L80-M236 WeakPolarHBondContact CD2-O 3.28Å
81	D	84.5	Confident	86.4	Confident	140 Å²	140	55.4 Å²	55.4	75%	0.749	30%	0.303	S	S	*	.			trans	52.3	49.2	179.7	-168.6	34.4	0	0	0	112.8
82	I	86.6	Confident	86.9	Confident	14 Å²	14	56.7 Å²	56.7	7%	0.072	31%	0.306	C	S	.	.			trans	-86.9	127.3	177.1	-52.1	-164.4	0	0	0	108.2	L80 M86 Y87 R136 I137	L80-I82 VanDerWaalsContact C-N 3.33Å; L80-I82 HydrophobicContact CB-CD1 4.15Å; L80-I82 HydrophobicContact CB-CG1 3.81Å; L80-I82 HydrophobicContact CD1-CD1 4.29Å; L80-I82 PolarHBondContact O-N 3.3Å; I82-M86 HydrophobicContact CG2-CB 4.06Å; I82-Y87 HydrophobicContact CB-CD2 3.85Å; I82-Y87 HydrophobicContact CB-CE1 4.2Å; I82-Y87 HydrophobicContact CB-CE2 3.4Å; I82-Y87 VanDerWaalsContact CB-CE2 3.4Å; I82-Y87 HydrophobicContact CB-CG 4.44Å; I82-Y87 HydrophobicContact CD1-CE1 3.84Å; I82-Y87 HydrophobicContact CD1-CE2 4.4Å; I82-Y87 VanDerWaalsContact CD1-OH 3.25Å; I82-Y87 WeakPolarHBondContact CD1-OH 3.28Å; I82-Y87 HydrophobicContact CG1-CE1 4.42Å; I82-Y87 HydrophobicContact CG1-CE2 4.1Å; I82-Y87 WeakPolarHBondContact CG1-OH 3.34Å; I82-Y87 HydrophobicContact CG2-CD1 4.18Å; I82-Y87 HydrophobicContact CG2-CD2 3.89Å; I82-Y87 HydrophobicContact CG2-CE1 4.13Å; I82-Y87 HydrophobicContact CG2-CE2 3.91Å; I82-Y87 HydrophobicContact CG2-CG 4.03Å; I82-R136 HydrophobicContact CD1-CB 3.82Å; I82-R136 HydrophobicContact CG1-CB 3.96Å; I82-I137 HydrophobicContact CD1-CG1 3.64Å; I82-I137 HydrophobicContact CG2-CD1 3.92Å; I82-I137 HydrophobicContact CG2-CG1 3.79Å
83	P	90	Very high	87.5	Confident	63 Å²	63	53 Å²	53	41%	0.409	29%	0.291	S	S	.	.			trans	-58.7	141.5	-179.7	-25.9	34	0	0	0	113.2	S85 M86 Y87	P83-S85 VanDerWaalsContact C-N 3.3Å; P83-S85 PolarHBondContact O-N 2.82Å; P83-M86 HydrophobicContact CB-CG 4.17Å; P83-M86 HydrophobicContact CB-SD 4.45Å; P83-M86 HydrophobicContact CG-CE 4.19Å; P83-M86 HydrophobicContact CG-CG 4.35Å; P83-M86 HydrophobicContact CG-SD 3.98Å; P83-M86 WeakPolarHBondContact O-CA 3.48Å; P83-M86 WeakPolarHBondContact O-CB 3.37Å; P83-M86 PolarHBondContact O-N 2.9Å; P83-Y87 PolarHBondContact O-N 3.05Å; P83-Y87 VanDerWaalsContact O-N 3.14Å
84	H	90.9	Very high	88.3	Confident	84 Å²	84	50.4 Å²	50.4	39%	0.389	26%	0.264	S	S	.	.	H	α-helix	trans	-52.9	-44.3	-177.8	-177.2	91.7	0	0	0	113.9	T67 E71 M86 Y87 Y88	T67-H84 WeakPolarHBondContact CG2-CE1 3.46Å; T67-H84 WeakPolarHBondContact CG2-ND1 3.32Å; E71-H84 WeakPolarHBondContact OE1-CA 2.91Å; E71-H84 WeakPolarHBondContact OE1-CB 3.4Å; E71-H84 IonicContact OE1-CE1 3.73Å; E71-H84 IonicContact OE1-CG 2.93Å; E71-H84 IonicContact OE1-ND1 2.87Å; E71-H84 PolarHBondContact OE1-ND1 2.86Å; E71-H84 IonicContact OE2-CE1 3.42Å; E71-H84 IonicContact OE2-CG 2.81Å; E71-H84 IonicContact OE2-ND1 2.68Å; E71-H84 PolarHBondContact OE2-ND1 3.44Å; H84-M86 VanDerWaalsContact C-N 3.26Å; H84-M86 PolarHBondContact O-N 3.05Å; H84-Y87 PolarHBondContact O-N 3.48Å; H84-Y88 VanDerWaalsContact O-CB 3.31Å; H84-Y88 WeakPolarHBondContact O-CB 3.28Å; H84-Y88 PolarHBondContact O-N 3.35Å
85	S	92.1	Very high	88.8	Confident	79 Å²	79	50.5 Å²	50.5	55%	0.552	26%	0.263	S	S	*	.	H	α-helix	trans	-62.4	-32.2	178	57.3	0	0	0	0	113.1	P83 T89	P83-S85 VanDerWaalsContact C-N 3.3Å; P83-S85 PolarHBondContact O-N 2.82Å; S85-T89 WeakPolarHBondContact O-CB 3.36Å; S85-T89 PolarHBondContact O-N 2.62Å; S85-T89 VanDerWaalsContact O-N 3.1Å; S85-T89 PolarHBondContact O-OG1 2.89Å
86	M	91.9	Very high	89.3	Confident	66 Å²	66	54.8 Å²	54.8	33%	0.325	28%	0.276	S	S	.	.	H	α-helix	trans	-71.7	-45.9	176.3	-66.6	-172	-175.7	0	0	111	I82 P83 H84 T89 H90 P134 I137	I82-M86 HydrophobicContact CG2-CB 4.06Å; P83-M86 HydrophobicContact CB-CG 4.17Å; P83-M86 HydrophobicContact CB-SD 4.45Å; P83-M86 HydrophobicContact CG-CE 4.19Å; P83-M86 HydrophobicContact CG-CG 4.35Å; P83-M86 HydrophobicContact CG-SD 3.98Å; P83-M86 WeakPolarHBondContact O-CA 3.48Å; P83-M86 WeakPolarHBondContact O-CB 3.37Å; P83-M86 PolarHBondContact O-N 2.9Å; H84-M86 VanDerWaalsContact C-N 3.26Å; H84-M86 PolarHBondContact O-N 3.05Å; M86-T89 PolarHBondContact O-N 3.17Å; M86-H90 WeakPolarHBondContact O-CB 3.43Å; M86-H90 PolarHBondContact O-N 3.34Å; M86-P134 HydrophobicContact CB-CG 4.05Å; M86-P134 HydrophobicContact CG-CG 4.07Å; M86-P134 HydrophobicContact SD-CB 4.32Å; M86-P134 HydrophobicContact SD-CG 4.17Å; M86-I137 HydrophobicContact CB-CD1 4.34Å
87	Y	89.4	Confident	89.8	Confident	15 Å²	15	55.5 Å²	55.5	6%	0.059	28%	0.284	C	S	.	.	H	α-helix	trans	-61.7	-48.5	175	-89.7	-47.8	0	0	0	112.1	T70 E71 V77 I82 P83 H84 T89 H90 I91 I137	T70-Y87 HydrophobicContact CG2-CE1 4.38Å; E71-Y87 HydrophobicContact CG-CD2 3.91Å; E71-Y87 HydrophobicContact CG-CE2 4.22Å; V77-Y87 WeakPolarHBondContact CB-OH 3.38Å; V77-Y87 HydrophobicContact CG2-CE1 4.39Å; V77-Y87 WeakPolarHBondContact CG2-OH 3.46Å; V77-Y87 PolarHBondContact O-OH 3.27Å; I82-Y87 HydrophobicContact CB-CD2 3.85Å; I82-Y87 HydrophobicContact CB-CE1 4.2Å; I82-Y87 HydrophobicContact CB-CE2 3.4Å; I82-Y87 VanDerWaalsContact CB-CE2 3.4Å; I82-Y87 HydrophobicContact CB-CG 4.44Å; I82-Y87 HydrophobicContact CD1-CE1 3.84Å; I82-Y87 HydrophobicContact CD1-CE2 4.4Å; I82-Y87 VanDerWaalsContact CD1-OH 3.25Å; I82-Y87 WeakPolarHBondContact CD1-OH 3.28Å; I82-Y87 HydrophobicContact CG1-CE1 4.42Å; I82-Y87 HydrophobicContact CG1-CE2 4.1Å; I82-Y87 WeakPolarHBondContact CG1-OH 3.34Å; I82-Y87 HydrophobicContact CG2-CD1 4.18Å; I82-Y87 HydrophobicContact CG2-CD2 3.89Å; I82-Y87 HydrophobicContact CG2-CE1 4.13Å; I82-Y87 HydrophobicContact CG2-CE2 3.91Å; I82-Y87 HydrophobicContact CG2-CG 4.03Å; P83-Y87 PolarHBondContact O-N 3.05Å; P83-Y87 VanDerWaalsContact O-N 3.14Å; H84-Y87 PolarHBondContact O-N 3.48Å; Y87-T89 VanDerWaalsContact C-N 3.29Å; Y87-T89 PolarHBondContact O-N 3.21Å; Y87-H90 PolarHBondContact O-N 3.03Å; Y87-I91 WeakPolarHBondContact O-CB 3.04Å; Y87-I91 WeakPolarHBondContact O-CD1 3.37Å; Y87-I91 WeakPolarHBondContact O-CG1 3.35Å; Y87-I91 PolarHBondContact O-N 2.83Å; Y87-I137 HydrophobicContact CD1-CD1 4.14Å
88	Y	93.4	Very high	90.4	Very high	70 Å²	70	55 Å²	55	28%	0.275	28%	0.283	S	S	.	.	H	α-helix	trans	-55.5	-47.6	179.4	-169.6	-78.9	0	0	0	110.9	V63 H84 I91 Y92	V63-Y88 HydrophobicContact CB-CE2 4.21Å; V63-Y88 HydrophobicContact CG1-CD1 3.86Å; V63-Y88 HydrophobicContact CG1-CD2 3.72Å; V63-Y88 HydrophobicContact CG1-CE1 3.71Å; V63-Y88 HydrophobicContact CG1-CE2 3.59Å; V63-Y88 HydrophobicContact CG1-CG 3.85Å; V63-Y88 WeakPolarHBondContact CG1-O 3.42Å; H84-Y88 VanDerWaalsContact O-CB 3.31Å; H84-Y88 WeakPolarHBondContact O-CB 3.28Å; H84-Y88 PolarHBondContact O-N 3.35Å; Y88-I91 PolarHBondContact O-N 3.45Å; Y88-Y92 WeakPolarHBondContact O-CB 3.5Å; Y88-Y92 PolarHBondContact O-N 3.23Å
89	T	94.5	Very high	91.1	Very high	53 Å²	53	53.2 Å²	53.2	33%	0.325	28%	0.276	S	S	.	.	H	α-helix	trans	-66.6	-42.2	179.5	-54.4	0	0	0	0	111.8	S85 M86 Y87 Y92 L93 Y132	S85-T89 WeakPolarHBondContact O-CB 3.36Å; S85-T89 PolarHBondContact O-N 2.62Å; S85-T89 VanDerWaalsContact O-N 3.1Å; S85-T89 PolarHBondContact O-OG1 2.89Å; M86-T89 PolarHBondContact O-N 3.17Å; Y87-T89 VanDerWaalsContact C-N 3.29Å; Y87-T89 PolarHBondContact O-N 3.21Å; T89-Y92 PolarHBondContact O-N 2.97Å; T89-L93 HydrophobicContact CG2-CD1 4.07Å; T89-L93 WeakPolarHBondContact O-CG 3.34Å; T89-L93 PolarHBondContact O-N 3.24Å; T89-Y132 HydrophobicContact CG2-CD1 3.8Å; T89-Y132 HydrophobicContact CG2-CE1 3.41Å; T89-Y132 VanDerWaalsContact CG2-CE1 3.41Å
90	H	94.3	Very high	91.8	Very high	12 Å²	12	54.3 Å²	54.3	6%	0.056	28%	0.278	C	S	.	.	H	α-helix	trans	-58.1	-50.7	174.9	173.5	73.9	0	0	0	111.6	M86 Y87 L93 A94 M131 Y132 I137	M86-H90 WeakPolarHBondContact O-CB 3.43Å; M86-H90 PolarHBondContact O-N 3.34Å; Y87-H90 PolarHBondContact O-N 3.03Å; H90-L93 PolarHBondContact O-N 3.01Å; H90-A94 WeakPolarHBondContact O-CB 3.41Å; H90-A94 PolarHBondContact O-N 2.62Å; H90-M131 VanDerWaalsContact CE1-CE 3.4Å; H90-M131 WeakPolarHBondContact CE1-CE 3.13Å; H90-Y132 PolarHBondContact ND1-O 2.88Å; H90-I137 HydrophobicContact CB-CD1 3.66Å
91	I	93.7	Very high	92.3	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-64.7	-42.6	-179.9	-67.3	158.8	0	0	0	110.8	V63 F66 T67 Y87 Y88 L93 A94 W95 L168	V63-I91 HydrophobicContact CB-CG2 4.38Å; V63-I91 HydrophobicContact CG1-CB 4.25Å; V63-I91 HydrophobicContact CG1-CG2 4.02Å; V63-I91 HydrophobicContact CG2-CG2 4.32Å; F66-I91 HydrophobicContact CB-CD1 3.93Å; F66-I91 HydrophobicContact CB-CG1 4.49Å; F66-I91 HydrophobicContact CB-CG2 3.7Å; F66-I91 HydrophobicContact CD2-CG2 4.07Å; F66-I91 HydrophobicContact CG-CG2 4.09Å; T67-I91 WeakPolarHBondContact OG1-CD1 3.26Å; Y87-I91 WeakPolarHBondContact O-CB 3.04Å; Y87-I91 WeakPolarHBondContact O-CD1 3.37Å; Y87-I91 WeakPolarHBondContact O-CG1 3.35Å; Y87-I91 PolarHBondContact O-N 2.83Å; Y88-I91 PolarHBondContact O-N 3.45Å; I91-L93 VanDerWaalsContact C-N 3.32Å; I91-L93 PolarHBondContact O-N 3.3Å; I91-A94 PolarHBondContact O-N 3.12Å; I91-W95 WeakPolarHBondContact O-CB 3.4Å; I91-W95 PolarHBondContact O-N 2.65Å; I91-L168 HydrophobicContact CG1-CD1 4.21Å; I91-L168 HydrophobicContact CG1-CD2 4.34Å
92	Y	95.2	Very high	92.9	Very high	82 Å²	82	51.1 Å²	51.1	32%	0.322	26%	0.261	S	S	.	.	H	α-helix	trans	-57.9	-44.3	177.1	176.3	-91	0	0	0	112	L59 V63 Y88 T89 K96	L59-Y92 HydrophobicContact CD2-CD2 3.92Å; L59-Y92 HydrophobicContact CD2-CE2 3.41Å; L59-Y92 VanDerWaalsContact CD2-CE2 3.41Å; L59-Y92 HydrophobicContact CG-CD2 4.23Å; L59-Y92 HydrophobicContact CG-CE2 4.11Å; V63-Y92 HydrophobicContact CG2-CD2 4.22Å; Y88-Y92 WeakPolarHBondContact O-CB 3.5Å; Y88-Y92 PolarHBondContact O-N 3.23Å; T89-Y92 PolarHBondContact O-N 2.97Å; Y92-K96 HydrophobicContact CE1-CD 4.48Å; Y92-K96 WeakPolarHBondContact OH-CE 3.49Å; Y92-K96 PolarHBondContact OH-NZ 3.46Å
93	L	95	Very high	93.4	Very high	58 Å²	58	50.5 Å²	50.5	30%	0.304	26%	0.257	S	S	.	.	H	α-helix	trans	-75.9	-36.7	178.3	-66.8	175.1	0	0	0	112.1	T89 H90 I91 W95 K96 S97 Y132	T89-L93 HydrophobicContact CG2-CD1 4.07Å; T89-L93 WeakPolarHBondContact O-CG 3.34Å; T89-L93 PolarHBondContact O-N 3.24Å; H90-L93 PolarHBondContact O-N 3.01Å; I91-L93 VanDerWaalsContact C-N 3.32Å; I91-L93 PolarHBondContact O-N 3.3Å; L93-W95 VanDerWaalsContact C-N 3.29Å; L93-W95 PolarHBondContact O-N 2.84Å; L93-K96 HydrophobicContact CD2-CD 4.48Å; L93-K96 PolarHBondContact O-N 3.21Å; L93-S97 PolarHBondContact O-N 3.36Å; L93-Y132 HydrophobicContact CD1-CD1 3.79Å; L93-Y132 HydrophobicContact CD1-CD2 4.27Å; L93-Y132 HydrophobicContact CD1-CG 3.54Å
94	A	93.8	Very high	93.7	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.025	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-40.1	173.6	0	0	0	0	0	112	H90 I91 K96 S97 A98 M131 L168	H90-A94 WeakPolarHBondContact O-CB 3.41Å; H90-A94 PolarHBondContact O-N 2.62Å; I91-A94 PolarHBondContact O-N 3.12Å; A94-K96 VanDerWaalsContact C-N 3.28Å; A94-K96 PolarHBondContact O-N 2.73Å; A94-S97 CarbonylContact O-C 3.58Å; A94-S97 PolarHBondContact O-N 3.28Å; A94-A98 PolarHBondContact O-N 3.43Å; A94-M131 HydrophobicContact CB-CE 3.42Å; A94-M131 VanDerWaalsContact CB-CE 3.42Å; A94-L168 HydrophobicContact CB-CD1 3.6Å
95	W	93.8	Very high	94	Very high	44 Å²	44	43.5 Å²	43.5	17%	0.167	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-40.5	176.8	-177	101.8	0	0	0	112	I54 T55 L59 I91 L93 S97 A98 L121	I54-W95 HydrophobicContact CD1-CD2 4.48Å; I54-W95 HydrophobicContact CD1-CZ2 4.39Å; I54-W95 HydrophobicContact CG1-CZ2 4.4Å; I54-W95 PolarHBondContact O-NE1 2.93Å; T55-W95 HydrophobicContact CG2-CH2 4.5Å; T55-W95 HydrophobicContact CG2-CZ2 4.26Å; L59-W95 HydrophobicContact CD1-CB 4.08Å; L59-W95 HydrophobicContact CD1-CD2 3.31Å; L59-W95 HydrophobicContact CD1-CE3 3.71Å; L59-W95 HydrophobicContact CD1-CG 3.45Å; L59-W95 VanDerWaalsContact CD1-CG 3.45Å; L59-W95 HydrophobicContact CD1-CZ2 4.24Å; L59-W95 HydrophobicContact CD1-CZ3 4.34Å; L59-W95 HydrophobicContact CD2-CE3 4.16Å; L59-W95 HydrophobicContact CD2-CZ3 4.34Å; I91-W95 WeakPolarHBondContact O-CB 3.4Å; I91-W95 PolarHBondContact O-N 2.65Å; L93-W95 VanDerWaalsContact C-N 3.29Å; L93-W95 PolarHBondContact O-N 2.84Å; W95-S97 PolarHBondContact O-N 3.49Å; W95-A98 WeakPolarHBondContact O-CB 3.48Å; W95-A98 PolarHBondContact O-N 2.83Å; W95-A98 VanDerWaalsContact O-N 3.17Å; W95-L121 HydrophobicContact CB-CD1 4.23Å
96	K	91.6	Very high	94.1	Very high	120 Å²	120	39.7 Å²	39.7	52%	0.522	19%	0.193	S	C	.	.	H	α-helix	trans	-64.6	-27.5	178.4	-65	-175.8	-179.9	-177.5	0	112.6	Y92 L93 A94	Y92-K96 HydrophobicContact CE1-CD 4.48Å; Y92-K96 WeakPolarHBondContact OH-CE 3.49Å; Y92-K96 PolarHBondContact OH-NZ 3.46Å; L93-K96 HydrophobicContact CD2-CD 4.48Å; L93-K96 PolarHBondContact O-N 3.21Å; A94-K96 VanDerWaalsContact C-N 3.28Å; A94-K96 PolarHBondContact O-N 2.73Å
97	S	91.7	Very high	94.3	Very high	45 Å²	45	37.2 Å²	37.2	32%	0.315	18%	0.181	S	C	.	.	H	α-helix	trans	-92.1	-8.6	179.3	-70.9	0	0	0	0	113.6	L93 A94 W95 K127	L93-S97 PolarHBondContact O-N 3.36Å; A94-S97 CarbonylContact O-C 3.58Å; A94-S97 PolarHBondContact O-N 3.28Å; W95-S97 PolarHBondContact O-N 3.49Å; S97-K127 WeakPolarHBondContact O-CD 3.49Å; S97-K127 PolarHBondContact O-NZ 3.32Å
98	A	94.3	Very high	94.4	Very high	10 Å²	10	40.1 Å²	40.1	8%	0.083	20%	0.195	C	C	.	.	S	Bend	trans	-70.4	148.1	-175.3	0	0	0	0	0	112.4	I54 A94 W95 Q100 L121 V122	I54-A98 HydrophobicContact CD1-CB 4Å; A94-A98 PolarHBondContact O-N 3.43Å; W95-A98 WeakPolarHBondContact O-CB 3.48Å; W95-A98 PolarHBondContact O-N 2.83Å; W95-A98 VanDerWaalsContact O-N 3.17Å; A98-Q100 PolarHBondContact O-N 3.37Å; A98-L121 HydrophobicContact CB-CB 4.3Å; A98-L121 HydrophobicContact CB-CD2 4.21Å; A98-V122 WeakPolarHBondContact CA-O 3.45Å
99	D	95.5	Very high	93.8	Very high	48 Å²	48	37.5 Å²	37.5	26%	0.257	19%	0.188	S	C	.	.			trans	-73	114.9	172.4	-174.3	-71.6	0	0	0	109.5	L101 M102 S103 V122	D99-L101 VanDerWaalsContact C-N 3.28Å; D99-L101 PolarHBondContact O-N 2.81Å; D99-L101 WeakPolarHBondContact OD1-CB 3.4Å; D99-L101 PolarHBondContact OD1-N 2.9Å; D99-M102 HydrophobicContact CB-CB 4.46Å; D99-M102 HydrophobicContact CB-CE 3.95Å; D99-M102 PolarHBondContact OD1-N 3.06Å; D99-M102 WeakPolarHBondContact OD2-CE 3.35Å; D99-S103 WeakPolarHBondContact O-CB 3.18Å; D99-S103 PolarHBondContact O-N 3.29Å; D99-S103 PolarHBondContact O-OG 2.89Å; D99-V122 PolarHBondContact N-O 3.04Å
100	Q	93.4	Very high	93	Very high	117 Å²	117	42.1 Å²	42.1	55%	0.547	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-25.3	-173.8	-66.7	-173.8	-5.9	0	0	113.9	A98	A98-Q100 PolarHBondContact O-N 3.37Å
101	L	93.6	Very high	92	Very high	88 Å²	88	43.8 Å²	43.8	46%	0.461	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-41.5	-177.7	178.1	61.3	0	0	0	110.9	D99 A191	D99-L101 VanDerWaalsContact C-N 3.28Å; D99-L101 PolarHBondContact O-N 2.81Å; D99-L101 WeakPolarHBondContact OD1-CB 3.4Å; D99-L101 PolarHBondContact OD1-N 2.9Å; L101-A191 HydrophobicContact CD2-CB 3.51Å
102	M	95.9	Very high	90.7	Very high	2 Å²	2	49 Å²	49	1%	0.01	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-25.8	-179.2	-69.8	-178.2	-80.8	0	0	113.2	D99 V122 F164 T184 Q187 F188	D99-M102 HydrophobicContact CB-CB 4.46Å; D99-M102 HydrophobicContact CB-CE 3.95Å; D99-M102 PolarHBondContact OD1-N 3.06Å; D99-M102 WeakPolarHBondContact OD2-CE 3.35Å; M102-V122 HydrophobicContact CB-CB 3.85Å; M102-V122 HydrophobicContact CB-CG1 3.88Å; M102-V122 HydrophobicContact CB-CG2 3.95Å; M102-V122 HydrophobicContact CE-CG1 4.44Å; M102-V122 HydrophobicContact SD-CG1 4.33Å; M102-F164 HydrophobicContact CE-CD1 3.39Å; M102-F164 HydrophobicContact CE-CD2 4.16Å; M102-F164 HydrophobicContact CE-CE1 3.29Å; M102-F164 HydrophobicContact CE-CE2 4.07Å; M102-F164 HydrophobicContact CE-CG 3.84Å; M102-F164 HydrophobicContact CE-CZ 3.65Å; M102-F164 HydrophobicContact SD-CD1 4.4Å; M102-F164 HydrophobicContact SD-CG 4.33Å; M102-T184 HydrophobicContact CB-CG2 4.48Å; M102-Q187 HydrophobicContact CG-CB 4.01Å; M102-F188 HydrophobicContact SD-CB 3.86Å; M102-F188 HydrophobicContact SD-CD2 4.1Å
103	S	97	Very high	89.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.269	C	S	.	.			trans	-77	137.5	176.8	-54.8	0	0	0	0	111.3	I54 D99 N120 V122	I54-S103 VanDerWaalsContact CG2-CB 3.48Å; D99-S103 WeakPolarHBondContact O-CB 3.18Å; D99-S103 PolarHBondContact O-N 3.29Å; D99-S103 PolarHBondContact O-OG 2.89Å; S103-N120 CarbonylContact C-O 3.56Å; S103-N120 VanDerWaalsContact CA-O 3.26Å; S103-N120 WeakPolarHBondContact CA-O 3.3Å; S103-N120 WeakPolarHBondContact CB-O 3.48Å; S103-V122 PolarHBondContact OG-N 2.93Å; S103-V122 PolarHBondContact OG-O 3.42Å
104	S	96.8	Very high	89	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	159	-173.7	48.8	0	0	0	0	113.3	K52 A119 N120 L180	K52-S104 CarbonylContact O-C 3.57Å; K52-S104 VanDerWaalsContact O-CA 3.25Å; K52-S104 WeakPolarHBondContact O-CA 3.35Å; K52-S104 WeakPolarHBondContact O-CB 3Å; S104-A119 CarbonylContact O-C 3.54Å; S104-A119 WeakPolarHBondContact O-CA 3.28Å; S104-N120 PolarHBondContact N-O 2.74Å; S104-N120 PolarHBondContact O-N 2.89Å; S104-L180 WeakPolarHBondContact OG-CD2 3.33Å
105	I	96.5	Very high	88.9	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	156.5	169	60.9	178.8	0	0	0	109.3	I51 K52 T53 I54 A57 I62 L107 L116 G118 A119	I51-I105 WeakPolarHBondContact CA-O 3.22Å; K52-I105 HydrophobicContact CB-CG1 4.09Å; K52-I105 PolarHBondContact N-O 3.04Å; K52-I105 PolarHBondContact O-N 3.32Å; T53-I105 WeakPolarHBondContact O-CG1 3.48Å; I54-I105 HydrophobicContact CG2-CG2 4.16Å; A57-I105 HydrophobicContact CB-CD1 3.68Å; I62-I105 HydrophobicContact CD1-CD1 4.41Å; I62-I105 HydrophobicContact CD1-CG2 4.21Å; I62-I105 HydrophobicContact CG1-CG2 4.37Å; I62-I105 HydrophobicContact CG2-CG2 4.48Å; I105-L107 HydrophobicContact CD1-CD1 4.44Å; I105-L107 HydrophobicContact CD1-CD2 4.1Å; I105-L107 HydrophobicContact CD1-CG 4.29Å; I105-L116 HydrophobicContact CB-CD2 3.78Å; I105-L116 HydrophobicContact CD1-CD2 3.95Å; I105-L116 HydrophobicContact CG1-CD2 4.34Å; I105-L116 HydrophobicContact CG2-CD2 4.05Å; I105-G118 CarbonylContact C-O 3.59Å; I105-G118 WeakPolarHBondContact CA-O 3.32Å; I105-A119 HydrophobicContact CG2-CB 4.02Å
106	T	95.6	Very high	88.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.5	167.2	65.9	0	0	0	0	110	Y49 V50 I51 L116 N117 G118 I176 L180	Y49-T106 HydrophobicContact CD2-CG2 4.41Å; V50-T106 CarbonylContact O-C 3.52Å; V50-T106 VanDerWaalsContact O-CA 3.29Å; V50-T106 WeakPolarHBondContact O-CA 3.44Å; I51-T106 HydrophobicContact CG1-CG2 3.97Å; T106-L116 WeakPolarHBondContact O-CA 3.29Å; T106-N117 PolarHBondContact O-N 3.33Å; T106-N117 VanDerWaalsContact OG1-C 3.26Å; T106-G118 PolarHBondContact N-O 3.02Å; T106-G118 WeakPolarHBondContact OG1-CA 3.4Å; T106-G118 PolarHBondContact OG1-N 3.03Å; T106-I176 HydrophobicContact CG2-CG2 3.78Å; T106-I176 WeakPolarHBondContact OG1-CG2 3.34Å; T106-L180 HydrophobicContact CG2-CD1 4.4Å; T106-L180 HydrophobicContact CG2-CD2 3.64Å; T106-L180 HydrophobicContact CG2-CG 3.86Å
107	L	94.5	Very high	88.9	Confident	13 Å²	13	50.3 Å²	50.3	7%	0.068	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.4	175.3	-57.4	172.4	0	0	0	109	Y49 V50 K52 I105 A109 S114 K115 L116	Y49-L107 CarbonylContact C-O 3.55Å; Y49-L107 WeakPolarHBondContact CA-O 3.27Å; Y49-L107 WeakPolarHBondContact CB-O 3.34Å; V50-L107 HydrophobicContact CG2-CB 4.03Å; V50-L107 PolarHBondContact N-O 3.28Å; V50-L107 PolarHBondContact O-N 3.1Å; K52-L107 HydrophobicContact CG-CD1 4.24Å; I105-L107 HydrophobicContact CD1-CD1 4.44Å; I105-L107 HydrophobicContact CD1-CD2 4.1Å; I105-L107 HydrophobicContact CD1-CG 4.29Å; L107-A109 PolarHBondContact O-N 3.41Å; L107-S114 WeakPolarHBondContact CD2-O 3.39Å; L107-K115 CarbonylContact C-O 3.57Å; L107-K115 WeakPolarHBondContact CA-O 3.4Å; L107-L116 HydrophobicContact CD2-CD2 3.61Å; L107-L116 HydrophobicContact CD2-CG 4.09Å
108	Q	91.3	Very high	89.1	Confident	77 Å²	77	48.1 Å²	48.1	36%	0.36	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	130.9	170.7	-176.3	63.8	37.5	0	0	109.4	G48 D111 K115 N117	G48-Q108 PolarHBondContact O-NE2 3.28Å; G48-Q108 PolarHBondContact O-OE1 3.03Å; Q108-D111 HydrophobicContact CB-CB 3.98Å; Q108-D111 HydrophobicContact CG-CB 3.96Å; Q108-K115 HydrophobicContact CB-CB 4.37Å; Q108-K115 PolarHBondContact N-O 2.68Å; Q108-N117 PolarHBondContact OE1-ND2 2.79Å
109	A	82.3	Confident	89.2	Confident	15 Å²	15	47.7 Å²	47.7	12%	0.124	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	144.5	174	0	0	0	0	0	109.5	G48 L107 D111	G48-A109 VanDerWaalsContact C-CB 3.49Å; G48-A109 PolarHBondContact O-N 3.11Å; L107-A109 PolarHBondContact O-N 3.41Å; A109-D111 PolarHBondContact O-N 2.95Å; A109-D111 VanDerWaalsContact O-N 3.13Å
110	D	76.7	Confident	89.2	Confident	149 Å²	149	45.4 Å²	45.4	80%	0.797	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	13.1	175.5	-45	-38	0	0	0	115.6
111	D	73.1	Confident	89.3	Confident	47 Å²	47	39.8 Å²	39.8	25%	0.251	21%	0.214	S	C	.	.			trans	-90.7	119.1	172	-179.5	13.4	0	0	0	110.4	Q108 A109 E113 S114 K115	Q108-D111 HydrophobicContact CB-CB 3.98Å; Q108-D111 HydrophobicContact CG-CB 3.96Å; A109-D111 PolarHBondContact O-N 2.95Å; A109-D111 VanDerWaalsContact O-N 3.13Å; D111-E113 PolarHBondContact O-N 3.23Å; D111-E113 PolarHBondContact OD1-N 3.39Å; D111-S114 PolarHBondContact O-N 3.07Å; D111-K115 WeakPolarHBondContact OD2-CB 3.39Å; D111-K115 PolarHBondContact OD2-N 3.35Å
112	S	66.7	Low	89.5	Confident	111 Å²	111	35.6 Å²	35.6	78%	0.776	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-30	177	56	0	0	0	0	112.3	S114	S112-S114 VanDerWaalsContact C-N 3.32Å
113	E	73.6	Confident	89.5	Confident	127 Å²	127	35.5 Å²	35.5	59%	0.593	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-8	178.9	-65.1	-58.2	138.7	0	0	112.9	R61 D111	R61-E113 VanDerWaalsContact CZ-O 3.29Å; R61-E113 PolarHBondContact NH1-O 3.18Å; R61-E113 PolarHBondContact NH2-O 2.96Å; D111-E113 PolarHBondContact O-N 3.23Å; D111-E113 PolarHBondContact OD1-N 3.39Å
114	S	80.5	Confident	89.4	Confident	51 Å²	51	36.6 Å²	36.6	36%	0.357	20%	0.199	S	C	.	.			trans	50.5	58	-175.7	-61.4	0	0	0	0	111.7	R61 L107 D111 S112 L116	R61-S114 PolarHBondContact NH2-O 2.84Å; R61-S114 VanDerWaalsContact NH2-O 3.11Å; L107-S114 WeakPolarHBondContact CD2-O 3.39Å; D111-S114 PolarHBondContact O-N 3.07Å; S112-S114 VanDerWaalsContact C-N 3.32Å; S114-L116 PolarHBondContact O-N 2.77Å
115	K	91.4	Very high	89.3	Confident	128 Å²	128	37.9 Å²	37.9	56%	0.557	21%	0.207	S	C	*	.			trans	-59.9	132.3	-179.9	-177.6	176.8	-179.2	178.9	0	111.7	L107 Q108 D111	L107-K115 CarbonylContact C-O 3.57Å; L107-K115 WeakPolarHBondContact CA-O 3.4Å; Q108-K115 HydrophobicContact CB-CB 4.37Å; Q108-K115 PolarHBondContact N-O 2.68Å; D111-K115 WeakPolarHBondContact OD2-CB 3.39Å; D111-K115 PolarHBondContact OD2-N 3.35Å
116	L	94.2	Very high	89	Confident	10 Å²	10	42.1 Å²	42.1	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	128.3	173.4	-73.2	164	0	0	0	110	R61 I62 Y65 I105 T106 L107 S114	R61-L116 HydrophobicContact CB-CD1 4.27Å; I62-L116 HydrophobicContact CG1-CD1 4.19Å; Y65-L116 HydrophobicContact CD1-CB 4.15Å; Y65-L116 HydrophobicContact CD1-CD1 4.49Å; Y65-L116 HydrophobicContact CD2-CB 3.78Å; Y65-L116 HydrophobicContact CE1-CB 4.36Å; Y65-L116 HydrophobicContact CE2-CB 4.04Å; Y65-L116 WeakPolarHBondContact CE2-O 3.24Å; Y65-L116 HydrophobicContact CG-CB 3.85Å; Y65-L116 HydrophobicContact CG-CD1 4.05Å; I105-L116 HydrophobicContact CB-CD2 3.78Å; I105-L116 HydrophobicContact CD1-CD2 3.95Å; I105-L116 HydrophobicContact CG1-CD2 4.34Å; I105-L116 HydrophobicContact CG2-CD2 4.05Å; T106-L116 WeakPolarHBondContact O-CA 3.29Å; L107-L116 HydrophobicContact CD2-CD2 3.61Å; L107-L116 HydrophobicContact CD2-CG 4.09Å; S114-L116 PolarHBondContact O-N 2.77Å
117	N	92.9	Very high	88.9	Confident	18 Å²	18	45.9 Å²	45.9	10%	0.096	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	2	175.5	-62.9	-18.6	0	0	0	113.4	Y65 T106 Q108 A172 I176	Y65-N117 WeakPolarHBondContact OH-CA 3.48Å; Y65-N117 PolarHBondContact OH-O 3.42Å; Y65-N117 VanDerWaalsContact OH-O 3.07Å; T106-N117 PolarHBondContact O-N 3.33Å; T106-N117 VanDerWaalsContact OG1-C 3.26Å; Q108-N117 PolarHBondContact OE1-ND2 2.79Å; N117-A172 HydrophobicContact CB-CB 4.48Å; N117-A172 WeakPolarHBondContact O-CB 3.37Å; N117-A172 PolarHBondContact O-N 2.93Å; N117-I176 HydrophobicContact CB-CD1 3.45Å; N117-I176 VanDerWaalsContact CB-CD1 3.45Å; N117-I176 WeakPolarHBondContact O-CD1 3.47Å; N117-I176 WeakPolarHBondContact O-CG2 3.33Å
118	G	95.2	Very high	88.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177	153.3	177.9	0	0	0	0	0	111.4	Y65 I105 T106 V170	Y65-G118 PolarHBondContact OH-N 3.39Å; I105-G118 CarbonylContact C-O 3.59Å; I105-G118 WeakPolarHBondContact CA-O 3.32Å; T106-G118 PolarHBondContact N-O 3.02Å; T106-G118 WeakPolarHBondContact OG1-CA 3.4Å; T106-G118 PolarHBondContact OG1-N 3.03Å; G118-V170 CarbonylContact C-O 3.53Å; G118-V170 VanDerWaalsContact CA-O 3.3Å; G118-V170 WeakPolarHBondContact CA-O 3.3Å
119	A	95.5	Very high	88.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143.7	179.3	0	0	0	0	0	110.5	Y65 F66 S104 I105 R169 V170	Y65-A119 HydrophobicContact CD1-CB 4.12Å; Y65-A119 HydrophobicContact CE1-CB 4.25Å; F66-A119 HydrophobicContact CD1-CB 4.4Å; F66-A119 HydrophobicContact CD2-CB 4.14Å; F66-A119 HydrophobicContact CE1-CB 3.69Å; F66-A119 WeakPolarHBondContact CE1-O 3.21Å; F66-A119 HydrophobicContact CE2-CB 3.42Å; F66-A119 VanDerWaalsContact CE2-CB 3.42Å; F66-A119 VanDerWaalsContact CZ-C 3.45Å; F66-A119 HydrophobicContact CZ-CB 3.15Å; S104-A119 CarbonylContact O-C 3.54Å; S104-A119 WeakPolarHBondContact O-CA 3.28Å; I105-A119 HydrophobicContact CG2-CB 4.02Å; A119-R169 WeakPolarHBondContact O-CA 3.47Å; A119-V170 HydrophobicContact CB-CG2 4.5Å; A119-V170 PolarHBondContact N-O 2.94Å; A119-V170 PolarHBondContact O-N 3.24Å; A119-V170 VanDerWaalsContact O-O 3.11Å
120	N	96.5	Very high	89	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	118.1	177.3	-174	35	0	0	0	109.8	S103 S104 V122 S166 R169 L180 T184	S103-N120 CarbonylContact C-O 3.56Å; S103-N120 VanDerWaalsContact CA-O 3.26Å; S103-N120 WeakPolarHBondContact CA-O 3.3Å; S103-N120 WeakPolarHBondContact CB-O 3.48Å; S104-N120 PolarHBondContact N-O 2.74Å; S104-N120 PolarHBondContact O-N 2.89Å; N120-V122 WeakPolarHBondContact ND2-CG2 3.4Å; N120-S166 PolarHBondContact ND2-OG 2.74Å; N120-S166 VanDerWaalsContact OD1-CB 3.29Å; N120-S166 WeakPolarHBondContact OD1-CB 3.33Å; N120-S166 PolarHBondContact OD1-OG 2.85Å; N120-R169 HydrophobicContact CB-CB 4.47Å; N120-R169 HydrophobicContact CB-CG 3.96Å; N120-R169 WeakPolarHBondContact OD1-CB 3.39Å; N120-L180 HydrophobicContact CB-CB 4.46Å; N120-L180 HydrophobicContact CB-CD2 4.34Å; N120-T184 PolarHBondContact ND2-OG1 2.96Å
121	L	95.9	Very high	89.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124	167.5	-55.7	179.3	0	0	0	109.7	I54 F66 W95 A98 L123 T167 L168	I54-L121 HydrophobicContact CD1-CD2 4.09Å; I54-L121 HydrophobicContact CG2-CD2 3.84Å; F66-L121 HydrophobicContact CD2-CD1 4.4Å; F66-L121 HydrophobicContact CE2-CD1 3.92Å; F66-L121 HydrophobicContact CE2-CD2 3.91Å; F66-L121 HydrophobicContact CE2-CG 3.61Å; F66-L121 HydrophobicContact CZ-CD1 4.23Å; F66-L121 HydrophobicContact CZ-CD2 4.18Å; F66-L121 HydrophobicContact CZ-CG 3.6Å; W95-L121 HydrophobicContact CB-CD1 4.23Å; A98-L121 HydrophobicContact CB-CB 4.3Å; A98-L121 HydrophobicContact CB-CD2 4.21Å; L121-L123 HydrophobicContact CB-CD1 4.35Å; L121-T167 PolarHBondContact O-N 3.46Å; L121-L168 HydrophobicContact CB-CB 4.16Å; L121-L168 HydrophobicContact CD1-CB 4.25Å; L121-L168 HydrophobicContact CD1-CD1 3.9Å; L121-L168 HydrophobicContact CG-CB 4.39Å; L121-L168 PolarHBondContact N-O 3.43Å
122	V	97.2	Very high	90.7	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.1	176	-177	0	0	0	0	108.5	A98 D99 M102 S103 N120 F164 I165 T184	A98-V122 WeakPolarHBondContact CA-O 3.45Å; D99-V122 PolarHBondContact N-O 3.04Å; M102-V122 HydrophobicContact CB-CB 3.85Å; M102-V122 HydrophobicContact CB-CG1 3.88Å; M102-V122 HydrophobicContact CB-CG2 3.95Å; M102-V122 HydrophobicContact CE-CG1 4.44Å; M102-V122 HydrophobicContact SD-CG1 4.33Å; S103-V122 PolarHBondContact OG-N 2.93Å; S103-V122 PolarHBondContact OG-O 3.42Å; N120-V122 WeakPolarHBondContact ND2-CG2 3.4Å; V122-F164 HydrophobicContact CG1-CB 3.96Å; V122-F164 HydrophobicContact CG1-CD1 4.27Å; V122-I165 VanDerWaalsContact CA-O 3.27Å; V122-I165 WeakPolarHBondContact CA-O 3.39Å; V122-T184 HydrophobicContact CG2-CG2 3.6Å
123	L	95.8	Very high	91.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	153.9	175.9	-64.4	102.6	0	0	0	110.1	L121 M131 F164 I165 T167	L121-L123 HydrophobicContact CB-CD1 4.35Å; L123-M131 HydrophobicContact CD2-CE 4.13Å; L123-M131 HydrophobicContact CD2-SD 4.13Å; L123-F164 CarbonylContact O-C 3.59Å; L123-F164 VanDerWaalsContact O-CA 3.28Å; L123-F164 WeakPolarHBondContact O-CA 3.41Å; L123-I165 HydrophobicContact CB-CG1 4.22Å; L123-I165 PolarHBondContact N-O 2.94Å; L123-I165 WeakPolarHBondContact O-CG1 3.25Å; L123-I165 PolarHBondContact O-N 3.35Å; L123-T167 HydrophobicContact CD1-CG2 3.64Å
124	S	95.3	Very high	92.7	Very high	22 Å²	22	38.7 Å²	38.7	15%	0.154	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	138.8	162.5	175.8	0	0	0	0	108.9	S126 K127 A163	S124-S126 PolarHBondContact O-N 3.45Å; S124-S126 PolarHBondContact OG-N 3.32Å; S124-S126 PolarHBondContact OG-OG 3.21Å; S124-K127 WeakPolarHBondContact O-CB 3.29Å; S124-K127 PolarHBondContact O-N 2.91Å; S124-A163 CarbonylContact C-O 3.5Å; S124-A163 WeakPolarHBondContact CA-O 3.05Å
125	T	94.1	Very high	93.2	Very high	27 Å²	27	38.8 Å²	38.8	17%	0.166	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-56.2	-31	173.5	54.2	0	0	0	0	112.1	K127 L128 A163 I165 Y199	T125-K127 PolarHBondContact O-N 3.44Å; T125-K127 VanDerWaalsContact O-N 3.16Å; T125-L128 WeakPolarHBondContact O-CB 3.4Å; T125-L128 WeakPolarHBondContact O-CG 3.45Å; T125-L128 PolarHBondContact O-N 2.93Å; T125-L128 VanDerWaalsContact O-N 3.12Å; T125-A163 HydrophobicContact CG2-CB 3.91Å; T125-A163 PolarHBondContact N-O 3.5Å; T125-A163 WeakPolarHBondContact OG1-CB 2.95Å; T125-A163 PolarHBondContact OG1-O 2.91Å; T125-I165 HydrophobicContact CG2-CG2 3.63Å; T125-Y199 HydrophobicContact CG2-CD2 4.43Å
126	S	91.8	Very high	93.2	Very high	89 Å²	89	39.5 Å²	39.5	62%	0.622	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-63.4	-19.1	176.4	69.1	0	0	0	0	113.7	S124	S124-S126 PolarHBondContact O-N 3.45Å; S124-S126 PolarHBondContact OG-N 3.32Å; S124-S126 PolarHBondContact OG-OG 3.21Å
127	K	92.8	Very high	93.1	Very high	79 Å²	79	39.3 Å²	39.3	34%	0.343	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-89.2	-8.8	178.3	-63.3	-169.2	-178	-175.3	0	113.4	S97 S124 T125 G129 D130 M131	S97-K127 WeakPolarHBondContact O-CD 3.49Å; S97-K127 PolarHBondContact O-NZ 3.32Å; S124-K127 WeakPolarHBondContact O-CB 3.29Å; S124-K127 PolarHBondContact O-N 2.91Å; T125-K127 PolarHBondContact O-N 3.44Å; T125-K127 VanDerWaalsContact O-N 3.16Å; K127-G129 VanDerWaalsContact C-N 3.34Å; K127-G129 PolarHBondContact O-N 2.87Å; K127-D130 PolarHBondContact O-N 2.94Å; K127-M131 WeakPolarHBondContact O-CG 3.39Å; K127-M131 PolarHBondContact O-N 3.4Å
128	L	92	Very high	93.2	Very high	5 Å²	5	41.2 Å²	41.2	3%	0.026	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-60.2	-42.5	-174.9	-77.5	180	0	0	0	112.6	T125 D130 M131 L141 Y148 I165	T125-L128 WeakPolarHBondContact O-CB 3.4Å; T125-L128 WeakPolarHBondContact O-CG 3.45Å; T125-L128 PolarHBondContact O-N 2.93Å; T125-L128 VanDerWaalsContact O-N 3.12Å; L128-D130 PolarHBondContact O-N 2.82Å; L128-M131 HydrophobicContact CD2-SD 3.76Å; L128-M131 PolarHBondContact O-N 3.46Å; L128-L141 HydrophobicContact CD2-CD2 4.2Å; L128-Y148 HydrophobicContact CD1-CD2 3.71Å; L128-Y148 HydrophobicContact CD1-CE2 3.99Å; L128-I165 HydrophobicContact CD1-CD1 3.8Å; L128-I165 HydrophobicContact CD2-CD1 3.31Å; L128-I165 HydrophobicContact CG-CD1 3.7Å
129	G	88.4	Confident	93	Very high	74 Å²	74	44.1 Å²	44.1	76%	0.763	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-67.4	-21.7	-179.6	0	0	0	0	0	114.2	K127	K127-G129 VanDerWaalsContact C-N 3.34Å; K127-G129 PolarHBondContact O-N 2.87Å
130	D	90	Very high	92.9	Very high	141 Å²	141	44.9 Å²	44.9	75%	0.754	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-95	-1.9	-178.4	-58.2	-35.7	0	0	0	112.7	K127 L128	K127-D130 PolarHBondContact O-N 2.94Å; L128-D130 PolarHBondContact O-N 2.82Å
131	M	92.4	Very high	92.8	Very high	20 Å²	20	45.6 Å²	45.6	10%	0.099	27%	0.272	C	S	.	.	S	Bend	trans	-72	135.1	-178.5	-69.9	179.7	78.4	0	0	110.7	H90 A94 L123 K127 L128 A133 L141	H90-M131 VanDerWaalsContact CE1-CE 3.4Å; H90-M131 WeakPolarHBondContact CE1-CE 3.13Å; A94-M131 HydrophobicContact CB-CE 3.42Å; A94-M131 VanDerWaalsContact CB-CE 3.42Å; L123-M131 HydrophobicContact CD2-CE 4.13Å; L123-M131 HydrophobicContact CD2-SD 4.13Å; K127-M131 WeakPolarHBondContact O-CG 3.39Å; K127-M131 PolarHBondContact O-N 3.4Å; L128-M131 HydrophobicContact CD2-SD 3.76Å; L128-M131 PolarHBondContact O-N 3.46Å; M131-A133 PolarHBondContact O-N 3.03Å; M131-L141 HydrophobicContact CB-CD1 3.75Å; M131-L141 HydrophobicContact SD-CD1 4.39Å; M131-L141 HydrophobicContact SD-CD2 4.36Å
132	Y	93	Very high	92.7	Very high	106 Å²	106	49.7 Å²	49.7	42%	0.416	29%	0.294	S	S	.	.			trans	-60.8	111.7	167.2	174.2	-100.2	0	0	0	109.8	T89 H90 L93 P134	T89-Y132 HydrophobicContact CG2-CD1 3.8Å; T89-Y132 HydrophobicContact CG2-CE1 3.41Å; T89-Y132 VanDerWaalsContact CG2-CE1 3.41Å; H90-Y132 PolarHBondContact ND1-O 2.88Å; L93-Y132 HydrophobicContact CD1-CD1 3.79Å; L93-Y132 HydrophobicContact CD1-CD2 4.27Å; L93-Y132 HydrophobicContact CD1-CG 3.54Å; Y132-P134 HydrophobicContact CD1-CG 4.38Å; Y132-P134 HydrophobicContact CE1-CG 3.58Å
133	A	92.6	Very high	92.6	Very high	18 Å²	18	50.3 Å²	50.3	15%	0.149	30%	0.297	C	S	.	.			trans	-141.1	86.4	-174.5	0	0	0	0	0	109.7	M131 I137 T138 L141	M131-A133 PolarHBondContact O-N 3.03Å; A133-I137 HydrophobicContact CB-CB 4.11Å; A133-I137 HydrophobicContact CB-CG2 3.68Å; A133-T138 PolarHBondContact O-OG1 2.92Å; A133-L141 HydrophobicContact CB-CD1 3.37Å; A133-L141 HydrophobicContact CB-CG 4.11Å
134	P	90.4	Very high	92.5	Very high	25 Å²	25	50.5 Å²	50.5	16%	0.162	30%	0.298	C	S	.	.			trans	-78.8	148	176.9	32	-37.3	0	0	0	111.8	M86 Y132 R136 I137	M86-P134 HydrophobicContact CB-CG 4.05Å; M86-P134 HydrophobicContact CG-CG 4.07Å; M86-P134 HydrophobicContact SD-CB 4.32Å; M86-P134 HydrophobicContact SD-CG 4.17Å; Y132-P134 HydrophobicContact CD1-CG 4.38Å; Y132-P134 HydrophobicContact CE1-CG 3.58Å; P134-R136 PolarHBondContact O-N 3.4Å; P134-I137 HydrophobicContact CG-CD1 4.46Å; P134-I137 WeakPolarHBondContact O-CB 3.43Å; P134-I137 PolarHBondContact O-N 2.81Å
135	G	90.4	Very high	92.5	Very high	52 Å²	52	51.7 Å²	51.7	54%	0.536	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	-127.2	169.5	0	0	0	0	0	113.3	I137 T138	G135-I137 PolarHBondContact O-N 3.32Å; G135-T138 WeakPolarHBondContact O-CB 3Å; G135-T138 PolarHBondContact O-N 2.86Å; G135-T138 VanDerWaalsContact O-N 3.09Å; G135-T138 PolarHBondContact O-OG1 3.19Å; G135-T138 VanDerWaalsContact O-OG1 3.05Å
136	R	91.3	Very high	92.5	Very high	144 Å²	144	56.7 Å²	56.7	54%	0.543	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-20.8	-177.8	-67.5	-179.9	-178.1	-86.9	6.1	113.6	L80 I82 P134 T138 S139 V140	L80-R136 WeakPolarHBondContact O-CD 3.07Å; L80-R136 PolarHBondContact O-NE 3.34Å; L80-R136 VanDerWaalsContact O-NE 3.14Å; I82-R136 HydrophobicContact CD1-CB 3.82Å; I82-R136 HydrophobicContact CG1-CB 3.96Å; P134-R136 PolarHBondContact O-N 3.4Å; R136-T138 VanDerWaalsContact C-N 3.27Å; R136-T138 PolarHBondContact O-N 2.84Å; R136-S139 PolarHBondContact O-N 3.41Å; R136-V140 WeakPolarHBondContact O-CG2 3.47Å; R136-V140 PolarHBondContact O-N 3.47Å; R136-V140 VanDerWaalsContact O-N 3.11Å
137	I	92	Very high	92.7	Very high	6 Å²	6	52.5 Å²	52.5	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-63.7	-37.3	174.5	-53.2	-176.4	0	0	0	109.8	I82 M86 Y87 H90 A133 P134 G135 S139 V140 L141	I82-I137 HydrophobicContact CD1-CG1 3.64Å; I82-I137 HydrophobicContact CG2-CD1 3.92Å; I82-I137 HydrophobicContact CG2-CG1 3.79Å; M86-I137 HydrophobicContact CB-CD1 4.34Å; Y87-I137 HydrophobicContact CD1-CD1 4.14Å; H90-I137 HydrophobicContact CB-CD1 3.66Å; A133-I137 HydrophobicContact CB-CB 4.11Å; A133-I137 HydrophobicContact CB-CG2 3.68Å; P134-I137 HydrophobicContact CG-CD1 4.46Å; P134-I137 WeakPolarHBondContact O-CB 3.43Å; P134-I137 PolarHBondContact O-N 2.81Å; G135-I137 PolarHBondContact O-N 3.32Å; I137-S139 VanDerWaalsContact C-N 3.33Å; I137-S139 PolarHBondContact O-N 3.02Å; I137-V140 PolarHBondContact O-N 3.37Å; I137-L141 HydrophobicContact CG2-CG 4.47Å; I137-L141 WeakPolarHBondContact O-CG 3.5Å; I137-L141 PolarHBondContact O-N 3.2Å
138	T	94	Very high	92.8	Very high	57 Å²	57	49 Å²	49	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-58.8	-46.4	175.4	-34	0	0	0	0	110.7	A133 G135 R136 V140 L141 D142	A133-T138 PolarHBondContact O-OG1 2.92Å; G135-T138 WeakPolarHBondContact O-CB 3Å; G135-T138 PolarHBondContact O-N 2.86Å; G135-T138 VanDerWaalsContact O-N 3.09Å; G135-T138 PolarHBondContact O-OG1 3.19Å; G135-T138 VanDerWaalsContact O-OG1 3.05Å; R136-T138 VanDerWaalsContact C-N 3.27Å; R136-T138 PolarHBondContact O-N 2.84Å; T138-V140 VanDerWaalsContact C-N 3.33Å; T138-V140 PolarHBondContact O-N 2.96Å; T138-L141 PolarHBondContact O-N 2.84Å; T138-L141 VanDerWaalsContact O-N 3.16Å; T138-D142 PolarHBondContact O-N 3.44Å
139	S	92.8	Very high	92.9	Very high	61 Å²	61	53.4 Å²	53.4	43%	0.427	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-39.4	-180	-51	0	0	0	0	112.4	R136 I137 F143	R136-S139 PolarHBondContact O-N 3.41Å; I137-S139 VanDerWaalsContact C-N 3.33Å; I137-S139 PolarHBondContact O-N 3.02Å; S139-F143 WeakPolarHBondContact O-CB 3.22Å; S139-F143 PolarHBondContact O-N 2.03Å
140	V	92.5	Very high	93.2	Very high	17 Å²	17	55.5 Å²	55.5	10%	0.103	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-45.2	173.9	176.5	0	0	0	0	110.8	V77 L80 R136 I137 T138 F143 V144 W233 M236	V77-V140 HydrophobicContact CG1-CG1 4.27Å; V77-V140 HydrophobicContact CG1-CG2 4.46Å; L80-V140 HydrophobicContact CD1-CG2 3.3Å; R136-V140 WeakPolarHBondContact O-CG2 3.47Å; R136-V140 PolarHBondContact O-N 3.47Å; R136-V140 VanDerWaalsContact O-N 3.11Å; I137-V140 PolarHBondContact O-N 3.37Å; T138-V140 VanDerWaalsContact C-N 3.33Å; T138-V140 PolarHBondContact O-N 2.96Å; V140-F143 PolarHBondContact O-N 3.45Å; V140-V144 HydrophobicContact CG1-CG1 4.45Å; V140-V144 WeakPolarHBondContact O-CG1 3.48Å; V140-V144 WeakPolarHBondContact O-CG2 3.38Å; V140-V144 PolarHBondContact O-N 3.3Å; V140-W233 HydrophobicContact CG1-CH2 4.26Å; V140-W233 HydrophobicContact CG1-CZ3 4.41Å; V140-M236 HydrophobicContact CB-CE 4.49Å; V140-M236 HydrophobicContact CG2-CE 3.81Å
141	L	93.9	Very high	93.4	Very high	15 Å²	15	48.9 Å²	48.9	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-42.5	178	-73.1	-166	0	0	0	112.3	L128 M131 A133 I137 T138 F143 V144 T145	L128-L141 HydrophobicContact CD2-CD2 4.2Å; M131-L141 HydrophobicContact CB-CD1 3.75Å; M131-L141 HydrophobicContact SD-CD1 4.39Å; M131-L141 HydrophobicContact SD-CD2 4.36Å; A133-L141 HydrophobicContact CB-CD1 3.37Å; A133-L141 HydrophobicContact CB-CG 4.11Å; I137-L141 HydrophobicContact CG2-CG 4.47Å; I137-L141 WeakPolarHBondContact O-CG 3.5Å; I137-L141 PolarHBondContact O-N 3.2Å; T138-L141 PolarHBondContact O-N 2.84Å; T138-L141 VanDerWaalsContact O-N 3.16Å; L141-F143 VanDerWaalsContact C-N 3.35Å; L141-F143 PolarHBondContact O-N 2.81Å; L141-V144 HydrophobicContact CD2-CG2 4.38Å; L141-V144 WeakPolarHBondContact O-CG2 3.49Å; L141-V144 PolarHBondContact O-N 3.34Å; L141-T145 WeakPolarHBondContact O-CB 3.36Å; L141-T145 PolarHBondContact O-N 2.96Å; L141-T145 PolarHBondContact O-OG1 2.88Å
142	D	94	Very high	93.4	Very high	85 Å²	85	51.5 Å²	51.5	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-61.5	-44.6	176.4	-74.4	-16	0	0	0	111.5	T138 K146	T138-D142 PolarHBondContact O-N 3.44Å; D142-K146 VanDerWaalsContact O-CG 3.31Å; D142-K146 WeakPolarHBondContact O-CG 3.4Å; D142-K146 PolarHBondContact O-N 3.07Å
143	F	94.4	Very high	93.4	Very high	14 Å²	14	47.4 Å²	47.4	6%	0.061	25%	0.247	C	C	.	.	H	α-helix	trans	-60.3	-53.5	176.4	164.8	-99.2	0	0	0	111.6	S139 V140 L141 T145 K146 C147 P230 D232 W233 L235 M236	S139-F143 WeakPolarHBondContact O-CB 3.22Å; S139-F143 PolarHBondContact O-N 2.03Å; V140-F143 PolarHBondContact O-N 3.45Å; L141-F143 VanDerWaalsContact C-N 3.35Å; L141-F143 PolarHBondContact O-N 2.81Å; F143-T145 VanDerWaalsContact C-N 3.31Å; F143-T145 PolarHBondContact O-N 3.1Å; F143-K146 PolarHBondContact O-N 3.35Å; F143-C147 PolarHBondContact O-N 2.84Å; F143-P230 WeakPolarHBondContact CE2-O 3.46Å; F143-D232 WeakPolarHBondContact CE2-O 3.46Å; F143-W233 HydrophobicContact CD1-CE3 4.33Å; F143-W233 HydrophobicContact CD1-CH2 4.02Å; F143-W233 HydrophobicContact CD1-CZ2 4.25Å; F143-W233 HydrophobicContact CD1-CZ3 4.07Å; F143-W233 AromaticContact CE1-CD2 3.64Å; F143-W233 HydrophobicContact CE1-CD2 3.64Å; F143-W233 AromaticContact CE1-CE2 3.54Å; F143-W233 AromaticContact CE1-CE3 3.82Å; F143-W233 HydrophobicContact CE1-CE3 3.82Å; F143-W233 HydrophobicContact CE1-CG 4.23Å; F143-W233 AromaticContact CE1-CH2 3.81Å; F143-W233 HydrophobicContact CE1-CH2 3.81Å; F143-W233 AromaticContact CE1-CZ2 3.62Å; F143-W233 HydrophobicContact CE1-CZ2 3.62Å; F143-W233 AromaticContact CE1-CZ3 3.91Å; F143-W233 HydrophobicContact CE1-CZ3 3.91Å; F143-W233 HydrophobicContact CZ-CD2 4.1Å; F143-W233 HydrophobicContact CZ-CG 4.22Å; F143-L235 HydrophobicContact CD2-CB 4.36Å; F143-L235 HydrophobicContact CD2-CD1 4.47Å; F143-L235 HydrophobicContact CE2-CB 4.29Å; F143-L235 HydrophobicContact CE2-CD1 4.2Å; F143-M236 HydrophobicContact CB-CG 4.02Å; F143-M236 HydrophobicContact CB-SD 3.6Å; F143-M236 VanDerWaalsContact CB-SD 3.6Å; F143-M236 HydrophobicContact CD1-CG 3.79Å; F143-M236 HydrophobicContact CD1-SD 4.5Å; F143-M236 HydrophobicContact CD2-CG 4.03Å; F143-M236 HydrophobicContact CD2-SD 4.35Å; F143-M236 HydrophobicContact CE1-CG 4.29Å; F143-M236 HydrophobicContact CE2-CG 4.48Å; F143-M236 HydrophobicContact CG-CG 3.65Å; F143-M236 HydrophobicContact CG-SD 3.9Å
144	V	94.8	Very high	93	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-67.2	-34.4	-177.8	-59.2	0	0	0	0	111.7	V140 L141 C147 Y148 W233	V140-V144 HydrophobicContact CG1-CG1 4.45Å; V140-V144 WeakPolarHBondContact O-CG1 3.48Å; V140-V144 WeakPolarHBondContact O-CG2 3.38Å; V140-V144 PolarHBondContact O-N 3.3Å; L141-V144 HydrophobicContact CD2-CG2 4.38Å; L141-V144 WeakPolarHBondContact O-CG2 3.49Å; L141-V144 PolarHBondContact O-N 3.34Å; V144-C147 PolarHBondContact O-N 3.31Å; V144-Y148 HydrophobicContact CB-CD2 4.25Å; V144-Y148 HydrophobicContact CB-CE2 3.69Å; V144-Y148 HydrophobicContact CG2-CD2 4.48Å; V144-Y148 HydrophobicContact CG2-CE2 3.91Å; V144-Y148 WeakPolarHBondContact O-CD2 3.15Å; V144-Y148 PolarHBondContact O-N 3.4Å; V144-W233 HydrophobicContact CG1-CH2 3.83Å; V144-W233 HydrophobicContact CG1-CZ2 3.97Å
145	T	94.9	Very high	92.6	Very high	46 Å²	46	58.1 Å²	58.1	28%	0.282	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-49.3	176.5	-59.7	0	0	0	0	110.6	L141 F143 C147 Y148 E149	L141-T145 WeakPolarHBondContact O-CB 3.36Å; L141-T145 PolarHBondContact O-N 2.96Å; L141-T145 PolarHBondContact O-OG1 2.88Å; F143-T145 VanDerWaalsContact C-N 3.31Å; F143-T145 PolarHBondContact O-N 3.1Å; T145-C147 VanDerWaalsContact C-N 3.31Å; T145-C147 PolarHBondContact O-N 2.88Å; T145-Y148 PolarHBondContact O-N 3.17Å; T145-E149 WeakPolarHBondContact O-CB 3.4Å; T145-E149 WeakPolarHBondContact O-CG 3.5Å; T145-E149 PolarHBondContact O-N 2.94Å
146	K	94.6	Very high	92.2	Very high	133 Å²	133	60.8 Å²	60.8	58%	0.578	31%	0.312	S	S	*	.	H	α-helix	trans	-59.5	-41.9	175.7	-71.8	170.8	-174.3	172.3	0	112.1	D142 F143 W150	D142-K146 VanDerWaalsContact O-CG 3.31Å; D142-K146 WeakPolarHBondContact O-CG 3.4Å; D142-K146 PolarHBondContact O-N 3.07Å; F143-K146 PolarHBondContact O-N 3.35Å; K146-W150 PolarHBondContact O-N 3.02Å
147	C	95.5	Very high	91.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-61.6	-47.7	175.4	170.5	0	0	0	0	112.1	F143 V144 T145 E149 W150 A151 W201 C231	F143-C147 PolarHBondContact O-N 2.84Å; V144-C147 PolarHBondContact O-N 3.31Å; T145-C147 VanDerWaalsContact C-N 3.31Å; T145-C147 PolarHBondContact O-N 2.88Å; C147-E149 VanDerWaalsContact C-N 3.34Å; C147-E149 PolarHBondContact O-N 3Å; C147-W150 PolarHBondContact O-N 3.04Å; C147-A151 WeakPolarHBondContact O-CB 3.44Å; C147-A151 PolarHBondContact O-N 3.49Å; C147-W201 WeakPolarHBondContact SG-CZ2 3.28Å; C147-C231 WeakPolarHBondContact CA-SG 3.29Å; C147-C231 HydrophobicContact CB-CB 3.98Å; C147-C231 WeakPolarHBondContact CB-SG 3.32Å; C147-C231 VanDerWaalsContact SG-CA 3.55Å; C147-C231 WeakPolarHBondContact SG-CB 3.31Å; C147-C231 CovalentContact SG-SG 2.03Å; C147-C231 PolarHBondContact SG-SG 2.82Å
148	Y	95.6	Very high	91.1	Very high	5 Å²	5	62.4 Å²	62.4	2%	0.02	34%	0.337	C	S	.	.	H	α-helix	trans	-67.1	-33.8	-179.4	-63.4	-42.8	0	0	0	113.3	L128 V144 T145 A151 K152 I165 Y199 W201 L248	L128-Y148 HydrophobicContact CD1-CD2 3.71Å; L128-Y148 HydrophobicContact CD1-CE2 3.99Å; V144-Y148 HydrophobicContact CB-CD2 4.25Å; V144-Y148 HydrophobicContact CB-CE2 3.69Å; V144-Y148 HydrophobicContact CG2-CD2 4.48Å; V144-Y148 HydrophobicContact CG2-CE2 3.91Å; V144-Y148 WeakPolarHBondContact O-CD2 3.15Å; V144-Y148 PolarHBondContact O-N 3.4Å; T145-Y148 PolarHBondContact O-N 3.17Å; Y148-A151 PolarHBondContact O-N 2.86Å; Y148-K152 WeakPolarHBondContact O-CG 3.36Å; Y148-K152 PolarHBondContact O-N 3.16Å; Y148-I165 HydrophobicContact CD1-CG2 4.23Å; Y148-I165 HydrophobicContact CD2-CG2 3.9Å; Y148-I165 HydrophobicContact CE1-CG2 3.93Å; Y148-I165 HydrophobicContact CE2-CB 4.36Å; Y148-I165 HydrophobicContact CE2-CD1 4Å; Y148-I165 HydrophobicContact CE2-CG2 3.56Å; Y148-I165 HydrophobicContact CG-CG2 4.23Å; Y148-Y199 HydrophobicContact CD1-CD1 4.47Å; Y148-Y199 AromaticContact CD1-CD2 3.61Å; Y148-Y199 HydrophobicContact CD1-CD2 3.61Å; Y148-Y199 AromaticContact CD1-CE2 3.99Å; Y148-Y199 HydrophobicContact CD1-CE2 3.99Å; Y148-Y199 AromaticContact CD1-CG 3.87Å; Y148-Y199 HydrophobicContact CD1-CG 3.87Å; Y148-Y199 HydrophobicContact CE1-CD2 4.16Å; Y148-Y199 HydrophobicContact CE1-CG 4.1Å; Y148-Y199 HydrophobicContact CG-CD2 4.12Å; Y148-Y199 HydrophobicContact CG-CE2 4.28Å; Y148-Y199 PolarHBondContact O-OH 2.88Å; Y148-W201 AromaticContact CE1-NE1 3.61Å; Y148-W201 AromaticContact CZ-NE1 3.62Å; Y148-W201 VanDerWaalsContact OH-CD1 3.32Å; Y148-W201 PolarHBondContact OH-NE1 3.37Å; Y148-L248 HydrophobicContact CD1-CD1 4.33Å; Y148-L248 HydrophobicContact CD1-CD2 4.33Å; Y148-L248 HydrophobicContact CE1-CD1 3.82Å
149	E	93.8	Very high	90.6	Very high	99 Å²	99	66.2 Å²	66.2	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-63.1	-46.7	172.4	-76	-61	129.5	0	0	111.5	T145 C147 A151 K152	T145-E149 WeakPolarHBondContact O-CB 3.4Å; T145-E149 WeakPolarHBondContact O-CG 3.5Å; T145-E149 PolarHBondContact O-N 2.94Å; C147-E149 VanDerWaalsContact C-N 3.34Å; C147-E149 PolarHBondContact O-N 3Å; E149-A151 VanDerWaalsContact C-N 3.33Å; E149-A151 PolarHBondContact O-N 2.93Å; E149-K152 VanDerWaalsContact CD-CE 3.47Å; E149-K152 WeakPolarHBondContact O-CG 3.32Å; E149-K152 PolarHBondContact O-N 3.5Å; E149-K152 WeakPolarHBondContact OE1-CE 3.44Å; E149-K152 IonicContact OE1-NZ 2.62Å; E149-K152 PolarHBondContact OE1-NZ 2.8Å; E149-K152 VanDerWaalsContact OE2-CE 3.29Å; E149-K152 WeakPolarHBondContact OE2-CE 3.38Å; E149-K152 IonicContact OE2-NZ 3.8Å; E149-K152 PolarHBondContact OE2-NZ 3.45Å
150	W	93.5	Very high	90.3	Very high	117 Å²	117	66.5 Å²	66.5	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-65.7	-36.6	174.8	177.6	88.8	0	0	0	112.5	K146 C147 K152 V219 I220 P230	K146-W150 PolarHBondContact O-N 3.02Å; C147-W150 PolarHBondContact O-N 3.04Å; W150-K152 PolarHBondContact O-N 3.34Å; W150-V219 HydrophobicContact CZ3-CG1 4.14Å; W150-I220 HydrophobicContact CH2-CB 4.34Å; W150-I220 HydrophobicContact CH2-CG1 4.36Å; W150-I220 HydrophobicContact CZ3-CB 4.08Å; W150-I220 HydrophobicContact CZ3-CG1 4.44Å; W150-I220 HydrophobicContact CZ3-CG2 3.94Å; W150-P230 HydrophobicContact CB-CB 4.48Å; W150-P230 HydrophobicContact CB-CG 3.49Å; W150-P230 VanDerWaalsContact CB-CG 3.49Å; W150-P230 HydrophobicContact CD2-CG 3.55Å; W150-P230 HydrophobicContact CE3-CG 4.03Å; W150-P230 HydrophobicContact CG-CG 3.29Å
151	A	94.3	Very high	90.2	Very high	2 Å²	2	67.4 Å²	67.4	2%	0.017	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	3.4	-177.4	0	0	0	0	0	114	C147 Y148 E149 Y199 V219 L248 R250	C147-A151 WeakPolarHBondContact O-CB 3.44Å; C147-A151 PolarHBondContact O-N 3.49Å; Y148-A151 PolarHBondContact O-N 2.86Å; E149-A151 VanDerWaalsContact C-N 3.33Å; E149-A151 PolarHBondContact O-N 2.93Å; A151-Y199 HydrophobicContact CB-CE1 3.97Å; A151-Y199 PolarHBondContact O-OH 3.29Å; A151-V219 HydrophobicContact CB-CG1 4.01Å; A151-L248 HydrophobicContact CB-CD2 3.5Å; A151-L248 VanDerWaalsContact CB-CD2 3.5Å; A151-R250 PolarHBondContact O-NH1 2.81Å
152	K	93.5	Very high	90.2	Very high	76 Å²	76	69.1 Å²	69.1	33%	0.33	39%	0.385	S	S	.	.	S	Bend	trans	-58.5	146.6	179.2	-72.7	-176.9	173.2	167.3	0	111.7	Y148 E149 W150 N154 Y197 Y199 R250	Y148-K152 WeakPolarHBondContact O-CG 3.36Å; Y148-K152 PolarHBondContact O-N 3.16Å; E149-K152 VanDerWaalsContact CD-CE 3.47Å; E149-K152 WeakPolarHBondContact O-CG 3.32Å; E149-K152 PolarHBondContact O-N 3.5Å; E149-K152 WeakPolarHBondContact OE1-CE 3.44Å; E149-K152 IonicContact OE1-NZ 2.62Å; E149-K152 PolarHBondContact OE1-NZ 2.8Å; E149-K152 VanDerWaalsContact OE2-CE 3.29Å; E149-K152 WeakPolarHBondContact OE2-CE 3.38Å; E149-K152 IonicContact OE2-NZ 3.8Å; E149-K152 PolarHBondContact OE2-NZ 3.45Å; W150-K152 PolarHBondContact O-N 3.34Å; K152-N154 PolarHBondContact O-N 3.43Å; K152-Y197 WeakPolarHBondContact CG-OH 3.49Å; K152-Y199 WeakPolarHBondContact CA-OH 3.5Å; K152-Y199 PolarHBondContact N-OH 2.62Å; K152-R250 PolarHBondContact O-NH1 2.98Å
153	P	92.1	Very high	90.3	Very high	20 Å²	20	65.4 Å²	65.4	13%	0.13	37%	0.367	C	S	.	.			trans	-58.5	138	172	-22.7	32.7	0	0	0	111.1	T155 Y197 R250 I252	P153-T155 PolarHBondContact O-N 2.96Å; P153-Y197 HydrophobicContact CG-CD1 3.75Å; P153-Y197 HydrophobicContact CG-CE1 4.12Å; P153-Y197 HydrophobicContact CG-CG 4.1Å; P153-R250 VanDerWaalsContact CA-NH1 3.34Å; P153-R250 VanDerWaalsContact N-NH1 3.13Å; P153-I252 HydrophobicContact CB-CD1 4.13Å; P153-I252 HydrophobicContact CG-CD1 3.89Å; P153-I252 HydrophobicContact CG-CG1 4.37Å
154	N	85.3	Confident	90.4	Very high	172 Å²	172	65.8 Å²	65.8	92%	0.92	37%	0.368	S	S	*	.	S	Bend	trans	-72.2	8.2	177.9	-67.5	-23.9	0	0	0	113.7	K152	K152-N154 PolarHBondContact O-N 3.43Å
155	T	81.5	Confident	90.5	Very high	95 Å²	95	65.6 Å²	65.6	58%	0.583	37%	0.367	S	S	*	.	S	Bend	trans	-80.1	150.3	179.1	50.5	0	0	0	0	110.8	P153	P153-T155 PolarHBondContact O-N 2.96Å
156	P	82	Confident	90.6	Very high	109 Å²	109	63.7 Å²	63.7	71%	0.708	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-50	137.6	174	-27.4	35	0	0	0	111.7	I158	P156-I158 PolarHBondContact O-N 3.28Å
157	P	76	Confident	89.8	Confident	125 Å²	125	59.1 Å²	59.1	81%	0.812	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-57.9	125.1	179.2	-22.4	31.7	0	0	0	110.7
158	I	84.8	Confident	89.4	Confident	58 Å²	58	60.1 Å²	60.1	30%	0.297	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-89.8	120.4	169.8	-57.1	-170.9	0	0	0	106.4	P156 S160 S161 H194	P156-I158 PolarHBondContact O-N 3.28Å; I158-S160 PolarHBondContact O-N 2.89Å; I158-S161 WeakPolarHBondContact O-CB 3.34Å; I158-S161 PolarHBondContact O-N 3.41Å; I158-S161 PolarHBondContact O-OG 3.02Å; I158-H194 VanDerWaalsContact CD1-CD2 3.44Å; I158-H194 WeakPolarHBondContact CD1-CD2 3.5Å
159	P	83.8	Confident	89.3	Confident	138 Å²	138	61 Å²	61	90%	0.896	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-30.1	-171.1	-30	35.7	0	0	0	115.1
160	S	85.2	Confident	89.3	Confident	67 Å²	67	56.7 Å²	56.7	47%	0.469	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-8.1	178.1	70.4	0	0	0	0	114.3	I158 T193	I158-S160 PolarHBondContact O-N 2.89Å; S160-T193 PolarHBondContact O-OG1 3.28Å; S160-T193 VanDerWaalsContact O-OG1 3.1Å; S160-T193 PolarHBondContact OG-OG1 3.4Å; S160-T193 VanDerWaalsContact OG-OG1 3.11Å
161	S	91	Very high	89.3	Confident	35 Å²	35	52.7 Å²	52.7	25%	0.245	32%	0.318	C	S	.	.			trans	-66.9	140.2	-177.4	64.7	0	0	0	0	111.1	I158	I158-S161 WeakPolarHBondContact O-CB 3.34Å; I158-S161 PolarHBondContact O-N 3.41Å; I158-S161 PolarHBondContact O-OG 3.02Å
162	S	93.5	Very high	89.2	Confident	52 Å²	52	55.6 Å²	55.6	36%	0.364	34%	0.342	S	S	.	.			trans	-127.3	154.3	179	-68.1	0	0	0	0	110.5	S196 Y197	S162-S196 PolarHBondContact N-OG 2.92Å; S162-S196 VanDerWaalsContact N-OG 3.12Å; S162-S196 CarbonylContact O-C 3.56Å; S162-S196 WeakPolarHBondContact O-CA 3.28Å; S162-S196 WeakPolarHBondContact O-CB 3.48Å; S162-Y197 PolarHBondContact O-N 3.13Å
163	A	95.8	Very high	89.1	Confident	7 Å²	7	55.2 Å²	55.2	6%	0.058	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.2	-172.5	0	0	0	0	0	109.8	S124 T125 Y197	S124-A163 CarbonylContact C-O 3.5Å; S124-A163 WeakPolarHBondContact CA-O 3.05Å; T125-A163 HydrophobicContact CG2-CB 3.91Å; T125-A163 PolarHBondContact N-O 3.5Å; T125-A163 WeakPolarHBondContact OG1-CB 2.95Å; T125-A163 PolarHBondContact OG1-O 2.91Å; A163-Y197 CarbonylContact C-O 3.54Å; A163-Y197 WeakPolarHBondContact CA-O 3.42Å; A163-Y197 HydrophobicContact CB-CD2 3.86Å; A163-Y197 HydrophobicContact CB-CE1 4.07Å; A163-Y197 HydrophobicContact CB-CE2 3.21Å; A163-Y197 WeakPolarHBondContact CB-OH 3.41Å
164	F	97.5	Very high	89.1	Confident	22 Å²	22	57.1 Å²	57.1	10%	0.096	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	153.8	-175.4	-62.9	-88.2	0	0	0	111.7	M102 V122 L123 F188 T192 Y197 H198 Y199	M102-F164 HydrophobicContact CE-CD1 3.39Å; M102-F164 HydrophobicContact CE-CD2 4.16Å; M102-F164 HydrophobicContact CE-CE1 3.29Å; M102-F164 HydrophobicContact CE-CE2 4.07Å; M102-F164 HydrophobicContact CE-CG 3.84Å; M102-F164 HydrophobicContact CE-CZ 3.65Å; M102-F164 HydrophobicContact SD-CD1 4.4Å; M102-F164 HydrophobicContact SD-CG 4.33Å; V122-F164 HydrophobicContact CG1-CB 3.96Å; V122-F164 HydrophobicContact CG1-CD1 4.27Å; L123-F164 CarbonylContact O-C 3.59Å; L123-F164 VanDerWaalsContact O-CA 3.28Å; L123-F164 WeakPolarHBondContact O-CA 3.41Å; F164-F188 HydrophobicContact CD2-CD2 4.07Å; F164-F188 AromaticContact CD2-CE2 3.97Å; F164-F188 HydrophobicContact CD2-CE2 3.97Å; F164-T192 HydrophobicContact CD2-CG2 4.1Å; F164-T192 HydrophobicContact CE2-CG2 3.55Å; F164-T192 HydrophobicContact CZ-CG2 4.31Å; F164-Y197 PolarHBondContact N-O 2.79Å; F164-H198 CarbonylContact O-C 3.53Å; F164-H198 WeakPolarHBondContact O-CA 3.25Å; F164-Y199 PolarHBondContact O-N 3.25Å
165	I	97.1	Very high	89.5	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	132.7	179.8	53	173.6	0	0	0	109.7	V122 L123 T125 L128 Y148 T167 Y199	V122-I165 VanDerWaalsContact CA-O 3.27Å; V122-I165 WeakPolarHBondContact CA-O 3.39Å; L123-I165 HydrophobicContact CB-CG1 4.22Å; L123-I165 PolarHBondContact N-O 2.94Å; L123-I165 WeakPolarHBondContact O-CG1 3.25Å; L123-I165 PolarHBondContact O-N 3.35Å; T125-I165 HydrophobicContact CG2-CG2 3.63Å; L128-I165 HydrophobicContact CD1-CD1 3.8Å; L128-I165 HydrophobicContact CD2-CD1 3.31Å; L128-I165 HydrophobicContact CG-CD1 3.7Å; Y148-I165 HydrophobicContact CD1-CG2 4.23Å; Y148-I165 HydrophobicContact CD2-CG2 3.9Å; Y148-I165 HydrophobicContact CE1-CG2 3.93Å; Y148-I165 HydrophobicContact CE2-CB 4.36Å; Y148-I165 HydrophobicContact CE2-CD1 4Å; Y148-I165 HydrophobicContact CE2-CG2 3.56Å; Y148-I165 HydrophobicContact CG-CG2 4.23Å; I165-T167 HydrophobicContact CD1-CG2 3.86Å; I165-T167 HydrophobicContact CG1-CG2 4.27Å; I165-T167 PolarHBondContact O-N 2.67Å; I165-Y199 HydrophobicContact CG2-CD2 3.87Å; I165-Y199 HydrophobicContact CG2-CG 4.4Å
166	S	96	Very high	90.2	Very high	5 Å²	5	49.3 Å²	49.3	4%	0.035	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	84.7	161.7	-69.6	0	0	0	0	108.7	N120 H198 Y199	N120-S166 PolarHBondContact ND2-OG 2.74Å; N120-S166 VanDerWaalsContact OD1-CB 3.29Å; N120-S166 WeakPolarHBondContact OD1-CB 3.33Å; N120-S166 PolarHBondContact OD1-OG 2.85Å; S166-H198 PolarHBondContact N-NE2 2.72Å; S166-H198 PolarHBondContact OG-CE1 3.47Å; S166-H198 VanDerWaalsContact OG-CE1 3.24Å; S166-H198 PolarHBondContact OG-NE2 3.01Å; S166-Y199 PolarHBondContact N-O 3.24Å; S166-Y199 VanDerWaalsContact N-O 3.07Å
167	T	78.2	Confident	90.8	Very high	37 Å²	37	44.8 Å²	44.8	23%	0.227	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-27.9	-168.7	-164.1	0	0	0	0	114.4	L121 L123 I165	L121-T167 PolarHBondContact O-N 3.46Å; L123-T167 HydrophobicContact CD1-CG2 3.64Å; I165-T167 HydrophobicContact CD1-CG2 3.86Å; I165-T167 HydrophobicContact CG1-CG2 4.27Å; I165-T167 PolarHBondContact O-N 2.67Å
168	L	86.8	Confident	91.8	Very high	22 Å²	22	43.8 Å²	43.8	12%	0.115	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	87.9	172.9	-64.6	168.7	0	0	0	106.9	F66 I91 A94 L121	F66-L168 HydrophobicContact CD1-CB 4.47Å; F66-L168 HydrophobicContact CE1-CB 4.24Å; F66-L168 WeakPolarHBondContact CE1-O 3.42Å; F66-L168 WeakPolarHBondContact CZ-O 3.45Å; I91-L168 HydrophobicContact CG1-CD1 4.21Å; I91-L168 HydrophobicContact CG1-CD2 4.34Å; A94-L168 HydrophobicContact CB-CD1 3.6Å; L121-L168 HydrophobicContact CB-CB 4.16Å; L121-L168 HydrophobicContact CD1-CB 4.25Å; L121-L168 HydrophobicContact CD1-CD1 3.9Å; L121-L168 HydrophobicContact CG-CB 4.39Å; L121-L168 PolarHBondContact N-O 3.43Å
169	R	93.4	Very high	92.4	Very high	22 Å²	22	41.8 Å²	41.8	8%	0.083	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.3	178.3	-170.7	170.9	64.6	-104.4	-11.5	109.9	A119 N120 N177 V200 W201 E202	A119-R169 WeakPolarHBondContact O-CA 3.47Å; N120-R169 HydrophobicContact CB-CB 4.47Å; N120-R169 HydrophobicContact CB-CG 3.96Å; N120-R169 WeakPolarHBondContact OD1-CB 3.39Å; R169-N177 WeakPolarHBondContact CD-OD1 3.23Å; R169-N177 PolarHBondContact NE-OD1 3.34Å; R169-V200 VanDerWaalsContact NH2-CG1 3.29Å; R169-W201 PolarHBondContact NH2-O 3.19Å; R169-E202 IonicContact CZ-OE1 2.73Å; R169-E202 IonicContact NE-OE1 3.54Å; R169-E202 IonicContact NH2-OE1 2.65Å; R169-E202 PolarHBondContact NH2-OE1 2.84Å
170	V	93.7	Very high	93	Very high	10 Å²	10	35.2 Å²	35.2	6%	0.061	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	150.8	175.2	-61.3	0	0	0	0	109.8	Y65 F66 L69 G118 A119	Y65-V170 HydrophobicContact CD1-CG2 3.95Å; Y65-V170 HydrophobicContact CE1-CG2 3.67Å; F66-V170 HydrophobicContact CD1-CB 4.41Å; F66-V170 HydrophobicContact CD1-CG1 4.16Å; F66-V170 HydrophobicContact CD1-CG2 3.53Å; F66-V170 HydrophobicContact CE1-CG2 3.83Å; F66-V170 HydrophobicContact CG-CG2 4.31Å; L69-V170 HydrophobicContact CB-CB 3.79Å; L69-V170 HydrophobicContact CB-CG1 3.99Å; L69-V170 HydrophobicContact CB-CG2 4.01Å; L69-V170 HydrophobicContact CD1-CB 4.01Å; L69-V170 HydrophobicContact CD1-CG2 4.05Å; G118-V170 CarbonylContact C-O 3.53Å; G118-V170 VanDerWaalsContact CA-O 3.3Å; G118-V170 WeakPolarHBondContact CA-O 3.3Å; A119-V170 HydrophobicContact CB-CG2 4.5Å; A119-V170 PolarHBondContact N-O 2.94Å; A119-V170 PolarHBondContact O-N 3.24Å; A119-V170 VanDerWaalsContact O-O 3.11Å
171	S	93.7	Very high	93.6	Very high	33 Å²	33	32 Å²	32	23%	0.231	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	141.7	-177.2	60.8	0	0	0	0	110.8	T173 N177	S171-T173 VanDerWaalsContact C-N 3.26Å; S171-T173 PolarHBondContact O-N 3.4Å; S171-T173 PolarHBondContact OG-O 2.88Å; S171-N177 WeakPolarHBondContact OG-CB 3.3Å
172	A	91.5	Very high	94	Very high	63 Å²	63	35.2 Å²	35.2	52%	0.521	19%	0.193	S	C	.	.	S	Bend	trans	-65.2	-30.1	175.3	0	0	0	0	0	112.8	N117 I176	N117-A172 HydrophobicContact CB-CB 4.48Å; N117-A172 WeakPolarHBondContact O-CB 3.37Å; N117-A172 PolarHBondContact O-N 2.93Å; A172-I176 HydrophobicContact CB-CD1 4.45Å
173	T	91.8	Very high	94.2	Very high	67 Å²	67	35 Å²	35	41%	0.411	18%	0.184	S	C	.	.	S	Bend	trans	-140.5	158.7	-178.6	75.3	0	0	0	0	112.3	S171 E175 I176 N177	S171-T173 VanDerWaalsContact C-N 3.26Å; S171-T173 PolarHBondContact O-N 3.4Å; S171-T173 PolarHBondContact OG-O 2.88Å; T173-E175 PolarHBondContact O-N 3.43Å; T173-E175 PolarHBondContact OG1-N 2.86Å; T173-I176 PolarHBondContact O-N 2.9Å; T173-I176 WeakPolarHBondContact OG1-CG1 3.28Å; T173-I176 PolarHBondContact OG1-N 3.19Å; T173-N177 PolarHBondContact O-N 3.43Å
174	N	92.1	Very high	94.3	Very high	60 Å²	60	34.7 Å²	34.7	32%	0.321	18%	0.182	S	C	.	.	H	α-helix	trans	-61.5	-28.9	172.2	-70.3	-35.6	0	0	0	112.4	R178 M207	N174-R178 WeakPolarHBondContact O-CB 3.37Å; N174-R178 VanDerWaalsContact O-CG 3.25Å; N174-R178 WeakPolarHBondContact O-CG 3.49Å; N174-R178 PolarHBondContact O-N 2.92Å; N174-M207 HydrophobicContact CB-CE 3.93Å
175	E	94.8	Very high	94.3	Very high	96 Å²	96	33.9 Å²	33.9	45%	0.449	18%	0.179	S	C	.	.	H	α-helix	trans	-65.1	-46.9	176.4	-175.2	-176.3	168.7	0	0	110.8	K47 T173 N177 R178 A179	K47-E175 WeakPolarHBondContact CD-OE1 3.49Å; K47-E175 IonicContact NZ-OE1 2.62Å; T173-E175 PolarHBondContact O-N 3.43Å; T173-E175 PolarHBondContact OG1-N 2.86Å; E175-N177 VanDerWaalsContact C-N 3.33Å; E175-N177 PolarHBondContact O-N 2.92Å; E175-R178 PolarHBondContact O-N 2.96Å; E175-A179 WeakPolarHBondContact O-CB 3.21Å; E175-A179 PolarHBondContact O-N 3.31Å
176	I	95	Very high	94.3	Very high	8 Å²	8	37.3 Å²	37.3	4%	0.041	20%	0.195	C	C	.	.	H	α-helix	trans	-64.8	-41.1	177.8	-67	174.6	0	0	0	110.4	Y49 T106 N117 A172 T173 R178 A179 L180	Y49-I176 HydrophobicContact CD1-CG1 4.4Å; Y49-I176 HydrophobicContact CE1-CG1 4.32Å; T106-I176 HydrophobicContact CG2-CG2 3.78Å; T106-I176 WeakPolarHBondContact OG1-CG2 3.34Å; N117-I176 HydrophobicContact CB-CD1 3.45Å; N117-I176 VanDerWaalsContact CB-CD1 3.45Å; N117-I176 WeakPolarHBondContact O-CD1 3.47Å; N117-I176 WeakPolarHBondContact O-CG2 3.33Å; A172-I176 HydrophobicContact CB-CD1 4.45Å; T173-I176 PolarHBondContact O-N 2.9Å; T173-I176 WeakPolarHBondContact OG1-CG1 3.28Å; T173-I176 PolarHBondContact OG1-N 3.19Å; I176-R178 VanDerWaalsContact C-N 3.33Å; I176-R178 PolarHBondContact O-N 3.29Å; I176-A179 WeakPolarHBondContact O-CB 3.34Å; I176-A179 PolarHBondContact O-N 3.09Å; I176-A179 VanDerWaalsContact O-N 3.13Å; I176-L180 HydrophobicContact CG2-CD1 4.03Å; I176-L180 HydrophobicContact CG2-CG 4.38Å; I176-L180 WeakPolarHBondContact O-CG 3.21Å; I176-L180 PolarHBondContact O-N 2.95Å
177	N	95.2	Very high	94.3	Very high	13 Å²	13	38.3 Å²	38.3	7%	0.07	20%	0.199	C	C	.	.	H	α-helix	trans	-55.9	-48.9	174.6	-166.4	19.1	0	0	0	111.7	R169 S171 T173 E175 A179 L180 I181 E202 M207	R169-N177 WeakPolarHBondContact CD-OD1 3.23Å; R169-N177 PolarHBondContact NE-OD1 3.34Å; S171-N177 WeakPolarHBondContact OG-CB 3.3Å; T173-N177 PolarHBondContact O-N 3.43Å; E175-N177 VanDerWaalsContact C-N 3.33Å; E175-N177 PolarHBondContact O-N 2.92Å; N177-A179 VanDerWaalsContact C-N 3.31Å; N177-A179 PolarHBondContact O-N 2.88Å; N177-L180 PolarHBondContact O-N 2.9Å; N177-I181 VanDerWaalsContact O-CG1 3.32Å; N177-I181 WeakPolarHBondContact O-CG1 3.47Å; N177-I181 PolarHBondContact O-N 2.83Å; N177-E202 PolarHBondContact ND2-OE1 3.25Å; N177-E202 PolarHBondContact ND2-OE2 3.05Å; N177-E202 PolarHBondContact OD1-OE1 3.43Å; N177-M207 HydrophobicContact CB-CE 4.12Å; N177-M207 WeakPolarHBondContact ND2-CE 3.3Å
178	R	96.9	Very high	95.2	Very high	104 Å²	104	36.5 Å²	36.5	39%	0.392	19%	0.188	S	C	.	.	H	α-helix	trans	-60.4	-41.4	176.3	-72.4	175.7	-178.5	180	1.8	111.6	N174 E175 I176 I181 K182 K206 M207 F210	N174-R178 WeakPolarHBondContact O-CB 3.37Å; N174-R178 VanDerWaalsContact O-CG 3.25Å; N174-R178 WeakPolarHBondContact O-CG 3.49Å; N174-R178 PolarHBondContact O-N 2.92Å; E175-R178 PolarHBondContact O-N 2.96Å; I176-R178 VanDerWaalsContact C-N 3.33Å; I176-R178 PolarHBondContact O-N 3.29Å; R178-I181 PolarHBondContact O-N 3.41Å; R178-K182 WeakPolarHBondContact O-CB 3.22Å; R178-K182 PolarHBondContact O-N 3.11Å; R178-K206 PolarHBondContact NH2-O 2.87Å; R178-M207 HydrophobicContact CG-CE 3.96Å; R178-M207 HydrophobicContact CG-SD 3.74Å; R178-M207 PolarHBondContact NE-SD 3.36Å; R178-F210 HydrophobicContact CB-CD1 4.32Å; R178-F210 HydrophobicContact CB-CD2 4.18Å; R178-F210 HydrophobicContact CB-CE1 3.88Å; R178-F210 HydrophobicContact CB-CE2 3.73Å; R178-F210 HydrophobicContact CB-CG 4.45Å; R178-F210 HydrophobicContact CB-CZ 3.56Å; R178-F210 HydrophobicContact CG-CD1 3.72Å; R178-F210 HydrophobicContact CG-CD2 3.95Å; R178-F210 HydrophobicContact CG-CE1 3.77Å; R178-F210 HydrophobicContact CG-CE2 4Å; R178-F210 HydrophobicContact CG-CG 3.8Å; R178-F210 HydrophobicContact CG-CZ 3.91Å; R178-F210 WeakPolarHBondContact O-CZ 3.48Å
179	A	96.8	Very high	95.7	Very high	16 Å²	16	37.8 Å²	37.8	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-43.9	178	0	0	0	0	0	112.1	Y49 I51 E175 I176 N177 K182 Y183	Y49-A179 HydrophobicContact CE2-CB 3.89Å; Y49-A179 WeakPolarHBondContact OH-CB 3.34Å; I51-A179 HydrophobicContact CD1-CB 4.04Å; E175-A179 WeakPolarHBondContact O-CB 3.21Å; E175-A179 PolarHBondContact O-N 3.31Å; I176-A179 WeakPolarHBondContact O-CB 3.34Å; I176-A179 PolarHBondContact O-N 3.09Å; I176-A179 VanDerWaalsContact O-N 3.13Å; N177-A179 VanDerWaalsContact C-N 3.31Å; N177-A179 PolarHBondContact O-N 2.88Å; A179-K182 PolarHBondContact O-N 3.13Å; A179-Y183 WeakPolarHBondContact O-CB 3.36Å; A179-Y183 PolarHBondContact O-N 3.23Å
180	L	97.5	Very high	95.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-45.5	175.3	-73.2	168.3	0	0	0	112.3	S104 T106 N120 I176 N177 Y183 T184	S104-L180 WeakPolarHBondContact OG-CD2 3.33Å; T106-L180 HydrophobicContact CG2-CD1 4.4Å; T106-L180 HydrophobicContact CG2-CD2 3.64Å; T106-L180 HydrophobicContact CG2-CG 3.86Å; N120-L180 HydrophobicContact CB-CB 4.46Å; N120-L180 HydrophobicContact CB-CD2 4.34Å; I176-L180 HydrophobicContact CG2-CD1 4.03Å; I176-L180 HydrophobicContact CG2-CG 4.38Å; I176-L180 WeakPolarHBondContact O-CG 3.21Å; I176-L180 PolarHBondContact O-N 2.95Å; N177-L180 PolarHBondContact O-N 2.9Å; L180-Y183 PolarHBondContact O-N 2.8Å; L180-T184 WeakPolarHBondContact O-CB 3.37Å; L180-T184 PolarHBondContact O-N 2.86Å; L180-T184 PolarHBondContact O-OG1 2.77Å
181	I	97.9	Very high	95.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-44.9	177.8	-66.1	164.8	0	0	0	110.7	N177 R178 T184 A185 V200 E202 F210 M211 L214 Y216	N177-I181 VanDerWaalsContact O-CG1 3.32Å; N177-I181 WeakPolarHBondContact O-CG1 3.47Å; N177-I181 PolarHBondContact O-N 2.83Å; R178-I181 PolarHBondContact O-N 3.41Å; I181-T184 PolarHBondContact O-N 2.97Å; I181-A185 WeakPolarHBondContact O-CB 3.2Å; I181-A185 PolarHBondContact O-N 3.32Å; I181-V200 HydrophobicContact CD1-CG1 4.31Å; I181-V200 HydrophobicContact CG1-CG1 4.5Å; I181-E202 HydrophobicContact CD1-CG 4Å; I181-E202 WeakPolarHBondContact CD1-OE1 3.4Å; I181-F210 HydrophobicContact CB-CE1 3.99Å; I181-F210 HydrophobicContact CB-CZ 4.4Å; I181-F210 HydrophobicContact CD1-CE1 4.24Å; I181-F210 HydrophobicContact CG2-CE1 3.91Å; I181-F210 HydrophobicContact CG2-CZ 4.47Å; I181-M211 HydrophobicContact CD1-SD 4.32Å; I181-M211 HydrophobicContact CG2-CE 4.3Å; I181-M211 HydrophobicContact CG2-SD 4.11Å; I181-L214 HydrophobicContact CG2-CD1 3.85Å; I181-Y216 HydrophobicContact CG2-CE2 4.42Å
182	K	98.1	Very high	95.8	Very high	103 Å²	103	45.8 Å²	45.8	45%	0.448	23%	0.232	S	C	.	.	H	α-helix	trans	-60.3	-50	177.5	179	175.9	173.8	179.7	0	111	R178 A179 T184 A185 E186 F210 L214	R178-K182 WeakPolarHBondContact O-CB 3.22Å; R178-K182 PolarHBondContact O-N 3.11Å; A179-K182 PolarHBondContact O-N 3.13Å; K182-T184 VanDerWaalsContact C-N 3.32Å; K182-T184 PolarHBondContact O-N 3.02Å; K182-A185 PolarHBondContact O-N 2.03Å; K182-E186 WeakPolarHBondContact CE-OE1 3.05Å; K182-E186 IonicContact NZ-OE1 3.96Å; K182-E186 WeakPolarHBondContact O-CG 3.1Å; K182-E186 PolarHBondContact O-N 3.05Å; K182-F210 HydrophobicContact CB-CZ 4.28Å; K182-L214 HydrophobicContact CB-CD1 4.25Å; K182-L214 HydrophobicContact CB-CD2 4.39Å; K182-L214 HydrophobicContact CG-CD2 4.11Å
183	Y	97.5	Very high	95.9	Very high	47 Å²	47	44.9 Å²	44.9	18%	0.184	22%	0.22	C	C	.	.	H	α-helix	trans	-56.5	-48.2	177	178.6	-90.5	0	0	0	111.2	I51 A179 L180 A185 E186 Q187	I51-Y183 HydrophobicContact CB-CD2 4.35Å; I51-Y183 HydrophobicContact CD1-CD2 4.42Å; I51-Y183 HydrophobicContact CD1-CG 4.37Å; I51-Y183 HydrophobicContact CG2-CD1 4.04Å; I51-Y183 HydrophobicContact CG2-CD2 3.79Å; I51-Y183 HydrophobicContact CG2-CE1 4.33Å; I51-Y183 HydrophobicContact CG2-CE2 4.08Å; I51-Y183 HydrophobicContact CG2-CG 3.77Å; A179-Y183 WeakPolarHBondContact O-CB 3.36Å; A179-Y183 PolarHBondContact O-N 3.23Å; L180-Y183 PolarHBondContact O-N 2.8Å; Y183-A185 PolarHBondContact O-N 3.32Å; Y183-E186 PolarHBondContact O-N 3.3Å; Y183-Q187 HydrophobicContact CD1-CG 4.03Å; Y183-Q187 HydrophobicContact CE1-CG 3.61Å; Y183-Q187 HydrophobicContact CE2-CG 4.43Å; Y183-Q187 WeakPolarHBondContact O-CG 3.45Å; Y183-Q187 PolarHBondContact O-N 3.1Å
184	T	98	Very high	96	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-43.4	-179.8	-55.6	0	0	0	0	111.8	M102 N120 V122 L180 I181 K182 E186 Q187 F188	M102-T184 HydrophobicContact CB-CG2 4.48Å; N120-T184 PolarHBondContact ND2-OG1 2.96Å; V122-T184 HydrophobicContact CG2-CG2 3.6Å; L180-T184 WeakPolarHBondContact O-CB 3.37Å; L180-T184 PolarHBondContact O-N 2.86Å; L180-T184 PolarHBondContact O-OG1 2.77Å; I181-T184 PolarHBondContact O-N 2.97Å; K182-T184 VanDerWaalsContact C-N 3.32Å; K182-T184 PolarHBondContact O-N 3.02Å; T184-E186 VanDerWaalsContact C-N 3.33Å; T184-E186 PolarHBondContact O-N 3.08Å; T184-Q187 PolarHBondContact O-N 3.21Å; T184-F188 VanDerWaalsContact O-CB 3.24Å; T184-F188 WeakPolarHBondContact O-CB 3.33Å; T184-F188 PolarHBondContact O-N 3.46Å
185	A	97.9	Very high	96	Very high	5 Å²	5	43 Å²	43	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-41.8	176.4	0	0	0	0	0	111.9	I181 K182 Y183 L189 Y216 L251	I181-A185 WeakPolarHBondContact O-CB 3.2Å; I181-A185 PolarHBondContact O-N 3.32Å; K182-A185 PolarHBondContact O-N 2.03Å; Y183-A185 PolarHBondContact O-N 3.32Å; A185-L189 WeakPolarHBondContact O-CB 3.33Å; A185-L189 VanDerWaalsContact O-CG 3.28Å; A185-L189 WeakPolarHBondContact O-CG 3.46Å; A185-L189 PolarHBondContact O-N 3.41Å; A185-Y216 HydrophobicContact CB-CE2 3.92Å; A185-L251 HydrophobicContact CB-CD2 3.88Å
186	E	97.3	Very high	96.1	Very high	73 Å²	73	38.5 Å²	38.5	34%	0.341	19%	0.187	S	C	.	.	H	α-helix	trans	-64.7	-44.5	176.4	-71.6	172.8	-174.8	0	0	112	K182 Y183 T184 R190	K182-E186 WeakPolarHBondContact CE-OE1 3.05Å; K182-E186 IonicContact NZ-OE1 3.96Å; K182-E186 WeakPolarHBondContact O-CG 3.1Å; K182-E186 PolarHBondContact O-N 3.05Å; Y183-E186 PolarHBondContact O-N 3.3Å; T184-E186 VanDerWaalsContact C-N 3.33Å; T184-E186 PolarHBondContact O-N 3.08Å; E186-R190 VanDerWaalsContact O-CG 3.24Å; E186-R190 WeakPolarHBondContact O-CG 3.2Å; E186-R190 PolarHBondContact O-N 3.03Å
187	Q	97	Very high	96.2	Very high	25 Å²	25	39.3 Å²	39.3	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-65.1	-45	176.4	-61.8	-48	-38	0	0	111.5	M102 Y183 T184 L189 R190 A191	M102-Q187 HydrophobicContact CG-CB 4.01Å; Y183-Q187 HydrophobicContact CD1-CG 4.03Å; Y183-Q187 HydrophobicContact CE1-CG 3.61Å; Y183-Q187 HydrophobicContact CE2-CG 4.43Å; Y183-Q187 WeakPolarHBondContact O-CG 3.45Å; Y183-Q187 PolarHBondContact O-N 3.1Å; T184-Q187 PolarHBondContact O-N 3.21Å; Q187-L189 PolarHBondContact O-N 2.93Å; Q187-R190 PolarHBondContact O-N 3.26Å; Q187-R190 VanDerWaalsContact O-N 3.1Å; Q187-A191 VanDerWaalsContact O-CB 3.26Å; Q187-A191 WeakPolarHBondContact O-CB 3.42Å; Q187-A191 PolarHBondContact O-N 3.09Å
188	F	97.3	Very high	96.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.7	-49.1	176.8	166	-100.1	0	0	0	112	M102 F164 T184 R190 A191 T192 S196 Y197 H198 L251 N253	M102-F188 HydrophobicContact SD-CB 3.86Å; M102-F188 HydrophobicContact SD-CD2 4.1Å; F164-F188 HydrophobicContact CD2-CD2 4.07Å; F164-F188 AromaticContact CD2-CE2 3.97Å; F164-F188 HydrophobicContact CD2-CE2 3.97Å; T184-F188 VanDerWaalsContact O-CB 3.24Å; T184-F188 WeakPolarHBondContact O-CB 3.33Å; T184-F188 PolarHBondContact O-N 3.46Å; F188-R190 PolarHBondContact O-N 2.85Å; F188-A191 PolarHBondContact O-N 2.95Å; F188-T192 HydrophobicContact CD2-CG2 3.58Å; F188-T192 HydrophobicContact CE2-CG2 3.69Å; F188-T192 HydrophobicContact CG-CG2 4.48Å; F188-T192 WeakPolarHBondContact O-CB 3.43Å; F188-T192 WeakPolarHBondContact O-CG2 3.48Å; F188-T192 PolarHBondContact O-N 3.33Å; F188-T192 VanDerWaalsContact O-N 3.14Å; F188-T192 PolarHBondContact O-OG1 2.98Å; F188-S196 WeakPolarHBondContact CZ-O 3.4Å; F188-Y197 VanDerWaalsContact CZ-C 3.5Å; F188-Y197 VanDerWaalsContact CZ-CA 3.5Å; F188-H198 HydrophobicContact CD1-CB 3.96Å; F188-H198 HydrophobicContact CD2-CB 3.7Å; F188-H198 HydrophobicContact CE1-CB 4.04Å; F188-H198 HydrophobicContact CE2-CB 3.78Å; F188-H198 HydrophobicContact CG-CB 3.8Å; F188-H198 HydrophobicContact CZ-CB 3.96Å; F188-L251 HydrophobicContact CD1-CD2 3.86Å; F188-L251 HydrophobicContact CD1-CG 4.27Å; F188-L251 HydrophobicContact CE1-CD2 4.18Å; F188-L251 HydrophobicContact CE1-CG 4.07Å; F188-N253 HydrophobicContact CE1-CB 4.07Å; F188-N253 HydrophobicContact CZ-CB 4.11Å
189	L	96.3	Very high	96.4	Very high	49 Å²	49	33.8 Å²	33.8	26%	0.257	17%	0.167	S	C	.	.	H	α-helix	trans	-69	-18.7	179.8	-70	175	0	0	0	113.7	A185 Q187 L251 N253	A185-L189 WeakPolarHBondContact O-CB 3.33Å; A185-L189 VanDerWaalsContact O-CG 3.28Å; A185-L189 WeakPolarHBondContact O-CG 3.46Å; A185-L189 PolarHBondContact O-N 3.41Å; Q187-L189 PolarHBondContact O-N 2.93Å; L189-L251 HydrophobicContact CD1-CD2 4.16Å; L189-L251 HydrophobicContact CD2-CD2 4.2Å; L189-L251 HydrophobicContact CD2-CG 4.35Å; L189-L251 HydrophobicContact CG-CD2 4.04Å; L189-N253 HydrophobicContact CD2-CB 4.09Å
190	R	94.8	Very high	96.4	Very high	168 Å²	168	33 Å²	33	63%	0.634	16%	0.161	S	C	*	.	H	α-helix	trans	-87.9	-37	175	-72.5	172.7	-174.7	-164.8	2.7	112.3	E186 Q187 F188	E186-R190 VanDerWaalsContact O-CG 3.24Å; E186-R190 WeakPolarHBondContact O-CG 3.2Å; E186-R190 PolarHBondContact O-N 3.03Å; Q187-R190 PolarHBondContact O-N 3.26Å; Q187-R190 VanDerWaalsContact O-N 3.1Å; F188-R190 PolarHBondContact O-N 2.85Å
191	A	93.7	Very high	96.3	Very high	54 Å²	54	33.4 Å²	33.4	45%	0.446	16%	0.163	S	C	.	.	H	α-helix	trans	-94.4	-17.8	-168	0	0	0	0	0	114.7	L101 Q187 F188	L101-A191 HydrophobicContact CD2-CB 3.51Å; Q187-A191 VanDerWaalsContact O-CB 3.26Å; Q187-A191 WeakPolarHBondContact O-CB 3.42Å; Q187-A191 PolarHBondContact O-N 3.09Å; F188-A191 PolarHBondContact O-N 2.95Å
192	T	94.8	Very high	96.2	Very high	10 Å²	10	34 Å²	34	6%	0.061	17%	0.166	C	C	.	.	S	Bend	trans	-107.5	159.6	-171.6	64.6	0	0	0	0	112.6	F164 F188 N253	F164-T192 HydrophobicContact CD2-CG2 4.1Å; F164-T192 HydrophobicContact CE2-CG2 3.55Å; F164-T192 HydrophobicContact CZ-CG2 4.31Å; F188-T192 HydrophobicContact CD2-CG2 3.58Å; F188-T192 HydrophobicContact CE2-CG2 3.69Å; F188-T192 HydrophobicContact CG-CG2 4.48Å; F188-T192 WeakPolarHBondContact O-CB 3.43Å; F188-T192 WeakPolarHBondContact O-CG2 3.48Å; F188-T192 PolarHBondContact O-N 3.33Å; F188-T192 VanDerWaalsContact O-N 3.14Å; F188-T192 PolarHBondContact O-OG1 2.98Å; T192-N253 PolarHBondContact O-ND2 2.94Å; T192-N253 PolarHBondContact OG1-ND2 2.87Å
193	T	93.4	Very high	96	Very high	44 Å²	44	33.7 Å²	33.7	27%	0.27	16%	0.162	S	C	.	.			trans	-82.7	165.3	176.8	67.5	0	0	0	0	111.8	S160 G195 S196	S160-T193 PolarHBondContact O-OG1 3.28Å; S160-T193 VanDerWaalsContact O-OG1 3.1Å; S160-T193 PolarHBondContact OG-OG1 3.4Å; S160-T193 VanDerWaalsContact OG-OG1 3.11Å; T193-G195 PolarHBondContact O-N 3.4Å; T193-S196 WeakPolarHBondContact O-CB 3.45Å; T193-S196 PolarHBondContact O-N 2.87Å; T193-S196 VanDerWaalsContact O-N 3.11Å; T193-S196 PolarHBondContact O-OG 3.44Å; T193-S196 PolarHBondContact OG1-OG 3.33Å
194	H	93.4	Very high	95.7	Very high	76 Å²	76	33.3 Å²	33.3	35%	0.352	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44.5	138.3	167	-170.5	65.9	0	0	0	112.2	I158 S196 N253 K254 K255	I158-H194 VanDerWaalsContact CD1-CD2 3.44Å; I158-H194 WeakPolarHBondContact CD1-CD2 3.5Å; H194-S196 PolarHBondContact O-N 2.83Å; H194-N253 WeakPolarHBondContact CA-O 3.26Å; H194-K254 PolarHBondContact CE1-O 3.11Å; H194-K254 VanDerWaalsContact ND1-C 3.31Å; H194-K254 PolarHBondContact ND1-O 3.14Å; H194-K254 VanDerWaalsContact ND1-O 3.12Å; H194-K255 WeakPolarHBondContact CA-O 3.49Å; H194-K255 WeakPolarHBondContact CB-O 3.34Å
195	G	93.8	Very high	95.5	Very high	12 Å²	12	37.6 Å²	37.6	12%	0.124	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	-11.2	180	0	0	0	0	0	115.1	T193 N253	T193-G195 PolarHBondContact O-N 3.4Å; G195-N253 PolarHBondContact N-O 3.28Å
196	S	96	Very high	95.2	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.007	21%	0.208	C	C	.	.			trans	-62	153.3	171.8	-57.9	0	0	0	0	110.6	S162 F188 T193 H194 N253	S162-S196 PolarHBondContact N-OG 2.92Å; S162-S196 VanDerWaalsContact N-OG 3.12Å; S162-S196 CarbonylContact O-C 3.56Å; S162-S196 WeakPolarHBondContact O-CA 3.28Å; S162-S196 WeakPolarHBondContact O-CB 3.48Å; F188-S196 WeakPolarHBondContact CZ-O 3.4Å; T193-S196 WeakPolarHBondContact O-CB 3.45Å; T193-S196 PolarHBondContact O-N 2.87Å; T193-S196 VanDerWaalsContact O-N 3.11Å; T193-S196 PolarHBondContact O-OG 3.44Å; T193-S196 PolarHBondContact OG1-OG 3.33Å; H194-S196 PolarHBondContact O-N 2.83Å; S196-N253 PolarHBondContact O-N 2.68Å
197	Y	96.7	Very high	95.1	Very high	25 Å²	25	38 Å²	38	10%	0.098	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151.7	179.1	52.4	-88.9	0	0	0	113.4	K152 P153 S162 A163 F164 F188 Y199 L251	K152-Y197 WeakPolarHBondContact CG-OH 3.49Å; P153-Y197 HydrophobicContact CG-CD1 3.75Å; P153-Y197 HydrophobicContact CG-CE1 4.12Å; P153-Y197 HydrophobicContact CG-CG 4.1Å; S162-Y197 PolarHBondContact O-N 3.13Å; A163-Y197 CarbonylContact C-O 3.54Å; A163-Y197 WeakPolarHBondContact CA-O 3.42Å; A163-Y197 HydrophobicContact CB-CD2 3.86Å; A163-Y197 HydrophobicContact CB-CE1 4.07Å; A163-Y197 HydrophobicContact CB-CE2 3.21Å; A163-Y197 WeakPolarHBondContact CB-OH 3.41Å; F164-Y197 PolarHBondContact N-O 2.79Å; F188-Y197 VanDerWaalsContact CZ-C 3.5Å; F188-Y197 VanDerWaalsContact CZ-CA 3.5Å; Y197-Y199 HydrophobicContact CD2-CD2 4.22Å; Y197-Y199 HydrophobicContact CD2-CE1 4.33Å; Y197-Y199 AromaticContact CD2-CE2 3.56Å; Y197-Y199 HydrophobicContact CD2-CE2 3.56Å; Y197-Y199 AromaticContact CD2-CZ 3.58Å; Y197-Y199 HydrophobicContact CE2-CD2 4.35Å; Y197-Y199 AromaticContact CE2-CE2 3.4Å; Y197-Y199 HydrophobicContact CE2-CE2 3.4Å; Y197-Y199 AromaticContact CE2-CZ 3.57Å; Y197-Y199 VanDerWaalsContact CE2-OH 3.31Å; Y197-Y199 WeakPolarHBondContact CE2-OH 3.22Å; Y197-L251 CarbonylContact C-O 3.52Å; Y197-L251 WeakPolarHBondContact CA-O 3.34Å; Y197-L251 WeakPolarHBondContact CB-O 3.47Å
198	H	97.7	Very high	95.1	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.2	180	174.2	-122.4	0	0	0	111	F164 S166 F188 V200 Y216 R250 L251	F164-H198 CarbonylContact O-C 3.53Å; F164-H198 WeakPolarHBondContact O-CA 3.25Å; S166-H198 PolarHBondContact N-NE2 2.72Å; S166-H198 PolarHBondContact OG-CE1 3.47Å; S166-H198 VanDerWaalsContact OG-CE1 3.24Å; S166-H198 PolarHBondContact OG-NE2 3.01Å; F188-H198 HydrophobicContact CD1-CB 3.96Å; F188-H198 HydrophobicContact CD2-CB 3.7Å; F188-H198 HydrophobicContact CE1-CB 4.04Å; F188-H198 HydrophobicContact CE2-CB 3.78Å; F188-H198 HydrophobicContact CG-CB 3.8Å; F188-H198 HydrophobicContact CZ-CB 3.96Å; H198-V200 WeakPolarHBondContact CE1-CG2 3.37Å; H198-Y216 PolarHBondContact CE1-OH 3.31Å; H198-Y216 AromaticContact ND1-CE1 3.87Å; H198-Y216 AromaticContact ND1-CZ 3.73Å; H198-Y216 PolarHBondContact ND1-OH 2.92Å; H198-R250 WeakPolarHBondContact O-CA 3.41Å; H198-L251 PolarHBondContact N-O 2.88Å; H198-L251 PolarHBondContact O-N 2.96Å
199	Y	98	Very high	95.1	Very high	1 Å²	1	49.1 Å²	49.1	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	142.2	-179.7	-68.5	-60.9	0	0	0	113	T125 Y148 A151 K152 F164 I165 S166 Y197 L248 Y249 R250	T125-Y199 HydrophobicContact CG2-CD2 4.43Å; Y148-Y199 HydrophobicContact CD1-CD1 4.47Å; Y148-Y199 AromaticContact CD1-CD2 3.61Å; Y148-Y199 HydrophobicContact CD1-CD2 3.61Å; Y148-Y199 AromaticContact CD1-CE2 3.99Å; Y148-Y199 HydrophobicContact CD1-CE2 3.99Å; Y148-Y199 AromaticContact CD1-CG 3.87Å; Y148-Y199 HydrophobicContact CD1-CG 3.87Å; Y148-Y199 HydrophobicContact CE1-CD2 4.16Å; Y148-Y199 HydrophobicContact CE1-CG 4.1Å; Y148-Y199 HydrophobicContact CG-CD2 4.12Å; Y148-Y199 HydrophobicContact CG-CE2 4.28Å; Y148-Y199 PolarHBondContact O-OH 2.88Å; A151-Y199 HydrophobicContact CB-CE1 3.97Å; A151-Y199 PolarHBondContact O-OH 3.29Å; K152-Y199 WeakPolarHBondContact CA-OH 3.5Å; K152-Y199 PolarHBondContact N-OH 2.62Å; F164-Y199 PolarHBondContact O-N 3.25Å; I165-Y199 HydrophobicContact CG2-CD2 3.87Å; I165-Y199 HydrophobicContact CG2-CG 4.4Å; S166-Y199 PolarHBondContact N-O 3.24Å; S166-Y199 VanDerWaalsContact N-O 3.07Å; Y197-Y199 HydrophobicContact CD2-CD2 4.22Å; Y197-Y199 HydrophobicContact CD2-CE1 4.33Å; Y197-Y199 AromaticContact CD2-CE2 3.56Å; Y197-Y199 HydrophobicContact CD2-CE2 3.56Å; Y197-Y199 AromaticContact CD2-CZ 3.58Å; Y197-Y199 HydrophobicContact CE2-CD2 4.35Å; Y197-Y199 AromaticContact CE2-CE2 3.4Å; Y197-Y199 HydrophobicContact CE2-CE2 3.4Å; Y197-Y199 AromaticContact CE2-CZ 3.57Å; Y197-Y199 VanDerWaalsContact CE2-OH 3.31Å; Y197-Y199 WeakPolarHBondContact CE2-OH 3.22Å; Y199-L248 HydrophobicContact CD1-CD1 3.97Å; Y199-L248 HydrophobicContact CD1-CD2 4.16Å; Y199-L248 HydrophobicContact CD1-CG 4.19Å; Y199-L248 HydrophobicContact CE1-CD2 4.31Å; Y199-L248 HydrophobicContact CG-CD1 4.26Å; Y199-Y249 WeakPolarHBondContact CA-O 3.42Å; Y199-R250 HydrophobicContact CD1-CB 3.86Å; Y199-R250 HydrophobicContact CD1-CG 3.95Å; Y199-R250 HydrophobicContact CE1-CB 3.83Å; Y199-R250 HydrophobicContact CE1-CG 3.64Å
200	V	97	Very high	95.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	127.4	177.5	173.4	0	0	0	0	109.8	R169 I181 H198 E202 M211 Y216 Y249	R169-V200 VanDerWaalsContact NH2-CG1 3.29Å; I181-V200 HydrophobicContact CD1-CG1 4.31Å; I181-V200 HydrophobicContact CG1-CG1 4.5Å; H198-V200 WeakPolarHBondContact CE1-CG2 3.37Å; V200-E202 HydrophobicContact CG1-CG 3.86Å; V200-M211 HydrophobicContact CB-CE 3.94Å; V200-M211 HydrophobicContact CG1-CE 3.84Å; V200-Y216 HydrophobicContact CB-CE1 4.19Å; V200-Y216 HydrophobicContact CG2-CE1 3.75Å; V200-Y249 PolarHBondContact N-O 3.48Å; V200-Y249 WeakPolarHBondContact O-CB 3.36Å; V200-Y249 PolarHBondContact O-N 3.32Å
201	W	95.8	Very high	95.4	Very high	8 Å²	8	40.4 Å²	40.4	3%	0.03	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.6	165.9	-71.6	98.1	0	0	0	110.7	K76 C147 Y148 R169 C231 W233 Q246 C247 L248	K76-W201 HydrophobicContact CD-CB 4.28Å; K76-W201 HydrophobicContact CD-CG 4.46Å; C147-W201 WeakPolarHBondContact SG-CZ2 3.28Å; Y148-W201 AromaticContact CE1-NE1 3.61Å; Y148-W201 AromaticContact CZ-NE1 3.62Å; Y148-W201 VanDerWaalsContact OH-CD1 3.32Å; Y148-W201 PolarHBondContact OH-NE1 3.37Å; R169-W201 PolarHBondContact NH2-O 3.19Å; W201-C231 HydrophobicContact CH2-CB 3.86Å; W201-C231 WeakPolarHBondContact CH2-O 3.3Å; W201-W233 HydrophobicContact CD2-CZ2 4.49Å; W201-W233 AromaticContact CD2-NE1 3.77Å; W201-W233 AromaticContact CE2-NE1 3.91Å; W201-W233 AromaticContact CE3-NE1 3.43Å; W201-W233 AromaticContact CH2-CD1 3.97Å; W201-W233 AromaticContact CH2-NE1 3.35Å; W201-W233 VanDerWaalsContact CH2-NE1 3.35Å; W201-W233 HydrophobicContact CZ2-CZ2 4.38Å; W201-W233 AromaticContact CZ2-NE1 3.72Å; W201-W233 AromaticContact CZ3-CD1 3.71Å; W201-W233 AromaticContact CZ3-NE1 3.22Å; W201-Q246 HydrophobicContact CE3-CB 4.46Å; W201-C247 WeakPolarHBondContact CA-O 3.47Å; W201-L248 HydrophobicContact CD2-CB 4.33Å; W201-L248 HydrophobicContact CD2-CD1 4.12Å; W201-L248 HydrophobicContact CE3-CB 4.06Å; W201-L248 HydrophobicContact CG-CD1 4.41Å; W201-L248 HydrophobicContact CH2-CB 4Å; W201-L248 HydrophobicContact CZ2-CB 4.23Å; W201-L248 HydrophobicContact CZ2-CD1 4.29Å; W201-L248 HydrophobicContact CZ3-CB 3.89Å
202	E	95.1	Very high	95.6	Very high	14 Å²	14	42.6 Å²	42.6	7%	0.065	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158.9	176.6	-87.7	-52	153.1	0	0	114.3	R169 N177 I181 V200 N204 M207 M211 C247 Y249	R169-E202 IonicContact CZ-OE1 2.73Å; R169-E202 IonicContact NE-OE1 3.54Å; R169-E202 IonicContact NH2-OE1 2.65Å; R169-E202 PolarHBondContact NH2-OE1 2.84Å; N177-E202 PolarHBondContact ND2-OE1 3.25Å; N177-E202 PolarHBondContact ND2-OE2 3.05Å; N177-E202 PolarHBondContact OD1-OE1 3.43Å; I181-E202 HydrophobicContact CD1-CG 4Å; I181-E202 WeakPolarHBondContact CD1-OE1 3.4Å; V200-E202 HydrophobicContact CG1-CG 3.86Å; E202-N204 PolarHBondContact O-N 3.44Å; E202-M207 HydrophobicContact CB-CB 3.88Å; E202-M207 HydrophobicContact CB-CG 4.13Å; E202-M207 HydrophobicContact CG-CB 4.02Å; E202-M207 HydrophobicContact CG-CG 3.94Å; E202-M207 VanDerWaalsContact OE2-CG 3.22Å; E202-M207 WeakPolarHBondContact OE2-CG 3.39Å; E202-M211 HydrophobicContact CG-SD 4.26Å; E202-C247 PolarHBondContact N-O 2.98Å; E202-C247 PolarHBondContact O-N 2.86Å; E202-Y249 HydrophobicContact CB-CD2 3.99Å; E202-Y249 HydrophobicContact CB-CE2 3.81Å
203	R	94	Very high	95.7	Very high	96 Å²	96	50.3 Å²	50.3	36%	0.362	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	118	172.8	-72.8	-175.5	-65.4	-171.8	-6.7	111.4	S205 K206 M207 E245	R203-S205 PolarHBondContact O-N 3.17Å; R203-K206 HydrophobicContact CB-CB 4.42Å; R203-K206 VanDerWaalsContact CZ-NZ 3.35Å; R203-K206 PolarHBondContact O-N 2.56Å; R203-K206 VanDerWaalsContact O-N 3.14Å; R203-M207 PolarHBondContact O-N 2.9Å; R203-E245 CarbonylContact C-O 3.51Å; R203-E245 VanDerWaalsContact CA-O 3.22Å; R203-E245 WeakPolarHBondContact CA-O 3.36Å
204	N	91.8	Very high	95.9	Very high	39 Å²	39	49.8 Å²	49.8	21%	0.209	23%	0.234	C	C	.	.	H	α-helix	trans	-54.7	-54.6	-174.7	-158	19.7	0	0	0	112.8	E202 K206 M207 K208 Q218 E245 C247 Y249	E202-N204 PolarHBondContact O-N 3.44Å; N204-K206 PolarHBondContact O-N 3.09Å; N204-M207 PolarHBondContact O-N 3.38Å; N204-K208 WeakPolarHBondContact O-CB 3.43Å; N204-K208 PolarHBondContact O-N 2.66Å; N204-K208 VanDerWaalsContact O-N 3.09Å; N204-K208 WeakPolarHBondContact OD1-CB 3.47Å; N204-Q218 PolarHBondContact OD1-OE1 2.98Å; N204-E245 PolarHBondContact N-O 3.2Å; N204-C247 WeakPolarHBondContact CB-SG 3.18Å; N204-C247 VanDerWaalsContact CG-SG 3.57Å; N204-Y249 PolarHBondContact OD1-OH 3.21Å; N204-Y249 VanDerWaalsContact OD1-OH 3.05Å
205	S	93	Very high	96.1	Very high	89 Å²	89	52.4 Å²	52.4	62%	0.622	25%	0.251	S	S	*	.	H	α-helix	trans	-55.5	-26.9	-178.6	52.3	0	0	0	0	114.1	R203 E245	R203-S205 PolarHBondContact O-N 3.17Å; S205-E245 WeakPolarHBondContact CB-OE2 3.32Å; S205-E245 PolarHBondContact N-OE2 3.2Å; S205-E245 PolarHBondContact OG-OE2 3.47Å
206	K	92.4	Very high	96.3	Very high	86 Å²	86	52.2 Å²	52.2	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-101.9	-30.5	-175.7	-68.1	-177	178.6	179.9	0	113.9	R178 R203 N204	R178-K206 PolarHBondContact NH2-O 2.87Å; R203-K206 HydrophobicContact CB-CB 4.42Å; R203-K206 VanDerWaalsContact CZ-NZ 3.35Å; R203-K206 PolarHBondContact O-N 2.56Å; R203-K206 VanDerWaalsContact O-N 3.14Å; N204-K206 PolarHBondContact O-N 3.09Å
207	M	95.4	Very high	96.4	Very high	1 Å²	1	56 Å²	56	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-118.9	-15.1	-166.7	-63.8	-49.5	-171.1	0	0	115.3	N174 N177 R178 E202 R203 N204 K209 F210 M211	N174-M207 HydrophobicContact CB-CE 3.93Å; N177-M207 HydrophobicContact CB-CE 4.12Å; N177-M207 WeakPolarHBondContact ND2-CE 3.3Å; R178-M207 HydrophobicContact CG-CE 3.96Å; R178-M207 HydrophobicContact CG-SD 3.74Å; R178-M207 PolarHBondContact NE-SD 3.36Å; E202-M207 HydrophobicContact CB-CB 3.88Å; E202-M207 HydrophobicContact CB-CG 4.13Å; E202-M207 HydrophobicContact CG-CB 4.02Å; E202-M207 HydrophobicContact CG-CG 3.94Å; E202-M207 VanDerWaalsContact OE2-CG 3.22Å; E202-M207 WeakPolarHBondContact OE2-CG 3.39Å; R203-M207 PolarHBondContact O-N 2.9Å; N204-M207 PolarHBondContact O-N 3.38Å; M207-K209 PolarHBondContact O-N 2.94Å; M207-F210 CarbonylContact O-C 3.59Å; M207-F210 WeakPolarHBondContact O-CA 3.49Å; M207-F210 WeakPolarHBondContact O-CB 3.39Å; M207-F210 PolarHBondContact O-N 3.14Å; M207-M211 HydrophobicContact CB-CG 4.13Å; M207-M211 WeakPolarHBondContact O-CG 3.21Å; M207-M211 PolarHBondContact O-N 3.07Å
208	K	96.9	Very high	96.3	Very high	89 Å²	89	58.4 Å²	58.4	39%	0.387	28%	0.276	S	S	.	.	H	α-helix	trans	-46.6	-59	-174.2	-173.2	177.5	-179.3	176.2	0	114.4	N204 F210 M211 E212 Y249	N204-K208 WeakPolarHBondContact O-CB 3.43Å; N204-K208 PolarHBondContact O-N 2.66Å; N204-K208 VanDerWaalsContact O-N 3.09Å; N204-K208 WeakPolarHBondContact OD1-CB 3.47Å; K208-F210 PolarHBondContact O-N 3.07Å; K208-M211 PolarHBondContact O-N 2.76Å; K208-M211 VanDerWaalsContact O-N 3.1Å; K208-E212 WeakPolarHBondContact CE-OE1 3.42Å; K208-E212 WeakPolarHBondContact O-CG 3.15Å; K208-E212 PolarHBondContact O-N 3.28Å; K208-Y249 WeakPolarHBondContact CA-OH 3.37Å
209	K	97.4	Very high	96.2	Very high	169 Å²	169	60.1 Å²	60.1	74%	0.735	29%	0.286	S	S	*	.	H	α-helix	trans	-59.6	-29.8	179.3	-70.4	-176.9	178.3	-179.9	0	113.5	M207 K213	M207-K209 PolarHBondContact O-N 2.94Å; K209-K213 VanDerWaalsContact O-CG 3.28Å; K209-K213 WeakPolarHBondContact O-CG 3.4Å; K209-K213 PolarHBondContact O-N 3.3Å
210	F	98.1	Very high	96.1	Very high	34 Å²	34	61 Å²	61	15%	0.149	29%	0.291	C	S	.	.	H	α-helix	trans	-76.4	-41.9	177.3	167.7	-99.2	0	0	0	111.2	R178 I181 K182 M207 K208 K213 L214	R178-F210 HydrophobicContact CB-CD1 4.32Å; R178-F210 HydrophobicContact CB-CD2 4.18Å; R178-F210 HydrophobicContact CB-CE1 3.88Å; R178-F210 HydrophobicContact CB-CE2 3.73Å; R178-F210 HydrophobicContact CB-CG 4.45Å; R178-F210 HydrophobicContact CB-CZ 3.56Å; R178-F210 HydrophobicContact CG-CD1 3.72Å; R178-F210 HydrophobicContact CG-CD2 3.95Å; R178-F210 HydrophobicContact CG-CE1 3.77Å; R178-F210 HydrophobicContact CG-CE2 4Å; R178-F210 HydrophobicContact CG-CG 3.8Å; R178-F210 HydrophobicContact CG-CZ 3.91Å; R178-F210 WeakPolarHBondContact O-CZ 3.48Å; I181-F210 HydrophobicContact CB-CE1 3.99Å; I181-F210 HydrophobicContact CB-CZ 4.4Å; I181-F210 HydrophobicContact CD1-CE1 4.24Å; I181-F210 HydrophobicContact CG2-CE1 3.91Å; I181-F210 HydrophobicContact CG2-CZ 4.47Å; K182-F210 HydrophobicContact CB-CZ 4.28Å; M207-F210 CarbonylContact O-C 3.59Å; M207-F210 WeakPolarHBondContact O-CA 3.49Å; M207-F210 WeakPolarHBondContact O-CB 3.39Å; M207-F210 PolarHBondContact O-N 3.14Å; K208-F210 PolarHBondContact O-N 3.07Å; F210-K213 WeakPolarHBondContact O-CB 3.47Å; F210-K213 PolarHBondContact O-N 2.73Å; F210-L214 HydrophobicContact CD1-CD1 4.44Å; F210-L214 HydrophobicContact CE1-CD1 3.62Å; F210-L214 HydrophobicContact CE2-CD1 3.98Å; F210-L214 HydrophobicContact CE2-CG 4.3Å; F210-L214 HydrophobicContact CZ-CD1 3.34Å; F210-L214 HydrophobicContact CZ-CG 4.14Å; F210-L214 PolarHBondContact O-N 3.1Å
211	M	98.3	Very high	96	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-44.2	176	-62	-52.1	-74.4	0	0	111.2	I181 V200 E202 M207 K208 K213 L214 N215 Y216 Y249	I181-M211 HydrophobicContact CD1-SD 4.32Å; I181-M211 HydrophobicContact CG2-CE 4.3Å; I181-M211 HydrophobicContact CG2-SD 4.11Å; V200-M211 HydrophobicContact CB-CE 3.94Å; V200-M211 HydrophobicContact CG1-CE 3.84Å; E202-M211 HydrophobicContact CG-SD 4.26Å; M207-M211 HydrophobicContact CB-CG 4.13Å; M207-M211 WeakPolarHBondContact O-CG 3.21Å; M207-M211 PolarHBondContact O-N 3.07Å; K208-M211 PolarHBondContact O-N 2.76Å; K208-M211 VanDerWaalsContact O-N 3.1Å; M211-K213 VanDerWaalsContact C-N 3.34Å; M211-K213 PolarHBondContact O-N 3.14Å; M211-L214 CarbonylContact O-C 3.59Å; M211-L214 WeakPolarHBondContact O-CA 3.15Å; M211-L214 PolarHBondContact O-N 3.33Å; M211-N215 PolarHBondContact O-N 2.86Å; M211-Y216 HydrophobicContact CE-CD1 3.62Å; M211-Y216 HydrophobicContact CE-CD2 3.91Å; M211-Y216 HydrophobicContact CE-CE1 4.04Å; M211-Y216 HydrophobicContact CE-CE2 4.29Å; M211-Y216 HydrophobicContact CE-CG 3.56Å; M211-Y216 PolarHBondContact O-N 2.71Å; M211-Y249 HydrophobicContact CB-CD1 3.55Å; M211-Y249 HydrophobicContact CB-CE1 3.59Å; M211-Y249 HydrophobicContact CB-CG 4.16Å; M211-Y249 HydrophobicContact CE-CD1 4.33Å; M211-Y249 HydrophobicContact CE-CD2 4.21Å; M211-Y249 HydrophobicContact CE-CG 3.8Å; M211-Y249 HydrophobicContact CG-CD1 3.83Å; M211-Y249 HydrophobicContact CG-CD2 4.13Å; M211-Y249 HydrophobicContact CG-CE1 3.83Å; M211-Y249 HydrophobicContact CG-CE2 4.15Å; M211-Y249 HydrophobicContact CG-CG 3.97Å
212	E	97.7	Very high	95.8	Very high	100 Å²	100	61.1 Å²	61.1	47%	0.467	29%	0.293	S	S	.	.	H	α-helix	trans	-58.2	-43.3	175	-72	168.8	174.5	0	0	112	K208 L214 N215	K208-E212 WeakPolarHBondContact CE-OE1 3.42Å; K208-E212 WeakPolarHBondContact O-CG 3.15Å; K208-E212 PolarHBondContact O-N 3.28Å; E212-L214 PolarHBondContact O-N 3.44Å; E212-N215 WeakPolarHBondContact O-CA 3.35Å; E212-N215 PolarHBondContact O-N 2.9Å
213	K	97.8	Very high	95.3	Very high	173 Å²	173	61.7 Å²	61.7	75%	0.752	30%	0.303	S	S	*	.	H	α-helix	trans	-61.4	-25.3	175.6	-77.6	176	-179.1	-171.6	0	113.6	K209 F210 M211 N215	K209-K213 VanDerWaalsContact O-CG 3.28Å; K209-K213 WeakPolarHBondContact O-CG 3.4Å; K209-K213 PolarHBondContact O-N 3.3Å; F210-K213 WeakPolarHBondContact O-CB 3.47Å; F210-K213 PolarHBondContact O-N 2.73Å; M211-K213 VanDerWaalsContact C-N 3.34Å; M211-K213 PolarHBondContact O-N 3.14Å; K213-N215 VanDerWaalsContact C-N 3.32Å
214	L	97.8	Very high	94.7	Very high	32 Å²	32	60.2 Å²	60.2	17%	0.168	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	9.2	175.4	-66.7	-176.2	0	0	0	112.8	I181 K182 F210 M211 E212 Y216	I181-L214 HydrophobicContact CG2-CD1 3.85Å; K182-L214 HydrophobicContact CB-CD1 4.25Å; K182-L214 HydrophobicContact CB-CD2 4.39Å; K182-L214 HydrophobicContact CG-CD2 4.11Å; F210-L214 HydrophobicContact CD1-CD1 4.44Å; F210-L214 HydrophobicContact CE1-CD1 3.62Å; F210-L214 HydrophobicContact CE2-CD1 3.98Å; F210-L214 HydrophobicContact CE2-CG 4.3Å; F210-L214 HydrophobicContact CZ-CD1 3.34Å; F210-L214 HydrophobicContact CZ-CG 4.14Å; F210-L214 PolarHBondContact O-N 3.1Å; M211-L214 CarbonylContact O-C 3.59Å; M211-L214 WeakPolarHBondContact O-CA 3.15Å; M211-L214 PolarHBondContact O-N 3.33Å; E212-L214 PolarHBondContact O-N 3.44Å; L214-Y216 HydrophobicContact CB-CD2 3.68Å; L214-Y216 HydrophobicContact CB-CE2 3.95Å; L214-Y216 HydrophobicContact CD1-CE2 4.33Å; L214-Y216 PolarHBondContact O-N 3.32Å
215	N	97.7	Very high	93.6	Very high	132 Å²	132	67.9 Å²	67.9	71%	0.706	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	24.5	-176.1	-56.2	-49.3	0	0	0	114.5	M211 E212 K213 L251	M211-N215 PolarHBondContact O-N 2.86Å; E212-N215 WeakPolarHBondContact O-CA 3.35Å; E212-N215 PolarHBondContact O-N 2.9Å; K213-N215 VanDerWaalsContact C-N 3.32Å; N215-L251 HydrophobicContact CB-CD1 4.19Å; N215-L251 WeakPolarHBondContact O-CD1 3.46Å
216	Y	98.2	Very high	92.4	Very high	7 Å²	7	66.1 Å²	66.1	3%	0.027	33%	0.327	C	S	.	.			trans	-75.4	133.7	165.8	-76.8	-104.6	0	0	0	109.3	I181 A185 H198 V200 M211 L214 R250 L251	I181-Y216 HydrophobicContact CG2-CE2 4.42Å; A185-Y216 HydrophobicContact CB-CE2 3.92Å; H198-Y216 PolarHBondContact CE1-OH 3.31Å; H198-Y216 AromaticContact ND1-CE1 3.87Å; H198-Y216 AromaticContact ND1-CZ 3.73Å; H198-Y216 PolarHBondContact ND1-OH 2.92Å; V200-Y216 HydrophobicContact CB-CE1 4.19Å; V200-Y216 HydrophobicContact CG2-CE1 3.75Å; M211-Y216 HydrophobicContact CE-CD1 3.62Å; M211-Y216 HydrophobicContact CE-CD2 3.91Å; M211-Y216 HydrophobicContact CE-CE1 4.04Å; M211-Y216 HydrophobicContact CE-CE2 4.29Å; M211-Y216 HydrophobicContact CE-CG 3.56Å; M211-Y216 PolarHBondContact O-N 2.71Å; L214-Y216 HydrophobicContact CB-CD2 3.68Å; L214-Y216 HydrophobicContact CB-CE2 3.95Å; L214-Y216 HydrophobicContact CD1-CE2 4.33Å; L214-Y216 PolarHBondContact O-N 3.32Å; Y216-R250 CarbonylContact C-O 3.54Å; Y216-R250 VanDerWaalsContact CA-O 3.3Å; Y216-R250 WeakPolarHBondContact CA-O 3.14Å; Y216-L251 HydrophobicContact CD1-CB 3.62Å; Y216-L251 HydrophobicContact CD2-CB 4.02Å; Y216-L251 HydrophobicContact CD2-CD2 4.4Å; Y216-L251 HydrophobicContact CE1-CB 3.44Å; Y216-L251 VanDerWaalsContact CE1-CB 3.44Å; Y216-L251 HydrophobicContact CE2-CB 3.88Å; Y216-L251 HydrophobicContact CE2-CD2 3.76Å; Y216-L251 HydrophobicContact CE2-CG 4.34Å; Y216-L251 HydrophobicContact CG-CB 3.9Å
217	E	96.6	Very high	91.3	Very high	80 Å²	80	72.7 Å²	72.7	37%	0.374	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	142.5	165.6	76.4	-160.9	128.8	0	0	109.8	V219 Y249 R250	E217-V219 HydrophobicContact CG-CG2 4.2Å; E217-V219 PolarHBondContact O-N 3.36Å; E217-Y249 CarbonylContact O-C 3.54Å; E217-Y249 WeakPolarHBondContact O-CA 3.5Å; E217-R250 HydrophobicContact CG-CB 4.06Å; E217-R250 PolarHBondContact N-O 2.98Å; E217-R250 PolarHBondContact O-N 3.2Å; E217-R250 IonicContact OE1-CZ 2.72Å; E217-R250 IonicContact OE1-NE 3.12Å; E217-R250 PolarHBondContact OE1-NE 2.93Å; E217-R250 IonicContact OE1-NH2 3.07Å; E217-R250 PolarHBondContact OE1-NH2 3.04Å; E217-R250 IonicContact OE2-NH2 3.93Å; E217-R250 PolarHBondContact OE2-NH2 3.42Å; E217-R250 VanDerWaalsContact OE2-NH2 3.12Å
218	Q	96.7	Very high	90.8	Very high	77 Å²	77	79.7 Å²	79.7	36%	0.36	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	112.1	168.6	-172.1	-166.5	-67	0	0	107.8	N204 C221 C247 Y249	N204-Q218 PolarHBondContact OD1-OE1 2.98Å; Q218-C221 PolarHBondContact NE2-SG 2.74Å; Q218-C247 HydrophobicContact CG-CB 4.21Å; Q218-Y249 HydrophobicContact CB-CD1 4.03Å; Q218-Y249 HydrophobicContact CB-CE1 3.75Å; Q218-Y249 HydrophobicContact CG-CD1 4.42Å; Q218-Y249 HydrophobicContact CG-CE1 3.94Å
219	V	95.4	Very high	90.5	Very high	36 Å²	36	76.2 Å²	76.2	22%	0.218	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-54.9	-178	-179.8	0	0	0	0	110.3	W150 A151 E217 L248 R250	W150-V219 HydrophobicContact CZ3-CG1 4.14Å; A151-V219 HydrophobicContact CB-CG1 4.01Å; E217-V219 HydrophobicContact CG-CG2 4.2Å; E217-V219 PolarHBondContact O-N 3.36Å; V219-L248 HydrophobicContact CB-CD2 4.44Å; V219-L248 HydrophobicContact CB-CG 4.4Å; V219-L248 PolarHBondContact N-O 3.45Å; V219-R250 HydrophobicContact CG2-CB 3.53Å
220	I	95.3	Very high	90.3	Very high	18 Å²	18	68.4 Å²	68.4	9%	0.092	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	155.8	-176.6	-165.8	58.5	0	0	0	110	W150 T224 C231 C247 L248	W150-I220 HydrophobicContact CH2-CB 4.34Å; W150-I220 HydrophobicContact CH2-CG1 4.36Å; W150-I220 HydrophobicContact CZ3-CB 4.08Å; W150-I220 HydrophobicContact CZ3-CG1 4.44Å; W150-I220 HydrophobicContact CZ3-CG2 3.94Å; I220-T224 HydrophobicContact CD1-CG2 3.94Å; I220-C231 HydrophobicContact CG2-CB 3.47Å; I220-C231 VanDerWaalsContact CG2-CB 3.47Å; I220-C247 CarbonylContact O-C 3.49Å; I220-C247 VanDerWaalsContact O-CA 3.26Å; I220-C247 WeakPolarHBondContact O-CA 3.2Å; I220-L248 HydrophobicContact CG2-CB 4.27Å; I220-L248 PolarHBondContact O-N 3.41Å
221	C	94.7	Very high	90.1	Very high	9 Å²	9	66.8 Å²	66.8	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	156.2	169	-56	0	0	0	0	109.9	Q218 T224 N229 Q246 C247	Q218-C221 PolarHBondContact NE2-SG 2.74Å; C221-T224 PolarHBondContact O-OG1 3.01Å; C221-N229 PolarHBondContact O-ND2 3.4Å; C221-Q246 WeakPolarHBondContact CA-O 3.31Å; C221-C247 HydrophobicContact CB-CB 4.04Å; C221-C247 WeakPolarHBondContact CB-SG 3.48Å; C221-C247 WeakPolarHBondContact SG-CB 3.34Å; C221-C247 CovalentContact SG-SG 2.03Å; C221-C247 PolarHBondContact SG-SG 3Å
222	G	92	Very high	89.9	Confident	2 Å²	2	67.8 Å²	67.8	2%	0.021	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	156.5	169.9	0	0	0	0	0	111.8	T224 A243 K244 Q246	G222-T224 PolarHBondContact O-N 3.46Å; G222-A243 VanDerWaalsContact CA-O 3.31Å; G222-A243 WeakPolarHBondContact CA-O 3.21Å; G222-A243 PolarHBondContact N-O 3.35Å; G222-K244 VanDerWaalsContact O-CA 3.3Å; G222-K244 WeakPolarHBondContact O-CA 3.32Å; G222-Q246 PolarHBondContact N-O 3.49Å
223	G	85	Confident	89.7	Confident	27 Å²	27	63.2 Å²	63.2	28%	0.278	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	15	178.4	0	0	0	0	0	115.9	D232	G223-D232 WeakPolarHBondContact CA-OD2 3.41Å; G223-D232 PolarHBondContact N-OD2 2.78Å
224	T	81	Confident	89.4	Confident	64 Å²	64	57.4 Å²	57.4	39%	0.393	29%	0.291	S	S	.	.			trans	-73.3	129.3	171	-53.3	0	0	0	0	108.7	I220 C221 G222 S226	I220-T224 HydrophobicContact CD1-CG2 3.94Å; C221-T224 PolarHBondContact O-OG1 3.01Å; G222-T224 PolarHBondContact O-N 3.46Å; T224-S226 PolarHBondContact O-N 2.73Å
225	E	69.2	Low	89.1	Confident	201 Å²	201	61.3 Å²	61.3	94%	0.939	31%	0.312	S	S	*	.			trans	-69	65.8	-178.6	-64.5	178.7	-173.5	0	0	112.1
226	S	67.2	Low	88.8	Confident	52 Å²	52	56.7 Å²	56.7	36%	0.364	29%	0.286	S	S	.	.			trans	-107.2	145.4	167.3	60.5	0	0	0	0	108.5	T224 Y228	T224-S226 PolarHBondContact O-N 2.73Å; S226-Y228 PolarHBondContact O-N 2.94Å
227	F	69.1	Low	88.4	Confident	223 Å²	223	59.6 Å²	59.6	98%	0.978	32%	0.319	S	S	*	.	S	Bend	trans	-53.9	-27.5	-179.7	-174.5	-97.4	0	0	0	112.6
228	Y	84.6	Confident	88.1	Confident	149 Å²	149	56.3 Å²	56.3	58%	0.584	30%	0.304	S	S	*	.			trans	-149.9	114.1	174.1	-177.7	-108.4	0	0	0	110.7	S226 P230	S226-Y228 PolarHBondContact O-N 2.94Å; Y228-P230 HydrophobicContact CD1-CB 4.5Å; Y228-P230 HydrophobicContact CD1-CG 4.26Å; Y228-P230 HydrophobicContact CE1-CB 3.68Å; Y228-P230 HydrophobicContact CE1-CG 3.81Å
229	N	90.9	Very high	87.8	Confident	16 Å²	16	57.4 Å²	57.4	9%	0.086	31%	0.309	C	S	.	.			trans	-113.6	94.3	173.2	-175.1	-0.5	0	0	0	109.7	C221 C231 D232	C221-N229 PolarHBondContact O-ND2 3.4Å; N229-C231 PolarHBondContact O-N 2.95Å; N229-C231 VanDerWaalsContact O-N 3.1Å; N229-C231 WeakPolarHBondContact OD1-CA 2.98Å; N229-C231 WeakPolarHBondContact OD1-CB 3.37Å; N229-C231 PolarHBondContact OD1-N 3.22Å; N229-C231 VanDerWaalsContact OD1-N 3.08Å; N229-D232 HydrophobicContact CB-CB 4.24Å; N229-D232 PolarHBondContact O-N 3.17Å
230	P	93	Very high	87.6	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.032	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-8	179.5	27.4	-31	0	0	0	112.9	F143 W150 Y228	F143-P230 WeakPolarHBondContact CE2-O 3.46Å; W150-P230 HydrophobicContact CB-CB 4.48Å; W150-P230 HydrophobicContact CB-CG 3.49Å; W150-P230 VanDerWaalsContact CB-CG 3.49Å; W150-P230 HydrophobicContact CD2-CG 3.55Å; W150-P230 HydrophobicContact CE3-CG 4.03Å; W150-P230 HydrophobicContact CG-CG 3.29Å; Y228-P230 HydrophobicContact CD1-CB 4.5Å; Y228-P230 HydrophobicContact CD1-CG 4.26Å; Y228-P230 HydrophobicContact CE1-CB 3.68Å; Y228-P230 HydrophobicContact CE1-CG 3.81Å
231	C	94.7	Very high	87.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	13.8	-177.8	-64.5	0	0	0	0	112.5	C147 W201 I220 N229 W233	C147-C231 WeakPolarHBondContact CA-SG 3.29Å; C147-C231 HydrophobicContact CB-CB 3.98Å; C147-C231 WeakPolarHBondContact CB-SG 3.32Å; C147-C231 VanDerWaalsContact SG-CA 3.55Å; C147-C231 WeakPolarHBondContact SG-CB 3.31Å; C147-C231 CovalentContact SG-SG 2.03Å; C147-C231 PolarHBondContact SG-SG 2.82Å; W201-C231 HydrophobicContact CH2-CB 3.86Å; W201-C231 WeakPolarHBondContact CH2-O 3.3Å; I220-C231 HydrophobicContact CG2-CB 3.47Å; I220-C231 VanDerWaalsContact CG2-CB 3.47Å; N229-C231 PolarHBondContact O-N 2.95Å; N229-C231 VanDerWaalsContact O-N 3.1Å; N229-C231 WeakPolarHBondContact OD1-CA 2.98Å; N229-C231 WeakPolarHBondContact OD1-CB 3.37Å; N229-C231 PolarHBondContact OD1-N 3.22Å; N229-C231 VanDerWaalsContact OD1-N 3.08Å; C231-W233 PolarHBondContact O-N 3.41Å
232	D	94.4	Very high	87.2	Confident	20 Å²	20	69.7 Å²	69.7	11%	0.107	37%	0.366	C	S	.	.			trans	-84.5	110.9	178.8	-162.4	-30.1	0	0	0	111.9	F143 G223 N229 T234 L235	F143-D232 WeakPolarHBondContact CE2-O 3.46Å; G223-D232 WeakPolarHBondContact CA-OD2 3.41Å; G223-D232 PolarHBondContact N-OD2 2.78Å; N229-D232 HydrophobicContact CB-CB 4.24Å; N229-D232 PolarHBondContact O-N 3.17Å; D232-T234 PolarHBondContact O-N 3.41Å; D232-T234 VanDerWaalsContact O-N 3.08Å; D232-T234 WeakPolarHBondContact OD1-CB 3.39Å; D232-T234 WeakPolarHBondContact OD1-CG2 3.31Å; D232-T234 PolarHBondContact OD1-N 2.58Å; D232-T234 PolarHBondContact OD1-OG1 3.03Å; D232-T234 PolarHBondContact OD2-OG1 3.43Å; D232-L235 HydrophobicContact CB-CG 4.49Å; D232-L235 VanDerWaalsContact O-CB 3.28Å; D232-L235 WeakPolarHBondContact O-CB 3.48Å; D232-L235 VanDerWaalsContact O-CG 3.29Å; D232-L235 WeakPolarHBondContact O-CG 3.06Å; D232-L235 PolarHBondContact O-N 3.14Å
233	W	92.7	Very high	87.3	Confident	5 Å²	5	69.6 Å²	69.6	2%	0.019	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-62.8	-13	178.9	-76.5	92.9	0	0	0	114.4	K76 V140 F143 V144 W201 C231 L235 M236 L238 A243 Q246	K76-W233 HydrophobicContact CB-CD2 4.31Å; K76-W233 HydrophobicContact CB-CE3 4.01Å; K76-W233 HydrophobicContact CB-CH2 3.88Å; K76-W233 HydrophobicContact CB-CZ2 4.17Å; K76-W233 HydrophobicContact CB-CZ3 3.79Å; K76-W233 HydrophobicContact CD-CD2 4.39Å; K76-W233 HydrophobicContact CD-CH2 4.02Å; K76-W233 HydrophobicContact CD-CZ2 3.5Å; K76-W233 VanDerWaalsContact CD-CZ2 3.5Å; K76-W233 HydrophobicContact CG-CD2 4.12Å; K76-W233 HydrophobicContact CG-CE3 4.35Å; K76-W233 HydrophobicContact CG-CH2 4.27Å; K76-W233 HydrophobicContact CG-CZ2 4.03Å; K76-W233 HydrophobicContact CG-CZ3 4.41Å; V140-W233 HydrophobicContact CG1-CH2 4.26Å; V140-W233 HydrophobicContact CG1-CZ3 4.41Å; F143-W233 HydrophobicContact CD1-CE3 4.33Å; F143-W233 HydrophobicContact CD1-CH2 4.02Å; F143-W233 HydrophobicContact CD1-CZ2 4.25Å; F143-W233 HydrophobicContact CD1-CZ3 4.07Å; F143-W233 AromaticContact CE1-CD2 3.64Å; F143-W233 HydrophobicContact CE1-CD2 3.64Å; F143-W233 AromaticContact CE1-CE2 3.54Å; F143-W233 AromaticContact CE1-CE3 3.82Å; F143-W233 HydrophobicContact CE1-CE3 3.82Å; F143-W233 HydrophobicContact CE1-CG 4.23Å; F143-W233 AromaticContact CE1-CH2 3.81Å; F143-W233 HydrophobicContact CE1-CH2 3.81Å; F143-W233 AromaticContact CE1-CZ2 3.62Å; F143-W233 HydrophobicContact CE1-CZ2 3.62Å; F143-W233 AromaticContact CE1-CZ3 3.91Å; F143-W233 HydrophobicContact CE1-CZ3 3.91Å; F143-W233 HydrophobicContact CZ-CD2 4.1Å; F143-W233 HydrophobicContact CZ-CG 4.22Å; V144-W233 HydrophobicContact CG1-CH2 3.83Å; V144-W233 HydrophobicContact CG1-CZ2 3.97Å; W201-W233 HydrophobicContact CD2-CZ2 4.49Å; W201-W233 AromaticContact CD2-NE1 3.77Å; W201-W233 AromaticContact CE2-NE1 3.91Å; W201-W233 AromaticContact CE3-NE1 3.43Å; W201-W233 AromaticContact CH2-CD1 3.97Å; W201-W233 AromaticContact CH2-NE1 3.35Å; W201-W233 VanDerWaalsContact CH2-NE1 3.35Å; W201-W233 HydrophobicContact CZ2-CZ2 4.38Å; W201-W233 AromaticContact CZ2-NE1 3.72Å; W201-W233 AromaticContact CZ3-CD1 3.71Å; W201-W233 AromaticContact CZ3-NE1 3.22Å; C231-W233 PolarHBondContact O-N 3.41Å; W233-L235 PolarHBondContact O-N 2.99Å; W233-M236 HydrophobicContact CE3-CB 4.12Å; W233-M236 HydrophobicContact CE3-CG 4.17Å; W233-M236 HydrophobicContact CZ3-CG 4.31Å; W233-M236 PolarHBondContact O-N 3.2Å; W233-L238 HydrophobicContact CB-CB 3.91Å; W233-L238 HydrophobicContact CB-CD2 3.66Å; W233-L238 HydrophobicContact CB-CG 4.4Å; W233-L238 HydrophobicContact CG-CD2 4.28Å; W233-L238 WeakPolarHBondContact O-CB 3.22Å; W233-L238 PolarHBondContact O-N 3.05Å; W233-A243 HydrophobicContact CB-CB 4.16Å; W233-Q246 HydrophobicContact CG-CB 4.48Å
234	T	92	Very high	87.7	Confident	50 Å²	50	73.9 Å²	73.9	31%	0.307	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-60	-27.6	169	56.4	0	0	0	0	112.3	D232 M236 G237 P240 A243	D232-T234 PolarHBondContact O-N 3.41Å; D232-T234 VanDerWaalsContact O-N 3.08Å; D232-T234 WeakPolarHBondContact OD1-CB 3.39Å; D232-T234 WeakPolarHBondContact OD1-CG2 3.31Å; D232-T234 PolarHBondContact OD1-N 2.58Å; D232-T234 PolarHBondContact OD1-OG1 3.03Å; D232-T234 PolarHBondContact OD2-OG1 3.43Å; T234-M236 PolarHBondContact O-N 3.28Å; T234-G237 PolarHBondContact O-N 3.01Å; T234-P240 HydrophobicContact CG2-CB 4.14Å; T234-P240 HydrophobicContact CG2-CG 4.06Å; T234-A243 HydrophobicContact CG2-CB 3.62Å
235	L	91.4	Very high	88.3	Confident	114 Å²	114	74 Å²	74	60%	0.597	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-63.1	-20.7	173.3	-60.6	175.7	0	0	0	112.8	F143 D232 W233	F143-L235 HydrophobicContact CD2-CB 4.36Å; F143-L235 HydrophobicContact CD2-CD1 4.47Å; F143-L235 HydrophobicContact CE2-CB 4.29Å; F143-L235 HydrophobicContact CE2-CD1 4.2Å; D232-L235 HydrophobicContact CB-CG 4.49Å; D232-L235 VanDerWaalsContact O-CB 3.28Å; D232-L235 WeakPolarHBondContact O-CB 3.48Å; D232-L235 VanDerWaalsContact O-CG 3.29Å; D232-L235 WeakPolarHBondContact O-CG 3.06Å; D232-L235 PolarHBondContact O-N 3.14Å; W233-L235 PolarHBondContact O-N 2.99Å
236	M	91	Very high	89.5	Confident	35 Å²	35	64.9 Å²	64.9	17%	0.172	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-101.6	9.7	175.1	-61.5	-53.5	-57.5	0	0	112.7	L80 V140 F143 W233 T234	L80-M236 WeakPolarHBondContact CD2-O 3.28Å; V140-M236 HydrophobicContact CB-CE 4.49Å; V140-M236 HydrophobicContact CG2-CE 3.81Å; F143-M236 HydrophobicContact CB-CG 4.02Å; F143-M236 HydrophobicContact CB-SD 3.6Å; F143-M236 VanDerWaalsContact CB-SD 3.6Å; F143-M236 HydrophobicContact CD1-CG 3.79Å; F143-M236 HydrophobicContact CD1-SD 4.5Å; F143-M236 HydrophobicContact CD2-CG 4.03Å; F143-M236 HydrophobicContact CD2-SD 4.35Å; F143-M236 HydrophobicContact CE1-CG 4.29Å; F143-M236 HydrophobicContact CE2-CG 4.48Å; F143-M236 HydrophobicContact CG-CG 3.65Å; F143-M236 HydrophobicContact CG-SD 3.9Å; W233-M236 HydrophobicContact CE3-CB 4.12Å; W233-M236 HydrophobicContact CE3-CG 4.17Å; W233-M236 HydrophobicContact CZ3-CG 4.31Å; W233-M236 PolarHBondContact O-N 3.2Å; T234-M236 PolarHBondContact O-N 3.28Å
237	G	89	Confident	90.8	Very high	69 Å²	69	62.4 Å²	62.4	71%	0.711	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	7	178.5	0	0	0	0	0	115	T234	T234-G237 PolarHBondContact O-N 3.01Å
238	L	89.9	Confident	92.2	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.058	27%	0.265	C	S	.	.			trans	-68.2	135.8	175.5	-172	58.8	0	0	0	110.5	A75 W233 K242 A243 Q246	A75-L238 WeakPolarHBondContact O-CD1 3.32Å; W233-L238 HydrophobicContact CB-CB 3.91Å; W233-L238 HydrophobicContact CB-CD2 3.66Å; W233-L238 HydrophobicContact CB-CG 4.4Å; W233-L238 HydrophobicContact CG-CD2 4.28Å; W233-L238 WeakPolarHBondContact O-CB 3.22Å; W233-L238 PolarHBondContact O-N 3.05Å; L238-K242 HydrophobicContact CD1-CB 3.82Å; L238-K242 HydrophobicContact CD1-CD 3.77Å; L238-K242 HydrophobicContact CD1-CG 4.48Å; L238-K242 HydrophobicContact CD2-CB 4.08Å; L238-K242 HydrophobicContact CG-CB 3.83Å; L238-A243 HydrophobicContact CB-CB 4.45Å; L238-A243 HydrophobicContact CD2-CB 4.18Å; L238-A243 HydrophobicContact CG-CB 4.32Å; L238-Q246 HydrophobicContact CD2-CG 3.93Å
239	E	90.8	Very high	92.8	Very high	100 Å²	100	44.7 Å²	44.7	47%	0.467	24%	0.237	S	C	.	.			trans	-51.4	132	176.4	-172.4	-162.5	159.6	0	0	110.8	K241 K242 A243	E239-K241 PolarHBondContact O-N 2.98Å; E239-K242 HydrophobicContact CB-CB 4.4Å; E239-K242 HydrophobicContact CB-CD 4.24Å; E239-K242 HydrophobicContact CB-CG 4.21Å; E239-K242 WeakPolarHBondContact O-CA 3.32Å; E239-K242 WeakPolarHBondContact O-CB 3.34Å; E239-K242 PolarHBondContact O-N 3.08Å; E239-A243 PolarHBondContact O-N 2.93Å
240	P	91.3	Very high	93.1	Very high	80 Å²	80	45.2 Å²	45.2	52%	0.519	24%	0.238	S	C	.	.	H	α-helix	trans	-51.6	-36.9	-175.4	-30.5	35.1	0	0	0	114.7	T234 A243 K244	T234-P240 HydrophobicContact CG2-CB 4.14Å; T234-P240 HydrophobicContact CG2-CG 4.06Å; P240-A243 PolarHBondContact O-N 3.19Å; P240-K244 WeakPolarHBondContact O-CG 2.8Å; P240-K244 PolarHBondContact O-N 2.82Å
241	K	91.5	Very high	93.3	Very high	158 Å²	158	45.2 Å²	45.2	69%	0.687	24%	0.238	S	C	*	.	H	α-helix	trans	-65.2	-41.3	176.5	-172.6	179.2	178.8	-179.2	0	112.3	E239	E239-K241 PolarHBondContact O-N 2.98Å
242	K	91.3	Very high	93.4	Very high	82 Å²	82	47.2 Å²	47.2	36%	0.357	25%	0.248	S	C	.	.	H	α-helix	trans	-70.9	-39.4	175.5	-64.8	-178.7	-172.1	175.9	0	111.1	D79 L238 E239 E245 Q246	D79-K242 IonicContact OD2-NZ 3.37Å; D79-K242 PolarHBondContact OD2-NZ 2.97Å; L238-K242 HydrophobicContact CD1-CB 3.82Å; L238-K242 HydrophobicContact CD1-CD 3.77Å; L238-K242 HydrophobicContact CD1-CG 4.48Å; L238-K242 HydrophobicContact CD2-CB 4.08Å; L238-K242 HydrophobicContact CG-CB 3.83Å; E239-K242 HydrophobicContact CB-CB 4.4Å; E239-K242 HydrophobicContact CB-CD 4.24Å; E239-K242 HydrophobicContact CB-CG 4.21Å; E239-K242 WeakPolarHBondContact O-CA 3.32Å; E239-K242 WeakPolarHBondContact O-CB 3.34Å; E239-K242 PolarHBondContact O-N 3.08Å; K242-E245 WeakPolarHBondContact O-CB 3.25Å; K242-E245 PolarHBondContact O-N 3.42Å; K242-Q246 PolarHBondContact O-N 3.37Å
243	A	92.6	Very high	93.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-40	178.1	0	0	0	0	0	112.3	G222 W233 T234 L238 E239 P240 E245 Q246	G222-A243 VanDerWaalsContact CA-O 3.31Å; G222-A243 WeakPolarHBondContact CA-O 3.21Å; G222-A243 PolarHBondContact N-O 3.35Å; W233-A243 HydrophobicContact CB-CB 4.16Å; T234-A243 HydrophobicContact CG2-CB 3.62Å; L238-A243 HydrophobicContact CB-CB 4.45Å; L238-A243 HydrophobicContact CD2-CB 4.18Å; L238-A243 HydrophobicContact CG-CB 4.32Å; E239-A243 PolarHBondContact O-N 2.93Å; P240-A243 PolarHBondContact O-N 3.19Å; A243-E245 PolarHBondContact O-N 3.09Å; A243-Q246 PolarHBondContact O-N 2.94Å
244	K	93.6	Very high	93.4	Very high	118 Å²	118	53.9 Å²	53.9	51%	0.513	28%	0.276	S	S	.	.	H	α-helix	trans	-57.8	-30.2	173.4	-78.1	179.3	178.6	-171.5	0	114.3	G222 P240	G222-K244 VanDerWaalsContact O-CA 3.3Å; G222-K244 WeakPolarHBondContact O-CA 3.32Å; P240-K244 WeakPolarHBondContact O-CG 2.8Å; P240-K244 PolarHBondContact O-N 2.82Å
245	E	93.8	Very high	93.1	Very high	67 Å²	67	57.2 Å²	57.2	31%	0.313	29%	0.287	S	S	.	.	H	α-helix	trans	-79.7	-19.6	175.8	-72.1	-65.1	134.9	0	0	112.9	R203 N204 S205 K242 A243 C247	R203-E245 CarbonylContact C-O 3.51Å; R203-E245 VanDerWaalsContact CA-O 3.22Å; R203-E245 WeakPolarHBondContact CA-O 3.36Å; N204-E245 PolarHBondContact N-O 3.2Å; S205-E245 WeakPolarHBondContact CB-OE2 3.32Å; S205-E245 PolarHBondContact N-OE2 3.2Å; S205-E245 PolarHBondContact OG-OE2 3.47Å; K242-E245 WeakPolarHBondContact O-CB 3.25Å; K242-E245 PolarHBondContact O-N 3.42Å; A243-E245 PolarHBondContact O-N 3.09Å; E245-C247 PolarHBondContact O-N 3.29Å
246	Q	94.1	Very high	92.1	Very high	8 Å²	8	55.5 Å²	55.5	4%	0.037	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	111.7	178.4	-56.8	-52.9	-48.5	0	0	110.1	K76 W201 C221 G222 W233 L238 K242 A243	K76-Q246 HydrophobicContact CG-CG 4.49Å; W201-Q246 HydrophobicContact CE3-CB 4.46Å; C221-Q246 WeakPolarHBondContact CA-O 3.31Å; G222-Q246 PolarHBondContact N-O 3.49Å; W233-Q246 HydrophobicContact CG-CB 4.48Å; L238-Q246 HydrophobicContact CD2-CG 3.93Å; K242-Q246 PolarHBondContact O-N 3.37Å; A243-Q246 PolarHBondContact O-N 2.94Å
247	C	96	Very high	90.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.9	175.5	-52.9	0	0	0	0	111.3	W201 E202 N204 Q218 I220 C221 E245 Y249	W201-C247 WeakPolarHBondContact CA-O 3.47Å; E202-C247 PolarHBondContact N-O 2.98Å; E202-C247 PolarHBondContact O-N 2.86Å; N204-C247 WeakPolarHBondContact CB-SG 3.18Å; N204-C247 VanDerWaalsContact CG-SG 3.57Å; Q218-C247 HydrophobicContact CG-CB 4.21Å; I220-C247 CarbonylContact O-C 3.49Å; I220-C247 VanDerWaalsContact O-CA 3.26Å; I220-C247 WeakPolarHBondContact O-CA 3.2Å; C221-C247 HydrophobicContact CB-CB 4.04Å; C221-C247 WeakPolarHBondContact CB-SG 3.48Å; C221-C247 WeakPolarHBondContact SG-CB 3.34Å; C221-C247 CovalentContact SG-SG 2.03Å; C221-C247 PolarHBondContact SG-SG 3Å; E245-C247 PolarHBondContact O-N 3.29Å; C247-Y249 HydrophobicContact CB-CD2 4.31Å; C247-Y249 HydrophobicContact CB-CE2 3.65Å; C247-Y249 WeakPolarHBondContact O-CD2 3.24Å
248	L	96.9	Very high	88.2	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.3	168.8	-179.3	63.9	0	0	0	109.1	Y148 A151 Y199 W201 V219 I220	Y148-L248 HydrophobicContact CD1-CD1 4.33Å; Y148-L248 HydrophobicContact CD1-CD2 4.33Å; Y148-L248 HydrophobicContact CE1-CD1 3.82Å; A151-L248 HydrophobicContact CB-CD2 3.5Å; A151-L248 VanDerWaalsContact CB-CD2 3.5Å; Y199-L248 HydrophobicContact CD1-CD1 3.97Å; Y199-L248 HydrophobicContact CD1-CD2 4.16Å; Y199-L248 HydrophobicContact CD1-CG 4.19Å; Y199-L248 HydrophobicContact CE1-CD2 4.31Å; Y199-L248 HydrophobicContact CG-CD1 4.26Å; W201-L248 HydrophobicContact CD2-CB 4.33Å; W201-L248 HydrophobicContact CD2-CD1 4.12Å; W201-L248 HydrophobicContact CE3-CB 4.06Å; W201-L248 HydrophobicContact CG-CD1 4.41Å; W201-L248 HydrophobicContact CH2-CB 4Å; W201-L248 HydrophobicContact CZ2-CB 4.23Å; W201-L248 HydrophobicContact CZ2-CD1 4.29Å; W201-L248 HydrophobicContact CZ3-CB 3.89Å; V219-L248 HydrophobicContact CB-CD2 4.44Å; V219-L248 HydrophobicContact CB-CG 4.4Å; V219-L248 PolarHBondContact N-O 3.45Å; I220-L248 HydrophobicContact CG2-CB 4.27Å; I220-L248 PolarHBondContact O-N 3.41Å
249	Y	97.8	Very high	85.7	Confident	1 Å²	1	74.3 Å²	74.3	0%	0.004	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146	174.5	-67.4	-92.4	0	0	0	110.2	Y199 V200 E202 N204 K208 M211 E217 Q218 C247	Y199-Y249 WeakPolarHBondContact CA-O 3.42Å; V200-Y249 PolarHBondContact N-O 3.48Å; V200-Y249 WeakPolarHBondContact O-CB 3.36Å; V200-Y249 PolarHBondContact O-N 3.32Å; E202-Y249 HydrophobicContact CB-CD2 3.99Å; E202-Y249 HydrophobicContact CB-CE2 3.81Å; N204-Y249 PolarHBondContact OD1-OH 3.21Å; N204-Y249 VanDerWaalsContact OD1-OH 3.05Å; K208-Y249 WeakPolarHBondContact CA-OH 3.37Å; M211-Y249 HydrophobicContact CB-CD1 3.55Å; M211-Y249 HydrophobicContact CB-CE1 3.59Å; M211-Y249 HydrophobicContact CB-CG 4.16Å; M211-Y249 HydrophobicContact CE-CD1 4.33Å; M211-Y249 HydrophobicContact CE-CD2 4.21Å; M211-Y249 HydrophobicContact CE-CG 3.8Å; M211-Y249 HydrophobicContact CG-CD1 3.83Å; M211-Y249 HydrophobicContact CG-CD2 4.13Å; M211-Y249 HydrophobicContact CG-CE1 3.83Å; M211-Y249 HydrophobicContact CG-CE2 4.15Å; M211-Y249 HydrophobicContact CG-CG 3.97Å; E217-Y249 CarbonylContact O-C 3.54Å; E217-Y249 WeakPolarHBondContact O-CA 3.5Å; Q218-Y249 HydrophobicContact CB-CD1 4.03Å; Q218-Y249 HydrophobicContact CB-CE1 3.75Å; Q218-Y249 HydrophobicContact CG-CD1 4.42Å; Q218-Y249 HydrophobicContact CG-CE1 3.94Å; C247-Y249 HydrophobicContact CB-CD2 4.31Å; C247-Y249 HydrophobicContact CB-CE2 3.65Å; C247-Y249 WeakPolarHBondContact O-CD2 3.24Å
250	R	97.9	Very high	85.4	Confident	27 Å²	27	73.1 Å²	73.1	10%	0.102	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.3	178.8	-175.1	178.5	64.2	-156.9	0.4	110.8	A151 K152 P153 H198 Y199 Y216 E217 V219 I252	A151-R250 PolarHBondContact O-NH1 2.81Å; K152-R250 PolarHBondContact O-NH1 2.98Å; P153-R250 VanDerWaalsContact CA-NH1 3.34Å; P153-R250 VanDerWaalsContact N-NH1 3.13Å; H198-R250 WeakPolarHBondContact O-CA 3.41Å; Y199-R250 HydrophobicContact CD1-CB 3.86Å; Y199-R250 HydrophobicContact CD1-CG 3.95Å; Y199-R250 HydrophobicContact CE1-CB 3.83Å; Y199-R250 HydrophobicContact CE1-CG 3.64Å; Y216-R250 CarbonylContact C-O 3.54Å; Y216-R250 VanDerWaalsContact CA-O 3.3Å; Y216-R250 WeakPolarHBondContact CA-O 3.14Å; E217-R250 HydrophobicContact CG-CB 4.06Å; E217-R250 PolarHBondContact N-O 2.98Å; E217-R250 PolarHBondContact O-N 3.2Å; E217-R250 IonicContact OE1-CZ 2.72Å; E217-R250 IonicContact OE1-NE 3.12Å; E217-R250 PolarHBondContact OE1-NE 2.93Å; E217-R250 IonicContact OE1-NH2 3.07Å; E217-R250 PolarHBondContact OE1-NH2 3.04Å; E217-R250 IonicContact OE2-NH2 3.93Å; E217-R250 PolarHBondContact OE2-NH2 3.42Å; E217-R250 VanDerWaalsContact OE2-NH2 3.12Å; V219-R250 HydrophobicContact CG2-CB 3.53Å; R250-I252 HydrophobicContact CG-CG1 4.27Å
251	L	97.7	Very high	85.1	Confident	5 Å²	5	72.7 Å²	72.7	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	129.7	169	175.5	64.3	0	0	0	108.6	A185 F188 L189 Y197 H198 N215 Y216	A185-L251 HydrophobicContact CB-CD2 3.88Å; F188-L251 HydrophobicContact CD1-CD2 3.86Å; F188-L251 HydrophobicContact CD1-CG 4.27Å; F188-L251 HydrophobicContact CE1-CD2 4.18Å; F188-L251 HydrophobicContact CE1-CG 4.07Å; L189-L251 HydrophobicContact CD1-CD2 4.16Å; L189-L251 HydrophobicContact CD2-CD2 4.2Å; L189-L251 HydrophobicContact CD2-CG 4.35Å; L189-L251 HydrophobicContact CG-CD2 4.04Å; Y197-L251 CarbonylContact C-O 3.52Å; Y197-L251 WeakPolarHBondContact CA-O 3.34Å; Y197-L251 WeakPolarHBondContact CB-O 3.47Å; H198-L251 PolarHBondContact N-O 2.88Å; H198-L251 PolarHBondContact O-N 2.96Å; N215-L251 HydrophobicContact CB-CD1 4.19Å; N215-L251 WeakPolarHBondContact O-CD1 3.46Å; Y216-L251 HydrophobicContact CD1-CB 3.62Å; Y216-L251 HydrophobicContact CD2-CB 4.02Å; Y216-L251 HydrophobicContact CD2-CD2 4.4Å; Y216-L251 HydrophobicContact CE1-CB 3.44Å; Y216-L251 VanDerWaalsContact CE1-CB 3.44Å; Y216-L251 HydrophobicContact CE2-CB 3.88Å; Y216-L251 HydrophobicContact CE2-CD2 3.76Å; Y216-L251 HydrophobicContact CE2-CG 4.34Å; Y216-L251 HydrophobicContact CG-CB 3.9Å
252	I	96.2	Very high	84.8	Confident	41 Å²	41	67.9 Å²	67.9	21%	0.21	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.5	178.3	-57.6	176.8	0	0	0	109.1	P153 R250 K254	P153-I252 HydrophobicContact CB-CD1 4.13Å; P153-I252 HydrophobicContact CG-CD1 3.89Å; P153-I252 HydrophobicContact CG-CG1 4.37Å; R250-I252 HydrophobicContact CG-CG1 4.27Å; I252-K254 HydrophobicContact CG2-CG 4.43Å; I252-K254 PolarHBondContact O-N 3.37Å
253	N	95.4	Very high	84.4	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	31%	0.311	C	S	.	.			trans	-75.6	105.3	172.3	-169.8	-10	0	0	0	110.1	F188 L189 T192 H194 G195 S196 K255	F188-N253 HydrophobicContact CE1-CB 4.07Å; F188-N253 HydrophobicContact CZ-CB 4.11Å; L189-N253 HydrophobicContact CD2-CB 4.09Å; T192-N253 PolarHBondContact O-ND2 2.94Å; T192-N253 PolarHBondContact OG1-ND2 2.87Å; H194-N253 WeakPolarHBondContact CA-O 3.26Å; G195-N253 PolarHBondContact N-O 3.28Å; S196-N253 PolarHBondContact O-N 2.68Å; N253-K255 WeakPolarHBondContact OD1-CB 3.45Å; N253-K255 PolarHBondContact OD1-N 3.13Å
254	K	92	Very high	83.9	Confident	164 Å²	164	71.3 Å²	71.3	71%	0.713	33%	0.331	S	S	*	.			trans	-91.9	-3.4	-179.8	-64.1	-179	-179	179.2	0	113.6	H194 I252 S256	H194-K254 PolarHBondContact CE1-O 3.11Å; H194-K254 VanDerWaalsContact ND1-C 3.31Å; H194-K254 PolarHBondContact ND1-O 3.14Å; H194-K254 VanDerWaalsContact ND1-O 3.12Å; I252-K254 HydrophobicContact CG2-CG 4.43Å; I252-K254 PolarHBondContact O-N 3.37Å; K254-S256 PolarHBondContact O-N 3.35Å
255	K	85.4	Confident	83.2	Confident	121 Å²	121	68.2 Å²	68.2	53%	0.526	32%	0.319	S	S	.	.			trans	-71.8	115.1	177.9	-63.9	-179.9	-179.5	177.6	0	108.9	H194 N253 N257	H194-K255 WeakPolarHBondContact CA-O 3.49Å; H194-K255 WeakPolarHBondContact CB-O 3.34Å; N253-K255 WeakPolarHBondContact OD1-CB 3.45Å; N253-K255 PolarHBondContact OD1-N 3.13Å; K255-N257 PolarHBondContact O-N 3.07Å
256	S	69.7	Low	82.5	Confident	78 Å²	78	68.3 Å²	68.3	55%	0.545	32%	0.319	S	S	.	.			trans	-66.4	118.3	161	45.6	0	0	0	0	106.6	K254 I258	K254-S256 PolarHBondContact O-N 3.35Å; S256-I258 PolarHBondContact O-N 2.63Å
257	N	57.2	Low	81.6	Confident	84 Å²	84	72.9 Å²	72.9	45%	0.449	34%	0.341	S	S	.	.			trans	-69.7	90.6	165.6	-73	-15.2	0	0	0	105.6	K255 Y259	K255-N257 PolarHBondContact O-N 3.07Å; N257-Y259 HydrophobicContact CB-CD2 4.01Å; N257-Y259 HydrophobicContact CB-CE2 4.26Å; N257-Y259 PolarHBondContact O-N 3.25Å; N257-Y259 VanDerWaalsContact O-N 3.07Å
258	I	41.1	Very low	80.4	Confident	149 Å²	149	79 Å²	79	76%	0.764	37%	0.369	S	S	*	.			trans	-73.7	90.5	162.4	-56	174.4	0	0	0	104.4	S256	S256-I258 PolarHBondContact O-N 2.63Å
259	Y	37.6	Very low	78.9	Confident	277 Å²	277	86.2 Å²	86.2	100%	1.086	40%	0.403	S	S	*	.			trans	-109	0	153.4	-71.3	-68.5	0	0	0	107	N257	N257-Y259 HydrophobicContact CB-CD2 4.01Å; N257-Y259 HydrophobicContact CB-CE2 4.26Å; N257-Y259 PolarHBondContact O-N 3.25Å; N257-Y259 VanDerWaalsContact O-N 3.07Å

Retrieved 259 of 259 residues in 173 ms (Link to these results)

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