G4VGT4_SCHMA Loading...

Ubiquinone biosynthesis O-methyltransferase, mitochondrial

O-methyltransferase required for two non-consecutive steps during ubiquinone biosynthesis. Catalyzes the 2 O-methylation of 3,4-dihydroxy-5-(all-trans-polyprenyl)benzoic acid into 4-hydroxy-3-methoxy-5-(all-trans-polyprenyl)benzoic acid. Also catalyzes the last step of ubiquinone biosynthesis by mediating methylation of 3-demethylubiquinone into ubiquinone. Also able to mediate the methylation of 3-demethylubiquinol into ubiquinol.

AlphaFold DB , UniProt , Accession G4VGT4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 286 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	31.4	Very low	29.4	Very low	243 Å²	243	164.7 Å²	164.7	100%	1.197	85%	0.848	S	S	*	*				0	131.4	0	-68.7	179.8	-157.4	0	0	107.8
2	A	31.7	Very low	29.3	Very low	99 Å²	99	163.9 Å²	163.9	82%	0.818	85%	0.845	S	S	*	*			trans	52.3	87.8	179.4	0	0	0	0	0	116.9
3	R	26.8	Very low	29.4	Very low	205 Å²	205	164.5 Å²	164.5	77%	0.774	85%	0.848	S	S	*	*				42.8	112.2	81.3	-78.9	-172.6	176.6	-172.9	-0.8	114.6
4	H	34.2	Very low	29.4	Very low	196 Å²	196	166 Å²	166	91%	0.907	85%	0.846	S	S	*	*				-156.3	125.4	117.4	-92.7	-51.5	0	0	0	112
5	Y	27.2	Very low	29.5	Very low	158 Å²	158	167.6 Å²	167.6	62%	0.62	84%	0.844	S	S	*	*			trans	-70.2	155.7	171.9	-73.8	-106.5	0	0	0	111	F7	Y5-F7 HydrophobicContact CD1-CD2 4.34Å; Y5-F7 AromaticContact CD1-CE2 3.98Å; Y5-F7 HydrophobicContact CD1-CE2 3.98Å; Y5-F7 HydrophobicContact CE1-CE2 4.37Å
6	L	30.3	Very low	29.8	Very low	182 Å²	182	169.4 Å²	169.4	95%	0.953	85%	0.845	S	S	*	*				-160.1	137.3	126.5	-101.1	156.7	0	0	0	110.5
7	F	29.2	Very low	29.9	Very low	175 Å²	175	166.5 Å²	166.5	77%	0.768	84%	0.843	S	S	*	*			trans	-76.8	169.3	-163.5	-101	-110.9	0	0	0	114.9	Y5	Y5-F7 HydrophobicContact CD1-CD2 4.34Å; Y5-F7 AromaticContact CD1-CE2 3.98Å; Y5-F7 HydrophobicContact CD1-CE2 3.98Å; Y5-F7 HydrophobicContact CE1-CE2 4.37Å
8	P	31.4	Very low	29.9	Very low	112 Å²	112	166.4 Å²	166.4	73%	0.727	84%	0.844	S	S	*	*			trans	-96	160.1	-175.3	38.1	-29.5	0	0	0	113.3
9	A	26.6	Very low	30.2	Very low	96 Å²	96	164 Å²	164	79%	0.793	84%	0.841	S	S	*	*			trans	164	113	143.7	0	0	0	0	0	111.4
10	V	28.9	Very low	30.2	Very low	153 Å²	153	161.1 Å²	161.1	93%	0.927	84%	0.836	S	S	*	*			trans	-142.6	114.5	145.6	-176.6	0	0	0	0	108.2
11	K	25.9	Very low	30.5	Very low	193 Å²	193	161.7 Å²	161.7	84%	0.839	84%	0.84	S	S	*	*			trans	-128.4	148	170.3	-154.3	178.8	-170	178.5	0	105.5
12	L	28.4	Very low	30.6	Very low	155 Å²	155	155.4 Å²	155.4	81%	0.812	82%	0.819	S	S	*	*			trans	102	104.7	175.5	-66.8	135.2	0	0	0	115.3
13	L	30.1	Very low	30.5	Very low	171 Å²	171	154 Å²	154	90%	0.895	82%	0.815	S	S	*	*				-173.8	120.9	95.6	-92.3	158.8	0	0	0	110.6
14	K	29.3	Very low	30.7	Very low	186 Å²	186	152 Å²	152	81%	0.809	82%	0.816	S	S	*	*			trans	-88.8	144	171.3	-100.8	-179.9	177.6	177	0	109.5
15	K	30.6	Very low	30.6	Very low	190 Å²	190	150.7 Å²	150.7	83%	0.826	81%	0.808	S	S	*	*			trans	68.7	115.5	152	-68.1	179.7	174.1	-173.5	0	117.8
16	K	34.3	Very low	30.6	Very low	196 Å²	196	148.3 Å²	148.3	85%	0.852	81%	0.814	S	S	*	*				-176.7	137.6	109.9	-100.6	170.8	-179.6	-176.3	0	112.7
17	C	32.4	Very low	30.6	Very low	121 Å²	121	148.4 Å²	148.4	82%	0.818	81%	0.81	S	S	*	*			trans	77.5	97.7	150.9	-62.3	0	0	0	0	120.2
18	L	29.9	Very low	30.7	Very low	164 Å²	164	147.4 Å²	147.4	86%	0.859	81%	0.812	S	S	*	*			trans	-74.3	152.2	137	-85	156.1	0	0	0	108.4
19	P	34.6	Very low	30.7	Very low	121 Å²	121	151.9 Å²	151.9	79%	0.786	82%	0.821	S	S	*	*				-147.9	169.7	72.8	35.6	-13.8	0	0	0	117.8
20	S	31.1	Very low	30.8	Very low	105 Å²	105	151.6 Å²	151.6	73%	0.734	81%	0.813	S	S	*	*			trans	-23.1	137	173.1	60.4	0	0	0	0	119.6
21	L	36.4	Very low	31.3	Very low	175 Å²	175	147.7 Å²	147.7	92%	0.916	79%	0.793	S	S	*	*			trans	-140.7	126.7	139	-91.2	165.9	0	0	0	109.8
22	S	33.6	Very low	32.5	Very low	111 Å²	111	140.9 Å²	140.9	78%	0.776	76%	0.764	S	S	*	*			trans	-65.2	143.7	176.6	46.8	0	0	0	0	113.6
23	G	29.1	Very low	33.7	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	76%	0.757	S	S	*	*			trans	87.3	102.3	147.9	0	0	0	0	0	115.6
24	M	31	Very low	34.8	Very low	161 Å²	161	134.1 Å²	134.1	79%	0.793	73%	0.729	S	S	*	*			trans	-169.9	115.8	136.2	-106.2	163.4	66	0	0	112
25	K	32	Very low	36.3	Very low	169 Å²	169	128.5 Å²	128.5	74%	0.735	71%	0.707	S	S	*	*			trans	78.3	116.4	139.7	-63.4	176.3	-178.5	-174.5	0	118.5	Q27	K25-Q27 PolarHBondContact O-N 3.12Å
26	S	27.5	Very low	37.7	Very low	109 Å²	109	123.3 Å²	123.3	76%	0.762	70%	0.7	S	S	*	*			trans	-37.4	115.7	156.3	54.9	0	0	0	0	111.2	N28	S26-N28 PolarHBondContact O-N 3.08Å
27	Q	31	Very low	39	Very low	184 Å²	184	117.9 Å²	117.9	86%	0.86	68%	0.683	S	S	*	*			trans	-79.1	117.9	165.2	-71.4	-162.6	-15.4	0	0	108	K25 F29	K25-Q27 PolarHBondContact O-N 3.12Å; Q27-F29 PolarHBondContact O-N 2.66Å
28	N	31.3	Very low	40.3	Very low	153 Å²	153	112.9 Å²	112.9	82%	0.818	65%	0.648	S	S	*	*			trans	-57.6	129.7	176.1	-79.6	-29.8	0	0	0	109.9	S26 S30	S26-N28 PolarHBondContact O-N 3.08Å; N28-S30 PolarHBondContact O-N 3.49Å
29	F	30.2	Very low	41.8	Very low	207 Å²	207	107.5 Å²	107.5	91%	0.908	62%	0.62	S	S	*	*			trans	-57.4	111.1	172.7	-87.1	-109.9	0	0	0	110.2	Q27 S31	Q27-F29 PolarHBondContact O-N 2.66Å; F29-S31 PolarHBondContact O-N 3.23Å
30	S	29.6	Very low	43.3	Very low	90 Å²	90	104.5 Å²	104.5	63%	0.629	61%	0.606	S	S	*	*			trans	-86.1	92.2	158.2	-175.2	0	0	0	0	106.8	N28 M32	N28-S30 PolarHBondContact O-N 3.49Å; S30-M32 PolarHBondContact O-N 3.38Å
31	S	39.1	Very low	44.7	Very low	71 Å²	71	101.3 Å²	101.3	50%	0.497	58%	0.58	S	S	.	*			trans	-55.4	125.9	166.7	49.3	0	0	0	0	108.4	F29 L33	F29-S31 PolarHBondContact O-N 3.23Å; S31-L33 PolarHBondContact O-N 2.98Å
32	M	51.3	Low	46	Very low	49 Å²	49	95.6 Å²	95.6	24%	0.241	55%	0.548	C	S	.	.			trans	-60.2	88.2	164.5	-80.4	-179.1	167.5	0	0	107.9	S30 I34 I156 Q157 V179 M185	S30-M32 PolarHBondContact O-N 3.38Å; M32-I34 PolarHBondContact O-N 3.33Å; M32-I156 HydrophobicContact CE-CG2 4.04Å; M32-I156 HydrophobicContact SD-CG2 4.4Å; M32-Q157 PolarHBondContact SD-NE2 3.2Å; M32-V179 HydrophobicContact CE-CG1 3.85Å; M32-M185 HydrophobicContact CE-CB 3.84Å; M32-M185 HydrophobicContact CE-CG 4.09Å; M32-M185 HydrophobicContact CE-SD 4.27Å
33	L	52.9	Low	47.6	Very low	128 Å²	128	94.7 Å²	94.7	67%	0.67	53%	0.53	S	S	*	.			trans	-76.5	106.4	173.3	-73.3	166.1	0	0	0	106.8	S31	S31-L33 PolarHBondContact O-N 2.98Å
34	I	54.7	Low	49.5	Very low	57 Å²	57	99.5 Å²	99.5	29%	0.292	53%	0.527	S	S	.	.			trans	-62.3	134.8	159.8	-70.3	172.4	0	0	0	107.1	M32 A36 E38 L121 I122	M32-I34 PolarHBondContact O-N 3.33Å; I34-A36 PolarHBondContact O-N 3.36Å; I34-E38 HydrophobicContact CG2-CB 4.03Å; I34-L121 HydrophobicContact CD1-CB 3.32Å; I34-L121 HydrophobicContact CD1-CD1 3.61Å; I34-L121 HydrophobicContact CD1-CG 4.09Å; I34-L121 HydrophobicContact CG1-CD1 4.06Å; I34-I122 HydrophobicContact CD1-CG1 4.2Å
35	D	59.9	Low	51.2	Low	67 Å²	67	92.6 Å²	92.6	36%	0.358	49%	0.492	S	S	.	.			trans	-62.6	126	175.5	-173.5	-29.1	0	0	0	108.6	T37 E38 K234	D35-T37 PolarHBondContact O-N 2.94Å; D35-T37 WeakPolarHBondContact OD1-CB 3.38Å; D35-T37 PolarHBondContact OD1-N 3.42Å; D35-T37 PolarHBondContact OD1-OG1 3.41Å; D35-T37 PolarHBondContact OD2-OG1 2.97Å; D35-E38 HydrophobicContact CB-CG 4.03Å; D35-E38 WeakPolarHBondContact O-CA 3.17Å; D35-E38 WeakPolarHBondContact O-CB 3.48Å; D35-E38 PolarHBondContact O-N 3.46Å; D35-K234 IonicContact OD2-NZ 3.12Å
36	A	59.4	Low	52.9	Low	81 Å²	81	85.5 Å²	85.5	67%	0.669	47%	0.465	S	S	*	.	H	α-helix	trans	-56.5	-22.8	-178.2	0	0	0	0	0	113.2	I34	I34-A36 PolarHBondContact O-N 3.36Å
37	T	61.2	Low	55.1	Low	83 Å²	83	88.7 Å²	88.7	51%	0.509	47%	0.468	S	S	.	.	H	α-helix	trans	-71.3	-29.8	173.6	60.7	0	0	0	0	113.2	D35 N41	D35-T37 PolarHBondContact O-N 2.94Å; D35-T37 WeakPolarHBondContact OD1-CB 3.38Å; D35-T37 PolarHBondContact OD1-N 3.42Å; D35-T37 PolarHBondContact OD1-OG1 3.41Å; D35-T37 PolarHBondContact OD2-OG1 2.97Å; T37-N41 PolarHBondContact O-N 3.02Å; T37-N41 PolarHBondContact O-ND2 2.83Å
38	E	60	Low	57.4	Low	15 Å²	15	84.4 Å²	84.4	7%	0.07	45%	0.448	C	S	.	.	H	α-helix	trans	-69.3	-46.3	177.1	-69.9	174	164.9	0	0	110.3	I34 D35 A40 N41 F42 H178 K234	I34-E38 HydrophobicContact CG2-CB 4.03Å; D35-E38 HydrophobicContact CB-CG 4.03Å; D35-E38 WeakPolarHBondContact O-CA 3.17Å; D35-E38 WeakPolarHBondContact O-CB 3.48Å; D35-E38 PolarHBondContact O-N 3.46Å; E38-A40 VanDerWaalsContact C-N 3.3Å; E38-A40 PolarHBondContact O-N 2.92Å; E38-N41 WeakPolarHBondContact O-CB 3.5Å; E38-N41 PolarHBondContact O-N 3.29Å; E38-F42 HydrophobicContact CB-CD2 4.43Å; E38-F42 HydrophobicContact CB-CE2 4.32Å; E38-F42 WeakPolarHBondContact O-CD2 3.35Å; E38-F42 PolarHBondContact O-N 2.77Å; E38-H178 IonicContact OE1-CE1 2.65Å; E38-H178 IonicContact OE1-CG 3.78Å; E38-H178 IonicContact OE1-ND1 3.59Å; E38-H178 PolarHBondContact OE1-ND1 3.45Å; E38-H178 IonicContact OE2-ND1 3.21Å; E38-K234 IonicContact OE1-NZ 3.01Å; E38-K234 PolarHBondContact OE1-NZ 2.9Å
39	D	61.6	Low	59.9	Low	51 Å²	51	77.8 Å²	77.8	27%	0.273	41%	0.411	S	S	.	.	H	α-helix	trans	-53.3	-45	176.9	179.3	37.6	0	0	0	112.3	N41 F42 K43	D39-N41 PolarHBondContact O-N 2.84Å; D39-F42 PolarHBondContact O-N 3.38Å; D39-K43 WeakPolarHBondContact O-CG 3.36Å; D39-K43 PolarHBondContact O-N 3.03Å; D39-K43 WeakPolarHBondContact OD1-CE 3.27Å; D39-K43 IonicContact OD1-NZ 2.72Å; D39-K43 PolarHBondContact OD1-NZ 2.95Å; D39-K43 IonicContact OD2-NZ 2.74Å; D39-K43 PolarHBondContact OD2-NZ 2.86Å
40	A	66	Low	62.8	Low	59 Å²	59	69.8 Å²	69.8	49%	0.488	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-37.2	176.9	0	0	0	0	0	113.5	E38 R44	E38-A40 VanDerWaalsContact C-N 3.3Å; E38-A40 PolarHBondContact O-N 2.92Å; A40-R44 PolarHBondContact O-N 3.19Å
41	N	61.9	Low	65.6	Low	38 Å²	38	68.9 Å²	68.9	20%	0.203	36%	0.363	C	S	.	.	H	α-helix	trans	-67.3	-42.9	176.1	-75.4	-30.5	0	0	0	111.2	T37 E38 D39 K43 R44 F45	T37-N41 PolarHBondContact O-N 3.02Å; T37-N41 PolarHBondContact O-ND2 2.83Å; E38-N41 WeakPolarHBondContact O-CB 3.5Å; E38-N41 PolarHBondContact O-N 3.29Å; D39-N41 PolarHBondContact O-N 2.84Å; N41-K43 PolarHBondContact O-N 3.14Å; N41-R44 WeakPolarHBondContact O-CB 3.39Å; N41-R44 PolarHBondContact O-N 3.46Å; N41-R44 VanDerWaalsContact O-N 3.17Å; N41-F45 WeakPolarHBondContact O-CD2 3.08Å; N41-F45 PolarHBondContact O-N 3.42Å
42	F	62.9	Low	68	Low	54 Å²	54	71.9 Å²	71.9	24%	0.237	36%	0.364	C	S	.	.	H	α-helix	trans	-64.7	-40	178.1	-77.3	-71.6	0	0	0	112.6	E38 D39 R44 F45 A46 W49 I122	E38-F42 HydrophobicContact CB-CD2 4.43Å; E38-F42 HydrophobicContact CB-CE2 4.32Å; E38-F42 WeakPolarHBondContact O-CD2 3.35Å; E38-F42 PolarHBondContact O-N 2.77Å; D39-F42 PolarHBondContact O-N 3.38Å; F42-R44 PolarHBondContact O-N 3.01Å; F42-F45 PolarHBondContact O-N 2.85Å; F42-F45 VanDerWaalsContact O-N 3.09Å; F42-A46 PolarHBondContact O-N 2.96Å; F42-W49 AromaticContact CD1-CH2 3.58Å; F42-W49 HydrophobicContact CD1-CH2 3.58Å; F42-W49 AromaticContact CD1-CZ3 3.81Å; F42-W49 HydrophobicContact CD1-CZ3 3.81Å; F42-W49 AromaticContact CE1-CH2 3.88Å; F42-W49 HydrophobicContact CE1-CH2 3.88Å; F42-I122 HydrophobicContact CB-CD1 3.84Å; F42-I122 HydrophobicContact CB-CG2 4.2Å; F42-I122 HydrophobicContact CD1-CD1 4.2Å; F42-I122 HydrophobicContact CD2-CD1 3.08Å; F42-I122 HydrophobicContact CE2-CD1 3.58Å; F42-I122 HydrophobicContact CG-CD1 3.44Å; F42-I122 VanDerWaalsContact CG-CD1 3.44Å; F42-I122 HydrophobicContact CZ-CD1 4.3Å
43	K	67.3	Low	69.7	Low	92 Å²	92	75.5 Å²	75.5	40%	0.4	39%	0.385	S	S	.	.	H	α-helix	trans	-56.1	-36	172.3	-80	166.3	172.2	156.7	0	113.1	D39 N41 A46 E124	D39-K43 WeakPolarHBondContact O-CG 3.36Å; D39-K43 PolarHBondContact O-N 3.03Å; D39-K43 WeakPolarHBondContact OD1-CE 3.27Å; D39-K43 IonicContact OD1-NZ 2.72Å; D39-K43 PolarHBondContact OD1-NZ 2.95Å; D39-K43 IonicContact OD2-NZ 2.74Å; D39-K43 PolarHBondContact OD2-NZ 2.86Å; N41-K43 PolarHBondContact O-N 3.14Å; K43-A46 VanDerWaalsContact O-CB 3.29Å; K43-A46 WeakPolarHBondContact O-CB 3.15Å; K43-A46 PolarHBondContact O-N 3.49Å; K43-E124 WeakPolarHBondContact CE-OE1 3.43Å; K43-E124 HydrophobicContact CG-CG 3.99Å; K43-E124 IonicContact NZ-OE1 3.06Å
44	R	69.2	Low	71	Confident	171 Å²	171	70.2 Å²	70.2	65%	0.645	36%	0.361	S	S	*	.	H	α-helix	trans	-66.7	-36	177.8	-177.8	-179.9	171	144.1	0.8	112.5	A40 N41 F42 A46	A40-R44 PolarHBondContact O-N 3.19Å; N41-R44 WeakPolarHBondContact O-CB 3.39Å; N41-R44 PolarHBondContact O-N 3.46Å; N41-R44 VanDerWaalsContact O-N 3.17Å; F42-R44 PolarHBondContact O-N 3.01Å; R44-A46 VanDerWaalsContact C-N 3.33Å
45	F	66.4	Low	71.8	Confident	17 Å²	17	71 Å²	71	8%	0.075	37%	0.366	C	S	.	.	H	α-helix	trans	-82.2	-13.6	-179.9	-61.3	-59.7	0	0	0	113.7	N41 F42 Q47 H48 W49 D55 L56 P226	N41-F45 WeakPolarHBondContact O-CD2 3.08Å; N41-F45 PolarHBondContact O-N 3.42Å; F42-F45 PolarHBondContact O-N 2.85Å; F42-F45 VanDerWaalsContact O-N 3.09Å; F45-Q47 VanDerWaalsContact C-N 3.28Å; F45-Q47 PolarHBondContact O-N 3.21Å; F45-Q47 VanDerWaalsContact O-N 3.12Å; F45-H48 CarbonylContact O-C 3.5Å; F45-H48 PolarHBondContact O-N 2.81Å; F45-W49 HydrophobicContact CB-CE3 4.39Å; F45-W49 PolarHBondContact O-N 3.09Å; F45-W49 VanDerWaalsContact O-N 3.09Å; F45-D55 HydrophobicContact CD1-CB 3.83Å; F45-D55 HydrophobicContact CE1-CB 3.59Å; F45-L56 HydrophobicContact CB-CD1 4.45Å; F45-L56 HydrophobicContact CD1-CD2 4.43Å; F45-L56 HydrophobicContact CG-CD2 4.33Å; F45-P226 HydrophobicContact CE1-CG 4.48Å; F45-P226 HydrophobicContact CE2-CG 4.47Å; F45-P226 HydrophobicContact CZ-CG 3.78Å
46	A	68.5	Low	72.8	Confident	19 Å²	19	69.1 Å²	69.1	16%	0.157	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-49.6	-45.4	-170.4	0	0	0	0	0	114	F42 K43 R44 H48 I128	F42-A46 PolarHBondContact O-N 2.96Å; K43-A46 VanDerWaalsContact O-CB 3.29Å; K43-A46 WeakPolarHBondContact O-CB 3.15Å; K43-A46 PolarHBondContact O-N 3.49Å; R44-A46 VanDerWaalsContact C-N 3.33Å; A46-H48 VanDerWaalsContact C-N 3.28Å; A46-H48 PolarHBondContact O-N 3.03Å; A46-I128 HydrophobicContact CB-CD1 3.6Å; A46-I128 WeakPolarHBondContact O-CD1 3.45Å
47	Q	72.1	Confident	74.1	Confident	176 Å²	176	66.1 Å²	66.1	82%	0.822	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-74.9	-15.2	-176.9	-64.9	-175.5	-8.1	0	0	114.2	F45	F45-Q47 VanDerWaalsContact C-N 3.28Å; F45-Q47 PolarHBondContact O-N 3.21Å; F45-Q47 VanDerWaalsContact O-N 3.12Å
48	H	80.3	Confident	75.3	Confident	94 Å²	94	63.3 Å²	63.3	44%	0.435	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-122.2	15.4	-174	-59.2	-60.8	0	0	0	112.4	F45 A46 W50 D51	F45-H48 CarbonylContact O-C 3.5Å; F45-H48 PolarHBondContact O-N 2.81Å; A46-H48 VanDerWaalsContact C-N 3.28Å; A46-H48 PolarHBondContact O-N 3.03Å; H48-W50 PolarHBondContact O-N 3.13Å; H48-D51 HydrophobicContact CB-CB 4.23Å; H48-D51 WeakPolarHBondContact O-CB 2.95Å; H48-D51 PolarHBondContact O-N 3.5Å
49	W	83.8	Confident	76.6	Confident	14 Å²	14	64.7 Å²	64.7	5%	0.053	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-38.7	-174	-156.5	-70.3	0	0	0	112.7	F42 F45 L56 H60 I128	F42-W49 AromaticContact CD1-CH2 3.58Å; F42-W49 HydrophobicContact CD1-CH2 3.58Å; F42-W49 AromaticContact CD1-CZ3 3.81Å; F42-W49 HydrophobicContact CD1-CZ3 3.81Å; F42-W49 AromaticContact CE1-CH2 3.88Å; F42-W49 HydrophobicContact CE1-CH2 3.88Å; F45-W49 HydrophobicContact CB-CE3 4.39Å; F45-W49 PolarHBondContact O-N 3.09Å; F45-W49 VanDerWaalsContact O-N 3.09Å; W49-L56 HydrophobicContact CB-CD1 4.24Å; W49-L56 HydrophobicContact CD2-CD1 3.47Å; W49-L56 VanDerWaalsContact CD2-CD1 3.47Å; W49-L56 HydrophobicContact CE3-CD1 4.02Å; W49-L56 HydrophobicContact CG-CD1 3.6Å; W49-L56 HydrophobicContact CZ2-CD1 4.15Å; W49-H60 PolarHBondContact O-NE2 2.93Å; W49-I128 HydrophobicContact CB-CD1 4.41Å; W49-I128 HydrophobicContact CB-CG2 3.81Å; W49-I128 HydrophobicContact CE3-CD1 3.99Å; W49-I128 HydrophobicContact CG-CG2 4.28Å
50	W	90.7	Very high	77.9	Confident	39 Å²	39	63.1 Å²	63.1	15%	0.148	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	11.5	179.4	-73.8	98.8	0	0	0	113.7	H48 Y52 H60 G102 I104 E107 H132	H48-W50 PolarHBondContact O-N 3.13Å; W50-Y52 PolarHBondContact O-N 2.95Å; W50-H60 AromaticContact CE3-CE1 3.74Å; W50-G102 WeakPolarHBondContact CZ2-O 3.35Å; W50-G102 PolarHBondContact NE1-O 2.89Å; W50-I104 HydrophobicContact CH2-CG1 4.33Å; W50-I104 HydrophobicContact CZ2-CG1 4.31Å; W50-I104 HydrophobicContact CZ3-CG1 4.47Å; W50-E107 HydrophobicContact CH2-CB 4.1Å; W50-E107 VanDerWaalsContact CH2-CD 3.44Å; W50-E107 HydrophobicContact CH2-CG 4.08Å; W50-E107 WeakPolarHBondContact CH2-OE2 3.38Å; W50-E107 VanDerWaalsContact CZ2-CD 3.44Å; W50-E107 HydrophobicContact CZ2-CG 4.17Å; W50-E107 VanDerWaalsContact CZ2-OE1 3.25Å; W50-E107 WeakPolarHBondContact CZ2-OE1 3.36Å; W50-H132 AromaticContact CD1-CD2 3.51Å; W50-H132 AromaticContact CD1-CG 3.5Å; W50-H132 VanDerWaalsContact CD1-CG 3.5Å; W50-H132 HydrophobicContact CD2-CB 4.46Å; W50-H132 AromaticContact CD2-CD2 3.42Å; W50-H132 VanDerWaalsContact CD2-CD2 3.42Å; W50-H132 AromaticContact CD2-CE1 3.4Å; W50-H132 VanDerWaalsContact CD2-CE1 3.4Å; W50-H132 AromaticContact CD2-CG 3.59Å; W50-H132 AromaticContact CD2-ND1 3.59Å; W50-H132 AromaticContact CD2-NE2 3.32Å; W50-H132 VanDerWaalsContact CD2-NE2 3.32Å; W50-H132 AromaticContact CE2-CD2 3.73Å; W50-H132 AromaticContact CE2-CE1 3.53Å; W50-H132 AromaticContact CE2-CG 3.35Å; W50-H132 AromaticContact CE2-ND1 3.23Å; W50-H132 AromaticContact CE2-NE2 3.86Å; W50-H132 AromaticContact CE3-CE1 3.37Å; W50-H132 AromaticContact CE3-ND1 3.98Å; W50-H132 AromaticContact CE3-NE2 3.41Å; W50-H132 HydrophobicContact CG-CB 4.29Å; W50-H132 AromaticContact CG-CD2 3.27Å; W50-H132 AromaticContact CG-CG 3.67Å; W50-H132 AromaticContact CG-NE2 3.62Å; W50-H132 AromaticContact CH2-CE1 3.59Å; W50-H132 AromaticContact CH2-ND1 3.73Å; W50-H132 AromaticContact CZ2-CE1 3.64Å; W50-H132 AromaticContact CZ2-CG 3.93Å; W50-H132 AromaticContact CZ2-ND1 3.33Å; W50-H132 VanDerWaalsContact CZ2-ND1 3.33Å; W50-H132 WeakPolarHBondContact CZ2-ND1 3.28Å; W50-H132 AromaticContact CZ3-CE1 3.47Å; W50-H132 VanDerWaalsContact CZ3-CE1 3.47Å; W50-H132 WeakPolarHBondContact CZ3-CE1 3.38Å; W50-H132 AromaticContact CZ3-NE2 3.98Å; W50-H132 AromaticContact NE1-CD2 3.77Å; W50-H132 AromaticContact NE1-CG 3.3Å; W50-H132 VanDerWaalsContact NE1-CG 3.3Å; W50-H132 AromaticContact NE1-ND1 3.68Å
51	D	88.9	Confident	79.1	Confident	71 Å²	71	61.3 Å²	61.3	38%	0.38	29%	0.292	S	S	.	.			trans	-75.4	106.4	167.5	-174.7	-6.3	0	0	0	109.4	H48 D53 G54	H48-D51 HydrophobicContact CB-CB 4.23Å; H48-D51 WeakPolarHBondContact O-CB 2.95Å; H48-D51 PolarHBondContact O-N 3.5Å; D51-D53 PolarHBondContact O-N 3.47Å; D51-D53 PolarHBondContact OD1-N 3.01Å; D51-G54 PolarHBondContact O-N 3.43Å; D51-G54 VanDerWaalsContact O-N 3.13Å; D51-G54 PolarHBondContact OD1-N 3.13Å
52	Y	88.8	Confident	80.6	Confident	134 Å²	134	59.7 Å²	59.7	53%	0.525	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.2	-178.7	-71.6	-80.7	0	0	0	113.7	W50 Q57 H60	W50-Y52 PolarHBondContact O-N 2.95Å; Y52-Q57 WeakPolarHBondContact O-CB 3.32Å; Y52-Q57 WeakPolarHBondContact O-CG 3.45Å; Y52-H60 HydrophobicContact CD1-CB 4.19Å; Y52-H60 AromaticContact CD1-CG 3.87Å; Y52-H60 AromaticContact CD1-ND1 3.7Å; Y52-H60 AromaticContact CE1-ND1 3.54Å
53	D	86.8	Confident	82.2	Confident	125 Å²	125	58.2 Å²	58.2	67%	0.668	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-0.2	177.2	-74	-57.2	0	0	0	112.8	D51 R265	D51-D53 PolarHBondContact O-N 3.47Å; D51-D53 PolarHBondContact OD1-N 3.01Å; D53-R265 IonicContact OD1-NH1 3.49Å
54	G	80	Confident	83.5	Confident	17 Å²	17	61 Å²	61	18%	0.175	29%	0.287	C	S	.	.	S	Bend	trans	-84.2	-164.2	-178.4	0	0	0	0	0	114.6	D51 L56 Q57	D51-G54 PolarHBondContact O-N 3.43Å; D51-G54 VanDerWaalsContact O-N 3.13Å; D51-G54 PolarHBondContact OD1-N 3.13Å; G54-L56 PolarHBondContact O-N 3.31Å; G54-Q57 WeakPolarHBondContact O-CB 3.14Å; G54-Q57 PolarHBondContact O-N 3.21Å
55	D	72.8	Confident	84.8	Confident	75 Å²	75	53.5 Å²	53.5	40%	0.401	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-30.3	-173.1	-65.8	-18.2	0	0	0	113.3	F45 Q57 P58	F45-D55 HydrophobicContact CD1-CB 3.83Å; F45-D55 HydrophobicContact CE1-CB 3.59Å; D55-Q57 VanDerWaalsContact C-N 3.33Å; D55-P58 WeakPolarHBondContact O-CD 3.29Å
56	L	80.4	Confident	86.2	Confident	26 Å²	26	53.1 Å²	53.1	14%	0.136	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	10.3	178.2	-58.7	-171	0	0	0	113.8	F45 W49 G54 P58 L59 H60	F45-L56 HydrophobicContact CB-CD1 4.45Å; F45-L56 HydrophobicContact CD1-CD2 4.43Å; F45-L56 HydrophobicContact CG-CD2 4.33Å; W49-L56 HydrophobicContact CB-CD1 4.24Å; W49-L56 HydrophobicContact CD2-CD1 3.47Å; W49-L56 VanDerWaalsContact CD2-CD1 3.47Å; W49-L56 HydrophobicContact CE3-CD1 4.02Å; W49-L56 HydrophobicContact CG-CD1 3.6Å; W49-L56 HydrophobicContact CZ2-CD1 4.15Å; G54-L56 PolarHBondContact O-N 3.31Å; L56-P58 VanDerWaalsContact C-CD 3.42Å; L56-P58 VanDerWaalsContact C-N 3.29Å; L56-L59 HydrophobicContact CB-CB 4.5Å; L56-L59 WeakPolarHBondContact O-CA 3.5Å; L56-L59 WeakPolarHBondContact O-CB 3.29Å; L56-L59 PolarHBondContact O-N 3.41Å; L56-H60 PolarHBondContact O-CD2 2.92Å; L56-H60 VanDerWaalsContact O-CD2 3.32Å; L56-H60 PolarHBondContact O-N 3.05Å; L56-H60 VanDerWaalsContact O-N 3.08Å
57	Q	86.7	Confident	87.6	Confident	19 Å²	19	53.2 Å²	53.2	9%	0.089	26%	0.255	C	S	.	.	H	α-helix	trans	-49.9	-41.2	175.4	-176.8	-77.2	-16.3	0	0	113.8	Y52 G54 D55 L59 H60 T61 Y260 R265	Y52-Q57 WeakPolarHBondContact O-CB 3.32Å; Y52-Q57 WeakPolarHBondContact O-CG 3.45Å; G54-Q57 WeakPolarHBondContact O-CB 3.14Å; G54-Q57 PolarHBondContact O-N 3.21Å; D55-Q57 VanDerWaalsContact C-N 3.33Å; Q57-L59 VanDerWaalsContact C-N 3.27Å; Q57-L59 PolarHBondContact O-N 3.28Å; Q57-H60 PolarHBondContact O-N 3Å; Q57-T61 PolarHBondContact O-N 3.37Å; Q57-T61 PolarHBondContact O-OG1 2.92Å; Q57-Y260 PolarHBondContact OE1-OH 2.91Å; Q57-R265 PolarHBondContact NE2-O 3.16Å
58	P	86.1	Confident	88.7	Confident	24 Å²	24	47.2 Å²	47.2	16%	0.156	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-38	176.1	-25.6	36.4	0	0	0	111.8	D55 L56 T61 M62 I224 Y260 W267	D55-P58 WeakPolarHBondContact O-CD 3.29Å; L56-P58 VanDerWaalsContact C-CD 3.42Å; L56-P58 VanDerWaalsContact C-N 3.29Å; P58-T61 PolarHBondContact O-N 3.26Å; P58-T61 PolarHBondContact O-OG1 3.42Å; P58-M62 WeakPolarHBondContact O-CB 3.45Å; P58-M62 PolarHBondContact O-N 2.98Å; P58-I224 HydrophobicContact CG-CG2 4.29Å; P58-Y260 HydrophobicContact CB-CE2 4.17Å; P58-Y260 HydrophobicContact CG-CE2 4.45Å; P58-W267 HydrophobicContact CB-CZ2 4.2Å; P58-W267 PolarHBondContact O-NE1 3.32Å
59	L	86.9	Confident	89.5	Confident	44 Å²	44	43.2 Å²	43.2	23%	0.23	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-42.9	178.9	-166.6	62.6	0	0	0	111.7	L56 Q57 T61 M62 R66 I104	L56-L59 HydrophobicContact CB-CB 4.5Å; L56-L59 WeakPolarHBondContact O-CA 3.5Å; L56-L59 WeakPolarHBondContact O-CB 3.29Å; L56-L59 PolarHBondContact O-N 3.41Å; Q57-L59 VanDerWaalsContact C-N 3.27Å; Q57-L59 PolarHBondContact O-N 3.28Å; L59-T61 PolarHBondContact O-N 3.14Å; L59-M62 WeakPolarHBondContact O-CB 3.34Å; L59-M62 PolarHBondContact O-N 3.34Å; L59-R66 PolarHBondContact O-NH2 3.16Å; L59-I104 HydrophobicContact CB-CD1 4.47Å; L59-I104 HydrophobicContact CD2-CD1 3.9Å; L59-I104 HydrophobicContact CG-CD1 4.2Å
60	H	89.4	Confident	90.1	Very high	18 Å²	18	42.7 Å²	42.7	8%	0.083	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-48.9	172.8	-77.2	-69.4	0	0	0	111.9	W49 W50 Y52 L56 Q57 M62 N63 I104	W49-H60 PolarHBondContact O-NE2 2.93Å; W50-H60 AromaticContact CE3-CE1 3.74Å; Y52-H60 HydrophobicContact CD1-CB 4.19Å; Y52-H60 AromaticContact CD1-CG 3.87Å; Y52-H60 AromaticContact CD1-ND1 3.7Å; Y52-H60 AromaticContact CE1-ND1 3.54Å; L56-H60 PolarHBondContact O-CD2 2.92Å; L56-H60 VanDerWaalsContact O-CD2 3.32Å; L56-H60 PolarHBondContact O-N 3.05Å; L56-H60 VanDerWaalsContact O-N 3.08Å; Q57-H60 PolarHBondContact O-N 3Å; H60-M62 VanDerWaalsContact C-N 3.31Å; H60-M62 PolarHBondContact O-N 3.22Å; H60-N63 WeakPolarHBondContact O-CB 3.42Å; H60-N63 PolarHBondContact O-N 3.39Å; H60-I104 VanDerWaalsContact CE1-CD1 3.45Å; H60-I104 WeakPolarHBondContact CE1-CD1 3.4Å
61	T	92	Very high	90.4	Very high	20 Å²	20	41.7 Å²	41.7	12%	0.123	21%	0.208	C	C	.	.	H	α-helix	trans	-74.3	-21.4	-178.8	55	0	0	0	0	113.7	Q57 P58 L59 N63 R64	Q57-T61 PolarHBondContact O-N 3.37Å; Q57-T61 PolarHBondContact O-OG1 2.92Å; P58-T61 PolarHBondContact O-N 3.26Å; P58-T61 PolarHBondContact O-OG1 3.42Å; L59-T61 PolarHBondContact O-N 3.14Å; T61-N63 PolarHBondContact O-N 3.42Å; T61-R64 VanDerWaalsContact O-CB 3.32Å; T61-R64 WeakPolarHBondContact O-CB 3.27Å; T61-R64 WeakPolarHBondContact O-CG 3.14Å; T61-R64 PolarHBondContact O-N 3.36Å; T61-R64 VanDerWaalsContact O-N 3.14Å
62	M	93.1	Very high	90.6	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.02	21%	0.208	C	C	.	.	H	α-helix	trans	-63.7	-25.8	174.2	-163.7	-169.8	-85.1	0	0	111.9	P58 L59 H60 R64 L65 R66 M258 W267	P58-M62 WeakPolarHBondContact O-CB 3.45Å; P58-M62 PolarHBondContact O-N 2.98Å; L59-M62 WeakPolarHBondContact O-CB 3.34Å; L59-M62 PolarHBondContact O-N 3.34Å; H60-M62 VanDerWaalsContact C-N 3.31Å; H60-M62 PolarHBondContact O-N 3.22Å; M62-R64 PolarHBondContact O-N 2.87Å; M62-L65 PolarHBondContact O-N 3.47Å; M62-R66 HydrophobicContact CG-CG 3.98Å; M62-R66 PolarHBondContact O-N 3.44Å; M62-R66 HydrophobicContact SD-CG 4.12Å; M62-M258 HydrophobicContact CE-CE 4.36Å; M62-M258 HydrophobicContact SD-CE 4.23Å; M62-W267 VanDerWaalsContact CA-CD1 3.45Å; M62-W267 HydrophobicContact CB-CD2 4.42Å; M62-W267 HydrophobicContact CB-CG 4.34Å; M62-W267 HydrophobicContact CE-CD2 4.32Å; M62-W267 HydrophobicContact CE-CE3 4.34Å; M62-W267 HydrophobicContact CE-CH2 3.35Å; M62-W267 HydrophobicContact CE-CZ2 3.32Å; M62-W267 HydrophobicContact CE-CZ3 3.88Å; M62-W267 HydrophobicContact CG-CD2 4.21Å; M62-W267 HydrophobicContact CG-CG 4.39Å; M62-W267 VanDerWaalsContact N-CD1 3.34Å
63	N	95.5	Very high	90.9	Very high	23 Å²	23	36.5 Å²	36.5	12%	0.123	20%	0.197	C	C	.	.	H	α-helix	trans	-57.3	-23.2	173.5	-80.4	2.2	0	0	0	113.3	H60 T61 L65 R66 V67 P68 I104	H60-N63 WeakPolarHBondContact O-CB 3.42Å; H60-N63 PolarHBondContact O-N 3.39Å; T61-N63 PolarHBondContact O-N 3.42Å; N63-L65 PolarHBondContact O-N 3.01Å; N63-R66 PolarHBondContact OD1-NE 3.39Å; N63-R66 PolarHBondContact OD1-NH2 3.07Å; N63-V67 HydrophobicContact CB-CG2 3.92Å; N63-V67 VanDerWaalsContact O-CB 3.29Å; N63-V67 WeakPolarHBondContact O-CB 3.34Å; N63-V67 WeakPolarHBondContact O-CG2 3.44Å; N63-V67 PolarHBondContact O-N 3.08Å; N63-P68 WeakPolarHBondContact O-CD 3.48Å; N63-I104 WeakPolarHBondContact ND2-CG2 3.16Å; N63-I104 PolarHBondContact ND2-O 2.91Å
64	R	95.1	Very high	91.3	Very high	152 Å²	152	31.6 Å²	31.6	57%	0.574	17%	0.17	S	C	*	.	H	α-helix	trans	-61.6	-23	172	-63.9	-178	179.1	-151.5	-0.4	113.3	T61 M62 P68	T61-R64 VanDerWaalsContact O-CB 3.32Å; T61-R64 WeakPolarHBondContact O-CB 3.27Å; T61-R64 WeakPolarHBondContact O-CG 3.14Å; T61-R64 PolarHBondContact O-N 3.36Å; T61-R64 VanDerWaalsContact O-N 3.14Å; M62-R64 PolarHBondContact O-N 2.87Å; R64-P68 WeakPolarHBondContact O-CG 3.3Å
65	L	96.1	Very high	91.7	Very high	13 Å²	13	31.6 Å²	31.6	7%	0.068	17%	0.168	C	C	.	.	H	α-helix	trans	-100.2	-51.1	173.1	-58.5	-169.5	0	0	0	111.5	M62 N63 V67 P68 F69 M258 W267 W269	M62-L65 PolarHBondContact O-N 3.47Å; N63-L65 PolarHBondContact O-N 3.01Å; L65-V67 PolarHBondContact O-N 3.09Å; L65-P68 WeakPolarHBondContact O-CD 3.4Å; L65-F69 VanDerWaalsContact O-CB 3.24Å; L65-F69 WeakPolarHBondContact O-CB 3.45Å; L65-F69 PolarHBondContact O-N 3.23Å; L65-M258 HydrophobicContact CD1-CB 4.27Å; L65-M258 HydrophobicContact CD1-CG 4.06Å; L65-M258 HydrophobicContact CD1-SD 4.14Å; L65-W267 HydrophobicContact CD1-CB 3.57Å; L65-W267 HydrophobicContact CG-CB 3.84Å; L65-W269 HydrophobicContact CB-CH2 4.19Å; L65-W269 HydrophobicContact CB-CZ2 3.75Å; L65-W269 HydrophobicContact CD1-CD2 4.32Å; L65-W269 HydrophobicContact CD1-CE3 4.48Å; L65-W269 HydrophobicContact CD2-CD2 4.35Å; L65-W269 HydrophobicContact CD2-CG 4.3Å
66	R	96.3	Very high	91.8	Very high	9 Å²	9	30.7 Å²	30.7	3%	0.034	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-44.9	-172.8	-65.8	-174.3	-63.8	-169.8	-2.9	113	L59 M62 N63 F69 I70 L105 S173 T202	L59-R66 PolarHBondContact O-NH2 3.16Å; M62-R66 HydrophobicContact CG-CG 3.98Å; M62-R66 PolarHBondContact O-N 3.44Å; M62-R66 HydrophobicContact SD-CG 4.12Å; N63-R66 PolarHBondContact OD1-NE 3.39Å; N63-R66 PolarHBondContact OD1-NH2 3.07Å; R66-F69 WeakPolarHBondContact O-CB 3.41Å; R66-F69 PolarHBondContact O-N 2.77Å; R66-I70 WeakPolarHBondContact O-CD1 3.45Å; R66-I70 WeakPolarHBondContact O-CG1 3.5Å; R66-I70 PolarHBondContact O-N 2.88Å; R66-L105 HydrophobicContact CB-CD1 4.15Å; R66-S173 WeakPolarHBondContact CD-OG 2.93Å; R66-S173 PolarHBondContact NH1-OG 2.89Å; R66-T202 HydrophobicContact CG-CG2 4.13Å
67	V	97.3	Very high	91.4	Very high	20 Å²	20	35.1 Å²	35.1	12%	0.121	19%	0.188	C	C	.	.	H	α-helix	trans	-65.4	-51.7	-175.9	173.1	0	0	0	0	110.7	N63 L65 F69 I70 Q71 L105 A108 L109 L112	N63-V67 HydrophobicContact CB-CG2 3.92Å; N63-V67 VanDerWaalsContact O-CB 3.29Å; N63-V67 WeakPolarHBondContact O-CB 3.34Å; N63-V67 WeakPolarHBondContact O-CG2 3.44Å; N63-V67 PolarHBondContact O-N 3.08Å; L65-V67 PolarHBondContact O-N 3.09Å; V67-F69 VanDerWaalsContact C-N 3.28Å; V67-F69 PolarHBondContact O-N 2.93Å; V67-I70 PolarHBondContact O-N 2.89Å; V67-Q71 VanDerWaalsContact O-CB 3.27Å; V67-Q71 WeakPolarHBondContact O-CB 3.17Å; V67-Q71 PolarHBondContact O-N 2.81Å; V67-L105 HydrophobicContact CG2-CD1 3.8Å; V67-A108 HydrophobicContact CG2-CB 3.76Å; V67-L109 HydrophobicContact CG1-CD2 4.44Å; V67-L109 HydrophobicContact CG2-CD2 4.44Å; V67-L112 HydrophobicContact CG1-CD1 3.43Å; V67-L112 VanDerWaalsContact CG1-CD1 3.43Å; V67-L112 HydrophobicContact CG1-CG 4.43Å
68	P	95.7	Very high	90.1	Very high	50 Å²	50	40.4 Å²	40.4	33%	0.325	22%	0.222	S	C	.	.	H	α-helix	trans	-60.3	-34.3	172.5	-26.4	36	0	0	0	114	N63 R64 L65 N72	N63-P68 WeakPolarHBondContact O-CD 3.48Å; R64-P68 WeakPolarHBondContact O-CG 3.3Å; L65-P68 WeakPolarHBondContact O-CD 3.4Å; P68-N72 WeakPolarHBondContact O-CB 3.28Å; P68-N72 PolarHBondContact O-N 2.85Å; P68-N72 PolarHBondContact O-ND2 3.01Å
69	F	96.5	Very high	89.1	Confident	10 Å²	10	45 Å²	45	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-48.5	177.3	176.5	-121.3	0	0	0	112.2	L65 R66 V67 G73 F200 Q254 W269 A278	L65-F69 VanDerWaalsContact O-CB 3.24Å; L65-F69 WeakPolarHBondContact O-CB 3.45Å; L65-F69 PolarHBondContact O-N 3.23Å; R66-F69 WeakPolarHBondContact O-CB 3.41Å; R66-F69 PolarHBondContact O-N 2.77Å; V67-F69 VanDerWaalsContact C-N 3.28Å; V67-F69 PolarHBondContact O-N 2.93Å; F69-G73 PolarHBondContact O-N 2.78Å; F69-G73 VanDerWaalsContact O-N 3.13Å; F69-F200 AromaticContact CD1-CD1 3.87Å; F69-F200 HydrophobicContact CD1-CD1 3.87Å; F69-F200 HydrophobicContact CE1-CB 4.33Å; F69-F200 AromaticContact CE1-CD1 3.56Å; F69-F200 HydrophobicContact CE1-CD1 3.56Å; F69-F200 HydrophobicContact CE1-CE1 4.4Å; F69-F200 HydrophobicContact CE1-CG 4.42Å; F69-F200 HydrophobicContact CZ-CD1 4.04Å; F69-Q254 HydrophobicContact CE2-CB 4.08Å; F69-Q254 HydrophobicContact CE2-CG 4.01Å; F69-W269 HydrophobicContact CB-CH2 4.04Å; F69-W269 HydrophobicContact CB-CZ2 3.9Å; F69-W269 HydrophobicContact CD2-CH2 4.14Å; F69-W269 HydrophobicContact CD2-CZ2 4.43Å; F69-W269 HydrophobicContact CG-CH2 4.05Å; F69-W269 HydrophobicContact CG-CZ2 4.35Å; F69-A278 HydrophobicContact CD1-CB 4.14Å; F69-A278 HydrophobicContact CE1-CB 3.77Å; F69-A278 HydrophobicContact CE2-CB 4.48Å; F69-A278 HydrophobicContact CZ-CB 3.96Å
70	I	97.6	Very high	88	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	25%	0.245	C	C	.	.	H	α-helix	trans	-66.8	-46.4	177.1	-65.8	158.8	0	0	0	110.2	R66 V67 N72 G73 L74 I95 L105 L109 V171 F200	R66-I70 WeakPolarHBondContact O-CD1 3.45Å; R66-I70 WeakPolarHBondContact O-CG1 3.5Å; R66-I70 PolarHBondContact O-N 2.88Å; V67-I70 PolarHBondContact O-N 2.89Å; I70-N72 PolarHBondContact O-N 2.96Å; I70-G73 PolarHBondContact O-N 2.81Å; I70-L74 HydrophobicContact CG2-CD1 3.95Å; I70-L74 PolarHBondContact O-N 3.28Å; I70-L74 VanDerWaalsContact O-N 3.08Å; I70-I95 HydrophobicContact CG2-CD1 4.37Å; I70-L105 HydrophobicContact CD1-CD1 4.16Å; I70-L105 HydrophobicContact CD1-CD2 4.09Å; I70-L109 HydrophobicContact CB-CD2 4.1Å; I70-L109 HydrophobicContact CD1-CD1 4.07Å; I70-L109 HydrophobicContact CD1-CD2 4.04Å; I70-L109 HydrophobicContact CG2-CD1 4.5Å; I70-L109 HydrophobicContact CG2-CD2 3.85Å; I70-V171 HydrophobicContact CD1-CG1 3.92Å; I70-V171 HydrophobicContact CD1-CG2 3.82Å; I70-V171 HydrophobicContact CG1-CG2 4.24Å; I70-F200 HydrophobicContact CG1-CB 4.16Å; I70-F200 HydrophobicContact CG1-CD1 4.1Å; I70-F200 HydrophobicContact CG1-CD2 4.14Å; I70-F200 HydrophobicContact CG1-CG 3.88Å; I70-F200 HydrophobicContact CG2-CD2 4.27Å; I70-F200 HydrophobicContact CG2-CE2 4.08Å; I70-F200 HydrophobicContact CG2-CZ 4.45Å
71	Q	95.8	Very high	86.6	Confident	18 Å²	18	48 Å²	48	8%	0.084	27%	0.267	C	S	.	.	H	α-helix	trans	-56	-51.3	178.8	-166.1	-148.1	-66.5	0	0	111.8	V67 G73 L74 C75 Y87 P89 L90 L112	V67-Q71 VanDerWaalsContact O-CB 3.27Å; V67-Q71 WeakPolarHBondContact O-CB 3.17Å; V67-Q71 PolarHBondContact O-N 2.81Å; Q71-G73 VanDerWaalsContact C-N 3.29Å; Q71-G73 PolarHBondContact O-N 3.24Å; Q71-L74 PolarHBondContact O-N 2.8Å; Q71-C75 CarbonylContact O-C 3.21Å; Q71-C75 WeakPolarHBondContact O-CA 3.33Å; Q71-C75 PolarHBondContact O-N 2.87Å; Q71-Y87 PolarHBondContact NE2-OH 3.41Å; Q71-Y87 PolarHBondContact OE1-OH 2.9Å; Q71-P89 VanDerWaalsContact CD-CG 3.4Å; Q71-P89 HydrophobicContact CG-CB 3.75Å; Q71-P89 HydrophobicContact CG-CG 3.62Å; Q71-L90 HydrophobicContact CG-CD2 4.29Å; Q71-L90 HydrophobicContact CG-CG 4.27Å; Q71-L112 HydrophobicContact CB-CD1 4.44Å; Q71-L112 HydrophobicContact CG-CD1 4.29Å
72	N	94.1	Very high	85.1	Confident	68 Å²	68	53.6 Å²	53.6	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-67.3	-30.2	-178.9	-70.1	-29	0	0	0	112.7	P68 I70 P76	P68-N72 WeakPolarHBondContact O-CB 3.28Å; P68-N72 PolarHBondContact O-N 2.85Å; P68-N72 PolarHBondContact O-ND2 3.01Å; I70-N72 PolarHBondContact O-N 2.96Å; N72-P76 WeakPolarHBondContact O-CG 3.45Å
73	G	95	Very high	83.6	Confident	29 Å²	29	61.4 Å²	61.4	30%	0.299	34%	0.34	S	S	.	.	H	α-helix	trans	-71.7	-31.4	176.3	0	0	0	0	0	113.5	F69 I70 Q71	F69-G73 PolarHBondContact O-N 2.78Å; F69-G73 VanDerWaalsContact O-N 3.13Å; I70-G73 PolarHBondContact O-N 2.81Å; Q71-G73 VanDerWaalsContact C-N 3.29Å; Q71-G73 PolarHBondContact O-N 3.24Å
74	L	94.9	Very high	82.2	Confident	21 Å²	21	65 Å²	65	11%	0.11	36%	0.36	C	S	.	.	H	α-helix	trans	-94.2	-32	180	-72.1	172.6	0	0	0	114.1	I70 Q71 L90 I95 A169 M198 F200	I70-L74 HydrophobicContact CG2-CD1 3.95Å; I70-L74 PolarHBondContact O-N 3.28Å; I70-L74 VanDerWaalsContact O-N 3.08Å; Q71-L74 PolarHBondContact O-N 2.8Å; L74-L90 HydrophobicContact CB-CD2 3.92Å; L74-L90 HydrophobicContact CD1-CD2 3.87Å; L74-I95 HydrophobicContact CD1-CD1 3.76Å; L74-I95 HydrophobicContact CD1-CG1 4.27Å; L74-A169 HydrophobicContact CD1-CB 3.7Å; L74-A169 HydrophobicContact CD2-CB 3.84Å; L74-A169 HydrophobicContact CG-CB 4.2Å; L74-M198 HydrophobicContact CD2-CB 4.04Å; L74-M198 HydrophobicContact CD2-CG 4.04Å; L74-F200 HydrophobicContact CD1-CE2 4.4Å; L74-F200 HydrophobicContact CD2-CE2 4.42Å; L74-F200 HydrophobicContact CG-CE2 4.05Å; L74-F200 HydrophobicContact CG-CZ 4.21Å
75	C	88.7	Confident	81.2	Confident	18 Å²	18	64 Å²	64	12%	0.122	38%	0.375	C	S	.	.	S	Bend	trans	-143.5	82.3	-178.4	-167.9	0	0	0	0	108.7	Q71 P89	Q71-C75 CarbonylContact O-C 3.21Å; Q71-C75 WeakPolarHBondContact O-CA 3.33Å; Q71-C75 PolarHBondContact O-N 2.87Å; C75-P89 VanDerWaalsContact CB-O 3.29Å; C75-P89 WeakPolarHBondContact CB-O 3.31Å
76	P	75.7	Confident	80.5	Confident	55 Å²	55	66.3 Å²	66.3	36%	0.357	39%	0.39	S	S	.	.			trans	-54.8	143.1	172.8	-24.2	32.8	0	0	0	110.4	N72 T78 L79	N72-P76 WeakPolarHBondContact O-CG 3.45Å; P76-T78 PolarHBondContact O-N 3.1Å; P76-L79 WeakPolarHBondContact O-CB 3.04Å; P76-L79 PolarHBondContact O-N 3.44Å
77	I	70.4	Confident	80	Confident	119 Å²	119	72 Å²	72	61%	0.61	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-48.6	-30.1	-176.3	-68.9	169	0	0	0	113.1	L79 L80	I77-L79 PolarHBondContact O-N 3.18Å; I77-L80 HydrophobicContact CB-CD1 4.31Å; I77-L80 HydrophobicContact CG1-CD1 4.29Å; I77-L80 HydrophobicContact CG2-CD1 4.28Å; I77-L80 WeakPolarHBondContact O-CB 3.48Å; I77-L80 PolarHBondContact O-N 3.22Å
78	T	60.8	Low	79.7	Confident	130 Å²	130	72.2 Å²	72.2	80%	0.798	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-65	-17.6	177.4	54.8	0	0	0	0	114.8	P76	P76-T78 PolarHBondContact O-N 3.1Å
79	L	63.7	Low	79.6	Confident	120 Å²	120	70.2 Å²	70.2	63%	0.628	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-98.2	-4.7	178.7	-60.8	-176.5	0	0	0	113	P76 I77 S81	P76-L79 WeakPolarHBondContact O-CB 3.04Å; P76-L79 PolarHBondContact O-N 3.44Å; I77-L79 PolarHBondContact O-N 3.18Å; L79-S81 PolarHBondContact O-N 3.42Å; L79-S81 VanDerWaalsContact O-N 3.1Å
80	L	64.7	Low	79.5	Confident	48 Å²	48	69.8 Å²	69.8	25%	0.251	40%	0.398	S	S	.	.			trans	-69.3	111.3	179.2	-66	170.2	0	0	0	109.2	I77 T82 Y87 P89	I77-L80 HydrophobicContact CB-CD1 4.31Å; I77-L80 HydrophobicContact CG1-CD1 4.29Å; I77-L80 HydrophobicContact CG2-CD1 4.28Å; I77-L80 WeakPolarHBondContact O-CB 3.48Å; I77-L80 PolarHBondContact O-N 3.22Å; L80-T82 PolarHBondContact O-N 3.01Å; L80-Y87 HydrophobicContact CD1-CE2 3.81Å; L80-Y87 HydrophobicContact CD2-CE2 4.08Å; L80-P89 HydrophobicContact CD2-CB 3.75Å
81	S	58.9	Low	79.3	Confident	77 Å²	77	73.8 Å²	73.8	54%	0.538	42%	0.415	S	S	.	.			trans	-71.3	126.4	171	98.3	0	0	0	0	108.2	L79 M83	L79-S81 PolarHBondContact O-N 3.42Å; L79-S81 VanDerWaalsContact O-N 3.1Å; S81-M83 PolarHBondContact O-N 3.43Å; S81-M83 VanDerWaalsContact O-N 3.09Å
82	T	61.5	Low	79.1	Confident	139 Å²	139	75.8 Å²	75.8	85%	0.853	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	14.8	179.5	57.4	0	0	0	0	113	L80	L80-T82 PolarHBondContact O-N 3.01Å
83	M	61	Low	79.3	Confident	167 Å²	167	75.6 Å²	75.6	82%	0.823	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-23.7	-169.3	-69.9	-78.3	177.4	0	0	113	S81	S81-M83 PolarHBondContact O-N 3.43Å; S81-M83 VanDerWaalsContact O-N 3.09Å
84	D	66.2	Low	79.4	Confident	100 Å²	100	77.4 Å²	77.4	54%	0.535	44%	0.436	S	S	.	.			trans	-84	135	-179.5	-67.6	-30.8	0	0	0	111	V86	D84-V86 PolarHBondContact O-N 3.27Å
85	S	75	Confident	79.6	Confident	129 Å²	129	76.4 Å²	76.4	90%	0.902	43%	0.431	S	S	*	.	S	Bend	trans	-69.6	-18.6	176.4	55.1	0	0	0	0	113
86	V	80.8	Confident	80.1	Confident	62 Å²	62	75.5 Å²	75.5	38%	0.376	43%	0.425	S	S	.	.	S	Bend	trans	-120	128	-179.1	-172.9	0	0	0	0	109.3	D84 L88	D84-V86 PolarHBondContact O-N 3.27Å; V86-L88 HydrophobicContact CG1-CD1 4.45Å; V86-L88 HydrophobicContact CG1-CD2 4.28Å; V86-L88 HydrophobicContact CG1-CG 3.99Å; V86-L88 PolarHBondContact O-N 2.63Å; V86-L88 VanDerWaalsContact O-N 3.08Å
87	Y	86.5	Confident	81.1	Confident	130 Å²	130	73.1 Å²	73.1	51%	0.51	41%	0.409	S	S	.	.			trans	-78.6	92.7	-179.2	-179.7	-104.6	0	0	0	111.1	Q71 L80 P89	Q71-Y87 PolarHBondContact NE2-OH 3.41Å; Q71-Y87 PolarHBondContact OE1-OH 2.9Å; L80-Y87 HydrophobicContact CD1-CE2 3.81Å; L80-Y87 HydrophobicContact CD2-CE2 4.08Å; Y87-P89 HydrophobicContact CD1-CG 4.24Å; Y87-P89 HydrophobicContact CE1-CB 4.32Å; Y87-P89 HydrophobicContact CE1-CG 3.63Å; Y87-P89 HydrophobicContact CE2-CB 4.21Å; Y87-P89 HydrophobicContact CE2-CG 4.38Å; Y87-P89 WeakPolarHBondContact O-CD 3.47Å
88	L	91.4	Very high	82.3	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.12	38%	0.383	C	S	.	.			trans	-118.2	73.8	175.6	-63.2	-178.4	0	0	0	111	V86 L90 K91 L112 H143 D145 L146	V86-L88 HydrophobicContact CG1-CD1 4.45Å; V86-L88 HydrophobicContact CG1-CD2 4.28Å; V86-L88 HydrophobicContact CG1-CG 3.99Å; V86-L88 PolarHBondContact O-N 2.63Å; V86-L88 VanDerWaalsContact O-N 3.08Å; L88-L90 PolarHBondContact O-N 3.49Å; L88-L90 VanDerWaalsContact O-N 3.11Å; L88-K91 HydrophobicContact CB-CB 4.07Å; L88-K91 VanDerWaalsContact O-CB 3.25Å; L88-K91 WeakPolarHBondContact O-CB 3.3Å; L88-K91 PolarHBondContact O-N 3.17Å; L88-L112 CarbonylContact C-O 3.46Å; L88-L112 WeakPolarHBondContact CA-O 3.28Å; L88-H143 WeakPolarHBondContact CD1-CE1 3.46Å; L88-D145 HydrophobicContact CD1-CB 3.72Å; L88-L146 HydrophobicContact CD1-CD2 4.32Å; L88-L146 HydrophobicContact CD2-CD2 3.62Å; L88-L146 HydrophobicContact CD2-CG 4.37Å
89	P	92.2	Very high	83.9	Confident	9 Å²	9	63 Å²	63	6%	0.058	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.5	-170.6	29.6	-38.5	0	0	0	114.1	Q71 C75 L80 Y87 L112	Q71-P89 VanDerWaalsContact CD-CG 3.4Å; Q71-P89 HydrophobicContact CG-CB 3.75Å; Q71-P89 HydrophobicContact CG-CG 3.62Å; C75-P89 VanDerWaalsContact CB-O 3.29Å; C75-P89 WeakPolarHBondContact CB-O 3.31Å; L80-P89 HydrophobicContact CD2-CB 3.75Å; Y87-P89 HydrophobicContact CD1-CG 4.24Å; Y87-P89 HydrophobicContact CE1-CB 4.32Å; Y87-P89 HydrophobicContact CE1-CG 3.63Å; Y87-P89 HydrophobicContact CE2-CB 4.21Å; Y87-P89 HydrophobicContact CE2-CG 4.38Å; Y87-P89 WeakPolarHBondContact O-CD 3.47Å; P89-L112 HydrophobicContact CG-CB 4.16Å; P89-L112 HydrophobicContact CG-CD1 4.32Å; P89-L112 HydrophobicContact CG-CD2 4.21Å; P89-L112 HydrophobicContact CG-CG 4.48Å
90	L	94.8	Very high	85.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	11.2	177.1	-63	-178.1	0	0	0	112.9	Q71 L74 L88 G92 K93 I95 L109 L112 G113 A114	Q71-L90 HydrophobicContact CG-CD2 4.29Å; Q71-L90 HydrophobicContact CG-CG 4.27Å; L74-L90 HydrophobicContact CB-CD2 3.92Å; L74-L90 HydrophobicContact CD1-CD2 3.87Å; L88-L90 PolarHBondContact O-N 3.49Å; L88-L90 VanDerWaalsContact O-N 3.11Å; L90-G92 PolarHBondContact O-N 3.33Å; L90-K93 HydrophobicContact CD2-CG 4.38Å; L90-K93 VanDerWaalsContact O-CB 3.28Å; L90-K93 WeakPolarHBondContact O-CB 3.5Å; L90-K93 WeakPolarHBondContact O-CG 3.49Å; L90-K93 PolarHBondContact O-N 3.11Å; L90-I95 HydrophobicContact CD1-CD1 3.99Å; L90-L109 HydrophobicContact CD1-CD2 3.93Å; L90-L112 WeakPolarHBondContact CA-O 3.35Å; L90-L112 HydrophobicContact CB-CB 4.07Å; L90-L112 WeakPolarHBondContact CB-O 3.44Å; L90-L112 HydrophobicContact CD1-CB 3.98Å; L90-L112 HydrophobicContact CD1-CD1 4.01Å; L90-L112 HydrophobicContact CG-CB 4.04Å; L90-L112 HydrophobicContact CG-CD1 4.42Å; L90-L112 PolarHBondContact N-O 3.04Å; L90-G113 CarbonylContact O-C 3.57Å; L90-A114 HydrophobicContact CB-CB 3.9Å; L90-A114 HydrophobicContact CD1-CB 4.3Å
91	K	93.2	Very high	86.5	Confident	88 Å²	88	55.8 Å²	55.8	38%	0.383	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	128.3	175.5	-180	172.7	172	171.2	0	111.2	L88 K93 G113 D145	L88-K91 HydrophobicContact CB-CB 4.07Å; L88-K91 VanDerWaalsContact O-CB 3.25Å; L88-K91 WeakPolarHBondContact O-CB 3.3Å; L88-K91 PolarHBondContact O-N 3.17Å; K91-K93 VanDerWaalsContact C-N 3.26Å; K91-K93 PolarHBondContact O-N 3.15Å; K91-G113 WeakPolarHBondContact CA-O 3.19Å; K91-D145 HydrophobicContact CD-CB 3.99Å; K91-D145 WeakPolarHBondContact CE-OD1 3.46Å; K91-D145 WeakPolarHBondContact CE-OD2 3.49Å; K91-D145 HydrophobicContact CG-CB 4.36Å; K91-D145 IonicContact NZ-OD1 3.03Å; K91-D145 PolarHBondContact NZ-OD1 3.21Å; K91-D145 IonicContact NZ-OD2 2.81Å; K91-D145 PolarHBondContact NZ-OD2 3.41Å
92	G	92.6	Very high	88.1	Confident	60 Å²	60	52.1 Å²	52.1	62%	0.619	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	7.1	178.7	0	0	0	0	0	115.2	L90	L90-G92 PolarHBondContact O-N 3.33Å
93	K	96.7	Very high	89.7	Confident	64 Å²	64	45.5 Å²	45.5	28%	0.278	26%	0.256	S	S	.	.			trans	-89.5	130.6	172.1	-57.9	-58.9	-177.3	-179.7	0	110.3	L90 K91 I95 A114 E115 D168	L90-K93 HydrophobicContact CD2-CG 4.38Å; L90-K93 VanDerWaalsContact O-CB 3.28Å; L90-K93 WeakPolarHBondContact O-CB 3.5Å; L90-K93 WeakPolarHBondContact O-CG 3.49Å; L90-K93 PolarHBondContact O-N 3.11Å; K91-K93 VanDerWaalsContact C-N 3.26Å; K91-K93 PolarHBondContact O-N 3.15Å; K93-I95 HydrophobicContact CB-CG1 4.45Å; K93-A114 WeakPolarHBondContact O-CA 3.46Å; K93-E115 PolarHBondContact O-N 2.91Å; K93-D168 HydrophobicContact CD-CB 4.2Å
94	K	98.1	Very high	91.3	Very high	66 Å²	66	37.8 Å²	37.8	29%	0.287	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.6	168.9	-64.1	-174.2	-178.8	-96.4	0	109.8	E115 F167 D168 A169	K94-E115 WeakPolarHBondContact CA-O 3.5Å; K94-E115 WeakPolarHBondContact CE-OE2 3.44Å; K94-E115 HydrophobicContact CG-CB 4.31Å; K94-E115 IonicContact NZ-OE1 3.68Å; K94-E115 PolarHBondContact NZ-OE1 3.22Å; K94-E115 IonicContact NZ-OE2 3.37Å; K94-E115 PolarHBondContact NZ-OE2 2.99Å; K94-F167 HydrophobicContact CB-CD1 4.26Å; K94-D168 PolarHBondContact N-OD2 3.29Å; K94-D168 PolarHBondContact O-N 2.95Å; K94-A169 PolarHBondContact O-N 3.34Å
95	I	98.6	Very high	92.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.9	-176.9	-54.4	-177.7	0	0	0	110.2	I70 L74 L90 K93 L109 A114 E115 V116 L117 A169 V171	I70-I95 HydrophobicContact CG2-CD1 4.37Å; L74-I95 HydrophobicContact CD1-CD1 3.76Å; L74-I95 HydrophobicContact CD1-CG1 4.27Å; L90-I95 HydrophobicContact CD1-CD1 3.99Å; K93-I95 HydrophobicContact CB-CG1 4.45Å; I95-L109 HydrophobicContact CD1-CD1 4.36Å; I95-L109 HydrophobicContact CG2-CD1 4.14Å; I95-A114 HydrophobicContact CD1-CB 3.71Å; I95-A114 HydrophobicContact CG1-CB 4.13Å; I95-E115 PolarHBondContact N-O 2.82Å; I95-V116 HydrophobicContact CB-CG2 4.44Å; I95-V116 WeakPolarHBondContact O-CA 3.31Å; I95-L117 PolarHBondContact O-N 2.72Å; I95-A169 WeakPolarHBondContact CA-O 3.37Å; I95-A169 HydrophobicContact CG1-CB 4.19Å; I95-A169 HydrophobicContact CG2-CB 4.23Å; I95-V171 HydrophobicContact CG2-CG2 3.88Å
96	L	98.6	Very high	93.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	120.4	168.6	-178.3	66.5	0	0	0	109.3	V98 L117 I119 I156 I159 F167 A169 V170 V171 C192	L96-V98 HydrophobicContact CD2-CG2 3.79Å; L96-V98 HydrophobicContact CG-CG2 3.8Å; L96-L117 CarbonylContact C-O 3.46Å; L96-L117 WeakPolarHBondContact CA-O 3.43Å; L96-L117 HydrophobicContact CD1-CB 4.26Å; L96-L117 HydrophobicContact CD1-CD2 3.98Å; L96-L117 HydrophobicContact CD1-CG 4.02Å; L96-I119 HydrophobicContact CD1-CD1 4.23Å; L96-I119 HydrophobicContact CD1-CG1 4.29Å; L96-I119 HydrophobicContact CD1-CG2 3.99Å; L96-I156 HydrophobicContact CD2-CD1 3.69Å; L96-I159 HydrophobicContact CD1-CG2 4.29Å; L96-I159 HydrophobicContact CD2-CG2 3.89Å; L96-F167 HydrophobicContact CB-CB 4.49Å; L96-F167 HydrophobicContact CB-CD1 3.68Å; L96-F167 HydrophobicContact CB-CD2 4.05Å; L96-F167 HydrophobicContact CB-CE1 3.81Å; L96-F167 HydrophobicContact CB-CE2 4.17Å; L96-F167 HydrophobicContact CB-CG 3.8Å; L96-F167 HydrophobicContact CB-CZ 4.07Å; L96-F167 HydrophobicContact CD1-CE1 4.31Å; L96-F167 HydrophobicContact CD1-CE2 4.37Å; L96-F167 HydrophobicContact CD1-CZ 3.99Å; L96-F167 HydrophobicContact CD2-CD2 4.29Å; L96-F167 HydrophobicContact CD2-CE2 4.13Å; L96-F167 HydrophobicContact CG-CE2 4.47Å; L96-F167 HydrophobicContact CG-CZ 4.44Å; L96-A169 PolarHBondContact N-O 3Å; L96-V170 HydrophobicContact CB-CG2 4.07Å; L96-V170 HydrophobicContact CD2-CG1 4.27Å; L96-V170 HydrophobicContact CD2-CG2 4.14Å; L96-V170 CarbonylContact O-C 3.59Å; L96-V170 WeakPolarHBondContact O-CA 3.28Å; L96-V171 PolarHBondContact O-N 3.2Å; L96-C192 HydrophobicContact CD2-CB 4.19Å
97	D	98	Very high	94.6	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	101.2	172.4	-168.6	20.7	0	0	0	108.7	C100 A106 V116 L117 G118 I119	D97-C100 HydrophobicContact CB-CB 4.18Å; D97-A106 HydrophobicContact CB-CB 4.3Å; D97-A106 WeakPolarHBondContact OD2-CB 3.15Å; D97-A106 PolarHBondContact OD2-N 3.17Å; D97-V116 HydrophobicContact CB-CG1 4.37Å; D97-L117 PolarHBondContact N-O 3.28Å; D97-G118 WeakPolarHBondContact O-CA 3.25Å; D97-I119 PolarHBondContact O-N 3.06Å
98	V	96	Very high	95.2	Very high	9 Å²	9	19.3 Å²	19.3	6%	0.055	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.1	-178.4	-177.8	0	0	0	0	108.8	L96 I119 I156 V170 V171 A172 V175 L189	L96-V98 HydrophobicContact CD2-CG2 3.79Å; L96-V98 HydrophobicContact CG-CG2 3.8Å; V98-I119 HydrophobicContact CB-CG1 4.37Å; V98-I119 HydrophobicContact CG1-CD1 4.26Å; V98-I119 HydrophobicContact CG1-CG1 4.34Å; V98-I119 HydrophobicContact CG2-CD1 4.07Å; V98-I119 HydrophobicContact CG2-CG1 4.26Å; V98-I156 HydrophobicContact CG2-CD1 3.94Å; V98-V170 HydrophobicContact CG2-CG1 3.85Å; V98-V171 PolarHBondContact N-O 2.81Å; V98-A172 HydrophobicContact CB-CB 4.5Å; V98-V175 VanDerWaalsContact O-CG2 3.24Å; V98-V175 WeakPolarHBondContact O-CG2 3.43Å; V98-L189 HydrophobicContact CB-CD2 4.34Å; V98-L189 HydrophobicContact CG1-CD2 4.36Å; V98-L189 HydrophobicContact CG2-CD2 3.68Å
99	G	93.2	Very high	95.5	Very high	27 Å²	27	18.2 Å²	18.2	28%	0.278	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	45.2	-172.3	0	0	0	0	0	111.4	G101 I119 D120	G99-G101 PolarHBondContact O-N 3.1Å; G99-I119 WeakPolarHBondContact CA-O 3.29Å; G99-I119 PolarHBondContact N-O 3.22Å; G99-D120 WeakPolarHBondContact CA-OD2 3.14Å
100	C	93.8	Very high	95.7	Very high	11 Å²	11	17.8 Å²	17.8	7%	0.074	11%	0.111	C	C	.	.			trans	-67.9	-16.2	-171.2	66.8	0	0	0	0	113.8	D97 G102 G103 G118 I119 D120	D97-C100 HydrophobicContact CB-CB 4.18Å; C100-G102 PolarHBondContact O-N 2.86Å; C100-G103 PolarHBondContact O-N 3.07Å; C100-G118 VanDerWaalsContact SG-C 3.55Å; C100-I119 PolarHBondContact N-O 3.37Å; C100-D120 PolarHBondContact N-OD2 3.28Å
101	G	90.6	Very high	95.8	Very high	6 Å²	6	20.5 Å²	20.5	6%	0.062	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	-132	-172.2	0	0	0	0	0	111.4	G99 G103 D120 G125	G99-G101 PolarHBondContact O-N 3.1Å; G101-G103 PolarHBondContact O-N 2.83Å; G101-D120 WeakPolarHBondContact CA-OD2 3.1Å; G101-D120 PolarHBondContact N-OD2 3.09Å; G101-G125 CarbonylContact O-C 3.57Å
102	G	90.8	Very high	95.9	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	10	175.7	0	0	0	0	0	116.1	W50 C100 G125 A129	W50-G102 WeakPolarHBondContact CZ2-O 3.35Å; W50-G102 PolarHBondContact NE1-O 2.89Å; C100-G102 PolarHBondContact O-N 2.86Å; G102-G125 WeakPolarHBondContact CA-O 3.42Å; G102-A129 VanDerWaalsContact C-CB 3.5Å; G102-A129 WeakPolarHBondContact O-CA 3.5Å
103	G	95	Very high	96	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	89.3	11.8	167.9	0	0	0	0	0	116.8	C100 G101 L105 A106 E107 Y151	C100-G103 PolarHBondContact O-N 3.07Å; G101-G103 PolarHBondContact O-N 2.83Å; G103-L105 VanDerWaalsContact C-N 3.34Å; G103-L105 PolarHBondContact O-N 2.94Å; G103-A106 PolarHBondContact O-N 2.79Å; G103-E107 WeakPolarHBondContact O-CG 3.39Å; G103-E107 PolarHBondContact O-N 2.87Å; G103-Y151 WeakPolarHBondContact CA-OH 3.39Å; G103-Y151 PolarHBondContact O-OH 2.83Å
104	I	94.7	Very high	96	Very high	6 Å²	6	11.8 Å²	11.8	3%	0.031	7%	0.071	C	C	.	.	H	α-helix	trans	-54.3	-45.5	-175.7	-69.5	171.5	0	0	0	112.7	W50 L59 H60 N63	W50-I104 HydrophobicContact CH2-CG1 4.33Å; W50-I104 HydrophobicContact CZ2-CG1 4.31Å; W50-I104 HydrophobicContact CZ3-CG1 4.47Å; L59-I104 HydrophobicContact CB-CD1 4.47Å; L59-I104 HydrophobicContact CD2-CD1 3.9Å; L59-I104 HydrophobicContact CG-CD1 4.2Å; H60-I104 VanDerWaalsContact CE1-CD1 3.45Å; H60-I104 WeakPolarHBondContact CE1-CD1 3.4Å; N63-I104 WeakPolarHBondContact ND2-CG2 3.16Å; N63-I104 PolarHBondContact ND2-O 2.91Å
105	L	96.9	Very high	96	Very high	6 Å²	6	12.9 Å²	12.9	3%	0.031	8%	0.077	C	C	.	.	H	α-helix	trans	-80.7	-45.7	-179.7	-178.6	57	0	0	0	111.2	R66 V67 I70 G103 E107 A108 L109 V171	R66-L105 HydrophobicContact CB-CD1 4.15Å; V67-L105 HydrophobicContact CG2-CD1 3.8Å; I70-L105 HydrophobicContact CD1-CD1 4.16Å; I70-L105 HydrophobicContact CD1-CD2 4.09Å; G103-L105 VanDerWaalsContact C-N 3.34Å; G103-L105 PolarHBondContact O-N 2.94Å; L105-E107 PolarHBondContact O-N 2.83Å; L105-A108 PolarHBondContact O-N 2.74Å; L105-A108 VanDerWaalsContact O-N 3.08Å; L105-L109 HydrophobicContact CD1-CD1 4.16Å; L105-L109 HydrophobicContact CD1-CD2 4.4Å; L105-L109 HydrophobicContact CD1-CG 4.02Å; L105-L109 HydrophobicContact CG-CD1 3.96Å; L105-L109 HydrophobicContact CG-CG 4.28Å; L105-L109 WeakPolarHBondContact O-CG 3.42Å; L105-L109 PolarHBondContact O-N 3.31Å; L105-V171 HydrophobicContact CD2-CG1 3.7Å
106	A	98.1	Very high	96	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-51.9	-49.1	178.2	0	0	0	0	0	113.4	D97 G103 A108 L109 S110 V116 P149 Y151	D97-A106 HydrophobicContact CB-CB 4.3Å; D97-A106 WeakPolarHBondContact OD2-CB 3.15Å; D97-A106 PolarHBondContact OD2-N 3.17Å; G103-A106 PolarHBondContact O-N 2.79Å; A106-A108 VanDerWaalsContact C-N 3.34Å; A106-A108 PolarHBondContact O-N 2.93Å; A106-L109 PolarHBondContact O-N 3.27Å; A106-S110 VanDerWaalsContact O-CB 3.29Å; A106-S110 WeakPolarHBondContact O-CB 3.38Å; A106-S110 PolarHBondContact O-N 2.89Å; A106-V116 HydrophobicContact CB-CG1 3.73Å; A106-P149 HydrophobicContact CB-CB 4.47Å; A106-Y151 HydrophobicContact CB-CE1 3.73Å
107	E	97.9	Very high	96	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-63.6	-39.2	177.3	-69.4	-169.5	-159.6	0	0	112.5	W50 G103 L105 S110 M111 H132 R139 W140 P149 Y151	W50-E107 HydrophobicContact CH2-CB 4.1Å; W50-E107 VanDerWaalsContact CH2-CD 3.44Å; W50-E107 HydrophobicContact CH2-CG 4.08Å; W50-E107 WeakPolarHBondContact CH2-OE2 3.38Å; W50-E107 VanDerWaalsContact CZ2-CD 3.44Å; W50-E107 HydrophobicContact CZ2-CG 4.17Å; W50-E107 VanDerWaalsContact CZ2-OE1 3.25Å; W50-E107 WeakPolarHBondContact CZ2-OE1 3.36Å; G103-E107 WeakPolarHBondContact O-CG 3.39Å; G103-E107 PolarHBondContact O-N 2.87Å; L105-E107 PolarHBondContact O-N 2.83Å; E107-S110 PolarHBondContact O-N 3.43Å; E107-M111 VanDerWaalsContact O-CG 3.32Å; E107-M111 WeakPolarHBondContact O-CG 3.47Å; E107-M111 PolarHBondContact O-N 3Å; E107-H132 VanDerWaalsContact CD-ND1 3.27Å; E107-H132 IonicContact OE1-CE1 2.76Å; E107-H132 IonicContact OE1-CG 2.76Å; E107-H132 IonicContact OE1-ND1 3.67Å; E107-H132 PolarHBondContact OE1-ND1 2.8Å; E107-H132 IonicContact OE2-CE1 3.27Å; E107-H132 PolarHBondContact OE2-CE1 3.21Å; E107-H132 IonicContact OE2-ND1 2.74Å; E107-H132 PolarHBondContact OE2-ND1 3.21Å; E107-H132 VanDerWaalsContact OE2-ND1 3.12Å; E107-R139 IonicContact OE2-CZ 3.66Å; E107-R139 IonicContact OE2-NH1 3.72Å; E107-R139 PolarHBondContact OE2-NH1 3.13Å; E107-R139 IonicContact OE2-NH2 2.71Å; E107-W140 HydrophobicContact CB-CH2 4.37Å; E107-W140 HydrophobicContact CB-CZ2 4.29Å; E107-W140 HydrophobicContact CG-CH2 4.1Å; E107-W140 HydrophobicContact CG-CZ2 4.34Å; E107-P149 HydrophobicContact CG-CG 3.87Å; E107-Y151 VanDerWaalsContact CG-OH 3.3Å; E107-Y151 WeakPolarHBondContact CG-OH 3.45Å
108	A	97.4	Very high	96	Very high	25 Å²	25	13.4 Å²	13.4	21%	0.207	8%	0.08	C	C	.	.	H	α-helix	trans	-66.7	-39.1	179.8	0	0	0	0	0	112.3	V67 L105 A106	V67-A108 HydrophobicContact CG2-CB 3.76Å; L105-A108 PolarHBondContact O-N 2.74Å; L105-A108 VanDerWaalsContact O-N 3.08Å; A106-A108 VanDerWaalsContact C-N 3.34Å; A106-A108 PolarHBondContact O-N 2.93Å
109	L	98.1	Very high	96	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-68.9	-40.1	175.5	-66.2	175.4	0	0	0	111.8	V67 I70 L90 I95 L105 A106 M111 L112 A114 V116 V171	V67-L109 HydrophobicContact CG1-CD2 4.44Å; V67-L109 HydrophobicContact CG2-CD2 4.44Å; I70-L109 HydrophobicContact CB-CD2 4.1Å; I70-L109 HydrophobicContact CD1-CD1 4.07Å; I70-L109 HydrophobicContact CD1-CD2 4.04Å; I70-L109 HydrophobicContact CG2-CD1 4.5Å; I70-L109 HydrophobicContact CG2-CD2 3.85Å; L90-L109 HydrophobicContact CD1-CD2 3.93Å; I95-L109 HydrophobicContact CD1-CD1 4.36Å; I95-L109 HydrophobicContact CG2-CD1 4.14Å; L105-L109 HydrophobicContact CD1-CD1 4.16Å; L105-L109 HydrophobicContact CD1-CD2 4.4Å; L105-L109 HydrophobicContact CD1-CG 4.02Å; L105-L109 HydrophobicContact CG-CD1 3.96Å; L105-L109 HydrophobicContact CG-CG 4.28Å; L105-L109 WeakPolarHBondContact O-CG 3.42Å; L105-L109 PolarHBondContact O-N 3.31Å; A106-L109 PolarHBondContact O-N 3.27Å; L109-M111 VanDerWaalsContact C-N 3.31Å; L109-M111 PolarHBondContact O-N 3.39Å; L109-L112 WeakPolarHBondContact O-CB 3.38Å; L109-L112 PolarHBondContact O-N 2.89Å; L109-A114 WeakPolarHBondContact O-CB 3.45Å; L109-V116 HydrophobicContact CB-CG2 3.98Å; L109-V171 HydrophobicContact CD1-CG2 4.44Å
110	S	97.7	Very high	96	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.3	-37.5	177	158.5	0	0	0	0	112.1	A106 E107 L112 G113 W140 Y147 P149	A106-S110 VanDerWaalsContact O-CB 3.29Å; A106-S110 WeakPolarHBondContact O-CB 3.38Å; A106-S110 PolarHBondContact O-N 2.89Å; E107-S110 PolarHBondContact O-N 3.43Å; S110-L112 PolarHBondContact O-N 3.37Å; S110-L112 VanDerWaalsContact O-N 3.1Å; S110-G113 PolarHBondContact O-N 3.28Å; S110-W140 PolarHBondContact OG-NE1 3.08Å; S110-Y147 PolarHBondContact OG-O 3.28Å; S110-P149 WeakPolarHBondContact OG-CD 3.39Å
111	M	95.6	Very high	95.8	Very high	58 Å²	58	15.6 Å²	15.6	29%	0.286	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.3	172.8	-69.7	-53.7	-53.4	0	0	114.2	E107 L109 R139 W140 L146	E107-M111 VanDerWaalsContact O-CG 3.32Å; E107-M111 WeakPolarHBondContact O-CG 3.47Å; E107-M111 PolarHBondContact O-N 3Å; L109-M111 VanDerWaalsContact C-N 3.31Å; L109-M111 PolarHBondContact O-N 3.39Å; M111-R139 HydrophobicContact CE-CB 4.36Å; M111-R139 VanDerWaalsContact CG-NH2 3.28Å; M111-R139 HydrophobicContact SD-CB 3.93Å; M111-W140 HydrophobicContact CG-CZ2 4.4Å; M111-W140 HydrophobicContact SD-CD2 4.27Å; M111-W140 HydrophobicContact SD-CZ2 3.87Å; M111-L146 HydrophobicContact CE-CD1 4.09Å
112	L	95.2	Very high	95.5	Very high	29 Å²	29	15.9 Å²	15.9	15%	0.152	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	8.8	173.2	-60.9	-177.6	0	0	0	113.1	V67 Q71 L88 P89 L90 L109 S110	V67-L112 HydrophobicContact CG1-CD1 3.43Å; V67-L112 VanDerWaalsContact CG1-CD1 3.43Å; V67-L112 HydrophobicContact CG1-CG 4.43Å; Q71-L112 HydrophobicContact CB-CD1 4.44Å; Q71-L112 HydrophobicContact CG-CD1 4.29Å; L88-L112 CarbonylContact C-O 3.46Å; L88-L112 WeakPolarHBondContact CA-O 3.28Å; P89-L112 HydrophobicContact CG-CB 4.16Å; P89-L112 HydrophobicContact CG-CD1 4.32Å; P89-L112 HydrophobicContact CG-CD2 4.21Å; P89-L112 HydrophobicContact CG-CG 4.48Å; L90-L112 WeakPolarHBondContact CA-O 3.35Å; L90-L112 HydrophobicContact CB-CB 4.07Å; L90-L112 WeakPolarHBondContact CB-O 3.44Å; L90-L112 HydrophobicContact CD1-CB 3.98Å; L90-L112 HydrophobicContact CD1-CD1 4.01Å; L90-L112 HydrophobicContact CG-CB 4.04Å; L90-L112 HydrophobicContact CG-CD1 4.42Å; L90-L112 PolarHBondContact N-O 3.04Å; L109-L112 WeakPolarHBondContact O-CB 3.38Å; L109-L112 PolarHBondContact O-N 2.89Å; S110-L112 PolarHBondContact O-N 3.37Å; S110-L112 VanDerWaalsContact O-N 3.1Å
113	G	95.1	Very high	95.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	6.1	178.5	0	0	0	0	0	115.2	L90 K91 S110	L90-G113 CarbonylContact O-C 3.57Å; K91-G113 WeakPolarHBondContact CA-O 3.19Å; S110-G113 PolarHBondContact O-N 3.28Å
114	A	97.4	Very high	95.1	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.124	C	C	.	.			trans	-73.5	143.1	175.8	0	0	0	0	0	111.7	L90 K93 I95 L109 V116	L90-A114 HydrophobicContact CB-CB 3.9Å; L90-A114 HydrophobicContact CD1-CB 4.3Å; K93-A114 WeakPolarHBondContact O-CA 3.46Å; I95-A114 HydrophobicContact CD1-CB 3.71Å; I95-A114 HydrophobicContact CG1-CB 4.13Å; L109-A114 WeakPolarHBondContact O-CB 3.45Å; A114-V116 HydrophobicContact CB-CG2 3.7Å; A114-V116 PolarHBondContact O-N 3.06Å
115	E	97.7	Very high	94.7	Very high	88 Å²	88	24.4 Å²	24.4	41%	0.411	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	106.3	162.7	-175.6	-172.6	155.7	0	0	107.6	K93 K94 I95 Y147	K93-E115 PolarHBondContact O-N 2.91Å; K94-E115 WeakPolarHBondContact CA-O 3.5Å; K94-E115 WeakPolarHBondContact CE-OE2 3.44Å; K94-E115 HydrophobicContact CG-CB 4.31Å; K94-E115 IonicContact NZ-OE1 3.68Å; K94-E115 PolarHBondContact NZ-OE1 3.22Å; K94-E115 IonicContact NZ-OE2 3.37Å; K94-E115 PolarHBondContact NZ-OE2 2.99Å; I95-E115 PolarHBondContact N-O 2.82Å; E115-Y147 HydrophobicContact CB-CD2 4.45Å
116	V	98.6	Very high	94.6	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.018	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.9	-172	-172.4	0	0	0	0	111.1	I95 D97 A106 L109 A114 P149 T150	I95-V116 HydrophobicContact CB-CG2 4.44Å; I95-V116 WeakPolarHBondContact O-CA 3.31Å; D97-V116 HydrophobicContact CB-CG1 4.37Å; A106-V116 HydrophobicContact CB-CG1 3.73Å; L109-V116 HydrophobicContact CB-CG2 3.98Å; A114-V116 HydrophobicContact CB-CG2 3.7Å; A114-V116 PolarHBondContact O-N 3.06Å; V116-P149 HydrophobicContact CB-CB 4.14Å; V116-P149 WeakPolarHBondContact O-CA 3.36Å; V116-T150 PolarHBondContact O-N 2.88Å; V116-T150 PolarHBondContact O-OG1 2.82Å
117	L	98.5	Very high	94.4	Very high	12 Å²	12	30.1 Å²	30.1	6%	0.063	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.1	164.7	176.1	62.8	0	0	0	108.4	I95 L96 D97 I119 T150 K152 I159 Y163 F167	I95-L117 PolarHBondContact O-N 2.72Å; L96-L117 CarbonylContact C-O 3.46Å; L96-L117 WeakPolarHBondContact CA-O 3.43Å; L96-L117 HydrophobicContact CD1-CB 4.26Å; L96-L117 HydrophobicContact CD1-CD2 3.98Å; L96-L117 HydrophobicContact CD1-CG 4.02Å; D97-L117 PolarHBondContact N-O 3.28Å; L117-I119 HydrophobicContact CD2-CG2 4.38Å; L117-I119 HydrophobicContact CG-CG2 4.12Å; L117-T150 CarbonylContact C-O 3.59Å; L117-T150 WeakPolarHBondContact CA-O 3.22Å; L117-T150 WeakPolarHBondContact CD1-OG1 3.29Å; L117-K152 HydrophobicContact CD1-CD 4.1Å; L117-K152 HydrophobicContact CD1-CG 4.03Å; L117-I159 HydrophobicContact CD2-CD1 4.09Å; L117-Y163 HydrophobicContact CD2-CD2 4.47Å; L117-Y163 HydrophobicContact CD2-CE2 4.28Å; L117-F167 HydrophobicContact CB-CE1 4.22Å; L117-F167 HydrophobicContact CD2-CE1 4.44Å; L117-F167 HydrophobicContact CD2-CZ 3.94Å
118	G	98.3	Very high	94.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	135	169.2	0	0	0	0	0	111	D97 C100 T150 Y151 K152	D97-G118 WeakPolarHBondContact O-CA 3.25Å; C100-G118 VanDerWaalsContact SG-C 3.55Å; G118-T150 PolarHBondContact N-O 3.46Å; G118-Y151 CarbonylContact O-C 3.47Å; G118-Y151 VanDerWaalsContact O-CA 3.3Å; G118-Y151 WeakPolarHBondContact O-CA 3.39Å; G118-K152 PolarHBondContact O-N 3Å
119	I	96.5	Very high	94	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.2	172.9	68.6	174.3	0	0	0	110.8	L96 D97 V98 G99 C100 L117 K152 T154 I156 I159	L96-I119 HydrophobicContact CD1-CD1 4.23Å; L96-I119 HydrophobicContact CD1-CG1 4.29Å; L96-I119 HydrophobicContact CD1-CG2 3.99Å; D97-I119 PolarHBondContact O-N 3.06Å; V98-I119 HydrophobicContact CB-CG1 4.37Å; V98-I119 HydrophobicContact CG1-CD1 4.26Å; V98-I119 HydrophobicContact CG1-CG1 4.34Å; V98-I119 HydrophobicContact CG2-CD1 4.07Å; V98-I119 HydrophobicContact CG2-CG1 4.26Å; G99-I119 WeakPolarHBondContact CA-O 3.29Å; G99-I119 PolarHBondContact N-O 3.22Å; C100-I119 PolarHBondContact N-O 3.37Å; L117-I119 HydrophobicContact CD2-CG2 4.38Å; L117-I119 HydrophobicContact CG-CG2 4.12Å; I119-K152 WeakPolarHBondContact CA-O 3.24Å; I119-K152 HydrophobicContact CG2-CB 4.31Å; I119-T154 HydrophobicContact CB-CG2 4.02Å; I119-T154 HydrophobicContact CG2-CG2 3.76Å; I119-I156 HydrophobicContact CD1-CB 4.3Å; I119-I156 HydrophobicContact CD1-CD1 4.1Å; I119-I159 HydrophobicContact CD1-CB 4.4Å; I119-I159 HydrophobicContact CD1-CG1 3.77Å; I119-I159 HydrophobicContact CG2-CD1 3.97Å; I119-I159 HydrophobicContact CG2-CG1 3.92Å
120	D	91.7	Very high	94	Very high	19 Å²	19	34.2 Å²	34.2	10%	0.102	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	160.7	174.6	-150.2	-66.4	0	0	0	109.1	G99 C100 G101 I122 I126 K152 L153 T154	G99-D120 WeakPolarHBondContact CA-OD2 3.14Å; C100-D120 PolarHBondContact N-OD2 3.28Å; G101-D120 WeakPolarHBondContact CA-OD2 3.1Å; G101-D120 PolarHBondContact N-OD2 3.09Å; D120-I122 PolarHBondContact OD1-N 3.4Å; D120-I126 HydrophobicContact CB-CD1 3.61Å; D120-I126 HydrophobicContact CB-CG1 3.81Å; D120-K152 PolarHBondContact N-O 3.46Å; D120-L153 CarbonylContact O-C 3.58Å; D120-L153 WeakPolarHBondContact O-CA 3.42Å; D120-T154 PolarHBondContact O-N 2.95Å
121	L	89.8	Confident	93.9	Very high	73 Å²	73	39.4 Å²	39.4	38%	0.382	19%	0.188	S	C	.	.	S	Bend	trans	-96	-12.9	175.8	-67.2	175.9	0	0	0	111.8	I34 L153	I34-L121 HydrophobicContact CD1-CB 3.32Å; I34-L121 HydrophobicContact CD1-CD1 3.61Å; I34-L121 HydrophobicContact CD1-CG 4.09Å; I34-L121 HydrophobicContact CG1-CD1 4.06Å; L121-L153 WeakPolarHBondContact O-CD1 3.44Å
122	I	85.4	Confident	93.9	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.056	18%	0.182	C	C	.	.			trans	-95.3	114.1	-178.5	-55.2	-177.8	0	0	0	109.8	I34 F42 D120 E124 G125 I126	I34-I122 HydrophobicContact CD1-CG1 4.2Å; F42-I122 HydrophobicContact CB-CD1 3.84Å; F42-I122 HydrophobicContact CB-CG2 4.2Å; F42-I122 HydrophobicContact CD1-CD1 4.2Å; F42-I122 HydrophobicContact CD2-CD1 3.08Å; F42-I122 HydrophobicContact CE2-CD1 3.58Å; F42-I122 HydrophobicContact CG-CD1 3.44Å; F42-I122 VanDerWaalsContact CG-CD1 3.44Å; F42-I122 HydrophobicContact CZ-CD1 4.3Å; D120-I122 PolarHBondContact OD1-N 3.4Å; I122-E124 VanDerWaalsContact C-N 3.34Å; I122-E124 HydrophobicContact CG2-CB 4.45Å; I122-E124 PolarHBondContact O-N 2.76Å; I122-G125 PolarHBondContact O-N 3.3Å; I122-I126 PolarHBondContact O-N 3.49Å
123	E	91	Very high	94	Very high	127 Å²	127	37 Å²	37	59%	0.593	18%	0.176	S	C	*	.	H	α-helix	trans	-58.6	-43.7	-176.4	-177.7	173	-165.1	0	0	112.2	G125 I126 K127 L153	E123-G125 VanDerWaalsContact C-N 3.33Å; E123-G125 PolarHBondContact O-N 3.5Å; E123-I126 PolarHBondContact O-N 3.06Å; E123-K127 WeakPolarHBondContact O-CB 3.21Å; E123-K127 PolarHBondContact O-N 3.25Å; E123-L153 HydrophobicContact CB-CD1 4.29Å; E123-L153 HydrophobicContact CB-CD2 3.95Å; E123-L153 HydrophobicContact CG-CD2 4.08Å
124	E	86.3	Confident	94	Very high	57 Å²	57	42 Å²	42	27%	0.266	20%	0.199	S	C	.	.	H	α-helix	trans	-61.6	-41.6	179.4	-69.2	79.4	-178.5	0	0	112	K43 I122 K127 I128	K43-E124 WeakPolarHBondContact CE-OE1 3.43Å; K43-E124 HydrophobicContact CG-CG 3.99Å; K43-E124 IonicContact NZ-OE1 3.06Å; I122-E124 VanDerWaalsContact C-N 3.34Å; I122-E124 HydrophobicContact CG2-CB 4.45Å; I122-E124 PolarHBondContact O-N 2.76Å; E124-K127 PolarHBondContact O-N 3.19Å; E124-I128 WeakPolarHBondContact O-CD1 3.32Å; E124-I128 WeakPolarHBondContact O-CG1 3.4Å; E124-I128 PolarHBondContact O-N 2.83Å
125	G	85.8	Confident	93.9	Very high	2 Å²	2	45.8 Å²	45.8	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-59.5	-50.1	176.8	0	0	0	0	0	111.6	G101 G102 I122 E123 K127 I128 A129	G101-G125 CarbonylContact O-C 3.57Å; G102-G125 WeakPolarHBondContact CA-O 3.42Å; I122-G125 PolarHBondContact O-N 3.3Å; E123-G125 VanDerWaalsContact C-N 3.33Å; E123-G125 PolarHBondContact O-N 3.5Å; G125-K127 VanDerWaalsContact C-N 3.35Å; G125-K127 PolarHBondContact O-N 3.25Å; G125-I128 PolarHBondContact O-N 3.15Å; G125-A129 PolarHBondContact O-N 3.48Å
126	I	93.7	Very high	93.8	Very high	6 Å²	6	42.5 Å²	42.5	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-61	-43.5	177.4	-67.7	-63.4	0	0	0	111.8	D120 I122 E123 I128 A129 Q130 K152 L153	D120-I126 HydrophobicContact CB-CD1 3.61Å; D120-I126 HydrophobicContact CB-CG1 3.81Å; I122-I126 PolarHBondContact O-N 3.49Å; E123-I126 PolarHBondContact O-N 3.06Å; I126-I128 VanDerWaalsContact C-N 3.34Å; I126-I128 PolarHBondContact O-N 2.87Å; I126-A129 WeakPolarHBondContact O-CB 3.31Å; I126-A129 PolarHBondContact O-N 3.47Å; I126-Q130 HydrophobicContact CG2-CG 4.33Å; I126-Q130 WeakPolarHBondContact O-CG 3.49Å; I126-Q130 PolarHBondContact O-N 3Å; I126-K152 WeakPolarHBondContact CD1-O 3.4Å; I126-L153 HydrophobicContact CG1-CB 4.25Å; I126-L153 HydrophobicContact CG1-CD1 4.26Å; I126-L153 HydrophobicContact CG2-CB 4.37Å
127	K	94.7	Very high	93.6	Very high	119 Å²	119	44.5 Å²	44.5	52%	0.517	23%	0.23	S	C	.	.	H	α-helix	trans	-59.3	-45.8	178.4	-179	176.5	172.4	-179.5	0	111.4	E123 E124 G125 A129 Q130 E131	E123-K127 WeakPolarHBondContact O-CB 3.21Å; E123-K127 PolarHBondContact O-N 3.25Å; E124-K127 PolarHBondContact O-N 3.19Å; G125-K127 VanDerWaalsContact C-N 3.35Å; G125-K127 PolarHBondContact O-N 3.25Å; K127-A129 VanDerWaalsContact C-N 3.35Å; K127-A129 PolarHBondContact O-N 3.35Å; K127-Q130 PolarHBondContact O-N 3.13Å; K127-E131 WeakPolarHBondContact CE-OE1 3.35Å; K127-E131 HydrophobicContact CG-CG 4.43Å; K127-E131 IonicContact NZ-OE1 2.88Å; K127-E131 WeakPolarHBondContact O-CB 3.42Å; K127-E131 WeakPolarHBondContact O-CG 3.5Å; K127-E131 PolarHBondContact O-N 2.88Å
128	I	92	Very high	93.5	Very high	22 Å²	22	51.5 Å²	51.5	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-62.5	-43.1	176.9	-63.9	151.6	0	0	0	111.2	A46 W49 E124 G125 I126 Q130 E131 H132	A46-I128 HydrophobicContact CB-CD1 3.6Å; A46-I128 WeakPolarHBondContact O-CD1 3.45Å; W49-I128 HydrophobicContact CB-CD1 4.41Å; W49-I128 HydrophobicContact CB-CG2 3.81Å; W49-I128 HydrophobicContact CE3-CD1 3.99Å; W49-I128 HydrophobicContact CG-CG2 4.28Å; E124-I128 WeakPolarHBondContact O-CD1 3.32Å; E124-I128 WeakPolarHBondContact O-CG1 3.4Å; E124-I128 PolarHBondContact O-N 2.83Å; G125-I128 PolarHBondContact O-N 3.15Å; I126-I128 VanDerWaalsContact C-N 3.34Å; I126-I128 PolarHBondContact O-N 2.87Å; I128-Q130 VanDerWaalsContact C-N 3.31Å; I128-Q130 PolarHBondContact O-N 3.45Å; I128-E131 PolarHBondContact O-N 3.22Å; I128-H132 VanDerWaalsContact O-CB 3.29Å; I128-H132 WeakPolarHBondContact O-CB 3.5Å; I128-H132 PolarHBondContact O-N 2.6Å
129	A	95	Very high	93.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-44	178.5	0	0	0	0	0	111.3	G102 G125 I126 K127 V133 Y151	G102-A129 VanDerWaalsContact C-CB 3.5Å; G102-A129 WeakPolarHBondContact O-CA 3.5Å; G125-A129 PolarHBondContact O-N 3.48Å; I126-A129 WeakPolarHBondContact O-CB 3.31Å; I126-A129 PolarHBondContact O-N 3.47Å; K127-A129 VanDerWaalsContact C-N 3.35Å; K127-A129 PolarHBondContact O-N 3.35Å; A129-V133 WeakPolarHBondContact O-CB 3.14Å; A129-V133 WeakPolarHBondContact O-CG1 3.16Å; A129-V133 PolarHBondContact O-N 3.36Å; A129-Y151 HydrophobicContact CB-CD1 3.83Å; A129-Y151 HydrophobicContact CB-CD2 3.65Å; A129-Y151 HydrophobicContact CB-CE1 3.87Å; A129-Y151 HydrophobicContact CB-CE2 3.67Å; A129-Y151 HydrophobicContact CB-CG 3.72Å; A129-Y151 WeakPolarHBondContact O-CE2 3.33Å
130	Q	97.3	Very high	93.2	Very high	90 Å²	90	55.3 Å²	55.3	42%	0.421	27%	0.271	S	S	.	.	H	α-helix	trans	-66.2	-45.3	176.2	-70.3	175.8	-13.2	0	0	112.1	I126 K127 I128 V133 E134 Y151	I126-Q130 HydrophobicContact CG2-CG 4.33Å; I126-Q130 WeakPolarHBondContact O-CG 3.49Å; I126-Q130 PolarHBondContact O-N 3Å; K127-Q130 PolarHBondContact O-N 3.13Å; I128-Q130 VanDerWaalsContact C-N 3.31Å; I128-Q130 PolarHBondContact O-N 3.45Å; Q130-V133 WeakPolarHBondContact O-CG1 3.41Å; Q130-E134 WeakPolarHBondContact O-CB 3.22Å; Q130-E134 WeakPolarHBondContact O-CG 3.44Å; Q130-E134 PolarHBondContact O-N 3.14Å; Q130-E134 VanDerWaalsContact O-N 3.08Å; Q130-Y151 HydrophobicContact CG-CD2 4.18Å; Q130-Y151 HydrophobicContact CG-CG 4.5Å; Q130-Y151 PolarHBondContact NE2-O 3.03Å; Q130-Y151 VanDerWaalsContact NE2-O 3.14Å
131	E	95.9	Very high	93.1	Very high	109 Å²	109	58 Å²	58	51%	0.509	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-43.6	178.2	-74.2	174.8	175.3	0	0	111.7	K127 I128 E134 A135	K127-E131 WeakPolarHBondContact CE-OE1 3.35Å; K127-E131 HydrophobicContact CG-CG 4.43Å; K127-E131 IonicContact NZ-OE1 2.88Å; K127-E131 WeakPolarHBondContact O-CB 3.42Å; K127-E131 WeakPolarHBondContact O-CG 3.5Å; K127-E131 PolarHBondContact O-N 2.88Å; I128-E131 PolarHBondContact O-N 3.22Å; E131-E134 PolarHBondContact O-N 3.11Å; E131-A135 VanDerWaalsContact O-CB 3.28Å; E131-A135 WeakPolarHBondContact O-CB 3.34Å; E131-A135 PolarHBondContact O-N 3.13Å
132	H	96.1	Very high	92.9	Very high	34 Å²	34	62 Å²	62	16%	0.157	32%	0.317	C	S	.	.	H	α-helix	trans	-68.3	-41.9	-179.8	-176.5	-91.4	0	0	0	112.4	W50 E107 I128 E134 A135 T136	W50-H132 AromaticContact CD1-CD2 3.51Å; W50-H132 AromaticContact CD1-CG 3.5Å; W50-H132 VanDerWaalsContact CD1-CG 3.5Å; W50-H132 HydrophobicContact CD2-CB 4.46Å; W50-H132 AromaticContact CD2-CD2 3.42Å; W50-H132 VanDerWaalsContact CD2-CD2 3.42Å; W50-H132 AromaticContact CD2-CE1 3.4Å; W50-H132 VanDerWaalsContact CD2-CE1 3.4Å; W50-H132 AromaticContact CD2-CG 3.59Å; W50-H132 AromaticContact CD2-ND1 3.59Å; W50-H132 AromaticContact CD2-NE2 3.32Å; W50-H132 VanDerWaalsContact CD2-NE2 3.32Å; W50-H132 AromaticContact CE2-CD2 3.73Å; W50-H132 AromaticContact CE2-CE1 3.53Å; W50-H132 AromaticContact CE2-CG 3.35Å; W50-H132 AromaticContact CE2-ND1 3.23Å; W50-H132 AromaticContact CE2-NE2 3.86Å; W50-H132 AromaticContact CE3-CE1 3.37Å; W50-H132 AromaticContact CE3-ND1 3.98Å; W50-H132 AromaticContact CE3-NE2 3.41Å; W50-H132 HydrophobicContact CG-CB 4.29Å; W50-H132 AromaticContact CG-CD2 3.27Å; W50-H132 AromaticContact CG-CG 3.67Å; W50-H132 AromaticContact CG-NE2 3.62Å; W50-H132 AromaticContact CH2-CE1 3.59Å; W50-H132 AromaticContact CH2-ND1 3.73Å; W50-H132 AromaticContact CZ2-CE1 3.64Å; W50-H132 AromaticContact CZ2-CG 3.93Å; W50-H132 AromaticContact CZ2-ND1 3.33Å; W50-H132 VanDerWaalsContact CZ2-ND1 3.33Å; W50-H132 WeakPolarHBondContact CZ2-ND1 3.28Å; W50-H132 AromaticContact CZ3-CE1 3.47Å; W50-H132 VanDerWaalsContact CZ3-CE1 3.47Å; W50-H132 WeakPolarHBondContact CZ3-CE1 3.38Å; W50-H132 AromaticContact CZ3-NE2 3.98Å; W50-H132 AromaticContact NE1-CD2 3.77Å; W50-H132 AromaticContact NE1-CG 3.3Å; W50-H132 VanDerWaalsContact NE1-CG 3.3Å; W50-H132 AromaticContact NE1-ND1 3.68Å; E107-H132 VanDerWaalsContact CD-ND1 3.27Å; E107-H132 IonicContact OE1-CE1 2.76Å; E107-H132 IonicContact OE1-CG 2.76Å; E107-H132 IonicContact OE1-ND1 3.67Å; E107-H132 PolarHBondContact OE1-ND1 2.8Å; E107-H132 IonicContact OE2-CE1 3.27Å; E107-H132 PolarHBondContact OE2-CE1 3.21Å; E107-H132 IonicContact OE2-ND1 2.74Å; E107-H132 PolarHBondContact OE2-ND1 3.21Å; E107-H132 VanDerWaalsContact OE2-ND1 3.12Å; I128-H132 VanDerWaalsContact O-CB 3.29Å; I128-H132 WeakPolarHBondContact O-CB 3.5Å; I128-H132 PolarHBondContact O-N 2.6Å; H132-E134 VanDerWaalsContact C-N 3.31Å; H132-E134 PolarHBondContact O-N 2.7Å; H132-A135 PolarHBondContact O-N 3.16Å; H132-T136 WeakPolarHBondContact O-CB 3.39Å; H132-T136 WeakPolarHBondContact O-CG2 3.44Å; H132-T136 PolarHBondContact O-N 3.15Å; H132-T136 PolarHBondContact O-OG1 3.05Å
133	V	96.4	Very high	93	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.024	32%	0.324	C	S	.	.	H	α-helix	trans	-68.2	-32.3	178.5	79.8	0	0	0	0	112.2	A129 Q130 S137 W140 K148 P149 Y151	A129-V133 WeakPolarHBondContact O-CB 3.14Å; A129-V133 WeakPolarHBondContact O-CG1 3.16Å; A129-V133 PolarHBondContact O-N 3.36Å; Q130-V133 WeakPolarHBondContact O-CG1 3.41Å; V133-S137 WeakPolarHBondContact O-CA 3.3Å; V133-S137 PolarHBondContact O-N 3.18Å; V133-W140 HydrophobicContact CG2-CH2 3.78Å; V133-W140 HydrophobicContact CG2-CZ2 4.48Å; V133-W140 HydrophobicContact CG2-CZ3 3.82Å; V133-K148 HydrophobicContact CB-CG 4.48Å; V133-K148 HydrophobicContact CG1-CD 4.13Å; V133-K148 HydrophobicContact CG1-CG 4.47Å; V133-K148 HydrophobicContact CG2-CD 3.73Å; V133-K148 HydrophobicContact CG2-CG 3.28Å; V133-P149 HydrophobicContact CG2-CG 3.65Å; V133-Y151 HydrophobicContact CB-CE2 4.02Å; V133-Y151 HydrophobicContact CG1-CD2 4.21Å; V133-Y151 HydrophobicContact CG1-CE2 3.93Å; V133-Y151 HydrophobicContact CG2-CE2 4.47Å
134	E	96.3	Very high	92.9	Very high	105 Å²	105	62.7 Å²	62.7	49%	0.491	33%	0.331	S	S	.	.	H	α-helix	trans	-71.2	-46.6	172.7	-71.5	-50.4	138.4	0	0	111.9	Q130 E131 H132 T136 S137 K148	Q130-E134 WeakPolarHBondContact O-CB 3.22Å; Q130-E134 WeakPolarHBondContact O-CG 3.44Å; Q130-E134 PolarHBondContact O-N 3.14Å; Q130-E134 VanDerWaalsContact O-N 3.08Å; E131-E134 PolarHBondContact O-N 3.11Å; H132-E134 VanDerWaalsContact C-N 3.31Å; H132-E134 PolarHBondContact O-N 2.7Å; E134-T136 PolarHBondContact O-N 3.46Å; E134-S137 VanDerWaalsContact O-CB 3.24Å; E134-S137 WeakPolarHBondContact O-CB 3.35Å; E134-S137 PolarHBondContact O-N 3.19Å; E134-S137 PolarHBondContact O-OG 2.84Å; E134-K148 IonicContact OE1-NZ 3.83Å; E134-K148 PolarHBondContact OE1-NZ 2.54Å; E134-K148 IonicContact OE2-NZ 3.91Å; E134-K148 PolarHBondContact OE2-NZ 2.75Å
135	A	95.6	Very high	93.1	Very high	78 Å²	78	61.9 Å²	61.9	65%	0.645	33%	0.328	S	S	*	.	H	α-helix	trans	-61	-29.7	176.9	0	0	0	0	0	112.9	E131 H132	E131-A135 VanDerWaalsContact O-CB 3.28Å; E131-A135 WeakPolarHBondContact O-CB 3.34Å; E131-A135 PolarHBondContact O-N 3.13Å; H132-A135 PolarHBondContact O-N 3.16Å
136	T	94.8	Very high	93.5	Very high	19 Å²	19	63 Å²	63	12%	0.117	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	16.7	179.8	68	0	0	0	0	113.9	H132 E134 Y138 R139 W140	H132-T136 WeakPolarHBondContact O-CB 3.39Å; H132-T136 WeakPolarHBondContact O-CG2 3.44Å; H132-T136 PolarHBondContact O-N 3.15Å; H132-T136 PolarHBondContact O-OG1 3.05Å; E134-T136 PolarHBondContact O-N 3.46Å; T136-Y138 PolarHBondContact O-N 3.27Å; T136-R139 WeakPolarHBondContact O-CB 3.21Å; T136-R139 WeakPolarHBondContact O-CD 3.34Å; T136-R139 VanDerWaalsContact O-CG 3.31Å; T136-R139 WeakPolarHBondContact O-CG 3.44Å; T136-R139 PolarHBondContact O-N 2.84Å; T136-W140 WeakPolarHBondContact O-CZ3 3.44Å
137	S	94.9	Very high	93.5	Very high	46 Å²	46	67.6 Å²	67.6	32%	0.322	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-26.4	-174.7	54.1	0	0	0	0	114.8	V133 E134 R139 W140	V133-S137 WeakPolarHBondContact O-CA 3.3Å; V133-S137 PolarHBondContact O-N 3.18Å; E134-S137 VanDerWaalsContact O-CB 3.24Å; E134-S137 WeakPolarHBondContact O-CB 3.35Å; E134-S137 PolarHBondContact O-N 3.19Å; E134-S137 PolarHBondContact O-OG 2.84Å; S137-R139 PolarHBondContact O-N 2.81Å; S137-R139 VanDerWaalsContact O-N 3.1Å; S137-W140 PolarHBondContact O-N 2.85Å; S137-W140 VanDerWaalsContact O-N 3.16Å
138	Y	95	Very high	93.6	Very high	159 Å²	159	65.3 Å²	65.3	62%	0.624	34%	0.341	S	S	*	.	H	α-helix	trans	-55.9	-24.8	174.5	67.3	-92.8	0	0	0	113.6	T136 W140 A141	T136-Y138 PolarHBondContact O-N 3.27Å; Y138-W140 PolarHBondContact O-N 2.95Å; Y138-A141 PolarHBondContact O-N 2.6Å
139	R	94.4	Very high	93.8	Very high	68 Å²	68	64.4 Å²	64.4	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-63.5	-22.5	179.1	-67.6	165.2	59.2	-167.3	-6.5	113.8	E107 M111 T136 S137	E107-R139 IonicContact OE2-CZ 3.66Å; E107-R139 IonicContact OE2-NH1 3.72Å; E107-R139 PolarHBondContact OE2-NH1 3.13Å; E107-R139 IonicContact OE2-NH2 2.71Å; M111-R139 HydrophobicContact CE-CB 4.36Å; M111-R139 VanDerWaalsContact CG-NH2 3.28Å; M111-R139 HydrophobicContact SD-CB 3.93Å; T136-R139 WeakPolarHBondContact O-CB 3.21Å; T136-R139 WeakPolarHBondContact O-CD 3.34Å; T136-R139 VanDerWaalsContact O-CG 3.31Å; T136-R139 WeakPolarHBondContact O-CG 3.44Å; T136-R139 PolarHBondContact O-N 2.84Å; S137-R139 PolarHBondContact O-N 2.81Å; S137-R139 VanDerWaalsContact O-N 3.1Å
140	W	95.2	Very high	94	Very high	14 Å²	14	68.3 Å²	68.3	5%	0.053	36%	0.36	C	S	.	.	H	α-helix	trans	-108	-10.6	179.8	-63.6	-93.2	0	0	0	113.2	E107 S110 M111 V133 T136 S137 Y138 D142 L146 Y147 K148 P149	E107-W140 HydrophobicContact CB-CH2 4.37Å; E107-W140 HydrophobicContact CB-CZ2 4.29Å; E107-W140 HydrophobicContact CG-CH2 4.1Å; E107-W140 HydrophobicContact CG-CZ2 4.34Å; S110-W140 PolarHBondContact OG-NE1 3.08Å; M111-W140 HydrophobicContact CG-CZ2 4.4Å; M111-W140 HydrophobicContact SD-CD2 4.27Å; M111-W140 HydrophobicContact SD-CZ2 3.87Å; V133-W140 HydrophobicContact CG2-CH2 3.78Å; V133-W140 HydrophobicContact CG2-CZ2 4.48Å; V133-W140 HydrophobicContact CG2-CZ3 3.82Å; T136-W140 WeakPolarHBondContact O-CZ3 3.44Å; S137-W140 PolarHBondContact O-N 2.85Å; S137-W140 VanDerWaalsContact O-N 3.16Å; Y138-W140 PolarHBondContact O-N 2.95Å; W140-D142 PolarHBondContact O-N 3.17Å; W140-L146 HydrophobicContact CB-CB 4.43Å; W140-Y147 VanDerWaalsContact CD1-C 3.42Å; W140-Y147 PolarHBondContact NE1-O 2.64Å; W140-K148 HydrophobicContact CD2-CB 4.44Å; W140-K148 HydrophobicContact CE3-CG 4.36Å; W140-K148 HydrophobicContact CG-CB 4.38Å; W140-P149 HydrophobicContact CZ2-CG 4.25Å
141	A	90	Very high	94	Very high	74 Å²	74	64.7 Å²	64.7	61%	0.612	34%	0.343	S	S	*	.	H	α-helix	trans	-66.8	-32.8	-167.8	0	0	0	0	0	113.9	Y138	Y138-A141 PolarHBondContact O-N 2.6Å
142	D	83.9	Confident	94.1	Very high	157 Å²	157	62.5 Å²	62.5	84%	0.84	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	8.3	-167.4	-62.9	-35.1	0	0	0	114.3	W140	W140-D142 PolarHBondContact O-N 3.17Å
143	H	87.7	Confident	94.1	Very high	41 Å²	41	65 Å²	65	19%	0.19	35%	0.346	C	S	.	.			trans	-135.7	119.4	-179.4	-162.2	-72.5	0	0	0	112.4	L88 D145 L146	L88-H143 WeakPolarHBondContact CD1-CE1 3.46Å; H143-D145 IonicContact CE1-OD2 3.72Å; H143-D145 PolarHBondContact CE1-OD2 2.83Å; H143-D145 PolarHBondContact ND1-N 2.85Å; H143-D145 VanDerWaalsContact ND1-N 3.2Å; H143-D145 PolarHBondContact O-N 3.22Å; H143-D145 VanDerWaalsContact O-N 3.16Å; H143-L146 HydrophobicContact CB-CB 4.05Å; H143-L146 HydrophobicContact CB-CD1 3.72Å; H143-L146 HydrophobicContact CB-CG 3.77Å; H143-L146 PolarHBondContact O-N 2.77Å
144	P	89.4	Confident	94.1	Very high	113 Å²	113	66 Å²	66	73%	0.734	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.6	-173.1	26.4	-35.5	0	0	0	114.3
145	D	90.4	Very high	93.9	Very high	40 Å²	40	62.1 Å²	62.1	21%	0.214	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	9.3	176.9	-54.4	-59.1	0	0	0	113.9	L88 K91 H143	L88-D145 HydrophobicContact CD1-CB 3.72Å; K91-D145 HydrophobicContact CD-CB 3.99Å; K91-D145 WeakPolarHBondContact CE-OD1 3.46Å; K91-D145 WeakPolarHBondContact CE-OD2 3.49Å; K91-D145 HydrophobicContact CG-CB 4.36Å; K91-D145 IonicContact NZ-OD1 3.03Å; K91-D145 PolarHBondContact NZ-OD1 3.21Å; K91-D145 IonicContact NZ-OD2 2.81Å; K91-D145 PolarHBondContact NZ-OD2 3.41Å; H143-D145 IonicContact CE1-OD2 3.72Å; H143-D145 PolarHBondContact CE1-OD2 2.83Å; H143-D145 PolarHBondContact ND1-N 2.85Å; H143-D145 VanDerWaalsContact ND1-N 3.2Å; H143-D145 PolarHBondContact O-N 3.22Å; H143-D145 VanDerWaalsContact O-N 3.16Å
146	L	94	Very high	93.8	Very high	24 Å²	24	58.8 Å²	58.8	13%	0.126	31%	0.308	C	S	.	.			trans	-101.7	127.9	172.8	-76.1	-175.1	0	0	0	109.7	L88 M111 W140 H143	L88-L146 HydrophobicContact CD1-CD2 4.32Å; L88-L146 HydrophobicContact CD2-CD2 3.62Å; L88-L146 HydrophobicContact CD2-CG 4.37Å; M111-L146 HydrophobicContact CE-CD1 4.09Å; W140-L146 HydrophobicContact CB-CB 4.43Å; H143-L146 HydrophobicContact CB-CB 4.05Å; H143-L146 HydrophobicContact CB-CD1 3.72Å; H143-L146 HydrophobicContact CB-CG 3.77Å; H143-L146 PolarHBondContact O-N 2.77Å
147	Y	93.8	Very high	93.7	Very high	103 Å²	103	60.1 Å²	60.1	40%	0.404	31%	0.313	S	S	.	.			trans	-115.9	121.5	-179.2	-54.5	-79.8	0	0	0	109.8	S110 E115 W140	S110-Y147 PolarHBondContact OG-O 3.28Å; E115-Y147 HydrophobicContact CB-CD2 4.45Å; W140-Y147 VanDerWaalsContact CD1-C 3.42Å; W140-Y147 PolarHBondContact NE1-O 2.64Å
148	K	96.5	Very high	93.6	Very high	71 Å²	71	60 Å²	60	31%	0.309	31%	0.312	S	S	.	.			trans	-52.7	131.2	170.7	-169.7	-170.2	-66.7	-179.1	0	109.3	V133 E134 W140	V133-K148 HydrophobicContact CB-CG 4.48Å; V133-K148 HydrophobicContact CG1-CD 4.13Å; V133-K148 HydrophobicContact CG1-CG 4.47Å; V133-K148 HydrophobicContact CG2-CD 3.73Å; V133-K148 HydrophobicContact CG2-CG 3.28Å; E134-K148 IonicContact OE1-NZ 3.83Å; E134-K148 PolarHBondContact OE1-NZ 2.54Å; E134-K148 IonicContact OE2-NZ 3.91Å; E134-K148 PolarHBondContact OE2-NZ 2.75Å; W140-K148 HydrophobicContact CD2-CB 4.44Å; W140-K148 HydrophobicContact CE3-CG 4.36Å; W140-K148 HydrophobicContact CG-CB 4.38Å
149	P	98	Very high	93.6	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.019	28%	0.283	C	S	.	.			trans	-64.4	149.1	176.3	27.9	-33.2	0	0	0	110.5	A106 E107 S110 V116 V133 W140 Y151	A106-P149 HydrophobicContact CB-CB 4.47Å; E107-P149 HydrophobicContact CG-CG 3.87Å; S110-P149 WeakPolarHBondContact OG-CD 3.39Å; V116-P149 HydrophobicContact CB-CB 4.14Å; V116-P149 WeakPolarHBondContact O-CA 3.36Å; V133-P149 HydrophobicContact CG2-CG 3.65Å; W140-P149 HydrophobicContact CZ2-CG 4.25Å; P149-Y151 HydrophobicContact CB-CE2 4.34Å; P149-Y151 HydrophobicContact CG-CE2 4.1Å; P149-Y151 WeakPolarHBondContact CG-OH 3.24Å
150	T	98.2	Very high	93.5	Very high	82 Å²	82	49.9 Å²	49.9	50%	0.503	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	145.5	176.2	57.2	0	0	0	0	109.8	V116 L117 G118	V116-T150 PolarHBondContact O-N 2.88Å; V116-T150 PolarHBondContact O-OG1 2.82Å; L117-T150 CarbonylContact C-O 3.59Å; L117-T150 WeakPolarHBondContact CA-O 3.22Å; L117-T150 WeakPolarHBondContact CD1-OG1 3.29Å; G118-T150 PolarHBondContact N-O 3.46Å
151	Y	98.2	Very high	93.3	Very high	14 Å²	14	57.1 Å²	57.1	6%	0.055	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.3	-176.6	-61.2	-69.5	0	0	0	111.3	G103 A106 E107 G118 A129 Q130 V133 P149	G103-Y151 WeakPolarHBondContact CA-OH 3.39Å; G103-Y151 PolarHBondContact O-OH 2.83Å; A106-Y151 HydrophobicContact CB-CE1 3.73Å; E107-Y151 VanDerWaalsContact CG-OH 3.3Å; E107-Y151 WeakPolarHBondContact CG-OH 3.45Å; G118-Y151 CarbonylContact O-C 3.47Å; G118-Y151 VanDerWaalsContact O-CA 3.3Å; G118-Y151 WeakPolarHBondContact O-CA 3.39Å; A129-Y151 HydrophobicContact CB-CD1 3.83Å; A129-Y151 HydrophobicContact CB-CD2 3.65Å; A129-Y151 HydrophobicContact CB-CE1 3.87Å; A129-Y151 HydrophobicContact CB-CE2 3.67Å; A129-Y151 HydrophobicContact CB-CG 3.72Å; A129-Y151 WeakPolarHBondContact O-CE2 3.33Å; Q130-Y151 HydrophobicContact CG-CD2 4.18Å; Q130-Y151 HydrophobicContact CG-CG 4.5Å; Q130-Y151 PolarHBondContact NE2-O 3.03Å; Q130-Y151 VanDerWaalsContact NE2-O 3.14Å; V133-Y151 HydrophobicContact CB-CE2 4.02Å; V133-Y151 HydrophobicContact CG1-CD2 4.21Å; V133-Y151 HydrophobicContact CG1-CE2 3.93Å; V133-Y151 HydrophobicContact CG2-CE2 4.47Å; P149-Y151 HydrophobicContact CB-CE2 4.34Å; P149-Y151 HydrophobicContact CG-CE2 4.1Å; P149-Y151 WeakPolarHBondContact CG-OH 3.24Å
152	K	97.7	Very high	93.4	Very high	63 Å²	63	58 Å²	58	27%	0.274	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.5	177.5	-71.9	-176.7	168	-172.9	0	111.3	L117 G118 I119 D120 I126 T154 I159 E162 Y163	L117-K152 HydrophobicContact CD1-CD 4.1Å; L117-K152 HydrophobicContact CD1-CG 4.03Å; G118-K152 PolarHBondContact O-N 3Å; I119-K152 WeakPolarHBondContact CA-O 3.24Å; I119-K152 HydrophobicContact CG2-CB 4.31Å; D120-K152 PolarHBondContact N-O 3.46Å; I126-K152 WeakPolarHBondContact CD1-O 3.4Å; K152-T154 HydrophobicContact CB-CG2 3.82Å; K152-T154 PolarHBondContact O-N 3.33Å; K152-T154 VanDerWaalsContact O-N 3.15Å; K152-I159 HydrophobicContact CD-CD1 4.47Å; K152-E162 IonicContact NZ-OE2 2.94Å; K152-E162 PolarHBondContact NZ-OE2 2.93Å; K152-Y163 PolarHBondContact NZ-OH 3.35Å
153	L	96.1	Very high	93.7	Very high	87 Å²	87	53.7 Å²	53.7	46%	0.455	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	96	164.7	-178.8	64.9	0	0	0	108.5	D120 L121 E123 I126	D120-L153 CarbonylContact O-C 3.58Å; D120-L153 WeakPolarHBondContact O-CA 3.42Å; L121-L153 WeakPolarHBondContact O-CD1 3.44Å; E123-L153 HydrophobicContact CB-CD1 4.29Å; E123-L153 HydrophobicContact CB-CD2 3.95Å; E123-L153 HydrophobicContact CG-CD2 4.08Å; I126-L153 HydrophobicContact CG1-CB 4.25Å; I126-L153 HydrophobicContact CG1-CD1 4.26Å; I126-L153 HydrophobicContact CG2-CB 4.37Å
154	T	95.4	Very high	94	Very high	24 Å²	24	55 Å²	55	15%	0.147	29%	0.285	C	S	.	.			trans	-166	164	-175.4	-165.6	0	0	0	0	111.9	I119 D120 K152 S158 I159	I119-T154 HydrophobicContact CB-CG2 4.02Å; I119-T154 HydrophobicContact CG2-CG2 3.76Å; D120-T154 PolarHBondContact O-N 2.95Å; K152-T154 HydrophobicContact CB-CG2 3.82Å; K152-T154 PolarHBondContact O-N 3.33Å; K152-T154 VanDerWaalsContact O-N 3.15Å; T154-S158 WeakPolarHBondContact OG1-CB 3.27Å; T154-I159 HydrophobicContact CG2-CD1 3.69Å; T154-I159 HydrophobicContact CG2-CG1 3.69Å
155	S	92.6	Very high	94.2	Very high	25 Å²	25	53 Å²	53	18%	0.175	27%	0.273	C	S	.	.			trans	-89.3	158.6	177.4	74.4	0	0	0	0	112.1	Q157 S158 I159	S155-Q157 PolarHBondContact O-N 3.29Å; S155-Q157 PolarHBondContact OG-N 3.05Å; S155-Q157 PolarHBondContact OG-OE1 3.16Å; S155-S158 PolarHBondContact O-N 3.08Å; S155-S158 PolarHBondContact OG-N 3.36Å; S155-S158 PolarHBondContact OG-OG 2.95Å; S155-I159 PolarHBondContact O-N 3.24Å; S155-I159 VanDerWaalsContact O-N 3.13Å
156	I	93.7	Very high	94.5	Very high	7 Å²	7	54.5 Å²	54.5	4%	0.036	28%	0.279	C	S	.	.	H	α-helix	trans	-61	-34.4	171.3	-173	59	0	0	0	111.6	M32 L96 V98 I119 S158 I159 T160 M185 N188 L189	M32-I156 HydrophobicContact CE-CG2 4.04Å; M32-I156 HydrophobicContact SD-CG2 4.4Å; L96-I156 HydrophobicContact CD2-CD1 3.69Å; V98-I156 HydrophobicContact CG2-CD1 3.94Å; I119-I156 HydrophobicContact CD1-CB 4.3Å; I119-I156 HydrophobicContact CD1-CD1 4.1Å; I156-S158 PolarHBondContact O-N 3.26Å; I156-I159 HydrophobicContact CD1-CB 4.48Å; I156-I159 HydrophobicContact CD1-CG2 4.5Å; I156-I159 PolarHBondContact O-N 3.02Å; I156-T160 WeakPolarHBondContact O-CG2 3.42Å; I156-T160 PolarHBondContact O-N 3.44Å; I156-M185 HydrophobicContact CG2-CG 4.21Å; I156-N188 HydrophobicContact CG1-CB 3.81Å; I156-N188 HydrophobicContact CG2-CB 4.07Å; I156-L189 HydrophobicContact CD1-CD2 3.78Å; I156-L189 HydrophobicContact CG1-CD2 3.77Å; I156-L189 HydrophobicContact CG1-CG 4.48Å
157	Q	92	Very high	94.7	Very high	48 Å²	48	54 Å²	54	22%	0.224	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-44.4	176.7	-67.6	82.2	-6.7	0	0	111.3	M32 S155 I159 T160	M32-Q157 PolarHBondContact SD-NE2 3.2Å; S155-Q157 PolarHBondContact O-N 3.29Å; S155-Q157 PolarHBondContact OG-N 3.05Å; S155-Q157 PolarHBondContact OG-OE1 3.16Å; Q157-I159 VanDerWaalsContact C-N 3.34Å; Q157-I159 PolarHBondContact O-N 2.95Å; Q157-T160 PolarHBondContact O-N 3.11Å; Q157-T160 PolarHBondContact O-OG1 3.49Å
158	S	93.8	Very high	95	Very high	44 Å²	44	50.4 Å²	50.4	31%	0.308	26%	0.263	S	S	.	.	H	α-helix	trans	-62.3	-42.6	175.2	-58.6	0	0	0	0	111.4	T154 S155 I156 T160 Q161 E162	T154-S158 WeakPolarHBondContact OG1-CB 3.27Å; S155-S158 PolarHBondContact O-N 3.08Å; S155-S158 PolarHBondContact OG-N 3.36Å; S155-S158 PolarHBondContact OG-OG 2.95Å; I156-S158 PolarHBondContact O-N 3.26Å; S158-T160 VanDerWaalsContact C-N 3.32Å; S158-T160 PolarHBondContact O-N 3.34Å; S158-Q161 WeakPolarHBondContact O-CB 3.41Å; S158-Q161 PolarHBondContact O-N 3.13Å; S158-Q161 VanDerWaalsContact O-N 3.1Å; S158-E162 PolarHBondContact O-N 3.04Å
159	I	94.7	Very high	95.1	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-34.9	177.9	-68.6	-64.3	0	0	0	112.8	L96 L117 I119 K152 T154 S155 I156 Q157 Q161 E162 Y163 F167	L96-I159 HydrophobicContact CD1-CG2 4.29Å; L96-I159 HydrophobicContact CD2-CG2 3.89Å; L117-I159 HydrophobicContact CD2-CD1 4.09Å; I119-I159 HydrophobicContact CD1-CB 4.4Å; I119-I159 HydrophobicContact CD1-CG1 3.77Å; I119-I159 HydrophobicContact CG2-CD1 3.97Å; I119-I159 HydrophobicContact CG2-CG1 3.92Å; K152-I159 HydrophobicContact CD-CD1 4.47Å; T154-I159 HydrophobicContact CG2-CD1 3.69Å; T154-I159 HydrophobicContact CG2-CG1 3.69Å; S155-I159 PolarHBondContact O-N 3.24Å; S155-I159 VanDerWaalsContact O-N 3.13Å; I156-I159 HydrophobicContact CD1-CB 4.48Å; I156-I159 HydrophobicContact CD1-CG2 4.5Å; I156-I159 PolarHBondContact O-N 3.02Å; Q157-I159 VanDerWaalsContact C-N 3.34Å; Q157-I159 PolarHBondContact O-N 2.95Å; I159-Q161 PolarHBondContact O-N 2.96Å; I159-E162 PolarHBondContact O-N 2.71Å; I159-Y163 HydrophobicContact CD1-CD2 3.92Å; I159-Y163 HydrophobicContact CD1-CE2 4.05Å; I159-Y163 HydrophobicContact CG2-CD2 4.29Å; I159-Y163 PolarHBondContact O-N 2.94Å; I159-F167 HydrophobicContact CG2-CE2 4.18Å
160	T	91.8	Very high	95.1	Very high	14 Å²	14	46.9 Å²	46.9	9%	0.086	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-30.1	175.6	61.9	0	0	0	0	113.1	I156 Q157 S158 N188 Q191 C192	I156-T160 WeakPolarHBondContact O-CG2 3.42Å; I156-T160 PolarHBondContact O-N 3.44Å; Q157-T160 PolarHBondContact O-N 3.11Å; Q157-T160 PolarHBondContact O-OG1 3.49Å; S158-T160 VanDerWaalsContact C-N 3.32Å; S158-T160 PolarHBondContact O-N 3.34Å; T160-N188 HydrophobicContact CG2-CB 3.74Å; T160-N188 WeakPolarHBondContact CG2-O 3.3Å; T160-Q191 HydrophobicContact CG2-CB 3.87Å; T160-C192 VanDerWaalsContact CG2-SG 3.56Å
161	Q	91.5	Very high	95.1	Very high	165 Å²	165	43.1 Å²	43.1	77%	0.771	23%	0.225	S	C	*	.	H	α-helix	trans	-81.7	-40.1	178.5	-60.3	-179.6	-2.2	0	0	111.8	S158 I159	S158-Q161 WeakPolarHBondContact O-CB 3.41Å; S158-Q161 PolarHBondContact O-N 3.13Å; S158-Q161 VanDerWaalsContact O-N 3.1Å; I159-Q161 PolarHBondContact O-N 2.96Å
162	E	92.1	Very high	94.9	Very high	94 Å²	94	42.5 Å²	42.5	44%	0.439	22%	0.222	S	C	.	.	H	α-helix	trans	-74.7	-38.1	-179.9	-70.6	177.8	-133.8	0	0	112.8	K152 S158 I159	K152-E162 IonicContact NZ-OE2 2.94Å; K152-E162 PolarHBondContact NZ-OE2 2.93Å; S158-E162 PolarHBondContact O-N 3.04Å; I159-E162 PolarHBondContact O-N 2.71Å
163	Y	90.9	Very high	94.7	Very high	65 Å²	65	40 Å²	40	26%	0.255	21%	0.213	S	C	.	.	S	Bend	trans	-133.8	56	-170.5	-56	-83.7	0	0	0	113.7	L117 K152 I159 C165 F167	L117-Y163 HydrophobicContact CD2-CD2 4.47Å; L117-Y163 HydrophobicContact CD2-CE2 4.28Å; K152-Y163 PolarHBondContact NZ-OH 3.35Å; I159-Y163 HydrophobicContact CD1-CD2 3.92Å; I159-Y163 HydrophobicContact CD1-CE2 4.05Å; I159-Y163 HydrophobicContact CG2-CD2 4.29Å; I159-Y163 PolarHBondContact O-N 2.94Å; Y163-C165 PolarHBondContact O-N 3.15Å; Y163-F167 HydrophobicContact CG-CE2 4.44Å; Y163-F167 HydrophobicContact CG-CZ 4.39Å
164	P	93	Very high	94.3	Very high	70 Å²	70	37.7 Å²	37.7	46%	0.455	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	134.1	177.4	28	-34.7	0	0	0	111.3	Q166	P164-Q166 VanDerWaalsContact C-N 3.29Å; P164-Q166 WeakPolarHBondContact O-CG 3.48Å; P164-Q166 PolarHBondContact O-N 3.31Å
165	C	95	Very high	93.9	Very high	71 Å²	71	37.3 Å²	37.3	48%	0.48	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	37	175.9	-61.7	0	0	0	0	115	Y163 Q191 C192 K194	Y163-C165 PolarHBondContact O-N 3.15Å; C165-Q191 PolarHBondContact N-O 3.34Å; C165-C192 CarbonylContact C-O 3.49Å; C165-C192 WeakPolarHBondContact CA-O 3.2Å; C165-K194 VanDerWaalsContact O-CG 3.28Å; C165-K194 WeakPolarHBondContact O-CG 3.46Å
166	Q	96.5	Very high	93.6	Very high	71 Å²	71	36.2 Å²	36.2	33%	0.332	19%	0.189	S	C	.	.			trans	-104	-19	-175.4	-65.2	-155.6	31.9	0	0	115.3	P164 C192 K194	P164-Q166 VanDerWaalsContact C-N 3.29Å; P164-Q166 WeakPolarHBondContact O-CG 3.48Å; P164-Q166 PolarHBondContact O-N 3.31Å; Q166-C192 PolarHBondContact N-O 3.41Å; Q166-K194 WeakPolarHBondContact O-CE 3.5Å
167	F	98.4	Very high	92.7	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.053	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	136.1	-171.2	-60.2	-81.4	0	0	0	112.6	K94 L96 L117 I159 Y163 A169 V170 C192 K194	K94-F167 HydrophobicContact CB-CD1 4.26Å; L96-F167 HydrophobicContact CB-CB 4.49Å; L96-F167 HydrophobicContact CB-CD1 3.68Å; L96-F167 HydrophobicContact CB-CD2 4.05Å; L96-F167 HydrophobicContact CB-CE1 3.81Å; L96-F167 HydrophobicContact CB-CE2 4.17Å; L96-F167 HydrophobicContact CB-CG 3.8Å; L96-F167 HydrophobicContact CB-CZ 4.07Å; L96-F167 HydrophobicContact CD1-CE1 4.31Å; L96-F167 HydrophobicContact CD1-CE2 4.37Å; L96-F167 HydrophobicContact CD1-CZ 3.99Å; L96-F167 HydrophobicContact CD2-CD2 4.29Å; L96-F167 HydrophobicContact CD2-CE2 4.13Å; L96-F167 HydrophobicContact CG-CE2 4.47Å; L96-F167 HydrophobicContact CG-CZ 4.44Å; L117-F167 HydrophobicContact CB-CE1 4.22Å; L117-F167 HydrophobicContact CD2-CE1 4.44Å; L117-F167 HydrophobicContact CD2-CZ 3.94Å; I159-F167 HydrophobicContact CG2-CE2 4.18Å; Y163-F167 HydrophobicContact CG-CE2 4.44Å; Y163-F167 HydrophobicContact CG-CZ 4.39Å; F167-A169 VanDerWaalsContact C-N 3.31Å; F167-A169 WeakPolarHBondContact CB-O 3.38Å; F167-V170 HydrophobicContact CB-CG2 4.26Å; F167-C192 HydrophobicContact CD2-CB 3.91Å; F167-C192 WeakPolarHBondContact CD2-O 3.45Å; F167-C192 HydrophobicContact CE2-CB 4.38Å; F167-C192 PolarHBondContact N-O 3.04Å; F167-C192 VanDerWaalsContact N-O 3.09Å; F167-K194 PolarHBondContact O-N 3.04Å
168	D	98.2	Very high	91.8	Very high	28 Å²	28	36.6 Å²	36.6	15%	0.15	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-28.4	170.3	-58.5	-73	0	0	0	110.9	K93 K94 K194 G197 M198	K93-D168 HydrophobicContact CD-CB 4.2Å; K94-D168 PolarHBondContact N-OD2 3.29Å; K94-D168 PolarHBondContact O-N 2.95Å; D168-K194 WeakPolarHBondContact OD1-CD 3.4Å; D168-K194 IonicContact OD1-NZ 3.91Å; D168-K194 PolarHBondContact OD1-NZ 2.66Å; D168-K194 IonicContact OD2-NZ 3.78Å; D168-K194 PolarHBondContact OD2-NZ 3.37Å; D168-G197 CarbonylContact O-C 3.48Å; D168-G197 VanDerWaalsContact O-CA 3.3Å; D168-G197 WeakPolarHBondContact O-CA 3.47Å; D168-M198 PolarHBondContact O-N 2.82Å
169	A	98.6	Very high	91	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	148.9	171.4	0	0	0	0	0	113.2	L74 K94 I95 L96 F167 M198 F200	L74-A169 HydrophobicContact CD1-CB 3.7Å; L74-A169 HydrophobicContact CD2-CB 3.84Å; L74-A169 HydrophobicContact CG-CB 4.2Å; K94-A169 PolarHBondContact O-N 3.34Å; I95-A169 WeakPolarHBondContact CA-O 3.37Å; I95-A169 HydrophobicContact CG1-CB 4.19Å; I95-A169 HydrophobicContact CG2-CB 4.23Å; L96-A169 PolarHBondContact N-O 3Å; F167-A169 VanDerWaalsContact C-N 3.31Å; F167-A169 WeakPolarHBondContact CB-O 3.38Å; A169-M198 CarbonylContact C-O 3.56Å; A169-M198 WeakPolarHBondContact CA-O 3.49Å; A169-F200 HydrophobicContact CB-CD2 4.18Å; A169-F200 HydrophobicContact CB-CE2 3.94Å
170	V	98.4	Very high	90.1	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.8	166.4	176.5	0	0	0	0	107	L96 V98 F167 L189 C192 L193 M198 L199 F200	L96-V170 HydrophobicContact CB-CG2 4.07Å; L96-V170 HydrophobicContact CD2-CG1 4.27Å; L96-V170 HydrophobicContact CD2-CG2 4.14Å; L96-V170 CarbonylContact O-C 3.59Å; L96-V170 WeakPolarHBondContact O-CA 3.28Å; V98-V170 HydrophobicContact CG2-CG1 3.85Å; F167-V170 HydrophobicContact CB-CG2 4.26Å; V170-L189 HydrophobicContact CG1-CB 4.22Å; V170-L189 HydrophobicContact CG1-CD2 3.49Å; V170-L189 VanDerWaalsContact CG1-CD2 3.49Å; V170-L189 HydrophobicContact CG1-CG 4.32Å; V170-C192 HydrophobicContact CG2-CB 4.14Å; V170-L193 HydrophobicContact CB-CD1 4.48Å; V170-L193 HydrophobicContact CB-CD2 4.03Å; V170-L193 HydrophobicContact CB-CG 4.18Å; V170-L193 HydrophobicContact CG2-CD1 4.37Å; V170-L193 HydrophobicContact CG2-CD2 3.56Å; V170-L193 HydrophobicContact CG2-CG 3.59Å; V170-M198 PolarHBondContact N-O 2.87Å; V170-L199 HydrophobicContact CG1-CD1 4.47Å; V170-L199 CarbonylContact O-C 3.58Å; V170-L199 WeakPolarHBondContact O-CA 3.4Å; V170-F200 PolarHBondContact O-N 3.39Å
171	V	98.2	Very high	89.8	Confident	4 Å²	4	44 Å²	44	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133	178.1	-172.8	0	0	0	0	108	I70 I95 L96 V98 L105 L109 F200	I70-V171 HydrophobicContact CD1-CG1 3.92Å; I70-V171 HydrophobicContact CD1-CG2 3.82Å; I70-V171 HydrophobicContact CG1-CG2 4.24Å; I95-V171 HydrophobicContact CG2-CG2 3.88Å; L96-V171 PolarHBondContact O-N 3.2Å; V98-V171 PolarHBondContact N-O 2.81Å; L105-V171 HydrophobicContact CD2-CG1 3.7Å; L109-V171 HydrophobicContact CD1-CG2 4.44Å; V171-F200 CarbonylContact C-O 3.55Å; V171-F200 WeakPolarHBondContact CA-O 3.49Å; V171-F200 HydrophobicContact CG1-CB 4.31Å; V171-F200 HydrophobicContact CG2-CB 4.27Å; V171-F200 HydrophobicContact CG2-CD2 4.25Å
172	A	95.4	Very high	89.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	89.7	171.1	0	0	0	0	0	108	V98 V175 F176 F200 V201 T202	V98-A172 HydrophobicContact CB-CB 4.5Å; A172-V175 HydrophobicContact CB-CB 4.39Å; A172-F176 HydrophobicContact CB-CD1 3.9Å; A172-F176 HydrophobicContact CB-CE1 3.37Å; A172-F176 HydrophobicContact CB-CZ 4.35Å; A172-F200 PolarHBondContact N-O 3.22Å; A172-V201 WeakPolarHBondContact O-CA 3.44Å; A172-T202 PolarHBondContact O-N 2.94Å
173	S	92.9	Very high	89.6	Confident	11 Å²	11	34.7 Å²	34.7	8%	0.077	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.6	-173.5	-169.7	0	0	0	0	110.9	R66 V175 T202	R66-S173 WeakPolarHBondContact CD-OG 2.93Å; R66-S173 PolarHBondContact NH1-OG 2.89Å; S173-V175 VanDerWaalsContact C-N 3.33Å; S173-T202 WeakPolarHBondContact CA-OG1 3.45Å; S173-T202 WeakPolarHBondContact CB-OG1 3.13Å; S173-T202 PolarHBondContact OG-OG1 2.82Å
174	E	88.6	Confident	89.5	Confident	39 Å²	39	34.6 Å²	34.6	18%	0.182	19%	0.191	C	C	.	.	S	Bend	trans	58.4	43	-177	-43.6	-60.1	96.5	0	0	112.3	E177 H178 T202 T203	E174-E177 WeakPolarHBondContact CA-OE1 3.38Å; E174-H178 PolarHBondContact O-CD2 2.76Å; E174-T202 PolarHBondContact N-O 3.07Å; E174-T202 PolarHBondContact N-OG1 2.95Å; E174-T202 WeakPolarHBondContact OE1-CB 3.41Å; E174-T202 PolarHBondContact OE1-OG1 3.24Å; E174-T203 WeakPolarHBondContact OE1-CA 3.29Å; E174-T203 PolarHBondContact OE1-N 3.17Å
175	V	86.5	Confident	89.5	Confident	16 Å²	16	31.4 Å²	31.4	10%	0.097	17%	0.17	C	C	.	.			trans	-115.4	-39.6	-176.8	178	0	0	0	0	112.6	V98 A172 S173 E177 H178 V179 M185	V98-V175 VanDerWaalsContact O-CG2 3.24Å; V98-V175 WeakPolarHBondContact O-CG2 3.43Å; A172-V175 HydrophobicContact CB-CB 4.39Å; S173-V175 VanDerWaalsContact C-N 3.33Å; V175-E177 PolarHBondContact N-OE2 3.14Å; V175-E177 PolarHBondContact O-N 2.83Å; V175-H178 PolarHBondContact O-N 3.2Å; V175-V179 HydrophobicContact CG1-CG2 4.2Å; V175-M185 HydrophobicContact CG1-CE 4.35Å; V175-M185 HydrophobicContact CG1-SD 4.36Å
176	F	85.5	Confident	89.4	Confident	1 Å²	1	28 Å²	28	0%	0.004	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-65.6	-31.6	-165.8	-78	24.5	0	0	0	111.8	A172 H178 V179 W182 M185 L186 L189 V201 I236 L241	A172-F176 HydrophobicContact CB-CD1 3.9Å; A172-F176 HydrophobicContact CB-CE1 3.37Å; A172-F176 HydrophobicContact CB-CZ 4.35Å; F176-H178 PolarHBondContact O-N 2.99Å; F176-V179 PolarHBondContact O-N 3.16Å; F176-W182 HydrophobicContact CB-CB 4.2Å; F176-W182 HydrophobicContact CD2-CB 4.25Å; F176-W182 HydrophobicContact CD2-CD2 4.4Å; F176-W182 AromaticContact CD2-CE3 3.92Å; F176-W182 HydrophobicContact CD2-CE3 3.92Å; F176-W182 HydrophobicContact CE2-CE3 4.05Å; F176-W182 HydrophobicContact CG-CB 4.31Å; F176-M185 HydrophobicContact CB-CE 4.44Å; F176-M185 HydrophobicContact CD1-CE 3.14Å; F176-M185 HydrophobicContact CE1-CE 3.26Å; F176-M185 HydrophobicContact CE1-SD 4.41Å; F176-M185 HydrophobicContact CG-CE 3.82Å; F176-M185 HydrophobicContact CZ-CE 4.05Å; F176-L186 HydrophobicContact CE2-CD2 3.91Å; F176-L186 HydrophobicContact CE2-CG 4.34Å; F176-L186 HydrophobicContact CZ-CD2 3.82Å; F176-L186 HydrophobicContact CZ-CG 4.47Å; F176-L189 HydrophobicContact CE1-CD1 3.83Å; F176-L189 HydrophobicContact CZ-CD1 3.74Å; F176-V201 HydrophobicContact CD1-CG1 4.37Å; F176-V201 HydrophobicContact CD2-CG1 4.07Å; F176-V201 HydrophobicContact CE1-CG1 4.43Å; F176-V201 HydrophobicContact CE1-CG2 4.17Å; F176-V201 HydrophobicContact CE2-CG1 4.12Å; F176-V201 HydrophobicContact CE2-CG2 3.99Å; F176-V201 HydrophobicContact CG-CG1 4.23Å; F176-V201 HydrophobicContact CZ-CG1 4.31Å; F176-V201 HydrophobicContact CZ-CG2 3.67Å; F176-I236 HydrophobicContact CB-CD1 3.38Å; F176-I236 HydrophobicContact CD2-CD1 3.87Å; F176-I236 HydrophobicContact CG-CD1 4.15Å; F176-L241 HydrophobicContact CD2-CD1 4.19Å; F176-L241 HydrophobicContact CE2-CD1 3.7Å
177	E	75.4	Confident	89.3	Confident	10 Å²	10	27.3 Å²	27.3	5%	0.047	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-66.8	-11.1	174.1	59.5	-96.5	-118.9	0	0	114	E174 V175 T203 K234	E174-E177 WeakPolarHBondContact CA-OE1 3.38Å; V175-E177 PolarHBondContact N-OE2 3.14Å; V175-E177 PolarHBondContact O-N 2.83Å; E177-T203 PolarHBondContact OE1-OG1 3.34Å; E177-T203 WeakPolarHBondContact OE2-CB 3.4Å; E177-T203 PolarHBondContact OE2-OG1 2.87Å; E177-K234 WeakPolarHBondContact O-CB 3.46Å; E177-K234 WeakPolarHBondContact O-CD 3.25Å
178	H	73	Confident	89.1	Confident	54 Å²	54	27.5 Å²	27.5	25%	0.25	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-101.4	-5	175.9	-61	-62.9	0	0	0	112.3	E38 E174 V175 F176	E38-H178 IonicContact OE1-CE1 2.65Å; E38-H178 IonicContact OE1-CG 3.78Å; E38-H178 IonicContact OE1-ND1 3.59Å; E38-H178 PolarHBondContact OE1-ND1 3.45Å; E38-H178 IonicContact OE2-ND1 3.21Å; E174-H178 PolarHBondContact O-CD2 2.76Å; V175-H178 PolarHBondContact O-N 3.2Å; F176-H178 PolarHBondContact O-N 2.99Å
179	V	76.3	Confident	89	Confident	26 Å²	26	26.2 Å²	26.2	16%	0.158	14%	0.141	C	C	.	.			trans	-107.5	127.4	-174	-178.7	0	0	0	0	110.8	M32 V175 F176 D181 W182 M185	M32-V179 HydrophobicContact CE-CG1 3.85Å; V175-V179 HydrophobicContact CG1-CG2 4.2Å; F176-V179 PolarHBondContact O-N 3.16Å; V179-D181 PolarHBondContact O-N 3.39Å; V179-W182 HydrophobicContact CB-CB 4.43Å; V179-M185 HydrophobicContact CB-CE 4.15Å; V179-M185 HydrophobicContact CG1-CE 4.31Å; V179-M185 HydrophobicContact CG2-CE 3.86Å; V179-M185 HydrophobicContact CG2-SD 4.03Å
180	T	77	Confident	88.9	Confident	110 Å²	110	27.1 Å²	27.1	68%	0.675	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-38.3	-179.3	50.1	0	0	0	0	113.5
181	D	84.3	Confident	88.7	Confident	78 Å²	78	31.4 Å²	31.4	42%	0.417	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.9	65.1	177.1	-164.5	-8.2	0	0	0	111.1	V179 E183 D184 M185	V179-D181 PolarHBondContact O-N 3.39Å; D181-E183 PolarHBondContact O-N 3.38Å; D181-E183 VanDerWaalsContact O-N 3.17Å; D181-D184 HydrophobicContact CB-CB 4.27Å; D181-D184 PolarHBondContact O-N 2.96Å; D181-D184 VanDerWaalsContact O-N 3.15Å; D181-D184 PolarHBondContact OD1-N 2.58Å; D181-D184 WeakPolarHBondContact OD2-CB 3.24Å; D181-M185 PolarHBondContact O-N 3.02Å; D181-M185 VanDerWaalsContact O-N 3.11Å
182	W	89	Confident	88.6	Confident	13 Å²	13	31.2 Å²	31.2	5%	0.049	16%	0.163	C	C	.	.	H	α-helix	trans	-60.2	-23.5	177.6	68.6	-98.4	0	0	0	112.5	F176 V179 M185 L186 I236 R240 L241 A244	F176-W182 HydrophobicContact CB-CB 4.2Å; F176-W182 HydrophobicContact CD2-CB 4.25Å; F176-W182 HydrophobicContact CD2-CD2 4.4Å; F176-W182 AromaticContact CD2-CE3 3.92Å; F176-W182 HydrophobicContact CD2-CE3 3.92Å; F176-W182 HydrophobicContact CE2-CE3 4.05Å; F176-W182 HydrophobicContact CG-CB 4.31Å; V179-W182 HydrophobicContact CB-CB 4.43Å; W182-M185 HydrophobicContact CB-CE 4.23Å; W182-M185 WeakPolarHBondContact O-CB 3.42Å; W182-M185 PolarHBondContact O-N 2.76Å; W182-L186 HydrophobicContact CE3-CD1 4.11Å; W182-L186 HydrophobicContact CE3-CG 4.42Å; W182-L186 HydrophobicContact CZ3-CD1 3.73Å; W182-L186 PolarHBondContact O-N 3.4Å; W182-I236 HydrophobicContact CB-CD1 4.23Å; W182-I236 HydrophobicContact CD2-CD1 3.59Å; W182-I236 HydrophobicContact CD2-CG1 4.4Å; W182-I236 HydrophobicContact CE3-CD1 4.22Å; W182-I236 HydrophobicContact CG-CD1 3.57Å; W182-I236 HydrophobicContact CG-CG1 4.46Å; W182-I236 HydrophobicContact CH2-CG2 4.03Å; W182-I236 HydrophobicContact CZ2-CD1 4.37Å; W182-I236 HydrophobicContact CZ2-CG1 4.42Å; W182-I236 HydrophobicContact CZ2-CG2 3.73Å; W182-R240 HydrophobicContact CH2-CG 4.03Å; W182-R240 HydrophobicContact CZ2-CG 3.82Å; W182-L241 HydrophobicContact CE3-CD1 4.32Å; W182-L241 HydrophobicContact CH2-CD1 4.4Å; W182-L241 HydrophobicContact CZ3-CD1 3.69Å; W182-A244 HydrophobicContact CH2-CB 3.74Å; W182-A244 HydrophobicContact CZ3-CB 3.77Å
183	E	90.9	Very high	88.8	Confident	50 Å²	50	31.2 Å²	31.2	23%	0.234	16%	0.163	C	C	.	.	H	α-helix	trans	-70.9	-38.8	176.3	-77.7	-166	-144.6	0	0	112	D181 L186 R240 A244 R248	D181-E183 PolarHBondContact O-N 3.38Å; D181-E183 VanDerWaalsContact O-N 3.17Å; E183-L186 WeakPolarHBondContact O-CB 3.35Å; E183-L186 PolarHBondContact O-N 3.2Å; E183-R240 IonicContact OE1-CZ 3.99Å; E183-R240 IonicContact OE1-NE 2.87Å; E183-R240 PolarHBondContact OE1-NE 2.79Å; E183-R240 IonicContact OE1-NH2 3.88Å; E183-R240 PolarHBondContact OE1-NH2 3.44Å; E183-A244 HydrophobicContact CG-CB 4.25Å; E183-R248 PolarHBondContact O-NE 3.46Å; E183-R248 PolarHBondContact O-NH2 2.76Å; E183-R248 VanDerWaalsContact O-NH2 3.09Å; E183-R248 IonicContact OE2-NH1 3.77Å; E183-R248 IonicContact OE2-NH2 2.71Å
184	D	89.2	Confident	89	Confident	63 Å²	63	33.9 Å²	33.9	34%	0.337	17%	0.174	S	C	.	.	H	α-helix	trans	-68.5	-37.7	169.6	-174.7	60.5	0	0	0	111.9	D181 L186 N187 N188	D181-D184 HydrophobicContact CB-CB 4.27Å; D181-D184 PolarHBondContact O-N 2.96Å; D181-D184 VanDerWaalsContact O-N 3.15Å; D181-D184 PolarHBondContact OD1-N 2.58Å; D181-D184 WeakPolarHBondContact OD2-CB 3.24Å; D184-L186 PolarHBondContact O-N 3.15Å; D184-L186 VanDerWaalsContact O-N 3.16Å; D184-N187 WeakPolarHBondContact O-CB 3.36Å; D184-N187 PolarHBondContact O-N 3.44Å; D184-N187 PolarHBondContact OD1-ND2 2.79Å; D184-N188 PolarHBondContact O-N 3.08Å; D184-N188 PolarHBondContact O-ND2 3.01Å; D184-N188 PolarHBondContact OD2-ND2 2.85Å
185	M	91.4	Very high	89.3	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-53.4	-38.8	174.5	-177.7	170.3	54.3	0	0	111.9	M32 I156 V175 F176 V179 D181 W182 N187 N188 L189	M32-M185 HydrophobicContact CE-CB 3.84Å; M32-M185 HydrophobicContact CE-CG 4.09Å; M32-M185 HydrophobicContact CE-SD 4.27Å; I156-M185 HydrophobicContact CG2-CG 4.21Å; V175-M185 HydrophobicContact CG1-CE 4.35Å; V175-M185 HydrophobicContact CG1-SD 4.36Å; F176-M185 HydrophobicContact CB-CE 4.44Å; F176-M185 HydrophobicContact CD1-CE 3.14Å; F176-M185 HydrophobicContact CE1-CE 3.26Å; F176-M185 HydrophobicContact CE1-SD 4.41Å; F176-M185 HydrophobicContact CG-CE 3.82Å; F176-M185 HydrophobicContact CZ-CE 4.05Å; V179-M185 HydrophobicContact CB-CE 4.15Å; V179-M185 HydrophobicContact CG1-CE 4.31Å; V179-M185 HydrophobicContact CG2-CE 3.86Å; V179-M185 HydrophobicContact CG2-SD 4.03Å; D181-M185 PolarHBondContact O-N 3.02Å; D181-M185 VanDerWaalsContact O-N 3.11Å; W182-M185 HydrophobicContact CB-CE 4.23Å; W182-M185 WeakPolarHBondContact O-CB 3.42Å; W182-M185 PolarHBondContact O-N 2.76Å; M185-N187 PolarHBondContact O-N 2.98Å; M185-N188 PolarHBondContact O-N 2.71Å; M185-L189 HydrophobicContact CG-CD1 4.03Å; M185-L189 HydrophobicContact CG-CD2 4.42Å; M185-L189 HydrophobicContact CG-CG 4.04Å; M185-L189 VanDerWaalsContact O-CG 3.31Å; M185-L189 WeakPolarHBondContact O-CG 3.24Å; M185-L189 PolarHBondContact O-N 3.18Å
186	L	94.4	Very high	89.8	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.2	-35.3	175.2	-75	175.5	0	0	0	113.8	F176 W182 E183 D184 L189 K190 L199 L241 A244	F176-L186 HydrophobicContact CE2-CD2 3.91Å; F176-L186 HydrophobicContact CE2-CG 4.34Å; F176-L186 HydrophobicContact CZ-CD2 3.82Å; F176-L186 HydrophobicContact CZ-CG 4.47Å; W182-L186 HydrophobicContact CE3-CD1 4.11Å; W182-L186 HydrophobicContact CE3-CG 4.42Å; W182-L186 HydrophobicContact CZ3-CD1 3.73Å; W182-L186 PolarHBondContact O-N 3.4Å; E183-L186 WeakPolarHBondContact O-CB 3.35Å; E183-L186 PolarHBondContact O-N 3.2Å; D184-L186 PolarHBondContact O-N 3.15Å; D184-L186 VanDerWaalsContact O-N 3.16Å; L186-L189 HydrophobicContact CD2-CD1 4.4Å; L186-K190 WeakPolarHBondContact O-CB 3.35Å; L186-K190 PolarHBondContact O-N 3.21Å; L186-L199 HydrophobicContact CD2-CD2 3.65Å; L186-L241 HydrophobicContact CD1-CD1 4.4Å; L186-A244 HydrophobicContact CD1-CB 3.77Å
187	N	93.6	Very high	90.4	Very high	56 Å²	56	41 Å²	41	30%	0.299	21%	0.212	S	C	.	.	H	α-helix	trans	-67	-40.4	176.5	-66.4	-35.6	0	0	0	111.1	D184 M185 K190 Q191 R248	D184-N187 WeakPolarHBondContact O-CB 3.36Å; D184-N187 PolarHBondContact O-N 3.44Å; D184-N187 PolarHBondContact OD1-ND2 2.79Å; M185-N187 PolarHBondContact O-N 2.98Å; N187-K190 PolarHBondContact O-N 3.36Å; N187-Q191 WeakPolarHBondContact O-CG 3.37Å; N187-Q191 PolarHBondContact O-N 3.36Å; N187-Q191 VanDerWaalsContact O-N 3.13Å; N187-Q191 PolarHBondContact O-NE2 2.97Å; N187-R248 WeakPolarHBondContact OD1-CD 3.4Å; N187-R248 WeakPolarHBondContact OD1-CG 3.48Å; N187-R248 PolarHBondContact OD1-NE 3.03Å; N187-R248 VanDerWaalsContact OD1-NE 3.13Å
188	N	94.3	Very high	91.5	Very high	16 Å²	16	41.3 Å²	41.3	9%	0.086	21%	0.214	C	C	.	.	H	α-helix	trans	-68	-44	177.6	-62.2	-54.6	0	0	0	110.7	I156 T160 D184 M185 K190 Q191 C192	I156-N188 HydrophobicContact CG1-CB 3.81Å; I156-N188 HydrophobicContact CG2-CB 4.07Å; T160-N188 HydrophobicContact CG2-CB 3.74Å; T160-N188 WeakPolarHBondContact CG2-O 3.3Å; D184-N188 PolarHBondContact O-N 3.08Å; D184-N188 PolarHBondContact O-ND2 3.01Å; D184-N188 PolarHBondContact OD2-ND2 2.85Å; M185-N188 PolarHBondContact O-N 2.71Å; N188-K190 VanDerWaalsContact C-N 3.3Å; N188-K190 PolarHBondContact O-N 2.57Å; N188-Q191 PolarHBondContact O-N 3.46Å; N188-Q191 VanDerWaalsContact O-N 3.14Å; N188-C192 PolarHBondContact O-N 2.9Å; N188-C192 PolarHBondContact O-SG 3Å; N188-C192 VanDerWaalsContact O-SG 3.41Å
189	L	95.9	Very high	92.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-41.2	174.9	-58.6	172.6	0	0	0	111.7	V98 I156 V170 F176 M185 L186 Q191 C192 L193 L199	V98-L189 HydrophobicContact CB-CD2 4.34Å; V98-L189 HydrophobicContact CG1-CD2 4.36Å; V98-L189 HydrophobicContact CG2-CD2 3.68Å; I156-L189 HydrophobicContact CD1-CD2 3.78Å; I156-L189 HydrophobicContact CG1-CD2 3.77Å; I156-L189 HydrophobicContact CG1-CG 4.48Å; V170-L189 HydrophobicContact CG1-CB 4.22Å; V170-L189 HydrophobicContact CG1-CD2 3.49Å; V170-L189 VanDerWaalsContact CG1-CD2 3.49Å; V170-L189 HydrophobicContact CG1-CG 4.32Å; F176-L189 HydrophobicContact CE1-CD1 3.83Å; F176-L189 HydrophobicContact CZ-CD1 3.74Å; M185-L189 HydrophobicContact CG-CD1 4.03Å; M185-L189 HydrophobicContact CG-CD2 4.42Å; M185-L189 HydrophobicContact CG-CG 4.04Å; M185-L189 VanDerWaalsContact O-CG 3.31Å; M185-L189 WeakPolarHBondContact O-CG 3.24Å; M185-L189 PolarHBondContact O-N 3.18Å; L186-L189 HydrophobicContact CD2-CD1 4.4Å; L189-Q191 PolarHBondContact O-N 3.31Å; L189-C192 PolarHBondContact O-N 3.1Å; L189-L193 PolarHBondContact O-N 3.39Å; L189-L199 HydrophobicContact CB-CD1 4.47Å; L189-L199 HydrophobicContact CD1-CD1 3.95Å
190	K	95.9	Very high	93.7	Very high	19 Å²	19	37.6 Å²	37.6	8%	0.083	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-41.6	175.7	-168.5	-166.4	-179.6	-168.6	0	112.5	L186 N187 N188 C192 L193 R248 F250 K283 D285 E286	L186-K190 WeakPolarHBondContact O-CB 3.35Å; L186-K190 PolarHBondContact O-N 3.21Å; N187-K190 PolarHBondContact O-N 3.36Å; N188-K190 VanDerWaalsContact C-N 3.3Å; N188-K190 PolarHBondContact O-N 2.57Å; K190-C192 VanDerWaalsContact C-N 3.28Å; K190-C192 PolarHBondContact O-N 3.04Å; K190-L193 PolarHBondContact O-N 2.72Å; K190-R248 WeakPolarHBondContact CD-O 3.33Å; K190-R248 WeakPolarHBondContact CE-O 3.44Å; K190-R248 PolarHBondContact NZ-O 3.08Å; K190-F250 HydrophobicContact CB-CE2 3.68Å; K190-F250 HydrophobicContact CB-CZ 3.52Å; K190-F250 HydrophobicContact CD-CE2 4.38Å; K190-F250 HydrophobicContact CG-CE1 4.48Å; K190-F250 HydrophobicContact CG-CE2 3.92Å; K190-F250 HydrophobicContact CG-CZ 3.79Å; K190-K283 HydrophobicContact CG-CD 3.79Å; K190-K283 HydrophobicContact CG-CG 4.12Å; K190-K283 WeakPolarHBondContact O-CD 2.85Å; K190-K283 PolarHBondContact O-NZ 3.13Å; K190-D285 WeakPolarHBondContact CE-O 3.44Å; K190-D285 PolarHBondContact NZ-O 3.06Å; K190-E286 VanDerWaalsContact CE-OXT 3.28Å; K190-E286 WeakPolarHBondContact CE-OXT 3.11Å; K190-E286 PolarHBondContact NZ-O 3Å; K190-E286 PolarHBondContact NZ-OXT 3.14Å
191	Q	95.6	Very high	94.6	Very high	90 Å²	90	32.4 Å²	32.4	42%	0.421	16%	0.163	S	C	.	.	H	α-helix	trans	-65.9	-31	-178.7	-76.9	175	74.4	0	0	112.5	T160 C165 N187 N188 L189	T160-Q191 HydrophobicContact CG2-CB 3.87Å; C165-Q191 PolarHBondContact N-O 3.34Å; N187-Q191 WeakPolarHBondContact O-CG 3.37Å; N187-Q191 PolarHBondContact O-N 3.36Å; N187-Q191 VanDerWaalsContact O-N 3.13Å; N187-Q191 PolarHBondContact O-NE2 2.97Å; N188-Q191 PolarHBondContact O-N 3.46Å; N188-Q191 VanDerWaalsContact O-N 3.14Å; L189-Q191 PolarHBondContact O-N 3.31Å
192	C	96.5	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-72.9	-28.4	175.4	-62	0	0	0	0	113	L96 T160 C165 Q166 F167 V170 N188 L189 K190	L96-C192 HydrophobicContact CD2-CB 4.19Å; T160-C192 VanDerWaalsContact CG2-SG 3.56Å; C165-C192 CarbonylContact C-O 3.49Å; C165-C192 WeakPolarHBondContact CA-O 3.2Å; Q166-C192 PolarHBondContact N-O 3.41Å; F167-C192 HydrophobicContact CD2-CB 3.91Å; F167-C192 WeakPolarHBondContact CD2-O 3.45Å; F167-C192 HydrophobicContact CE2-CB 4.38Å; F167-C192 PolarHBondContact N-O 3.04Å; F167-C192 VanDerWaalsContact N-O 3.09Å; V170-C192 HydrophobicContact CG2-CB 4.14Å; N188-C192 PolarHBondContact O-N 2.9Å; N188-C192 PolarHBondContact O-SG 3Å; N188-C192 VanDerWaalsContact O-SG 3.41Å; L189-C192 PolarHBondContact O-N 3.1Å; K190-C192 VanDerWaalsContact C-N 3.28Å; K190-C192 PolarHBondContact O-N 3.04Å
193	L	97.8	Very high	94.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	138.4	-176.8	-75.7	168.4	0	0	0	112.8	V170 L189 K190 L199 F250 K283	V170-L193 HydrophobicContact CB-CD1 4.48Å; V170-L193 HydrophobicContact CB-CD2 4.03Å; V170-L193 HydrophobicContact CB-CG 4.18Å; V170-L193 HydrophobicContact CG2-CD1 4.37Å; V170-L193 HydrophobicContact CG2-CD2 3.56Å; V170-L193 HydrophobicContact CG2-CG 3.59Å; L189-L193 PolarHBondContact O-N 3.39Å; K190-L193 PolarHBondContact O-N 2.72Å; L193-L199 HydrophobicContact CD1-CB 4.26Å; L193-F250 HydrophobicContact CD1-CE1 3.65Å; L193-F250 HydrophobicContact CD1-CZ 4.12Å; L193-K283 HydrophobicContact CB-CB 4.45Å; L193-K283 HydrophobicContact CB-CD 3.84Å; L193-K283 HydrophobicContact CD1-CB 4.48Å; L193-K283 PolarHBondContact O-NZ 3.22Å
194	K	97.4	Very high	94	Very high	68 Å²	68	26.6 Å²	26.6	30%	0.296	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	159.1	160.2	-65.2	175.9	-164.7	169.4	0	110.2	C165 Q166 F167 D168 G197	C165-K194 VanDerWaalsContact O-CG 3.28Å; C165-K194 WeakPolarHBondContact O-CG 3.46Å; Q166-K194 WeakPolarHBondContact O-CE 3.5Å; F167-K194 PolarHBondContact O-N 3.04Å; D168-K194 WeakPolarHBondContact OD1-CD 3.4Å; D168-K194 IonicContact OD1-NZ 3.91Å; D168-K194 PolarHBondContact OD1-NZ 2.66Å; D168-K194 IonicContact OD2-NZ 3.78Å; D168-K194 PolarHBondContact OD2-NZ 3.37Å; K194-G197 WeakPolarHBondContact O-CA 3.28Å; K194-G197 PolarHBondContact O-N 3.32Å
195	L	96.4	Very high	92.7	Very high	100 Å²	100	24.1 Å²	24.1	52%	0.524	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	141.5	163.6	-170.8	65.8	0	0	0	109.2	G197	L195-G197 PolarHBondContact O-N 2.98Å; L195-G197 VanDerWaalsContact O-N 3.14Å
196	D	96.1	Very high	91	Very high	103 Å²	103	25.9 Å²	25.9	55%	0.551	13%	0.129	S	C	*	.	E	Extended strand (participates in β ladder)	trans	62.6	6.9	-170.2	-55.5	-43.1	0	0	0	114.9	M282 K283	D196-M282 HydrophobicContact CB-SD 4.43Å; D196-K283 WeakPolarHBondContact CA-O 3.29Å; D196-K283 PolarHBondContact N-O 3.26Å
197	G	97.5	Very high	89	Confident	2 Å²	2	27.4 Å²	27.4	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	150.8	173.8	0	0	0	0	0	112.5	D168 K194 L195 M282 K283	D168-G197 CarbonylContact O-C 3.48Å; D168-G197 VanDerWaalsContact O-CA 3.3Å; D168-G197 WeakPolarHBondContact O-CA 3.47Å; K194-G197 WeakPolarHBondContact O-CA 3.28Å; K194-G197 PolarHBondContact O-N 3.32Å; L195-G197 PolarHBondContact O-N 2.98Å; L195-G197 VanDerWaalsContact O-N 3.14Å; G197-M282 WeakPolarHBondContact O-CA 3.13Å; G197-K283 PolarHBondContact O-N 2.92Å
198	M	98.3	Very high	86.3	Confident	16 Å²	16	27.8 Å²	27.8	8%	0.079	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.9	-172.3	-68.1	-68.8	-66.2	0	0	112.4	L74 D168 A169 V170 F200 R253 M282	L74-M198 HydrophobicContact CD2-CB 4.04Å; L74-M198 HydrophobicContact CD2-CG 4.04Å; D168-M198 PolarHBondContact O-N 2.82Å; A169-M198 CarbonylContact C-O 3.56Å; A169-M198 WeakPolarHBondContact CA-O 3.49Å; V170-M198 PolarHBondContact N-O 2.87Å; M198-F200 HydrophobicContact CB-CD2 4.2Å; M198-F200 HydrophobicContact CB-CE2 3.44Å; M198-F200 VanDerWaalsContact CB-CE2 3.44Å; M198-F200 HydrophobicContact CB-CZ 3.78Å; M198-F200 HydrophobicContact CE-CE1 4.23Å; M198-F200 HydrophobicContact CE-CZ 4.03Å; M198-F200 HydrophobicContact CG-CE2 4.43Å; M198-F200 HydrophobicContact CG-CZ 4.35Å; M198-R253 HydrophobicContact CE-CB 4.41Å; M198-R253 HydrophobicContact CE-CG 4.08Å; M198-R253 HydrophobicContact SD-CG 4.46Å; M198-M282 HydrophobicContact SD-CB 3.72Å; M198-M282 HydrophobicContact SD-CG 3.93Å
199	L	98.3	Very high	83.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131.6	164.5	174.7	63.8	0	0	0	109.3	V170 L186 L189 L193 V201 F250 S280 A281	V170-L199 HydrophobicContact CG1-CD1 4.47Å; V170-L199 CarbonylContact O-C 3.58Å; V170-L199 WeakPolarHBondContact O-CA 3.4Å; L186-L199 HydrophobicContact CD2-CD2 3.65Å; L189-L199 HydrophobicContact CB-CD1 4.47Å; L189-L199 HydrophobicContact CD1-CD1 3.95Å; L193-L199 HydrophobicContact CD1-CB 4.26Å; L199-V201 HydrophobicContact CD1-CG2 4Å; L199-V201 HydrophobicContact CD2-CG2 4.17Å; L199-V201 HydrophobicContact CG-CG2 3.95Å; L199-F250 HydrophobicContact CB-CD1 4.41Å; L199-F250 HydrophobicContact CB-CE1 3.95Å; L199-F250 HydrophobicContact CD2-CE1 4.3Å; L199-F250 HydrophobicContact CD2-CZ 4.25Å; L199-S280 CarbonylContact O-C 3.52Å; L199-S280 WeakPolarHBondContact O-CA 2.78Å; L199-A281 PolarHBondContact N-O 2.92Å; L199-A281 PolarHBondContact O-N 2.93Å
200	F	98.3	Very high	81.9	Confident	3 Å²	3	28.5 Å²	28.5	1%	0.013	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.4	170.2	-60.8	-86.1	0	0	0	109.9	F69 I70 L74 A169 V170 V171 A172 M198	F69-F200 AromaticContact CD1-CD1 3.87Å; F69-F200 HydrophobicContact CD1-CD1 3.87Å; F69-F200 HydrophobicContact CE1-CB 4.33Å; F69-F200 AromaticContact CE1-CD1 3.56Å; F69-F200 HydrophobicContact CE1-CD1 3.56Å; F69-F200 HydrophobicContact CE1-CE1 4.4Å; F69-F200 HydrophobicContact CE1-CG 4.42Å; F69-F200 HydrophobicContact CZ-CD1 4.04Å; I70-F200 HydrophobicContact CG1-CB 4.16Å; I70-F200 HydrophobicContact CG1-CD1 4.1Å; I70-F200 HydrophobicContact CG1-CD2 4.14Å; I70-F200 HydrophobicContact CG1-CG 3.88Å; I70-F200 HydrophobicContact CG2-CD2 4.27Å; I70-F200 HydrophobicContact CG2-CE2 4.08Å; I70-F200 HydrophobicContact CG2-CZ 4.45Å; L74-F200 HydrophobicContact CD1-CE2 4.4Å; L74-F200 HydrophobicContact CD2-CE2 4.42Å; L74-F200 HydrophobicContact CG-CE2 4.05Å; L74-F200 HydrophobicContact CG-CZ 4.21Å; A169-F200 HydrophobicContact CB-CD2 4.18Å; A169-F200 HydrophobicContact CB-CE2 3.94Å; V170-F200 PolarHBondContact O-N 3.39Å; V171-F200 CarbonylContact C-O 3.55Å; V171-F200 WeakPolarHBondContact CA-O 3.49Å; V171-F200 HydrophobicContact CG1-CB 4.31Å; V171-F200 HydrophobicContact CG2-CB 4.27Å; V171-F200 HydrophobicContact CG2-CD2 4.25Å; A172-F200 PolarHBondContact N-O 3.22Å; M198-F200 HydrophobicContact CB-CD2 4.2Å; M198-F200 HydrophobicContact CB-CE2 3.44Å; M198-F200 VanDerWaalsContact CB-CE2 3.44Å; M198-F200 HydrophobicContact CB-CZ 3.78Å; M198-F200 HydrophobicContact CE-CE1 4.23Å; M198-F200 HydrophobicContact CE-CZ 4.03Å; M198-F200 HydrophobicContact CG-CE2 4.43Å; M198-F200 HydrophobicContact CG-CZ 4.35Å
201	V	96.3	Very high	79.4	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.7	179.5	-179.6	0	0	0	0	109.1	A172 F176 L199 T203 L241 A278 F279	A172-V201 WeakPolarHBondContact O-CA 3.44Å; F176-V201 HydrophobicContact CD1-CG1 4.37Å; F176-V201 HydrophobicContact CD2-CG1 4.07Å; F176-V201 HydrophobicContact CE1-CG1 4.43Å; F176-V201 HydrophobicContact CE1-CG2 4.17Å; F176-V201 HydrophobicContact CE2-CG1 4.12Å; F176-V201 HydrophobicContact CE2-CG2 3.99Å; F176-V201 HydrophobicContact CG-CG1 4.23Å; F176-V201 HydrophobicContact CZ-CG1 4.31Å; F176-V201 HydrophobicContact CZ-CG2 3.67Å; L199-V201 HydrophobicContact CD1-CG2 4Å; L199-V201 HydrophobicContact CD2-CG2 4.17Å; L199-V201 HydrophobicContact CG-CG2 3.95Å; V201-T203 HydrophobicContact CG1-CG2 4.47Å; V201-L241 HydrophobicContact CB-CD2 4.36Å; V201-L241 HydrophobicContact CG1-CD2 4.17Å; V201-A278 CarbonylContact O-C 3.57Å; V201-A278 WeakPolarHBondContact O-CA 3.31Å; V201-F279 HydrophobicContact CB-CB 4.44Å; V201-F279 HydrophobicContact CB-CD1 4.45Å; V201-F279 HydrophobicContact CG2-CD1 4.48Å; V201-F279 PolarHBondContact N-O 3.22Å; V201-F279 PolarHBondContact O-N 3.32Å
202	T	91.9	Very high	76.7	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	142.7	158.4	69.2	0	0	0	0	108.8	R66 A172 S173 E174 M258 Y277 A278	R66-T202 HydrophobicContact CG-CG2 4.13Å; A172-T202 PolarHBondContact O-N 2.94Å; S173-T202 WeakPolarHBondContact CA-OG1 3.45Å; S173-T202 WeakPolarHBondContact CB-OG1 3.13Å; S173-T202 PolarHBondContact OG-OG1 2.82Å; E174-T202 PolarHBondContact N-O 3.07Å; E174-T202 PolarHBondContact N-OG1 2.95Å; E174-T202 WeakPolarHBondContact OE1-CB 3.41Å; E174-T202 PolarHBondContact OE1-OG1 3.24Å; T202-M258 HydrophobicContact CG2-CE 3.79Å; T202-M258 HydrophobicContact CG2-SD 4.33Å; T202-Y277 WeakPolarHBondContact CA-O 3.05Å; T202-A278 HydrophobicContact CG2-CB 3.96Å
203	T	85.2	Confident	74.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	166.4	178.4	-171.2	0	0	0	0	110.4	E174 E177 V201 N276 Y277	E174-T203 WeakPolarHBondContact OE1-CA 3.29Å; E174-T203 PolarHBondContact OE1-N 3.17Å; E177-T203 PolarHBondContact OE1-OG1 3.34Å; E177-T203 WeakPolarHBondContact OE2-CB 3.4Å; E177-T203 PolarHBondContact OE2-OG1 2.87Å; V201-T203 HydrophobicContact CG1-CG2 4.47Å; T203-N276 WeakPolarHBondContact O-CA 3.44Å; T203-Y277 HydrophobicContact CG2-CD1 4.4Å; T203-Y277 HydrophobicContact CG2-CD2 4.49Å; T203-Y277 HydrophobicContact CG2-CE1 3.61Å; T203-Y277 HydrophobicContact CG2-CE2 3.69Å; T203-Y277 WeakPolarHBondContact CG2-OH 3.47Å; T203-Y277 PolarHBondContact N-O 3.14Å; T203-Y277 PolarHBondContact O-N 3.18Å
204	I	74	Confident	72.1	Confident	14 Å²	14	38.3 Å²	38.3	7%	0.072	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	131	173.3	-51.3	176.3	0	0	0	109.5	H230 F235 I236 L275 N276	I204-H230 VanDerWaalsContact CD1-CD2 3.46Å; I204-H230 WeakPolarHBondContact CD1-CD2 3.45Å; I204-F235 HydrophobicContact CB-CD1 3.74Å; I204-F235 HydrophobicContact CB-CE1 3.64Å; I204-F235 HydrophobicContact CB-CG 4.4Å; I204-F235 HydrophobicContact CB-CZ 4.2Å; I204-F235 HydrophobicContact CD1-CE1 3.98Å; I204-F235 HydrophobicContact CD1-CZ 4.41Å; I204-F235 HydrophobicContact CG1-CE1 4.38Å; I204-F235 HydrophobicContact CG2-CD1 3.8Å; I204-F235 HydrophobicContact CG2-CD2 4.17Å; I204-F235 HydrophobicContact CG2-CE1 3.5Å; I204-F235 HydrophobicContact CG2-CE2 3.87Å; I204-F235 HydrophobicContact CG2-CG 4.13Å; I204-F235 HydrophobicContact CG2-CZ 3.53Å; I204-F235 WeakPolarHBondContact O-CB 3.39Å; I204-I236 PolarHBondContact O-N 3.32Å; I204-L275 CarbonylContact C-O 3.56Å; I204-L275 WeakPolarHBondContact CG2-O 3.33Å; I204-N276 WeakPolarHBondContact CG1-OD1 3.29Å
205	N	61.6	Low	70	Confident	11 Å²	11	35.6 Å²	35.6	6%	0.059	21%	0.207	C	C	.	.			trans	-75.1	150.4	179	-168.6	0.7	0	0	0	112	T207 S210 F235 I236 P238 L273 L275 Y277	N205-T207 HydrophobicContact CB-CG2 4.39Å; N205-T207 PolarHBondContact O-N 3.08Å; N205-T207 VanDerWaalsContact O-N 3.15Å; N205-S210 WeakPolarHBondContact O-CB 3.49Å; N205-S210 PolarHBondContact O-OG 3.32Å; N205-F235 VanDerWaalsContact C-CB 3.49Å; N205-F235 WeakPolarHBondContact O-CB 3.38Å; N205-F235 VanDerWaalsContact O-CD2 3.24Å; N205-F235 WeakPolarHBondContact O-CD2 3.32Å; N205-I236 PolarHBondContact OD1-O 2.79Å; N205-P238 WeakPolarHBondContact OD1-CD 3.46Å; N205-L273 WeakPolarHBondContact CB-O 3.33Å; N205-L273 PolarHBondContact ND2-O 3.29Å; N205-L275 PolarHBondContact N-O 2.97Å; N205-Y277 HydrophobicContact CB-CD1 3.88Å; N205-Y277 HydrophobicContact CB-CE1 3.97Å
206	H	55.7	Low	67.4	Low	39 Å²	39	31.8 Å²	31.8	18%	0.181	19%	0.192	C	C	.	.			trans	-83.7	77.3	175.9	-164.1	-83.3	0	0	0	112.1	W232 F235 E237	H206-W232 PolarHBondContact CD2-O 3.38Å; H206-W232 AromaticContact CE1-CD2 3.74Å; H206-W232 AromaticContact CE1-CE2 3.6Å; H206-W232 AromaticContact CE1-CE3 3.61Å; H206-W232 AromaticContact CE1-CH2 3.31Å; H206-W232 WeakPolarHBondContact CE1-CH2 3.33Å; H206-W232 AromaticContact CE1-CZ2 3.42Å; H206-W232 VanDerWaalsContact CE1-CZ2 3.42Å; H206-W232 WeakPolarHBondContact CE1-CZ2 3.47Å; H206-W232 AromaticContact CE1-CZ3 3.4Å; H206-W232 WeakPolarHBondContact CE1-CZ3 3.45Å; H206-W232 AromaticContact ND1-CE2 3.99Å; H206-W232 AromaticContact ND1-CZ2 3.75Å; H206-W232 AromaticContact NE2-CD2 3.67Å; H206-W232 AromaticContact NE2-CE2 3.94Å; H206-W232 AromaticContact NE2-CE3 3.59Å; H206-W232 AromaticContact NE2-CZ3 3.84Å; H206-W232 PolarHBondContact NE2-O 3.49Å; H206-W232 VanDerWaalsContact NE2-O 3.15Å; H206-F235 HydrophobicContact CB-CB 3.53Å; H206-F235 WeakPolarHBondContact CB-O 3.29Å; H206-F235 PolarHBondContact CD2-O 2.95Å; H206-E237 HydrophobicContact CB-CG 4.1Å
207	T	51.8	Low	65	Low	33 Å²	33	29.6 Å²	29.6	20%	0.202	18%	0.182	C	C	.	.	S	Bend	trans	-130.3	161.6	174.2	78.8	0	0	0	0	112.3	N205 A209 S210 L211 W232 S274	N205-T207 HydrophobicContact CB-CG2 4.39Å; N205-T207 PolarHBondContact O-N 3.08Å; N205-T207 VanDerWaalsContact O-N 3.15Å; T207-A209 PolarHBondContact O-N 3.28Å; T207-A209 WeakPolarHBondContact OG1-CB 3.49Å; T207-A209 PolarHBondContact OG1-N 3.29Å; T207-A209 VanDerWaalsContact OG1-N 3.16Å; T207-S210 PolarHBondContact N-OG 3.35Å; T207-S210 VanDerWaalsContact N-OG 3.11Å; T207-S210 PolarHBondContact O-N 3.12Å; T207-S210 PolarHBondContact O-OG 2.74Å; T207-S210 PolarHBondContact OG1-N 3.48Å; T207-S210 VanDerWaalsContact OG1-N 3.13Å; T207-L211 PolarHBondContact O-N 2.89Å; T207-L211 VanDerWaalsContact O-N 3.16Å; T207-W232 PolarHBondContact O-NE1 2.99Å; T207-S274 WeakPolarHBondContact CB-O 3.48Å; T207-S274 WeakPolarHBondContact CG2-O 3.32Å; T207-S274 PolarHBondContact OG1-O 2.92Å
208	A	36.9	Very low	62.8	Low	63 Å²	63	30.5 Å²	30.5	52%	0.521	19%	0.19	S	C	.	.	H	α-helix	trans	-59.9	-26.7	170.1	0	0	0	0	0	111.8	L212	A208-L212 WeakPolarHBondContact O-CB 3.5Å; A208-L212 PolarHBondContact O-N 3.36Å
209	A	45.1	Very low	60.8	Low	32 Å²	32	30 Å²	30	26%	0.264	19%	0.187	S	C	.	.	H	α-helix	trans	-72	-38.4	176.2	0	0	0	0	0	111.7	T207 L211 L212 L213 L275	T207-A209 PolarHBondContact O-N 3.28Å; T207-A209 WeakPolarHBondContact OG1-CB 3.49Å; T207-A209 PolarHBondContact OG1-N 3.29Å; T207-A209 VanDerWaalsContact OG1-N 3.16Å; A209-L211 VanDerWaalsContact C-N 3.34Å; A209-L212 PolarHBondContact O-N 2.94Å; A209-L213 WeakPolarHBondContact O-CA 3.34Å; A209-L213 WeakPolarHBondContact O-CB 3.14Å; A209-L213 PolarHBondContact O-N 2.94Å; A209-L275 HydrophobicContact CB-CD2 3.81Å; A209-L275 VanDerWaalsContact O-CD2 3.28Å; A209-L275 WeakPolarHBondContact O-CD2 3.41Å
210	S	53	Low	57.9	Low	0 Å²	0	37 Å²	37	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-70.3	-31.9	175.3	60.1	0	0	0	0	112.1	N205 T207 G214 I215 F235	N205-S210 WeakPolarHBondContact O-CB 3.49Å; N205-S210 PolarHBondContact O-OG 3.32Å; T207-S210 PolarHBondContact N-OG 3.35Å; T207-S210 VanDerWaalsContact N-OG 3.11Å; T207-S210 PolarHBondContact O-N 3.12Å; T207-S210 PolarHBondContact O-OG 2.74Å; T207-S210 PolarHBondContact OG1-N 3.48Å; T207-S210 VanDerWaalsContact OG1-N 3.13Å; S210-G214 WeakPolarHBondContact O-CA 3.43Å; S210-G214 PolarHBondContact O-N 2.65Å; S210-I215 PolarHBondContact O-N 3.21Å; S210-I215 VanDerWaalsContact O-N 3.14Å; S210-F235 WeakPolarHBondContact OG-CD2 3.45Å; S210-F235 WeakPolarHBondContact OG-CE2 3.38Å
211	L	44	Very low	55.2	Low	73 Å²	73	42.2 Å²	42.2	38%	0.382	25%	0.246	S	C	.	.	I	π-helix	trans	-61.3	-53.1	167.9	-174.2	58.5	0	0	0	111.9	T207 A209 I215 G216 W232	T207-L211 PolarHBondContact O-N 2.89Å; T207-L211 VanDerWaalsContact O-N 3.16Å; A209-L211 VanDerWaalsContact C-N 3.34Å; L211-I215 HydrophobicContact CD1-CD1 3.7Å; L211-I215 HydrophobicContact CD1-CG1 4.42Å; L211-I215 VanDerWaalsContact O-CB 3.23Å; L211-I215 WeakPolarHBondContact O-CB 3.46Å; L211-I215 PolarHBondContact O-N 3.2Å; L211-G216 PolarHBondContact O-N 3.01Å; L211-W232 HydrophobicContact CB-CG 4.41Å; L211-W232 HydrophobicContact CD1-CB 4.07Å; L211-W232 HydrophobicContact CD1-CG 4.12Å; L211-W232 HydrophobicContact CD2-CG 4.31Å
212	L	38.3	Very low	53	Low	122 Å²	122	44.5 Å²	44.5	64%	0.639	27%	0.265	S	S	*	.	I	π-helix	trans	-75.1	-40.7	-175.1	-84.9	159.7	0	0	0	113.5	A208 A209 G216 V217	A208-L212 WeakPolarHBondContact O-CB 3.5Å; A208-L212 PolarHBondContact O-N 3.36Å; A209-L212 PolarHBondContact O-N 2.94Å; L212-G216 CarbonylContact O-C 3.54Å; L212-G216 WeakPolarHBondContact O-CA 3.48Å; L212-G216 PolarHBondContact O-N 2.76Å; L212-V217 PolarHBondContact O-N 3.44Å
213	L	48.3	Very low	50.9	Low	96 Å²	96	53.7 Å²	53.7	50%	0.503	30%	0.299	S	S	.	.	I	π-helix	trans	-94.9	-38.6	-175.5	-62.5	173.7	0	0	0	112.6	A209 V217 L275	A209-L213 WeakPolarHBondContact O-CA 3.34Å; A209-L213 WeakPolarHBondContact O-CB 3.14Å; A209-L213 PolarHBondContact O-N 2.94Å; L213-V217 HydrophobicContact CD2-CG2 4.02Å; L213-V217 VanDerWaalsContact O-CB 3.32Å; L213-V217 WeakPolarHBondContact O-CB 3.49Å; L213-L275 HydrophobicContact CB-CD1 4.34Å; L213-L275 HydrophobicContact CB-CD2 4Å; L213-L275 HydrophobicContact CD1-CD1 4.03Å; L213-L275 HydrophobicContact CD1-CD2 4.11Å
214	G	50.1	Low	49.3	Very low	24 Å²	24	56.3 Å²	56.3	25%	0.247	31%	0.313	C	S	.	.	I	π-helix	trans	-73.1	-57.2	176.1	0	0	0	0	0	110.7	S210 A218	S210-G214 WeakPolarHBondContact O-CA 3.43Å; S210-G214 PolarHBondContact O-N 2.65Å; G214-A218 WeakPolarHBondContact O-CB 3.23Å; G214-A218 PolarHBondContact O-N 2.9Å
215	I	52.4	Low	48.1	Very low	11 Å²	11	57.2 Å²	57.2	6%	0.056	32%	0.319	C	S	.	.	I	π-helix	trans	-82.7	-51.5	-175.7	-43.2	-172.3	0	0	0	110.3	S210 L211 E219 Y220 H230 F235	S210-I215 PolarHBondContact O-N 3.21Å; S210-I215 VanDerWaalsContact O-N 3.14Å; L211-I215 HydrophobicContact CD1-CD1 3.7Å; L211-I215 HydrophobicContact CD1-CG1 4.42Å; L211-I215 VanDerWaalsContact O-CB 3.23Å; L211-I215 WeakPolarHBondContact O-CB 3.46Å; L211-I215 PolarHBondContact O-N 3.2Å; I215-E219 VanDerWaalsContact CG2-CD 3.41Å; I215-E219 HydrophobicContact CG2-CG 4.12Å; I215-E219 WeakPolarHBondContact CG2-OE1 3.35Å; I215-E219 WeakPolarHBondContact CG2-OE2 3.32Å; I215-E219 WeakPolarHBondContact O-CA 3.39Å; I215-E219 WeakPolarHBondContact O-CB 3.33Å; I215-E219 WeakPolarHBondContact O-CG 3.36Å; I215-E219 PolarHBondContact O-N 3.35Å; I215-Y220 HydrophobicContact CG2-CE2 4.32Å; I215-H230 HydrophobicContact CB-CB 4.35Å; I215-H230 HydrophobicContact CD1-CB 3.27Å; I215-H230 WeakPolarHBondContact CD1-O 3.15Å; I215-H230 HydrophobicContact CG1-CB 3.4Å; I215-H230 HydrophobicContact CG2-CB 4.25Å; I215-F235 HydrophobicContact CD1-CE2 4.05Å; I215-F235 HydrophobicContact CD1-CZ 3.9Å; I215-F235 HydrophobicContact CG1-CE2 4.48Å; I215-F235 HydrophobicContact CG1-CZ 4.21Å
216	G	41.4	Very low	47.1	Very low	20 Å²	20	57.8 Å²	57.8	21%	0.206	32%	0.323	C	S	.	.	I	π-helix	trans	-59.3	-52.9	-177.8	0	0	0	0	0	113.3	L211 L212 Y220 V221	L211-G216 PolarHBondContact O-N 3.01Å; L212-G216 CarbonylContact O-C 3.54Å; L212-G216 WeakPolarHBondContact O-CA 3.48Å; L212-G216 PolarHBondContact O-N 2.76Å; G216-Y220 WeakPolarHBondContact O-CA 2.94Å; G216-Y220 WeakPolarHBondContact O-CB 3.41Å; G216-Y220 PolarHBondContact O-N 3.27Å; G216-V221 PolarHBondContact O-N 3.43Å
217	V	45.8	Very low	46.6	Very low	57 Å²	57	64.5 Å²	64.5	35%	0.345	35%	0.347	S	S	.	.	I	π-helix	trans	-74.9	-42.8	-178.9	-179.6	0	0	0	0	111.5	L212 L213 V221 A222	L212-V217 PolarHBondContact O-N 3.44Å; L213-V217 HydrophobicContact CD2-CG2 4.02Å; L213-V217 VanDerWaalsContact O-CB 3.32Å; L213-V217 WeakPolarHBondContact O-CB 3.49Å; V217-V221 HydrophobicContact CG1-CB 4.27Å; V217-V221 PolarHBondContact O-N 3.35Å; V217-A222 VanDerWaalsContact O-CB 3.3Å; V217-A222 WeakPolarHBondContact O-CB 3.48Å; V217-A222 PolarHBondContact O-N 2.97Å
218	A	52.3	Low	46.7	Very low	21 Å²	21	65.6 Å²	65.6	17%	0.174	37%	0.365	C	S	.	.	I	π-helix	trans	-73.9	-38.4	-176.1	0	0	0	0	0	113.1	G214 R223 I224 V225	G214-A218 WeakPolarHBondContact O-CB 3.23Å; G214-A218 PolarHBondContact O-N 2.9Å; A218-R223 CarbonylContact O-C 3.48Å; A218-R223 WeakPolarHBondContact O-CA 3.3Å; A218-R223 PolarHBondContact O-N 3.22Å; A218-R223 VanDerWaalsContact O-N 3.13Å; A218-I224 PolarHBondContact O-N 3.16Å; A218-V225 HydrophobicContact CB-CG2 3.52Å; A218-V225 PolarHBondContact O-N 3.3Å
219	E	55.4	Low	47.2	Very low	4 Å²	4	64.1 Å²	64.1	2%	0.019	35%	0.35	C	S	.	.	I	π-helix	trans	-88.9	-39.3	-179	-57.2	-175.8	-173	0	0	113.1	I215 V225 P226 G228 T229 H230	I215-E219 VanDerWaalsContact CG2-CD 3.41Å; I215-E219 HydrophobicContact CG2-CG 4.12Å; I215-E219 WeakPolarHBondContact CG2-OE1 3.35Å; I215-E219 WeakPolarHBondContact CG2-OE2 3.32Å; I215-E219 WeakPolarHBondContact O-CA 3.39Å; I215-E219 WeakPolarHBondContact O-CB 3.33Å; I215-E219 WeakPolarHBondContact O-CG 3.36Å; I215-E219 PolarHBondContact O-N 3.35Å; E219-V225 HydrophobicContact CG-CG2 3.69Å; E219-P226 WeakPolarHBondContact CG-O 3.32Å; E219-G228 PolarHBondContact OE2-N 3.21Å; E219-T229 PolarHBondContact OE1-N 3.37Å; E219-T229 VanDerWaalsContact OE1-N 3.12Å; E219-H230 IonicContact OE1-CG 2.83Å; E219-H230 PolarHBondContact OE1-N 3.31Å; E219-H230 VanDerWaalsContact OE1-N 3.07Å; E219-H230 IonicContact OE1-ND1 2.78Å; E219-H230 PolarHBondContact OE1-ND1 3.32Å
220	Y	37	Very low	47.5	Very low	147 Å²	147	64.8 Å²	64.8	58%	0.576	35%	0.347	S	S	*	.	I	π-helix	trans	-100.9	-36	-170.7	-60	-96.4	0	0	0	114.2	I215 G216	I215-Y220 HydrophobicContact CG2-CE2 4.32Å; G216-Y220 WeakPolarHBondContact O-CA 2.94Å; G216-Y220 WeakPolarHBondContact O-CB 3.41Å; G216-Y220 PolarHBondContact O-N 3.27Å
221	V	43.2	Very low	47.5	Very low	114 Å²	114	68.6 Å²	68.6	69%	0.691	37%	0.367	S	S	*	.	I	π-helix	trans	-93.7	-53.3	-176.4	-176.2	0	0	0	0	111.6	G216 V217	G216-V221 PolarHBondContact O-N 3.43Å; V217-V221 HydrophobicContact CG1-CB 4.27Å; V217-V221 PolarHBondContact O-N 3.35Å
222	A	50.2	Low	47.7	Very low	49 Å²	49	69.3 Å²	69.3	41%	0.405	37%	0.365	S	S	.	.	S	Bend	trans	-93.9	-16.8	-173.2	0	0	0	0	0	113.6	V217 I224	V217-A222 VanDerWaalsContact O-CB 3.3Å; V217-A222 WeakPolarHBondContact O-CB 3.48Å; V217-A222 PolarHBondContact O-N 2.97Å; A222-I224 HydrophobicContact CB-CD1 3.53Å; A222-I224 HydrophobicContact CB-CG1 3.65Å; A222-I224 PolarHBondContact O-N 2.71Å; A222-I224 VanDerWaalsContact O-N 3.17Å
223	R	47.6	Very low	48.4	Very low	197 Å²	197	69.4 Å²	69.4	74%	0.743	37%	0.366	S	S	*	.			trans	50.6	33.2	-176.5	-57.3	-177	-177.1	179.2	1.4	113.6	A218 V225	A218-R223 CarbonylContact O-C 3.48Å; A218-R223 WeakPolarHBondContact O-CA 3.3Å; A218-R223 PolarHBondContact O-N 3.22Å; A218-R223 VanDerWaalsContact O-N 3.13Å; R223-V225 VanDerWaalsContact C-N 3.27Å
224	I	51.7	Low	48.7	Very low	56 Å²	56	67.5 Å²	67.5	29%	0.287	35%	0.354	S	S	.	.			trans	-73.2	-26.3	-179.9	-64.6	168.4	0	0	0	110.5	P58 A218 A222	P58-I224 HydrophobicContact CG-CG2 4.29Å; A218-I224 PolarHBondContact O-N 3.16Å; A222-I224 HydrophobicContact CB-CD1 3.53Å; A222-I224 HydrophobicContact CB-CG1 3.65Å; A222-I224 PolarHBondContact O-N 2.71Å; A222-I224 VanDerWaalsContact O-N 3.17Å
225	V	47.9	Very low	49.6	Very low	33 Å²	33	66.9 Å²	66.9	20%	0.2	34%	0.344	C	S	.	.	S	Bend	trans	-132.9	147.1	179.3	-80.5	0	0	0	0	110.3	A218 E219 R223	A218-V225 HydrophobicContact CB-CG2 3.52Å; A218-V225 PolarHBondContact O-N 3.3Å; E219-V225 HydrophobicContact CG-CG2 3.69Å; R223-V225 VanDerWaalsContact C-N 3.27Å
226	P	41.7	Very low	50.8	Low	23 Å²	23	66.4 Å²	66.4	15%	0.149	34%	0.342	C	S	.	.			trans	-53.1	153.7	174.7	-24.5	32.9	0	0	0	112.2	F45 E219 T229	F45-P226 HydrophobicContact CE1-CG 4.48Å; F45-P226 HydrophobicContact CE2-CG 4.47Å; F45-P226 HydrophobicContact CZ-CG 3.78Å; E219-P226 WeakPolarHBondContact CG-O 3.32Å; P226-T229 PolarHBondContact O-OG1 3.27Å
227	R	45	Very low	53	Low	180 Å²	180	70 Å²	70	68%	0.679	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	137	176.6	-67.3	178.3	175.5	173.3	-3.1	110.4
228	G	53.3	Low	55	Low	56 Å²	56	67.9 Å²	67.9	58%	0.577	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	10.7	177	0	0	0	0	0	114.2	E219 H230	E219-G228 PolarHBondContact OE2-N 3.21Å; G228-H230 PolarHBondContact O-N 3.37Å
229	T	46.8	Very low	56.8	Low	32 Å²	32	69.7 Å²	69.7	20%	0.196	35%	0.352	C	S	.	.			trans	-64.8	-28.8	177.3	-63.5	0	0	0	0	111.7	E219 P226	E219-T229 PolarHBondContact OE1-N 3.37Å; E219-T229 VanDerWaalsContact OE1-N 3.12Å; P226-T229 PolarHBondContact O-OG1 3.27Å
230	H	52.4	Low	58.5	Low	45 Å²	45	75.2 Å²	75.2	21%	0.208	37%	0.373	C	S	.	.			trans	-114.3	123.1	-177.8	-57	90.1	0	0	0	112.5	I204 I215 E219 G228 F235	I204-H230 VanDerWaalsContact CD1-CD2 3.46Å; I204-H230 WeakPolarHBondContact CD1-CD2 3.45Å; I215-H230 HydrophobicContact CB-CB 4.35Å; I215-H230 HydrophobicContact CD1-CB 3.27Å; I215-H230 WeakPolarHBondContact CD1-O 3.15Å; I215-H230 HydrophobicContact CG1-CB 3.4Å; I215-H230 HydrophobicContact CG2-CB 4.25Å; E219-H230 IonicContact OE1-CG 2.83Å; E219-H230 PolarHBondContact OE1-N 3.31Å; E219-H230 VanDerWaalsContact OE1-N 3.07Å; E219-H230 IonicContact OE1-ND1 2.78Å; E219-H230 PolarHBondContact OE1-ND1 3.32Å; G228-H230 PolarHBondContact O-N 3.37Å; H230-F235 HydrophobicContact CB-CE1 4.41Å; H230-F235 HydrophobicContact CB-CZ 4.03Å
231	N	53.3	Low	61.2	Low	80 Å²	80	68.2 Å²	68.2	43%	0.428	35%	0.345	S	S	.	.			trans	-103.9	115.5	170.9	-175.5	-21.8	0	0	0	109.3	N233 K234	N231-N233 PolarHBondContact O-N 3.42Å; N231-N233 VanDerWaalsContact O-N 3.13Å; N231-N233 PolarHBondContact OD1-N 3.01Å; N231-K234 HydrophobicContact CB-CD 4.24Å; N231-K234 HydrophobicContact CB-CG 4.05Å; N231-K234 WeakPolarHBondContact O-CB 3.37Å; N231-K234 PolarHBondContact O-N 3.27Å
232	W	46.7	Very low	63.6	Low	88 Å²	88	65.7 Å²	65.7	33%	0.333	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-52.3	-40.6	-172.7	-168.2	62.2	0	0	0	113.3	H206 T207 L211 K234 F235	H206-W232 PolarHBondContact CD2-O 3.38Å; H206-W232 AromaticContact CE1-CD2 3.74Å; H206-W232 AromaticContact CE1-CE2 3.6Å; H206-W232 AromaticContact CE1-CE3 3.61Å; H206-W232 AromaticContact CE1-CH2 3.31Å; H206-W232 WeakPolarHBondContact CE1-CH2 3.33Å; H206-W232 AromaticContact CE1-CZ2 3.42Å; H206-W232 VanDerWaalsContact CE1-CZ2 3.42Å; H206-W232 WeakPolarHBondContact CE1-CZ2 3.47Å; H206-W232 AromaticContact CE1-CZ3 3.4Å; H206-W232 WeakPolarHBondContact CE1-CZ3 3.45Å; H206-W232 AromaticContact ND1-CE2 3.99Å; H206-W232 AromaticContact ND1-CZ2 3.75Å; H206-W232 AromaticContact NE2-CD2 3.67Å; H206-W232 AromaticContact NE2-CE2 3.94Å; H206-W232 AromaticContact NE2-CE3 3.59Å; H206-W232 AromaticContact NE2-CZ3 3.84Å; H206-W232 PolarHBondContact NE2-O 3.49Å; H206-W232 VanDerWaalsContact NE2-O 3.15Å; T207-W232 PolarHBondContact O-NE1 2.99Å; L211-W232 HydrophobicContact CB-CG 4.41Å; L211-W232 HydrophobicContact CD1-CB 4.07Å; L211-W232 HydrophobicContact CD1-CG 4.12Å; L211-W232 HydrophobicContact CD2-CG 4.31Å; W232-K234 PolarHBondContact O-N 3.02Å; W232-F235 AromaticContact CD1-CD2 3.77Å; W232-F235 AromaticContact CD1-CE2 3.93Å; W232-F235 PolarHBondContact O-N 3.42Å; W232-F235 VanDerWaalsContact O-N 3.14Å
233	N	52.9	Low	65.8	Low	125 Å²	125	67.6 Å²	67.6	67%	0.668	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-65.1	-11.8	-178.1	-65.4	-35.9	0	0	0	114.1	N231	N231-N233 PolarHBondContact O-N 3.42Å; N231-N233 VanDerWaalsContact O-N 3.13Å; N231-N233 PolarHBondContact OD1-N 3.01Å
234	K	56.4	Low	68	Low	56 Å²	56	58.4 Å²	58.4	24%	0.243	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-90.6	-12.7	179.2	-55.6	-167.7	-172.2	-175.2	0	113.4	D35 E38 E177 N231 W232	D35-K234 IonicContact OD2-NZ 3.12Å; E38-K234 IonicContact OE1-NZ 3.01Å; E38-K234 PolarHBondContact OE1-NZ 2.9Å; E177-K234 WeakPolarHBondContact O-CB 3.46Å; E177-K234 WeakPolarHBondContact O-CD 3.25Å; N231-K234 HydrophobicContact CB-CD 4.24Å; N231-K234 HydrophobicContact CB-CG 4.05Å; N231-K234 WeakPolarHBondContact O-CB 3.37Å; N231-K234 PolarHBondContact O-N 3.27Å; W232-K234 PolarHBondContact O-N 3.02Å
235	F	68	Low	70.2	Confident	10 Å²	10	55.7 Å²	55.7	4%	0.044	28%	0.281	C	S	.	.			trans	-68.7	151.4	178.8	-62.2	-25.4	0	0	0	111.7	I204 N205 H206 S210 I215 H230 W232	I204-F235 HydrophobicContact CB-CD1 3.74Å; I204-F235 HydrophobicContact CB-CE1 3.64Å; I204-F235 HydrophobicContact CB-CG 4.4Å; I204-F235 HydrophobicContact CB-CZ 4.2Å; I204-F235 HydrophobicContact CD1-CE1 3.98Å; I204-F235 HydrophobicContact CD1-CZ 4.41Å; I204-F235 HydrophobicContact CG1-CE1 4.38Å; I204-F235 HydrophobicContact CG2-CD1 3.8Å; I204-F235 HydrophobicContact CG2-CD2 4.17Å; I204-F235 HydrophobicContact CG2-CE1 3.5Å; I204-F235 HydrophobicContact CG2-CE2 3.87Å; I204-F235 HydrophobicContact CG2-CG 4.13Å; I204-F235 HydrophobicContact CG2-CZ 3.53Å; I204-F235 WeakPolarHBondContact O-CB 3.39Å; N205-F235 VanDerWaalsContact C-CB 3.49Å; N205-F235 WeakPolarHBondContact O-CB 3.38Å; N205-F235 VanDerWaalsContact O-CD2 3.24Å; N205-F235 WeakPolarHBondContact O-CD2 3.32Å; H206-F235 HydrophobicContact CB-CB 3.53Å; H206-F235 WeakPolarHBondContact CB-O 3.29Å; H206-F235 PolarHBondContact CD2-O 2.95Å; S210-F235 WeakPolarHBondContact OG-CD2 3.45Å; S210-F235 WeakPolarHBondContact OG-CE2 3.38Å; I215-F235 HydrophobicContact CD1-CE2 4.05Å; I215-F235 HydrophobicContact CD1-CZ 3.9Å; I215-F235 HydrophobicContact CG1-CE2 4.48Å; I215-F235 HydrophobicContact CG1-CZ 4.21Å; H230-F235 HydrophobicContact CB-CE1 4.41Å; H230-F235 HydrophobicContact CB-CZ 4.03Å; W232-F235 AromaticContact CD1-CD2 3.77Å; W232-F235 AromaticContact CD1-CE2 3.93Å; W232-F235 PolarHBondContact O-N 3.42Å; W232-F235 VanDerWaalsContact O-N 3.14Å
236	I	78.8	Confident	72.5	Confident	2 Å²	2	59 Å²	59	1%	0.01	30%	0.296	C	S	.	.			trans	-115.4	129.6	-172.6	-60.7	171.8	0	0	0	110	F176 W182 I204 N205 L241 Y277	F176-I236 HydrophobicContact CB-CD1 3.38Å; F176-I236 HydrophobicContact CD2-CD1 3.87Å; F176-I236 HydrophobicContact CG-CD1 4.15Å; W182-I236 HydrophobicContact CB-CD1 4.23Å; W182-I236 HydrophobicContact CD2-CD1 3.59Å; W182-I236 HydrophobicContact CD2-CG1 4.4Å; W182-I236 HydrophobicContact CE3-CD1 4.22Å; W182-I236 HydrophobicContact CG-CD1 3.57Å; W182-I236 HydrophobicContact CG-CG1 4.46Å; W182-I236 HydrophobicContact CH2-CG2 4.03Å; W182-I236 HydrophobicContact CZ2-CD1 4.37Å; W182-I236 HydrophobicContact CZ2-CG1 4.42Å; W182-I236 HydrophobicContact CZ2-CG2 3.73Å; I204-I236 PolarHBondContact O-N 3.32Å; N205-I236 PolarHBondContact OD1-O 2.79Å; I236-L241 HydrophobicContact CG2-CB 4.04Å; I236-Y277 VanDerWaalsContact O-CE1 3.29Å; I236-Y277 WeakPolarHBondContact O-CE1 3.37Å; I236-Y277 PolarHBondContact O-OH 3.12Å; I236-Y277 VanDerWaalsContact O-OH 3.07Å
237	E	85.6	Confident	75	Confident	96 Å²	96	65.9 Å²	65.9	45%	0.449	32%	0.323	S	S	.	.			trans	-72.3	134.4	172.6	-65.6	-175.8	172.5	0	0	110.8	H206 S239 R240 L241	H206-E237 HydrophobicContact CB-CG 4.1Å; E237-S239 PolarHBondContact O-N 3.09Å; E237-S239 VanDerWaalsContact O-N 3.16Å; E237-R240 HydrophobicContact CB-CB 4.17Å; E237-R240 WeakPolarHBondContact O-CB 3.42Å; E237-R240 PolarHBondContact O-N 3.3Å; E237-L241 PolarHBondContact O-N 3.03Å
238	P	88.5	Confident	77.4	Confident	12 Å²	12	59.6 Å²	59.6	8%	0.078	30%	0.3	C	S	.	.	H	α-helix	trans	-56.7	-33.4	179.3	-25.9	28.2	0	0	0	114.5	N205 Q242 L255 L273 Y277	N205-P238 WeakPolarHBondContact OD1-CD 3.46Å; P238-Q242 WeakPolarHBondContact O-CB 3.4Å; P238-Q242 VanDerWaalsContact O-CG 3.31Å; P238-Q242 WeakPolarHBondContact O-CG 3.42Å; P238-Q242 PolarHBondContact O-N 2.95Å; P238-Q242 VanDerWaalsContact O-N 3.08Å; P238-Q242 PolarHBondContact O-NE2 3.18Å; P238-L255 HydrophobicContact CB-CD1 4.1Å; P238-L255 HydrophobicContact CB-CD2 3.82Å; P238-L273 HydrophobicContact CB-CD1 4.32Å; P238-L273 HydrophobicContact CG-CB 4.19Å; P238-L273 HydrophobicContact CG-CD1 4.23Å; P238-Y277 HydrophobicContact CG-CD1 3.75Å; P238-Y277 HydrophobicContact CG-CE1 3.73Å; P238-Y277 HydrophobicContact CG-CG 4.16Å
239	S	90.5	Very high	79.4	Confident	58 Å²	58	57.5 Å²	57.5	41%	0.406	28%	0.278	S	S	.	.	H	α-helix	trans	-66.2	-43.7	175.5	49.9	0	0	0	0	111.2	E237 Q242 I243	E237-S239 PolarHBondContact O-N 3.09Å; E237-S239 VanDerWaalsContact O-N 3.16Å; S239-Q242 PolarHBondContact O-N 3.26Å; S239-I243 WeakPolarHBondContact O-CB 3.17Å; S239-I243 VanDerWaalsContact O-CG1 3.27Å; S239-I243 WeakPolarHBondContact O-CG1 3.46Å; S239-I243 PolarHBondContact O-N 3.45Å
240	R	91.7	Very high	81.8	Confident	120 Å²	120	56.2 Å²	56.2	45%	0.453	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-45.2	177.9	-171.3	179.3	169.5	-164.3	-5.9	111	W182 E183 E237 I243 A244	W182-R240 HydrophobicContact CH2-CG 4.03Å; W182-R240 HydrophobicContact CZ2-CG 3.82Å; E183-R240 IonicContact OE1-CZ 3.99Å; E183-R240 IonicContact OE1-NE 2.87Å; E183-R240 PolarHBondContact OE1-NE 2.79Å; E183-R240 IonicContact OE1-NH2 3.88Å; E183-R240 PolarHBondContact OE1-NH2 3.44Å; E237-R240 HydrophobicContact CB-CB 4.17Å; E237-R240 WeakPolarHBondContact O-CB 3.42Å; E237-R240 PolarHBondContact O-N 3.3Å; R240-I243 PolarHBondContact O-N 3.35Å; R240-A244 VanDerWaalsContact O-CB 3.3Å; R240-A244 WeakPolarHBondContact O-CB 3.47Å; R240-A244 PolarHBondContact O-N 3.32Å
241	L	92.9	Very high	83.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.8	-49.4	175	179.1	59.8	0	0	0	111.6	F176 W182 L186 V201 I236 E237 I243 A244 C245 Y277 F279	F176-L241 HydrophobicContact CD2-CD1 4.19Å; F176-L241 HydrophobicContact CE2-CD1 3.7Å; W182-L241 HydrophobicContact CE3-CD1 4.32Å; W182-L241 HydrophobicContact CH2-CD1 4.4Å; W182-L241 HydrophobicContact CZ3-CD1 3.69Å; L186-L241 HydrophobicContact CD1-CD1 4.4Å; V201-L241 HydrophobicContact CB-CD2 4.36Å; V201-L241 HydrophobicContact CG1-CD2 4.17Å; I236-L241 HydrophobicContact CG2-CB 4.04Å; E237-L241 PolarHBondContact O-N 3.03Å; L241-I243 PolarHBondContact O-N 3.01Å; L241-A244 PolarHBondContact O-N 3.48Å; L241-C245 WeakPolarHBondContact O-CB 3.42Å; L241-C245 PolarHBondContact O-N 2.93Å; L241-C245 PolarHBondContact O-SG 3.44Å; L241-C245 VanDerWaalsContact O-SG 3.42Å; L241-Y277 HydrophobicContact CD2-CE2 3.72Å; L241-F279 HydrophobicContact CD2-CB 3.86Å; L241-F279 HydrophobicContact CD2-CD1 3.52Å; L241-F279 HydrophobicContact CD2-CE1 4.21Å; L241-F279 HydrophobicContact CD2-CG 3.74Å; L241-F279 HydrophobicContact CG-CD1 3.93Å; L241-F279 HydrophobicContact CG-CE1 4.11Å; L241-F279 HydrophobicContact CG-CG 4.38Å
242	Q	94.5	Very high	86	Confident	61 Å²	61	55.9 Å²	55.9	29%	0.285	27%	0.269	S	S	.	.	H	α-helix	trans	-58.3	-47	178.6	-79.2	175.2	101.6	0	0	112.5	P238 S239 C245 I246 P252 F279	P238-Q242 WeakPolarHBondContact O-CB 3.4Å; P238-Q242 VanDerWaalsContact O-CG 3.31Å; P238-Q242 WeakPolarHBondContact O-CG 3.42Å; P238-Q242 PolarHBondContact O-N 2.95Å; P238-Q242 VanDerWaalsContact O-N 3.08Å; P238-Q242 PolarHBondContact O-NE2 3.18Å; S239-Q242 PolarHBondContact O-N 3.26Å; Q242-C245 PolarHBondContact O-N 3.23Å; Q242-I246 VanDerWaalsContact O-CG1 3.29Å; Q242-I246 WeakPolarHBondContact O-CG1 3.18Å; Q242-I246 PolarHBondContact O-N 2.86Å; Q242-P252 HydrophobicContact CG-CG 4.45Å; Q242-F279 HydrophobicContact CG-CD2 4.18Å; Q242-F279 HydrophobicContact CG-CE2 3.55Å; Q242-F279 HydrophobicContact CG-CZ 4.18Å
243	I	95.3	Very high	88.4	Confident	90 Å²	90	58.9 Å²	58.9	46%	0.462	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-43.7	178.7	-69	165.7	0	0	0	110.6	S239 R240 L241 C245 I246 K247	S239-I243 WeakPolarHBondContact O-CB 3.17Å; S239-I243 VanDerWaalsContact O-CG1 3.27Å; S239-I243 WeakPolarHBondContact O-CG1 3.46Å; S239-I243 PolarHBondContact O-N 3.45Å; R240-I243 PolarHBondContact O-N 3.35Å; L241-I243 PolarHBondContact O-N 3.01Å; I243-C245 VanDerWaalsContact C-N 3.32Å; I243-C245 PolarHBondContact O-N 2.86Å; I243-I246 PolarHBondContact O-N 3.2Å; I243-K247 HydrophobicContact CG2-CD 4.07Å; I243-K247 HydrophobicContact CG2-CG 4.42Å; I243-K247 WeakPolarHBondContact O-CB 3.5Å; I243-K247 WeakPolarHBondContact O-CG 3.19Å; I243-K247 PolarHBondContact O-N 3.13Å
244	A	95.1	Very high	90.4	Very high	3 Å²	3	56.9 Å²	56.9	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-40.1	178.8	0	0	0	0	0	112	W182 E183 L186 R240 L241 R248	W182-A244 HydrophobicContact CH2-CB 3.74Å; W182-A244 HydrophobicContact CZ3-CB 3.77Å; E183-A244 HydrophobicContact CG-CB 4.25Å; L186-A244 HydrophobicContact CD1-CB 3.77Å; R240-A244 VanDerWaalsContact O-CB 3.3Å; R240-A244 WeakPolarHBondContact O-CB 3.47Å; R240-A244 PolarHBondContact O-N 3.32Å; L241-A244 PolarHBondContact O-N 3.48Å; A244-R248 WeakPolarHBondContact O-CD 3.22Å; A244-R248 WeakPolarHBondContact O-CG 3.47Å; A244-R248 PolarHBondContact O-N 2.86Å; A244-R248 PolarHBondContact O-NH1 2.76Å
245	C	96.2	Very high	92.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-49.8	173.3	-76.6	0	0	0	0	112	L241 Q242 I243 K247 R248 G249 F250 F279	L241-C245 WeakPolarHBondContact O-CB 3.42Å; L241-C245 PolarHBondContact O-N 2.93Å; L241-C245 PolarHBondContact O-SG 3.44Å; L241-C245 VanDerWaalsContact O-SG 3.42Å; Q242-C245 PolarHBondContact O-N 3.23Å; I243-C245 VanDerWaalsContact C-N 3.32Å; I243-C245 PolarHBondContact O-N 2.86Å; C245-K247 VanDerWaalsContact C-N 3.33Å; C245-K247 PolarHBondContact O-N 2.87Å; C245-R248 CarbonylContact O-C 3.59Å; C245-R248 PolarHBondContact O-N 3.37Å; C245-G249 PolarHBondContact O-N 3.46Å; C245-F250 HydrophobicContact CB-CB 3.86Å; C245-F250 HydrophobicContact CB-CD2 4.38Å; C245-F250 HydrophobicContact CB-CG 4.42Å; C245-F250 WeakPolarHBondContact O-CB 3.06Å; C245-F250 PolarHBondContact O-N 3.02Å; C245-F279 HydrophobicContact CB-CE1 4.34Å; C245-F279 HydrophobicContact CB-CZ 4.25Å; C245-F279 VanDerWaalsContact SG-CE1 3.59Å
246	I	96.4	Very high	93.6	Very high	101 Å²	101	57.3 Å²	57.3	52%	0.518	27%	0.274	S	S	.	.	H	α-helix	trans	-57.9	-46.5	179.6	-69.3	164.8	0	0	0	111.1	Q242 I243 R248 G249 F250 P252	Q242-I246 VanDerWaalsContact O-CG1 3.29Å; Q242-I246 WeakPolarHBondContact O-CG1 3.18Å; Q242-I246 PolarHBondContact O-N 2.86Å; I243-I246 PolarHBondContact O-N 3.2Å; I246-R248 PolarHBondContact O-N 3.47Å; I246-R248 VanDerWaalsContact O-N 3.08Å; I246-G249 PolarHBondContact O-N 2.84Å; I246-G249 VanDerWaalsContact O-N 3.12Å; I246-F250 WeakPolarHBondContact CA-O 3.14Å; I246-P252 HydrophobicContact CD1-CG 4.02Å; I246-P252 HydrophobicContact CG1-CG 3.77Å
247	K	95.4	Very high	94.3	Very high	168 Å²	168	57.2 Å²	57.2	73%	0.73	27%	0.274	S	S	*	.	H	α-helix	trans	-59.4	-21.2	178.2	-75.6	178.2	177.3	-179.7	0	113.7	I243 C245	I243-K247 HydrophobicContact CG2-CD 4.07Å; I243-K247 HydrophobicContact CG2-CG 4.42Å; I243-K247 WeakPolarHBondContact O-CB 3.5Å; I243-K247 WeakPolarHBondContact O-CG 3.19Å; I243-K247 PolarHBondContact O-N 3.13Å; C245-K247 VanDerWaalsContact C-N 3.33Å; C245-K247 PolarHBondContact O-N 2.87Å
248	R	94.9	Very high	94.7	Very high	49 Å²	49	52.6 Å²	52.6	19%	0.185	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	10.7	-177.3	-68.8	172.1	172.7	78.3	-1.3	112.9	E183 N187 K190 A244 C245 I246 F250	E183-R248 PolarHBondContact O-NE 3.46Å; E183-R248 PolarHBondContact O-NH2 2.76Å; E183-R248 VanDerWaalsContact O-NH2 3.09Å; E183-R248 IonicContact OE2-NH1 3.77Å; E183-R248 IonicContact OE2-NH2 2.71Å; N187-R248 WeakPolarHBondContact OD1-CD 3.4Å; N187-R248 WeakPolarHBondContact OD1-CG 3.48Å; N187-R248 PolarHBondContact OD1-NE 3.03Å; N187-R248 VanDerWaalsContact OD1-NE 3.13Å; K190-R248 WeakPolarHBondContact CD-O 3.33Å; K190-R248 WeakPolarHBondContact CE-O 3.44Å; K190-R248 PolarHBondContact NZ-O 3.08Å; A244-R248 WeakPolarHBondContact O-CD 3.22Å; A244-R248 WeakPolarHBondContact O-CG 3.47Å; A244-R248 PolarHBondContact O-N 2.86Å; A244-R248 PolarHBondContact O-NH1 2.76Å; C245-R248 CarbonylContact O-C 3.59Å; C245-R248 PolarHBondContact O-N 3.37Å; I246-R248 PolarHBondContact O-N 3.47Å; I246-R248 VanDerWaalsContact O-N 3.08Å; R248-F250 HydrophobicContact CB-CD2 4.28Å
249	G	95.3	Very high	94.8	Very high	12 Å²	12	54.3 Å²	54.3	12%	0.124	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	26.8	177	0	0	0	0	0	114	C245 I246 I284 D285	C245-G249 PolarHBondContact O-N 3.46Å; I246-G249 PolarHBondContact O-N 2.84Å; I246-G249 VanDerWaalsContact O-N 3.12Å; G249-I284 WeakPolarHBondContact O-CG1 3.28Å; G249-I284 PolarHBondContact O-N 3.04Å; G249-D285 PolarHBondContact O-N 3.22Å
250	F	97.4	Very high	94.6	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	146.5	165.6	-69.8	-83.7	0	0	0	111.3	K190 L193 L199 C245 I246 R248 P252 A281 M282 K283	K190-F250 HydrophobicContact CB-CE2 3.68Å; K190-F250 HydrophobicContact CB-CZ 3.52Å; K190-F250 HydrophobicContact CD-CE2 4.38Å; K190-F250 HydrophobicContact CG-CE1 4.48Å; K190-F250 HydrophobicContact CG-CE2 3.92Å; K190-F250 HydrophobicContact CG-CZ 3.79Å; L193-F250 HydrophobicContact CD1-CE1 3.65Å; L193-F250 HydrophobicContact CD1-CZ 4.12Å; L199-F250 HydrophobicContact CB-CD1 4.41Å; L199-F250 HydrophobicContact CB-CE1 3.95Å; L199-F250 HydrophobicContact CD2-CE1 4.3Å; L199-F250 HydrophobicContact CD2-CZ 4.25Å; C245-F250 HydrophobicContact CB-CB 3.86Å; C245-F250 HydrophobicContact CB-CD2 4.38Å; C245-F250 HydrophobicContact CB-CG 4.42Å; C245-F250 WeakPolarHBondContact O-CB 3.06Å; C245-F250 PolarHBondContact O-N 3.02Å; I246-F250 WeakPolarHBondContact CA-O 3.14Å; R248-F250 HydrophobicContact CB-CD2 4.28Å; F250-P252 WeakPolarHBondContact O-CD 3.34Å; F250-A281 HydrophobicContact CB-CB 3.93Å; F250-A281 HydrophobicContact CD1-CB 4.26Å; F250-A281 HydrophobicContact CG-CB 4.42Å; F250-M282 CarbonylContact C-O 3.58Å; F250-M282 VanDerWaalsContact CA-O 3.29Å; F250-M282 WeakPolarHBondContact CA-O 3.36Å; F250-K283 HydrophobicContact CD1-CB 4.26Å; F250-K283 HydrophobicContact CE1-CB 4.1Å
251	Q	97.4	Very high	94.4	Very high	81 Å²	81	52 Å²	52	38%	0.379	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	109.6	169.6	-176	179.7	-1.4	0	0	109.9	A281 M282 I284	Q251-A281 CarbonylContact O-C 3.56Å; Q251-A281 VanDerWaalsContact O-CA 3.27Å; Q251-A281 WeakPolarHBondContact O-CA 3.42Å; Q251-M282 PolarHBondContact N-O 3.45Å; Q251-M282 PolarHBondContact O-N 2.76Å; Q251-I284 HydrophobicContact CB-CD1 4.17Å; Q251-I284 HydrophobicContact CB-CG1 4.37Å; Q251-I284 HydrophobicContact CB-CG2 3.68Å
252	P	97.4	Very high	94	Very high	38 Å²	38	55.8 Å²	55.8	25%	0.247	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	138.1	171.4	-31.1	38.5	0	0	0	113	Q242 I246 F250 F279	Q242-P252 HydrophobicContact CG-CG 4.45Å; I246-P252 HydrophobicContact CD1-CG 4.02Å; I246-P252 HydrophobicContact CG1-CG 3.77Å; F250-P252 WeakPolarHBondContact O-CD 3.34Å; P252-F279 HydrophobicContact CB-CE2 3.92Å; P252-F279 HydrophobicContact CB-CZ 4.15Å; P252-F279 HydrophobicContact CG-CE2 4.33Å; P252-F279 HydrophobicContact CG-CZ 4.18Å
253	R	96.3	Very high	93.7	Very high	150 Å²	150	60.9 Å²	60.9	57%	0.566	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	-52	-177.4	-61.4	-57.9	-62.2	173.5	-1.9	112.4	M198 S280 M282	M198-R253 HydrophobicContact CE-CB 4.41Å; M198-R253 HydrophobicContact CE-CG 4.08Å; M198-R253 HydrophobicContact SD-CG 4.46Å; R253-S280 PolarHBondContact N-O 3.17Å; R253-M282 HydrophobicContact CG-CB 4.17Å
254	Q	95.5	Very high	93.5	Very high	83 Å²	83	59.2 Å²	59.2	39%	0.388	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	144.3	-179.6	-173.4	173.7	-9.8	0	0	110.8	F69 S256 F279 S280	F69-Q254 HydrophobicContact CE2-CB 4.08Å; F69-Q254 HydrophobicContact CE2-CG 4.01Å; Q254-S256 PolarHBondContact NE2-OG 3.32Å; Q254-F279 CarbonylContact O-C 3.54Å; Q254-F279 WeakPolarHBondContact O-CA 3.34Å; Q254-F279 WeakPolarHBondContact O-CD2 3.27Å; Q254-S280 WeakPolarHBondContact CB-OG 3.35Å; Q254-S280 PolarHBondContact N-O 3.09Å; Q254-S280 PolarHBondContact N-OG 3.35Å; Q254-S280 PolarHBondContact O-N 2.99Å
255	L	95.7	Very high	93	Very high	49 Å²	49	65.3 Å²	65.3	26%	0.257	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	125.9	169.7	177.2	61.2	0	0	0	107.9	P238 L273 Y277 A278 F279	P238-L255 HydrophobicContact CB-CD1 4.1Å; P238-L255 HydrophobicContact CB-CD2 3.82Å; L255-L273 HydrophobicContact CD1-CD2 4.18Å; L255-L273 HydrophobicContact CD2-CD1 3.68Å; L255-L273 HydrophobicContact CG-CD1 4.02Å; L255-L273 HydrophobicContact CG-CD2 3.96Å; L255-Y277 HydrophobicContact CD1-CD2 3.64Å; L255-Y277 HydrophobicContact CD1-CE2 4.41Å; L255-Y277 HydrophobicContact CD1-CG 4.12Å; L255-A278 WeakPolarHBondContact CA-O 3.44Å; L255-F279 HydrophobicContact CB-CD2 4.49Å; L255-F279 HydrophobicContact CD1-CB 4.26Å; L255-F279 HydrophobicContact CD1-CD2 4.37Å
256	S	95	Very high	92.7	Very high	26 Å²	26	72.2 Å²	72.2	18%	0.182	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	139.5	-176.9	-61.1	0	0	0	0	110.3	Q254 Y277 A278	Q254-S256 PolarHBondContact NE2-OG 3.32Å; S256-Y277 CarbonylContact O-C 3.55Å; S256-Y277 WeakPolarHBondContact O-CA 3.14Å; S256-Y277 WeakPolarHBondContact O-CB 3.45Å; S256-A278 PolarHBondContact N-O 3.41Å; S256-A278 PolarHBondContact O-N 3.12Å
257	G	93.8	Very high	92.5	Very high	0 Å²	0	69 Å²	69	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	154.8	176.3	0	0	0	0	0	111.4	S270 N272 N276	G257-S270 VanDerWaalsContact CA-O 3.24Å; G257-S270 WeakPolarHBondContact CA-O 3.47Å; G257-S270 PolarHBondContact N-O 3.18Å; G257-S270 PolarHBondContact O-N 2.84Å; G257-N272 WeakPolarHBondContact CA-O 3.43Å; G257-N276 CarbonylContact C-O 3.59Å; G257-N276 VanDerWaalsContact CA-O 3.3Å; G257-N276 WeakPolarHBondContact CA-O 3.47Å
258	M	93	Very high	92.5	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	129.3	174.7	-56.9	-172.3	-62.8	0	0	110.1	M62 L65 T202 W267 W269 N276 A278	M62-M258 HydrophobicContact CE-CE 4.36Å; M62-M258 HydrophobicContact SD-CE 4.23Å; L65-M258 HydrophobicContact CD1-CB 4.27Å; L65-M258 HydrophobicContact CD1-CG 4.06Å; L65-M258 HydrophobicContact CD1-SD 4.14Å; T202-M258 HydrophobicContact CG2-CE 3.79Å; T202-M258 HydrophobicContact CG2-SD 4.33Å; M258-W267 HydrophobicContact CB-CE3 4.05Å; M258-W267 HydrophobicContact CB-CZ3 4.17Å; M258-W269 HydrophobicContact CG-CE3 3.98Å; M258-W269 HydrophobicContact CG-CH2 4.43Å; M258-W269 HydrophobicContact CG-CZ3 3.61Å; M258-W269 HydrophobicContact SD-CH2 4.32Å; M258-W269 HydrophobicContact SD-CZ3 4.05Å; M258-N276 HydrophobicContact CB-CB 4.22Å; M258-N276 HydrophobicContact CE-CB 4.32Å; M258-N276 PolarHBondContact N-O 3.44Å; M258-N276 PolarHBondContact O-ND2 3.17Å; M258-N276 VanDerWaalsContact O-ND2 3.15Å; M258-A278 HydrophobicContact CG-CB 4.46Å; M258-A278 HydrophobicContact SD-CB 4.07Å
259	L	90.7	Very high	92.5	Very high	48 Å²	48	66.4 Å²	66.4	25%	0.251	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.9	177.8	-63.3	177	0	0	0	109.9	W267 C268 S270 L275	L259-W267 CarbonylContact O-C 3.54Å; L259-W267 VanDerWaalsContact O-CA 3.29Å; L259-W267 WeakPolarHBondContact O-CA 3.46Å; L259-C268 PolarHBondContact N-O 2.82Å; L259-C268 PolarHBondContact O-N 3.38Å; L259-S270 WeakPolarHBondContact CD1-OG 3.33Å; L259-L275 HydrophobicContact CD2-CB 4.27Å; L259-L275 HydrophobicContact CD2-CD1 3.69Å; L259-L275 HydrophobicContact CD2-CG 4.27Å
260	Y	86.9	Confident	92.4	Very high	59 Å²	59	67.1 Å²	67.1	23%	0.231	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.9	171	-177.9	-109	0	0	0	109.9	Q57 P58 P262 R265 W267	Q57-Y260 PolarHBondContact OE1-OH 2.91Å; P58-Y260 HydrophobicContact CB-CE2 4.17Å; P58-Y260 HydrophobicContact CG-CE2 4.45Å; Y260-P262 HydrophobicContact CE1-CB 4.15Å; Y260-R265 WeakPolarHBondContact OH-CA 3.36Å; Y260-W267 AromaticContact CD2-CD1 3.68Å; Y260-W267 AromaticContact CD2-CD2 3.9Å; Y260-W267 HydrophobicContact CD2-CD2 3.9Å; Y260-W267 AromaticContact CD2-CE2 3.51Å; Y260-W267 HydrophobicContact CD2-CG 4Å; Y260-W267 HydrophobicContact CD2-CZ2 4.03Å; Y260-W267 AromaticContact CD2-NE1 3.38Å; Y260-W267 AromaticContact CE2-NE1 3.89Å; Y260-W267 HydrophobicContact CG-CD2 4.37Å; Y260-W267 HydrophobicContact CG-CZ2 4.14Å
261	N	87.5	Confident	92.1	Very high	71 Å²	71	72.7 Å²	72.7	38%	0.38	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	109.5	172.6	178.5	-18.2	0	0	0	109.4	L263 S264 R265 R266	N261-L263 VanDerWaalsContact C-N 3.29Å; N261-L263 PolarHBondContact O-N 3.04Å; N261-L263 WeakPolarHBondContact OD1-CB 3.3Å; N261-L263 PolarHBondContact OD1-N 3.24Å; N261-S264 WeakPolarHBondContact CB-OG 3.48Å; N261-S264 PolarHBondContact ND2-OG 3.1Å; N261-S264 PolarHBondContact O-N 2.72Å; N261-S264 PolarHBondContact OD1-N 3.27Å; N261-R265 VanDerWaalsContact O-CA 3.27Å; N261-R265 WeakPolarHBondContact O-CA 3.29Å; N261-R265 PolarHBondContact O-N 3.19Å; N261-R266 PolarHBondContact N-O 2.83Å; N261-R266 PolarHBondContact O-N 2.99Å
262	P	84.3	Confident	91.5	Very high	78 Å²	78	72.5 Å²	72.5	51%	0.506	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-25.8	-176.5	26.4	-34.4	0	0	0	113.7	Y260	Y260-P262 HydrophobicContact CE1-CB 4.15Å
263	L	88.2	Confident	91	Very high	168 Å²	168	73 Å²	73	88%	0.88	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-41.8	178.6	-65.2	175.2	0	0	0	111.9	N261	N261-L263 VanDerWaalsContact C-N 3.29Å; N261-L263 PolarHBondContact O-N 3.04Å; N261-L263 WeakPolarHBondContact OD1-CB 3.3Å; N261-L263 PolarHBondContact OD1-N 3.24Å
264	S	90.7	Very high	90	Very high	55 Å²	55	67.2 Å²	67.2	39%	0.385	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-6.4	177.7	59.7	0	0	0	0	113.6	N261 R266	N261-S264 WeakPolarHBondContact CB-OG 3.48Å; N261-S264 PolarHBondContact ND2-OG 3.1Å; N261-S264 PolarHBondContact O-N 2.72Å; N261-S264 PolarHBondContact OD1-N 3.27Å; S264-R266 WeakPolarHBondContact O-CG 3.45Å; S264-R266 PolarHBondContact O-N 3.01Å
265	R	86.1	Confident	89.1	Confident	132 Å²	132	64.5 Å²	64.5	50%	0.498	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	39.5	-174.3	-53.3	-176.3	-179.9	176.7	-3	113.4	D53 Q57 Y260 N261	D53-R265 IonicContact OD1-NH1 3.49Å; Q57-R265 PolarHBondContact NE2-O 3.16Å; Y260-R265 WeakPolarHBondContact OH-CA 3.36Å; N261-R265 VanDerWaalsContact O-CA 3.27Å; N261-R265 WeakPolarHBondContact O-CA 3.29Å; N261-R265 PolarHBondContact O-N 3.19Å
266	R	89.3	Confident	88.7	Confident	145 Å²	145	63.2 Å²	63.2	55%	0.547	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.9	-174.4	-76.5	173.8	-172.3	-163.2	2.9	111.2	N261 S264	N261-R266 PolarHBondContact N-O 2.83Å; N261-R266 PolarHBondContact O-N 2.99Å; S264-R266 WeakPolarHBondContact O-CG 3.45Å; S264-R266 PolarHBondContact O-N 3.01Å
267	W	92.6	Very high	88.6	Confident	32 Å²	32	62 Å²	62	12%	0.121	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	147.2	170.1	-67.4	88	0	0	0	111.5	P58 M62 L65 M258 L259 Y260	P58-W267 HydrophobicContact CB-CZ2 4.2Å; P58-W267 PolarHBondContact O-NE1 3.32Å; M62-W267 VanDerWaalsContact CA-CD1 3.45Å; M62-W267 HydrophobicContact CB-CD2 4.42Å; M62-W267 HydrophobicContact CB-CG 4.34Å; M62-W267 HydrophobicContact CE-CD2 4.32Å; M62-W267 HydrophobicContact CE-CE3 4.34Å; M62-W267 HydrophobicContact CE-CH2 3.35Å; M62-W267 HydrophobicContact CE-CZ2 3.32Å; M62-W267 HydrophobicContact CE-CZ3 3.88Å; M62-W267 HydrophobicContact CG-CD2 4.21Å; M62-W267 HydrophobicContact CG-CG 4.39Å; M62-W267 VanDerWaalsContact N-CD1 3.34Å; L65-W267 HydrophobicContact CD1-CB 3.57Å; L65-W267 HydrophobicContact CG-CB 3.84Å; M258-W267 HydrophobicContact CB-CE3 4.05Å; M258-W267 HydrophobicContact CB-CZ3 4.17Å; L259-W267 CarbonylContact O-C 3.54Å; L259-W267 VanDerWaalsContact O-CA 3.29Å; L259-W267 WeakPolarHBondContact O-CA 3.46Å; Y260-W267 AromaticContact CD2-CD1 3.68Å; Y260-W267 AromaticContact CD2-CD2 3.9Å; Y260-W267 HydrophobicContact CD2-CD2 3.9Å; Y260-W267 AromaticContact CD2-CE2 3.51Å; Y260-W267 HydrophobicContact CD2-CG 4Å; Y260-W267 HydrophobicContact CD2-CZ2 4.03Å; Y260-W267 AromaticContact CD2-NE1 3.38Å; Y260-W267 AromaticContact CE2-NE1 3.89Å; Y260-W267 HydrophobicContact CG-CD2 4.37Å; Y260-W267 HydrophobicContact CG-CZ2 4.14Å
268	C	94.5	Very high	88.7	Confident	63 Å²	63	62 Å²	62	43%	0.426	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.9	169.1	62.6	0	0	0	0	111.7	L259	L259-C268 PolarHBondContact N-O 2.82Å; L259-C268 PolarHBondContact O-N 3.38Å
269	W	95.9	Very high	88.9	Confident	100 Å²	100	62 Å²	62	38%	0.379	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	144.8	167.5	-68.3	117.4	0	0	0	110.5	L65 F69 M258 A278	L65-W269 HydrophobicContact CB-CH2 4.19Å; L65-W269 HydrophobicContact CB-CZ2 3.75Å; L65-W269 HydrophobicContact CD1-CD2 4.32Å; L65-W269 HydrophobicContact CD1-CE3 4.48Å; L65-W269 HydrophobicContact CD2-CD2 4.35Å; L65-W269 HydrophobicContact CD2-CG 4.3Å; F69-W269 HydrophobicContact CB-CH2 4.04Å; F69-W269 HydrophobicContact CB-CZ2 3.9Å; F69-W269 HydrophobicContact CD2-CH2 4.14Å; F69-W269 HydrophobicContact CD2-CZ2 4.43Å; F69-W269 HydrophobicContact CG-CH2 4.05Å; F69-W269 HydrophobicContact CG-CZ2 4.35Å; M258-W269 HydrophobicContact CG-CE3 3.98Å; M258-W269 HydrophobicContact CG-CH2 4.43Å; M258-W269 HydrophobicContact CG-CZ3 3.61Å; M258-W269 HydrophobicContact SD-CH2 4.32Å; M258-W269 HydrophobicContact SD-CZ3 4.05Å; W269-A278 HydrophobicContact CH2-CB 3.71Å; W269-A278 HydrophobicContact CZ3-CB 3.6Å
270	S	92.4	Very high	89.2	Confident	27 Å²	27	60 Å²	60	19%	0.189	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	151.2	179.3	-173.4	0	0	0	0	110.7	G257 L259 N272	G257-S270 VanDerWaalsContact CA-O 3.24Å; G257-S270 WeakPolarHBondContact CA-O 3.47Å; G257-S270 PolarHBondContact N-O 3.18Å; G257-S270 PolarHBondContact O-N 2.84Å; L259-S270 WeakPolarHBondContact CD1-OG 3.33Å; S270-N272 WeakPolarHBondContact OG-CB 3.46Å; S270-N272 PolarHBondContact OG-N 3.39Å
271	S	90.1	Very high	89.8	Confident	122 Å²	122	57.1 Å²	57.1	85%	0.853	30%	0.301	S	S	*	.	S	Bend	trans	-76.4	-16.1	165.1	55.4	0	0	0	0	112	L273	S271-L273 PolarHBondContact O-N 2.97Å
272	N	86.4	Confident	90.2	Very high	76 Å²	76	55.7 Å²	55.7	41%	0.406	29%	0.292	S	S	.	.			trans	-79.4	108.9	179.4	-173	-9.2	0	0	0	110.4	G257 S270 S274	G257-N272 WeakPolarHBondContact CA-O 3.43Å; S270-N272 WeakPolarHBondContact OG-CB 3.46Å; S270-N272 PolarHBondContact OG-N 3.39Å; N272-S274 VanDerWaalsContact C-N 3.32Å; N272-S274 VanDerWaalsContact CG-OG 3.25Å; N272-S274 PolarHBondContact ND2-OG 2.81Å; N272-S274 WeakPolarHBondContact OD1-CB 3.24Å; N272-S274 PolarHBondContact OD1-N 3.32Å; N272-S274 PolarHBondContact OD1-OG 3.49Å
273	L	85.9	Confident	90.9	Very high	50 Å²	50	52.1 Å²	52.1	26%	0.262	27%	0.269	S	S	.	.			trans	-81.6	-8.1	177.9	-57.6	178	0	0	0	113.3	N205 P238 L255 S271 L275	N205-L273 WeakPolarHBondContact CB-O 3.33Å; N205-L273 PolarHBondContact ND2-O 3.29Å; P238-L273 HydrophobicContact CB-CD1 4.32Å; P238-L273 HydrophobicContact CG-CB 4.19Å; P238-L273 HydrophobicContact CG-CD1 4.23Å; L255-L273 HydrophobicContact CD1-CD2 4.18Å; L255-L273 HydrophobicContact CD2-CD1 3.68Å; L255-L273 HydrophobicContact CG-CD1 4.02Å; L255-L273 HydrophobicContact CG-CD2 3.96Å; S271-L273 PolarHBondContact O-N 2.97Å; L273-L275 VanDerWaalsContact C-N 3.27Å; L273-L275 PolarHBondContact O-N 3.33Å; L273-L275 VanDerWaalsContact O-N 3.17Å
274	S	74.7	Confident	91.2	Very high	27 Å²	27	48.1 Å²	48.1	19%	0.189	25%	0.247	C	C	.	.	S	Bend	trans	-64	-22.9	-167	62.2	0	0	0	0	115.6	T207 N272	T207-S274 WeakPolarHBondContact CB-O 3.48Å; T207-S274 WeakPolarHBondContact CG2-O 3.32Å; T207-S274 PolarHBondContact OG1-O 2.92Å; N272-S274 VanDerWaalsContact C-N 3.32Å; N272-S274 VanDerWaalsContact CG-OG 3.25Å; N272-S274 PolarHBondContact ND2-OG 2.81Å; N272-S274 WeakPolarHBondContact OD1-CB 3.24Å; N272-S274 PolarHBondContact OD1-N 3.32Å; N272-S274 PolarHBondContact OD1-OG 3.49Å
275	L	78.3	Confident	91.1	Very high	27 Å²	27	50.1 Å²	50.1	14%	0.141	25%	0.254	C	S	.	.	S	Bend	trans	-102.1	-71.3	-177.6	-64	-174.2	0	0	0	111.9	I204 N205 A209 L213 L259 L273	I204-L275 CarbonylContact C-O 3.56Å; I204-L275 WeakPolarHBondContact CG2-O 3.33Å; N205-L275 PolarHBondContact N-O 2.97Å; A209-L275 HydrophobicContact CB-CD2 3.81Å; A209-L275 VanDerWaalsContact O-CD2 3.28Å; A209-L275 WeakPolarHBondContact O-CD2 3.41Å; L213-L275 HydrophobicContact CB-CD1 4.34Å; L213-L275 HydrophobicContact CB-CD2 4Å; L213-L275 HydrophobicContact CD1-CD1 4.03Å; L213-L275 HydrophobicContact CD1-CD2 4.11Å; L259-L275 HydrophobicContact CD2-CB 4.27Å; L259-L275 HydrophobicContact CD2-CD1 3.69Å; L259-L275 HydrophobicContact CD2-CG 4.27Å; L273-L275 VanDerWaalsContact C-N 3.27Å; L273-L275 PolarHBondContact O-N 3.33Å; L273-L275 VanDerWaalsContact O-N 3.17Å
276	N	86.8	Confident	90.7	Very high	22 Å²	22	53.1 Å²	53.1	12%	0.118	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.7	179.7	-40.3	-72.2	0	0	0	107.9	T203 I204 G257 M258	T203-N276 WeakPolarHBondContact O-CA 3.44Å; I204-N276 WeakPolarHBondContact CG1-OD1 3.29Å; G257-N276 CarbonylContact C-O 3.59Å; G257-N276 VanDerWaalsContact CA-O 3.3Å; G257-N276 WeakPolarHBondContact CA-O 3.47Å; M258-N276 HydrophobicContact CB-CB 4.22Å; M258-N276 HydrophobicContact CE-CB 4.32Å; M258-N276 PolarHBondContact N-O 3.44Å; M258-N276 PolarHBondContact O-ND2 3.17Å; M258-N276 VanDerWaalsContact O-ND2 3.15Å
277	Y	92.2	Very high	90.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	154.4	175.3	63	-89.2	0	0	0	111.9	T202 T203 N205 I236 P238 L241 L255 S256 F279	T202-Y277 WeakPolarHBondContact CA-O 3.05Å; T203-Y277 HydrophobicContact CG2-CD1 4.4Å; T203-Y277 HydrophobicContact CG2-CD2 4.49Å; T203-Y277 HydrophobicContact CG2-CE1 3.61Å; T203-Y277 HydrophobicContact CG2-CE2 3.69Å; T203-Y277 WeakPolarHBondContact CG2-OH 3.47Å; T203-Y277 PolarHBondContact N-O 3.14Å; T203-Y277 PolarHBondContact O-N 3.18Å; N205-Y277 HydrophobicContact CB-CD1 3.88Å; N205-Y277 HydrophobicContact CB-CE1 3.97Å; I236-Y277 VanDerWaalsContact O-CE1 3.29Å; I236-Y277 WeakPolarHBondContact O-CE1 3.37Å; I236-Y277 PolarHBondContact O-OH 3.12Å; I236-Y277 VanDerWaalsContact O-OH 3.07Å; P238-Y277 HydrophobicContact CG-CD1 3.75Å; P238-Y277 HydrophobicContact CG-CE1 3.73Å; P238-Y277 HydrophobicContact CG-CG 4.16Å; L241-Y277 HydrophobicContact CD2-CE2 3.72Å; L255-Y277 HydrophobicContact CD1-CD2 3.64Å; L255-Y277 HydrophobicContact CD1-CE2 4.41Å; L255-Y277 HydrophobicContact CD1-CG 4.12Å; S256-Y277 CarbonylContact O-C 3.55Å; S256-Y277 WeakPolarHBondContact O-CA 3.14Å; S256-Y277 WeakPolarHBondContact O-CB 3.45Å; Y277-F279 HydrophobicContact CD2-CB 4.2Å; Y277-F279 HydrophobicContact CE2-CB 4.25Å
278	A	95.8	Very high	90.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	136.2	166.1	0	0	0	0	0	109	F69 V201 T202 L255 S256 M258 W269	F69-A278 HydrophobicContact CD1-CB 4.14Å; F69-A278 HydrophobicContact CE1-CB 3.77Å; F69-A278 HydrophobicContact CE2-CB 4.48Å; F69-A278 HydrophobicContact CZ-CB 3.96Å; V201-A278 CarbonylContact O-C 3.57Å; V201-A278 WeakPolarHBondContact O-CA 3.31Å; T202-A278 HydrophobicContact CG2-CB 3.96Å; L255-A278 WeakPolarHBondContact CA-O 3.44Å; S256-A278 PolarHBondContact N-O 3.41Å; S256-A278 PolarHBondContact O-N 3.12Å; M258-A278 HydrophobicContact CG-CB 4.46Å; M258-A278 HydrophobicContact SD-CB 4.07Å; W269-A278 HydrophobicContact CH2-CB 3.71Å; W269-A278 HydrophobicContact CZ3-CB 3.6Å
279	F	97.1	Very high	90.4	Very high	1 Å²	1	48.7 Å²	48.7	0%	0.004	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	141.2	-178.7	172.3	-104.4	0	0	0	109.8	V201 L241 Q242 C245 P252 Q254 L255 Y277 A281	V201-F279 HydrophobicContact CB-CB 4.44Å; V201-F279 HydrophobicContact CB-CD1 4.45Å; V201-F279 HydrophobicContact CG2-CD1 4.48Å; V201-F279 PolarHBondContact N-O 3.22Å; V201-F279 PolarHBondContact O-N 3.32Å; L241-F279 HydrophobicContact CD2-CB 3.86Å; L241-F279 HydrophobicContact CD2-CD1 3.52Å; L241-F279 HydrophobicContact CD2-CE1 4.21Å; L241-F279 HydrophobicContact CD2-CG 3.74Å; L241-F279 HydrophobicContact CG-CD1 3.93Å; L241-F279 HydrophobicContact CG-CE1 4.11Å; L241-F279 HydrophobicContact CG-CG 4.38Å; Q242-F279 HydrophobicContact CG-CD2 4.18Å; Q242-F279 HydrophobicContact CG-CE2 3.55Å; Q242-F279 HydrophobicContact CG-CZ 4.18Å; C245-F279 HydrophobicContact CB-CE1 4.34Å; C245-F279 HydrophobicContact CB-CZ 4.25Å; C245-F279 VanDerWaalsContact SG-CE1 3.59Å; P252-F279 HydrophobicContact CB-CE2 3.92Å; P252-F279 HydrophobicContact CB-CZ 4.15Å; P252-F279 HydrophobicContact CG-CE2 4.33Å; P252-F279 HydrophobicContact CG-CZ 4.18Å; Q254-F279 CarbonylContact O-C 3.54Å; Q254-F279 WeakPolarHBondContact O-CA 3.34Å; Q254-F279 WeakPolarHBondContact O-CD2 3.27Å; L255-F279 HydrophobicContact CB-CD2 4.49Å; L255-F279 HydrophobicContact CD1-CB 4.26Å; L255-F279 HydrophobicContact CD1-CD2 4.37Å; Y277-F279 HydrophobicContact CD2-CB 4.2Å; Y277-F279 HydrophobicContact CE2-CB 4.25Å; F279-A281 HydrophobicContact CE1-CB 3.72Å; F279-A281 HydrophobicContact CZ-CB 3.69Å
280	S	98	Very high	90.1	Very high	4 Å²	4	45.6 Å²	45.6	3%	0.028	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	146.8	169.9	64.5	0	0	0	0	112	L199 R253 Q254	L199-S280 CarbonylContact O-C 3.52Å; L199-S280 WeakPolarHBondContact O-CA 2.78Å; R253-S280 PolarHBondContact N-O 3.17Å; Q254-S280 WeakPolarHBondContact CB-OG 3.35Å; Q254-S280 PolarHBondContact N-O 3.09Å; Q254-S280 PolarHBondContact N-OG 3.35Å; Q254-S280 PolarHBondContact O-N 2.99Å
281	A	98	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	150	176.5	0	0	0	0	0	111.3	L199 F250 Q251 F279	L199-A281 PolarHBondContact N-O 2.92Å; L199-A281 PolarHBondContact O-N 2.93Å; F250-A281 HydrophobicContact CB-CB 3.93Å; F250-A281 HydrophobicContact CD1-CB 4.26Å; F250-A281 HydrophobicContact CG-CB 4.42Å; Q251-A281 CarbonylContact O-C 3.56Å; Q251-A281 VanDerWaalsContact O-CA 3.27Å; Q251-A281 WeakPolarHBondContact O-CA 3.42Å; F279-A281 HydrophobicContact CE1-CB 3.72Å; F279-A281 HydrophobicContact CZ-CB 3.69Å
282	M	98	Very high	90	Very high	40 Å²	40	41.8 Å²	41.8	20%	0.197	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.5	179.8	-169.8	174.8	80.9	0	0	109.9	D196 G197 M198 F250 Q251 R253 I284	D196-M282 HydrophobicContact CB-SD 4.43Å; G197-M282 WeakPolarHBondContact O-CA 3.13Å; M198-M282 HydrophobicContact SD-CB 3.72Å; M198-M282 HydrophobicContact SD-CG 3.93Å; F250-M282 CarbonylContact C-O 3.58Å; F250-M282 VanDerWaalsContact CA-O 3.29Å; F250-M282 WeakPolarHBondContact CA-O 3.36Å; Q251-M282 PolarHBondContact N-O 3.45Å; Q251-M282 PolarHBondContact O-N 2.76Å; R253-M282 HydrophobicContact CG-CB 4.17Å; M282-I284 HydrophobicContact CE-CG2 3.63Å; M282-I284 PolarHBondContact O-N 3.25Å
283	K	97.7	Very high	90.2	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.017	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	119.5	171.8	177.6	175.5	173.1	178.3	0	109.3	K190 L193 D196 G197 F250 D285	K190-K283 HydrophobicContact CG-CD 3.79Å; K190-K283 HydrophobicContact CG-CG 4.12Å; K190-K283 WeakPolarHBondContact O-CD 2.85Å; K190-K283 PolarHBondContact O-NZ 3.13Å; L193-K283 HydrophobicContact CB-CB 4.45Å; L193-K283 HydrophobicContact CB-CD 3.84Å; L193-K283 HydrophobicContact CD1-CB 4.48Å; L193-K283 PolarHBondContact O-NZ 3.22Å; D196-K283 WeakPolarHBondContact CA-O 3.29Å; D196-K283 PolarHBondContact N-O 3.26Å; G197-K283 PolarHBondContact O-N 2.92Å; F250-K283 HydrophobicContact CD1-CB 4.26Å; F250-K283 HydrophobicContact CE1-CB 4.1Å; K283-D285 WeakPolarHBondContact CE-O 3.38Å; K283-D285 VanDerWaalsContact CG-O 3.32Å; K283-D285 WeakPolarHBondContact CG-O 3.14Å
284	I	95.8	Very high	90.5	Very high	83 Å²	83	38.5 Å²	38.5	43%	0.426	20%	0.197	S	C	.	.			trans	-114	-8.5	-177.7	57.1	161.4	0	0	0	113.9	G249 Q251 M282	G249-I284 WeakPolarHBondContact O-CG1 3.28Å; G249-I284 PolarHBondContact O-N 3.04Å; Q251-I284 HydrophobicContact CB-CD1 4.17Å; Q251-I284 HydrophobicContact CB-CG1 4.37Å; Q251-I284 HydrophobicContact CB-CG2 3.68Å; M282-I284 HydrophobicContact CE-CG2 3.63Å; M282-I284 PolarHBondContact O-N 3.25Å
285	D	87.9	Confident	91.9	Very high	98 Å²	98	39.5 Å²	39.5	52%	0.524	20%	0.197	S	C	.	.			trans	-139.2	158.2	-178.4	-168	10.9	0	0	0	109.7	K190 G249 K283	K190-D285 WeakPolarHBondContact CE-O 3.44Å; K190-D285 PolarHBondContact NZ-O 3.06Å; G249-D285 PolarHBondContact O-N 3.22Å; K283-D285 WeakPolarHBondContact CE-O 3.38Å; K283-D285 VanDerWaalsContact CG-O 3.32Å; K283-D285 WeakPolarHBondContact CG-O 3.14Å
286	E	77	Confident	93.1	Very high	195 Å²	195	40.6 Å²	40.6	91%	0.911	20%	0.202	S	C	*	.			trans	-67.5	0	175.5	-69.7	-172.3	167.8	0	0	111.9	K190	K190-E286 VanDerWaalsContact CE-OXT 3.28Å; K190-E286 WeakPolarHBondContact CE-OXT 3.11Å; K190-E286 PolarHBondContact NZ-O 3Å; K190-E286 PolarHBondContact NZ-OXT 3.14Å

Retrieved 286 of 286 residues in 66.2 ms (Link to these results)

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