A0A075Q3S5_DROME Loading...

NADH dehydrogenase [ubiquinone] 1 alpha subcomplex subunit 9, mitochondrial

AlphaFold DB (Q9VPE2), UniProt , Accession A0A075Q3S5, Species DROME (Drosophila melanogaster, Fruit fly), Gene CG6020-RA, Length 416 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	40.9	Very low	34.5	Very low	252 Å²	252	159.5 Å²	159.5	100%	1.241	86%	0.858	S	S	*	*				0	65.2	0	-78.7	-76.6	-105.4	0	0	110
2	A	32	Very low	34.5	Very low	103 Å²	103	158.8 Å²	158.8	85%	0.851	85%	0.852	S	S	*	*			trans	-146.5	132.7	174.7	0	0	0	0	0	108.8
3	A	36.6	Very low	34.7	Very low	89 Å²	89	154.5 Å²	154.5	74%	0.736	85%	0.853	S	S	*	*			trans	-68	162.4	-176.9	0	0	0	0	0	112.8
4	I	33.3	Very low	34.6	Very low	165 Å²	165	157.4 Å²	157.4	85%	0.846	85%	0.852	S	S	*	*			trans	-159.7	126.6	138.6	-91.6	139.9	0	0	0	109.1	L6	I4-L6 HydrophobicContact CG2-CD1 4.5Å
5	V	35.3	Very low	34.6	Very low	128 Å²	128	159.7 Å²	159.7	78%	0.776	85%	0.854	S	S	*	*			trans	-65.5	143.7	168.7	171.4	0	0	0	0	109.7
6	L	33.5	Very low	34.6	Very low	156 Å²	156	161.6 Å²	161.6	82%	0.817	86%	0.856	S	S	*	*			trans	-164.1	137.8	145.4	-103.1	148.5	0	0	0	114.2	I4	I4-L6 HydrophobicContact CG2-CD1 4.5Å
7	T	33.2	Very low	34.8	Very low	118 Å²	118	155.7 Å²	155.7	72%	0.724	84%	0.843	S	S	*	*			trans	-47.5	138.5	-177.7	45.2	0	0	0	0	118.1	N9	T7-N9 PolarHBondContact O-N 3.4Å
8	R	31.1	Very low	34.9	Very low	239 Å²	239	154.6 Å²	154.6	90%	0.902	85%	0.849	S	S	*	*	S	Bend	trans	2.3	98.6	153.1	-70.1	179.1	174	177.1	-2.1	116.3
9	N	34.5	Very low	35	Very low	151 Å²	151	149.7 Å²	149.7	81%	0.807	84%	0.838	S	S	*	*			trans	166.2	73	137.4	-81.9	-22.9	0	0	0	109.7	T7	T7-N9 PolarHBondContact O-N 3.4Å
10	L	33.6	Very low	35	Very low	152 Å²	152	149.8 Å²	149.8	80%	0.796	84%	0.842	S	S	*	*			trans	-153.2	111.6	165.6	-113.2	121.7	0	0	0	109.5	L12	L10-L12 HydrophobicContact CD2-CD1 4.29Å
11	Q	35.4	Very low	34.9	Very low	202 Å²	202	148.6 Å²	148.6	94%	0.944	84%	0.838	S	S	*	*			trans	-99.5	126.6	162.6	-81.9	-169.5	-23.8	0	0	108.2
12	L	34.9	Very low	34.6	Very low	150 Å²	150	139.9 Å²	139.9	79%	0.785	81%	0.812	S	S	*	*			trans	-113.3	109.6	-178.7	-125.2	147.9	0	0	0	107.5	L10	L10-L12 HydrophobicContact CD2-CD1 4.29Å
13	A	37.3	Very low	34.9	Very low	104 Å²	104	140.8 Å²	140.8	86%	0.86	81%	0.807	S	S	*	*			trans	-93.3	121.9	171.5	0	0	0	0	0	109.3
14	K	32.4	Very low	34.8	Very low	194 Å²	194	143.2 Å²	143.2	84%	0.843	81%	0.807	S	S	*	*			trans	-88.5	131.6	174.5	-82.1	-179.7	173.6	178.4	0	109.8
15	H	35.7	Very low	34.8	Very low	192 Å²	192	141 Å²	141	89%	0.889	81%	0.805	S	S	*	*			trans	-125.3	136.6	156.7	-122.9	-83.8	0	0	0	110
16	H	34.2	Very low	34.8	Very low	190 Å²	190	142 Å²	142	88%	0.88	81%	0.805	S	S	*	*			trans	-63.7	136	-176.6	-84.9	26.8	0	0	0	112.3
17	G	38.3	Very low	34.9	Very low	62 Å²	62	145 Å²	145	64%	0.639	81%	0.806	S	S	*	*	S	Bend	trans	145.2	96.6	172.9	0	0	0	0	0	111	G19	G17-G19 PolarHBondContact O-N 2.79Å
18	S	35.5	Very low	35	Very low	135 Å²	135	142.4 Å²	142.4	94%	0.944	80%	0.802	S	S	*	*	S	Bend	trans	4.6	93.9	161.8	53.9	0	0	0	0	116.8
19	G	38.1	Very low	35.1	Very low	62 Å²	62	141.6 Å²	141.6	64%	0.639	80%	0.8	S	S	*	*			trans	146.6	96.3	171.3	0	0	0	0	0	112.2	G17 V21	G17-G19 PolarHBondContact O-N 2.79Å; G19-V21 VanDerWaalsContact C-N 3.33Å; G19-V21 PolarHBondContact O-N 3.36Å
20	V	34.4	Very low	35.1	Very low	151 Å²	151	138.3 Å²	138.3	92%	0.915	79%	0.789	S	S	*	*			trans	-79.4	85.2	174.1	-176.5	0	0	0	0	108.4
21	V	32.9	Very low	35.2	Very low	126 Å²	126	136.3 Å²	136.3	76%	0.764	80%	0.795	S	S	*	*			trans	-95.5	94.5	163	-178.5	0	0	0	0	107.2	G19 V23	G19-V21 VanDerWaalsContact C-N 3.33Å; G19-V21 PolarHBondContact O-N 3.36Å; V21-V23 HydrophobicContact CG1-CG2 4.38Å; V21-V23 PolarHBondContact O-N 3.17Å
22	G	35.2	Very low	35.2	Very low	68 Å²	68	131.4 Å²	131.4	70%	0.701	79%	0.789	S	S	*	*			trans	-73.9	101.5	172.2	0	0	0	0	0	110	L24	G22-L24 PolarHBondContact O-N 3.14Å; G22-L24 VanDerWaalsContact O-N 3.14Å
23	V	37.4	Very low	35.4	Very low	123 Å²	123	127.8 Å²	127.8	75%	0.745	78%	0.78	S	S	*	*			trans	-76.1	99.4	170.3	-178.9	0	0	0	0	108.2	V21 C25	V21-V23 HydrophobicContact CG1-CG2 4.38Å; V21-V23 PolarHBondContact O-N 3.17Å; V23-C25 PolarHBondContact O-N 3.17Å
24	L	33.7	Very low	35.8	Very low	140 Å²	140	127 Å²	127	73%	0.733	77%	0.773	S	S	*	*			trans	-80.5	91.8	175	-156.3	95	0	0	0	108.8	G22 L26	G22-L24 PolarHBondContact O-N 3.14Å; G22-L24 VanDerWaalsContact O-N 3.14Å; L24-L26 VanDerWaalsContact C-N 3.31Å; L24-L26 HydrophobicContact CD2-CD1 3.88Å; L24-L26 HydrophobicContact CD2-CD2 4.29Å; L24-L26 HydrophobicContact CD2-CG 3.77Å; L24-L26 PolarHBondContact O-N 2.9Å
25	C	34.6	Very low	36.7	Very low	119 Å²	119	122 Å²	122	80%	0.804	76%	0.761	S	S	*	*			trans	-72.4	87.2	169.7	-93	0	0	0	0	109.9	V23 R27	V23-C25 PolarHBondContact O-N 3.17Å; C25-R27 PolarHBondContact O-N 2.98Å
26	L	35.3	Very low	37.2	Very low	147 Å²	147	117.9 Å²	117.9	77%	0.77	75%	0.752	S	S	*	*			trans	-68.7	105	166.1	-81	160.7	0	0	0	108.8	L24 G28	L24-L26 VanDerWaalsContact C-N 3.31Å; L24-L26 HydrophobicContact CD2-CD1 3.88Å; L24-L26 HydrophobicContact CD2-CD2 4.29Å; L24-L26 HydrophobicContact CD2-CG 3.77Å; L24-L26 PolarHBondContact O-N 2.9Å; L26-G28 PolarHBondContact O-N 2.94Å
27	R	35	Very low	38.2	Very low	221 Å²	221	118.7 Å²	118.7	83%	0.834	76%	0.755	S	S	*	*			trans	-73.6	82.1	167.5	-148	178	-167	175.6	3.4	107.9	C25 Y29	C25-R27 PolarHBondContact O-N 2.98Å; R27-Y29 PolarHBondContact O-N 3.41Å
28	G	35.1	Very low	39.2	Very low	62 Å²	62	123.7 Å²	123.7	64%	0.639	77%	0.768	S	S	*	*			trans	-64.4	110.4	174.7	0	0	0	0	0	110.1	L26 S30	L26-G28 PolarHBondContact O-N 2.94Å; G28-S30 PolarHBondContact O-N 3.4Å
29	Y	32.7	Very low	40.2	Very low	222 Å²	222	118.8 Å²	118.8	87%	0.871	74%	0.739	S	S	*	*			trans	-72.5	80	160.1	-83	-87.9	0	0	0	107.8	R27 A31	R27-Y29 PolarHBondContact O-N 3.41Å; Y29-A31 PolarHBondContact O-N 2.95Å
30	S	34.6	Very low	41	Very low	82 Å²	82	122 Å²	122	57%	0.573	75%	0.748	S	S	*	*			trans	-80.6	106.8	165.8	47	0	0	0	0	108.3	G28 A32 A33	G28-S30 PolarHBondContact O-N 3.4Å; S30-A32 PolarHBondContact O-N 3.2Å; S30-A33 PolarHBondContact O-N 3.21Å
31	A	35.6	Very low	42	Very low	111 Å²	111	125.6 Å²	125.6	92%	0.917	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	68.1	166.9	0	0	0	0	0	110.1	Y29	Y29-A31 PolarHBondContact O-N 2.95Å
32	A	36.6	Very low	42.8	Very low	99 Å²	99	124.5 Å²	124.5	82%	0.818	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.1	8.7	168.9	0	0	0	0	0	113.4	S30 A34	S30-A32 PolarHBondContact O-N 3.2Å; A32-A34 PolarHBondContact O-N 3.01Å
33	A	38.8	Very low	43.5	Very low	73 Å²	73	127.2 Å²	127.2	60%	0.603	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-80.1	118	-176.5	0	0	0	0	0	112.1	S30	S30-A33 PolarHBondContact O-N 3.21Å
34	A	46.7	Very low	44.1	Very low	87 Å²	87	131.6 Å²	131.6	72%	0.719	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-51.3	140.7	168.8	0	0	0	0	0	110.9	A32	A32-A34 PolarHBondContact O-N 3.01Å
35	P	49.4	Very low	45.2	Very low	91 Å²	91	127.8 Å²	127.8	59%	0.591	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.5	178.6	26.4	-31.1	0	0	0	110	E37	P35-E37 PolarHBondContact O-N 3.2Å
36	P	47.7	Very low	46.6	Very low	105 Å²	105	128.3 Å²	128.3	68%	0.682	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-56.3	137	174	24.2	-31.4	0	0	0	109.4	D38 G39	P36-D38 PolarHBondContact O-N 3.19Å; P36-G39 PolarHBondContact O-N 3.32Å; P36-G39 VanDerWaalsContact O-N 3.08Å
37	E	55.1	Low	48.3	Very low	206 Å²	206	124.7 Å²	124.7	96%	0.963	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-13.6	-171.2	-69.6	-164.6	147.3	0	0	114.5	P35	P35-E37 PolarHBondContact O-N 3.2Å
38	D	58.3	Low	50.1	Low	168 Å²	168	115.5 Å²	115.5	90%	0.898	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	8.8	-176.7	-120.7	-6	0	0	0	114.8	P36	P36-D38 PolarHBondContact O-N 3.19Å
39	G	57.3	Low	51.9	Low	32 Å²	32	114.9 Å²	114.9	33%	0.33	67%	0.669	S	S	.	*	S	Bend	trans	-83.8	151.1	172.1	0	0	0	0	0	112.5	P36 R41	P36-G39 PolarHBondContact O-N 3.32Å; P36-G39 VanDerWaalsContact O-N 3.08Å; G39-R41 PolarHBondContact O-N 3.35Å
40	P	54.1	Low	53.8	Low	130 Å²	130	107.3 Å²	107.3	84%	0.844	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-57.1	117.9	171.4	23.8	-31.4	0	0	0	108.8	P42	P40-P42 VanDerWaalsContact O-N 3.16Å
41	R	55.4	Low	56	Low	226 Å²	226	105.9 Å²	105.9	85%	0.853	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-55.3	122.8	-179.3	-66.4	-177.7	-172.3	-175.9	1.9	108.5	G39 L43	G39-R41 PolarHBondContact O-N 3.35Å; R41-L43 PolarHBondContact O-N 3.27Å
42	P	51.2	Low	58.3	Low	102 Å²	102	108 Å²	108	66%	0.662	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-58.7	128.4	175.9	23.1	-31.4	0	0	0	108.8	P40 K44	P40-P42 VanDerWaalsContact O-N 3.16Å; P42-K44 PolarHBondContact O-N 3.33Å
43	L	47.9	Very low	60.6	Low	125 Å²	125	112.6 Å²	112.6	65%	0.654	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-62.8	120.8	177.6	-68.3	172.3	0	0	0	108.3	R41 T45 M51	R41-L43 PolarHBondContact O-N 3.27Å; L43-T45 PolarHBondContact O-N 2.95Å; L43-T45 VanDerWaalsContact O-N 3.12Å; L43-M51 HydrophobicContact CD1-CE 4.15Å; L43-M51 HydrophobicContact CD2-CE 4.45Å
44	K	51.1	Low	62.9	Low	215 Å²	215	112.2 Å²	112.2	94%	0.935	63%	0.625	S	S	*	*	S	Bend	trans	-58.6	-24.6	180	-71	-174.9	177	-176.7	0	112.8	P42	P42-K44 PolarHBondContact O-N 3.33Å
45	T	56.2	Low	64.8	Low	61 Å²	61	115.4 Å²	115.4	37%	0.374	64%	0.636	S	S	.	*			trans	-145	138.5	175.2	47.9	0	0	0	0	108.3	L43 A50 M51	L43-T45 PolarHBondContact O-N 2.95Å; L43-T45 VanDerWaalsContact O-N 3.12Å; T45-A50 HydrophobicContact CG2-CB 4.04Å; T45-M51 WeakPolarHBondContact O-CE 3.47Å
46	T	64.2	Low	66.4	Low	129 Å²	129	113.4 Å²	113.4	79%	0.791	63%	0.632	S	S	*	*			trans	-94.5	-8.6	171.1	49.2	0	0	0	0	112.3	P48	T46-P48 WeakPolarHBondContact O-CD 3.49Å
47	N	72.4	Confident	68.5	Low	71 Å²	71	109.7 Å²	109.7	38%	0.38	61%	0.612	S	S	.	*			trans	-77.1	116.6	177.5	-171.2	-21.9	0	0	0	109.7	A49 A50	N47-A49 PolarHBondContact O-N 3.41Å; N47-A49 WeakPolarHBondContact OD1-CB 3.4Å; N47-A49 PolarHBondContact OD1-N 3.03Å; N47-A50 PolarHBondContact O-N 3.12Å; N47-A50 VanDerWaalsContact O-N 3.09Å
48	P	71.9	Confident	70.3	Confident	28 Å²	28	105.4 Å²	105.4	18%	0.182	59%	0.587	C	S	.	*	G	3₁₀ helix	trans	-58.1	-31.8	-179.8	24.2	-34.5	0	0	0	112.6	T46 A50 M51 F61 G63 V65	T46-P48 WeakPolarHBondContact O-CD 3.49Å; P48-A50 PolarHBondContact O-N 3.12Å; P48-M51 WeakPolarHBondContact O-CB 3.23Å; P48-M51 PolarHBondContact O-N 3.35Å; P48-F61 HydrophobicContact CB-CE1 4.44Å; P48-F61 HydrophobicContact CB-CZ 4.15Å; P48-G63 CarbonylContact C-O 3.57Å; P48-G63 VanDerWaalsContact C-O 3.32Å; P48-G63 WeakPolarHBondContact O-CA 3.15Å; P48-V65 HydrophobicContact CB-CG2 3.84Å; P48-V65 HydrophobicContact CG-CG2 4.21Å
49	A	72.7	Confident	71.9	Confident	49 Å²	49	101.9 Å²	101.9	41%	0.405	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-59.9	-32.6	178.9	0	0	0	0	0	112.5	N47 M51 G63	N47-A49 PolarHBondContact O-N 3.41Å; N47-A49 WeakPolarHBondContact OD1-CB 3.4Å; N47-A49 PolarHBondContact OD1-N 3.03Å; A49-M51 VanDerWaalsContact C-N 3.27Å; A49-M51 PolarHBondContact O-N 3.34Å; A49-G63 WeakPolarHBondContact CA-O 3.37Å; A49-G63 PolarHBondContact N-O 3.38Å
50	A	73.1	Confident	73.5	Confident	64 Å²	64	100.8 Å²	100.8	53%	0.529	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-78	-9.4	178	0	0	0	0	0	113.5	T45 N47 P48	T45-A50 HydrophobicContact CG2-CB 4.04Å; N47-A50 PolarHBondContact O-N 3.12Å; N47-A50 VanDerWaalsContact O-N 3.09Å; P48-A50 PolarHBondContact O-N 3.12Å
51	M	79.7	Confident	75.3	Confident	51 Å²	51	96.4 Å²	96.4	25%	0.251	53%	0.531	S	S	.	.	G	3₁₀ helix	trans	-97	13.2	-178	-61.5	-174.1	-169.1	0	0	113.5	L43 T45 P48 A49 R53 F61	L43-M51 HydrophobicContact CD1-CE 4.15Å; L43-M51 HydrophobicContact CD2-CE 4.45Å; T45-M51 WeakPolarHBondContact O-CE 3.47Å; P48-M51 WeakPolarHBondContact O-CB 3.23Å; P48-M51 PolarHBondContact O-N 3.35Å; A49-M51 VanDerWaalsContact C-N 3.27Å; A49-M51 PolarHBondContact O-N 3.34Å; M51-R53 WeakPolarHBondContact O-CG 3.27Å; M51-R53 PolarHBondContact O-N 3.19Å; M51-F61 HydrophobicContact CB-CD1 4.13Å; M51-F61 HydrophobicContact CB-CE1 3.91Å; M51-F61 WeakPolarHBondContact O-CD1 3.43Å
52	K	84	Confident	76.9	Confident	155 Å²	155	87 Å²	87	67%	0.674	50%	0.497	S	S	*	.			trans	-52.4	123.9	179	-176.7	176.1	179.1	-174.8	0	111.2	F61	K52-F61 CarbonylContact C-O 3.58Å; K52-F61 VanDerWaalsContact CA-O 3.3Å; K52-F61 WeakPolarHBondContact CA-O 2.98Å
53	R	85.7	Confident	78.8	Confident	197 Å²	197	82.1 Å²	82.1	74%	0.743	47%	0.466	S	S	*	.	B	Isolated β-bridge	trans	-140.4	141.5	-177.4	-74.7	177.9	-174.7	-176.5	3.7	111.3	M51 S60 F61	M51-R53 WeakPolarHBondContact O-CG 3.27Å; M51-R53 PolarHBondContact O-N 3.19Å; R53-S60 WeakPolarHBondContact O-CB 3.36Å; R53-F61 PolarHBondContact N-O 2.83Å; R53-F61 PolarHBondContact O-N 3.2Å; R53-F61 VanDerWaalsContact O-O 3.13Å
54	G	86.6	Confident	80.9	Confident	65 Å²	65	77.1 Å²	77.1	67%	0.67	44%	0.44	S	S	*	.	S	Bend	trans	94.9	174.3	175.8	0	0	0	0	0	114.3	G56	G54-G56 VanDerWaalsContact C-N 3.27Å; G54-G56 PolarHBondContact O-N 3.44Å
55	T	86.6	Confident	83	Confident	154 Å²	154	67.2 Å²	67.2	95%	0.945	40%	0.397	S	S	*	.	S	Bend	trans	-81.8	-0.8	-174	49.3	0	0	0	0	114.2
56	G	84.4	Confident	84.9	Confident	49 Å²	49	64.3 Å²	64.3	51%	0.505	38%	0.379	S	S	.	.	S	Bend	trans	88.4	138.2	-165.9	0	0	0	0	0	111.3	G54 S60	G54-G56 VanDerWaalsContact C-N 3.27Å; G54-G56 PolarHBondContact O-N 3.44Å; G56-S60 VanDerWaalsContact CA-OG 3.32Å; G56-S60 WeakPolarHBondContact CA-OG 3.43Å
57	G	90.2	Very high	86.5	Confident	26 Å²	26	58.1 Å²	58.1	27%	0.268	34%	0.342	S	S	.	.	S	Bend	trans	133.5	-176.5	-175	0	0	0	0	0	112.5	S59 S60 K85 S86 G87	G57-S59 PolarHBondContact O-N 3.41Å; G57-S60 PolarHBondContact N-OG 3.41Å; G57-S60 PolarHBondContact O-N 2.93Å; G57-S60 PolarHBondContact O-OG 2.89Å; G57-K85 CarbonylContact C-O 3.54Å; G57-K85 WeakPolarHBondContact CA-O 3.45Å; G57-S86 CarbonylContact O-C 3.4Å; G57-G87 WeakPolarHBondContact O-CA 3.41Å; G57-G87 PolarHBondContact O-N 3.48Å
58	R	92.5	Very high	87.8	Confident	116 Å²	116	54.8 Å²	54.8	44%	0.438	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-43.5	-172.8	-175.7	-175	173.9	103	-2.6	113.8	K85 V106 G108 D109	R58-K85 PolarHBondContact N-O 3.08Å; R58-V106 PolarHBondContact NH1-O 2.91Å; R58-V106 PolarHBondContact NH2-O 2.94Å; R58-G108 PolarHBondContact NH2-O 2.95Å; R58-D109 HydrophobicContact CG-CB 4.25Å
59	S	92.3	Very high	89	Confident	94 Å²	94	53.4 Å²	53.4	66%	0.657	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	8.7	-176.6	-53.1	0	0	0	0	113.6	G57 D109	G57-S59 PolarHBondContact O-N 3.41Å; S59-D109 WeakPolarHBondContact CA-OD2 3.43Å; S59-D109 WeakPolarHBondContact CB-OD2 3.3Å; S59-D109 PolarHBondContact OG-OD2 3.47Å
60	S	92.1	Very high	90.1	Very high	10 Å²	10	51.8 Å²	51.8	7%	0.07	30%	0.303	C	S	.	.	S	Bend	trans	-87.8	166	172.9	71.4	0	0	0	0	110.7	R53 G56 G57 S86 G87	R53-S60 WeakPolarHBondContact O-CB 3.36Å; G56-S60 VanDerWaalsContact CA-OG 3.32Å; G56-S60 WeakPolarHBondContact CA-OG 3.43Å; G57-S60 PolarHBondContact N-OG 3.41Å; G57-S60 PolarHBondContact O-N 2.93Å; G57-S60 PolarHBondContact O-OG 2.89Å; S60-S86 PolarHBondContact OG-O 3.31Å; S60-G87 CarbonylContact O-C 3.51Å; S60-G87 WeakPolarHBondContact O-CA 3.44Å; S60-G87 VanDerWaalsContact O-O 3.13Å
61	F	91.3	Very high	91.2	Very high	38 Å²	38	48.8 Å²	48.8	17%	0.167	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-120	117.1	168.1	-176	-120.1	0	0	0	109.3	P48 M51 K52 R53 G63 V65 G87 Q89	P48-F61 HydrophobicContact CB-CE1 4.44Å; P48-F61 HydrophobicContact CB-CZ 4.15Å; M51-F61 HydrophobicContact CB-CD1 4.13Å; M51-F61 HydrophobicContact CB-CE1 3.91Å; M51-F61 WeakPolarHBondContact O-CD1 3.43Å; K52-F61 CarbonylContact C-O 3.58Å; K52-F61 VanDerWaalsContact CA-O 3.3Å; K52-F61 WeakPolarHBondContact CA-O 2.98Å; R53-F61 PolarHBondContact N-O 2.83Å; R53-F61 PolarHBondContact O-N 3.2Å; R53-F61 VanDerWaalsContact O-O 3.13Å; F61-G63 VanDerWaalsContact C-N 3.35Å; F61-V65 HydrophobicContact CE2-CG2 4.5Å; F61-V65 HydrophobicContact CZ-CG2 4.19Å; F61-G87 WeakPolarHBondContact CA-O 3.18Å; F61-Q89 HydrophobicContact CE2-CB 3.99Å
62	N	89.8	Confident	91.9	Very high	27 Å²	27	48.7 Å²	48.7	14%	0.144	28%	0.28	C	S	.	.			trans	-86.8	-4.2	-175.7	66.5	6.1	0	0	0	114.2	I64 S86 G87 T88	N62-I64 WeakPolarHBondContact OD1-CA 3.39Å; N62-I64 VanDerWaalsContact OD1-CB 3.29Å; N62-I64 WeakPolarHBondContact OD1-CB 3.14Å; N62-I64 PolarHBondContact OD1-N 3.22Å; N62-S86 PolarHBondContact ND2-OG 2.94Å; N62-G87 PolarHBondContact N-O 3.01Å; N62-G87 VanDerWaalsContact N-O 3.1Å; N62-G87 PolarHBondContact OD1-O 3.12Å; N62-T88 PolarHBondContact ND2-OG1 3.28Å
63	G	89.3	Confident	92.3	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.01	26%	0.263	C	S	.	.	S	Bend	trans	87	2.1	-176	0	0	0	0	0	114.6	P48 A49 F61 N134	P48-G63 CarbonylContact C-O 3.57Å; P48-G63 VanDerWaalsContact C-O 3.32Å; P48-G63 WeakPolarHBondContact O-CA 3.15Å; A49-G63 WeakPolarHBondContact CA-O 3.37Å; A49-G63 PolarHBondContact N-O 3.38Å; F61-G63 VanDerWaalsContact C-N 3.35Å; G63-N134 PolarHBondContact O-ND2 2.76Å
64	I	92.9	Very high	92.7	Very high	20 Å²	20	34.4 Å²	34.4	10%	0.103	23%	0.232	C	C	.	.			trans	-98.6	129.8	177.2	-55.7	174.9	0	0	0	109	N62 A66 T88 Q89 V135 K273	N62-I64 WeakPolarHBondContact OD1-CA 3.39Å; N62-I64 VanDerWaalsContact OD1-CB 3.29Å; N62-I64 WeakPolarHBondContact OD1-CB 3.14Å; N62-I64 PolarHBondContact OD1-N 3.22Å; I64-A66 HydrophobicContact CG2-CB 4.26Å; I64-T88 HydrophobicContact CB-CG2 3.81Å; I64-T88 HydrophobicContact CG2-CG2 3.68Å; I64-T88 WeakPolarHBondContact O-CG2 3.31Å; I64-Q89 PolarHBondContact O-N 3.45Å; I64-Q89 VanDerWaalsContact O-N 3.1Å; I64-V135 HydrophobicContact CG2-CB 4.17Å; I64-V135 HydrophobicContact CG2-CG2 3.71Å; I64-K273 HydrophobicContact CD1-CG 4Å
65	V	95.3	Very high	93.2	Very high	6 Å²	6	32.1 Å²	32.1	4%	0.036	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	100.8	168.5	-175.6	0	0	0	0	106.8	P48 F61 Q89 I91 H132 S133 N134 V135	P48-V65 HydrophobicContact CB-CG2 3.84Å; P48-V65 HydrophobicContact CG-CG2 4.21Å; F61-V65 HydrophobicContact CE2-CG2 4.5Å; F61-V65 HydrophobicContact CZ-CG2 4.19Å; V65-Q89 CarbonylContact C-O 3.48Å; V65-Q89 WeakPolarHBondContact CA-O 3.28Å; V65-Q89 HydrophobicContact CG2-CB 4.31Å; V65-I91 HydrophobicContact CG1-CD1 4.15Å; V65-I91 HydrophobicContact CG1-CG1 4.39Å; V65-H132 WeakPolarHBondContact CG1-O 3.29Å; V65-S133 VanDerWaalsContact O-CA 3.31Å; V65-S133 WeakPolarHBondContact O-CA 3.35Å; V65-S133 WeakPolarHBondContact O-CB 3.39Å; V65-N134 PolarHBondContact N-OD1 3.42Å; V65-N134 PolarHBondContact O-N 2.9Å; V65-N134 PolarHBondContact O-OD1 3.48Å; V65-V135 PolarHBondContact O-N 3.1Å
66	A	96.8	Very high	93.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125	-173.3	0	0	0	0	0	111.5	I64 V68 L83 T88 Q89 M90 I91 V135	I64-A66 HydrophobicContact CG2-CB 4.26Å; A66-V68 HydrophobicContact CB-CG2 4.5Å; A66-L83 HydrophobicContact CB-CD1 4.09Å; A66-T88 HydrophobicContact CB-CG2 3.97Å; A66-Q89 PolarHBondContact N-O 3.02Å; A66-M90 CarbonylContact O-C 3.59Å; A66-M90 VanDerWaalsContact O-CA 3.31Å; A66-M90 WeakPolarHBondContact O-CA 3.3Å; A66-I91 PolarHBondContact O-N 3.07Å; A66-V135 CarbonylContact C-O 3.32Å; A66-V135 VanDerWaalsContact CA-O 3.27Å; A66-V135 WeakPolarHBondContact CA-O 3.48Å; A66-V135 HydrophobicContact CB-CB 4.41Å
67	T	97.9	Very high	94.2	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	119.6	163.8	-70.2	0	0	0	0	109.9	F69 I91 P93 A129 V130 S133 V135 V136 I137	T67-F69 HydrophobicContact CG2-CD2 3.97Å; T67-F69 HydrophobicContact CG2-CE1 4.41Å; T67-F69 HydrophobicContact CG2-CE2 3.55Å; T67-F69 HydrophobicContact CG2-CZ 3.79Å; T67-I91 WeakPolarHBondContact CA-O 3.44Å; T67-P93 HydrophobicContact CG2-CG 3.55Å; T67-A129 HydrophobicContact CG2-CB 4.4Å; T67-A129 PolarHBondContact OG1-O 2.77Å; T67-A129 VanDerWaalsContact OG1-O 3.13Å; T67-V130 HydrophobicContact CG2-CG1 4.25Å; T67-S133 PolarHBondContact OG1-OG 3.3Å; T67-V135 PolarHBondContact N-O 2.82Å; T67-V136 WeakPolarHBondContact O-CA 3.49Å; T67-I137 PolarHBondContact O-N 3.44Å
68	V	97.9	Very high	94.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	95.9	-178.5	-172.3	0	0	0	0	110.5	A66 A71 L83 I91 L92 I137 L139	A66-V68 HydrophobicContact CB-CG2 4.5Å; V68-A71 HydrophobicContact CB-CB 4.25Å; V68-A71 HydrophobicContact CG1-CB 4.06Å; V68-A71 WeakPolarHBondContact O-CB 3.36Å; V68-A71 PolarHBondContact O-N 2.91Å; V68-L83 HydrophobicContact CG2-CD1 3.89Å; V68-I91 PolarHBondContact N-O 3.44Å; V68-L92 HydrophobicContact CB-CD2 4.01Å; V68-L92 HydrophobicContact CG2-CD2 4.3Å; V68-I137 HydrophobicContact CG1-CB 4.47Å; V68-I137 HydrophobicContact CG2-CB 4.47Å; V68-I137 HydrophobicContact CG2-CD1 4.26Å; V68-L139 HydrophobicContact CG1-CD1 4Å
69	F	97.8	Very high	94.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	132.3	171.1	-66.5	-78.9	0	0	0	110.2	T67 P93 Y118 I126 A129 V130 V136 I137 L139 V140 I162	T67-F69 HydrophobicContact CG2-CD2 3.97Å; T67-F69 HydrophobicContact CG2-CE1 4.41Å; T67-F69 HydrophobicContact CG2-CE2 3.55Å; T67-F69 HydrophobicContact CG2-CZ 3.79Å; F69-P93 HydrophobicContact CD1-CB 3.82Å; F69-P93 HydrophobicContact CD1-CG 3.86Å; F69-P93 HydrophobicContact CE1-CB 3.8Å; F69-P93 HydrophobicContact CE1-CG 3.67Å; F69-P93 HydrophobicContact CZ-CG 4.21Å; F69-Y118 HydrophobicContact CD1-CD2 4.14Å; F69-Y118 HydrophobicContact CD1-CE1 4.37Å; F69-Y118 AromaticContact CD1-CE2 3.61Å; F69-Y118 HydrophobicContact CD1-CE2 3.61Å; F69-Y118 AromaticContact CD1-CZ 3.73Å; F69-Y118 AromaticContact CE1-CD2 3.9Å; F69-Y118 HydrophobicContact CE1-CD2 3.9Å; F69-Y118 AromaticContact CE1-CE2 3.84Å; F69-Y118 HydrophobicContact CE1-CE2 3.84Å; F69-Y118 HydrophobicContact CE1-CG 4.42Å; F69-I126 HydrophobicContact CE1-CG2 4.37Å; F69-I126 HydrophobicContact CZ-CG2 3.85Å; F69-A129 HydrophobicContact CZ-CB 4.33Å; F69-V130 HydrophobicContact CE2-CG1 3.76Å; F69-V130 HydrophobicContact CZ-CG1 3.82Å; F69-V136 HydrophobicContact CD2-CG1 3.8Å; F69-V136 HydrophobicContact CE2-CG1 3.74Å; F69-I137 PolarHBondContact N-O 3.44Å; F69-L139 WeakPolarHBondContact O-CA 3.45Å; F69-L139 WeakPolarHBondContact O-CB 3.41Å; F69-L139 PolarHBondContact O-N 3.44Å; F69-V140 HydrophobicContact CB-CG2 3.64Å; F69-I162 HydrophobicContact CB-CD1 4.22Å; F69-I162 HydrophobicContact CD1-CD1 4.22Å; F69-I162 HydrophobicContact CD2-CD1 4.12Å; F69-I162 HydrophobicContact CD2-CG1 4.41Å; F69-I162 HydrophobicContact CD2-CG2 3.82Å; F69-I162 HydrophobicContact CE2-CG1 4.39Å; F69-I162 HydrophobicContact CE2-CG2 3.78Å; F69-I162 HydrophobicContact CG-CD1 3.94Å
70	G	95.6	Very high	95	Very high	14 Å²	14	15.8 Å²	15.8	14%	0.144	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	18.1	-175.5	0	0	0	0	0	114.2	T72 G73	G70-T72 PolarHBondContact O-N 3.04Å; G70-T72 VanDerWaalsContact O-N 3.16Å; G70-G73 PolarHBondContact O-N 3.02Å; G70-G73 VanDerWaalsContact O-N 3.15Å
71	A	96	Very high	95.2	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.008	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.6	177.7	0	0	0	0	0	114.2	V68 G73 G76 R77 L92 L104	V68-A71 HydrophobicContact CB-CB 4.25Å; V68-A71 HydrophobicContact CG1-CB 4.06Å; V68-A71 WeakPolarHBondContact O-CB 3.36Å; V68-A71 PolarHBondContact O-N 2.91Å; A71-G73 VanDerWaalsContact C-N 3.26Å; A71-G73 PolarHBondContact O-N 3.22Å; A71-G76 CarbonylContact O-C 3.57Å; A71-R77 PolarHBondContact O-N 3.09Å; A71-L92 HydrophobicContact CB-CB 4.4Å; A71-L92 HydrophobicContact CB-CD2 3.87Å; A71-L104 HydrophobicContact CB-CD1 3.99Å
72	T	94.3	Very high	95.4	Very high	50 Å²	50	19.8 Å²	19.8	31%	0.307	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-20.5	-178	64.9	0	0	0	0	113.8	G70 R77 V101	G70-T72 PolarHBondContact O-N 3.04Å; G70-T72 VanDerWaalsContact O-N 3.16Å; T72-R77 PolarHBondContact O-NE 3.49Å; T72-R77 PolarHBondContact O-NH2 3.25Å; T72-V101 HydrophobicContact CG2-CG1 3.33Å
73	G	92.9	Very high	95.7	Very high	29 Å²	29	18.7 Å²	18.7	30%	0.299	10%	0.103	S	C	.	.	S	Bend	trans	-80.4	-179	-176.7	0	0	0	0	0	114.3	G70 A71 G76 R77	G70-G73 PolarHBondContact O-N 3.02Å; G70-G73 VanDerWaalsContact O-N 3.15Å; A71-G73 VanDerWaalsContact C-N 3.26Å; A71-G73 PolarHBondContact O-N 3.22Å; G73-G76 PolarHBondContact O-N 2.73Å; G73-R77 WeakPolarHBondContact O-CG 3.14Å; G73-R77 PolarHBondContact O-N 2.86Å
74	F	95	Very high	96	Very high	22 Å²	22	18.7 Å²	18.7	10%	0.096	10%	0.103	C	C	.	.	H	α-helix	trans	-53.5	-62.8	-178.5	170.3	-125.8	0	0	0	112.3	G76 Y78 I223 S226 E227 D228 V261	F74-G76 VanDerWaalsContact C-N 3.35Å; F74-G76 PolarHBondContact O-N 2.83Å; F74-Y78 AromaticContact CD2-CE2 3.95Å; F74-Y78 HydrophobicContact CD2-CE2 3.95Å; F74-Y78 HydrophobicContact CE2-CD2 4.45Å; F74-Y78 AromaticContact CE2-CE2 3.67Å; F74-Y78 HydrophobicContact CE2-CE2 3.67Å; F74-Y78 VanDerWaalsContact O-CD2 3.27Å; F74-Y78 WeakPolarHBondContact O-CD2 3.07Å; F74-I223 HydrophobicContact CE1-CB 4.13Å; F74-I223 HydrophobicContact CE1-CG2 3.69Å; F74-I223 HydrophobicContact CZ-CG2 4.28Å; F74-S226 VanDerWaalsContact CE2-O 3.23Å; F74-S226 WeakPolarHBondContact CE2-O 3.42Å; F74-E227 HydrophobicContact CD2-CB 4.2Å; F74-D228 HydrophobicContact CE1-CB 3.9Å; F74-D228 HydrophobicContact CE2-CB 4.11Å; F74-D228 HydrophobicContact CZ-CB 3.59Å; F74-V261 HydrophobicContact CD1-CG2 4.46Å; F74-V261 HydrophobicContact CE1-CB 4.11Å; F74-V261 HydrophobicContact CE1-CG2 3.89Å; F74-V261 HydrophobicContact CE2-CB 4.28Å; F74-V261 HydrophobicContact CE2-CG1 4.19Å; F74-V261 HydrophobicContact CE2-CG2 4.1Å; F74-V261 HydrophobicContact CZ-CB 3.62Å; F74-V261 HydrophobicContact CZ-CG1 3.91Å; F74-V261 HydrophobicContact CZ-CG2 3.68Å
75	V	96.7	Very high	96	Very high	18 Å²	18	25 Å²	25	11%	0.109	13%	0.13	C	C	.	.	H	α-helix	trans	-65.5	-38.4	-178.2	-176.6	0	0	0	0	111.9	R77 Y78 V79 L139 L177 I223 V261 I268	V75-R77 VanDerWaalsContact C-N 3.3Å; V75-R77 PolarHBondContact O-N 3.17Å; V75-Y78 PolarHBondContact O-N 3Å; V75-Y78 VanDerWaalsContact O-N 3.14Å; V75-V79 HydrophobicContact CG1-CG2 4.1Å; V75-V79 WeakPolarHBondContact O-CG2 2.9Å; V75-V79 PolarHBondContact O-N 3.49Å; V75-V79 VanDerWaalsContact O-N 3.1Å; V75-L139 HydrophobicContact CG1-CD1 4.3Å; V75-L139 HydrophobicContact CG1-CD2 4.49Å; V75-L177 HydrophobicContact CG1-CD2 4.22Å; V75-L177 HydrophobicContact CG2-CD2 4.36Å; V75-I223 HydrophobicContact CG2-CD1 3.69Å; V75-V261 HydrophobicContact CG2-CG2 4.43Å; V75-I268 HydrophobicContact CG1-CD1 4.34Å
76	G	96.2	Very high	95.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-56.4	-40.9	-177.5	0	0	0	0	0	113.5	A71 G73 F74 Y78 V79 C80 L139	A71-G76 CarbonylContact O-C 3.57Å; G73-G76 PolarHBondContact O-N 2.73Å; F74-G76 VanDerWaalsContact C-N 3.35Å; F74-G76 PolarHBondContact O-N 2.83Å; G76-Y78 PolarHBondContact O-N 2.86Å; G76-V79 PolarHBondContact O-N 2.99Å; G76-C80 WeakPolarHBondContact O-CB 3.48Å; G76-C80 PolarHBondContact O-N 3.21Å; G76-C80 PolarHBondContact O-SG 2.77Å; G76-L139 VanDerWaalsContact CA-CD1 3.48Å
77	R	95.6	Very high	95.7	Very high	50 Å²	50	25.8 Å²	25.8	19%	0.189	14%	0.136	C	C	.	.	H	α-helix	trans	-60	-42.8	177.5	-68.2	163.6	-169.6	-160.6	-1.4	112.8	A71 T72 G73 V75 N81 R103 L104 E227	A71-R77 PolarHBondContact O-N 3.09Å; T72-R77 PolarHBondContact O-NE 3.49Å; T72-R77 PolarHBondContact O-NH2 3.25Å; G73-R77 WeakPolarHBondContact O-CG 3.14Å; G73-R77 PolarHBondContact O-N 2.86Å; V75-R77 VanDerWaalsContact C-N 3.3Å; V75-R77 PolarHBondContact O-N 3.17Å; R77-N81 VanDerWaalsContact O-CB 3.31Å; R77-N81 WeakPolarHBondContact O-CB 3.36Å; R77-N81 PolarHBondContact O-N 2.82Å; R77-R103 VanDerWaalsContact CZ-CZ 3.43Å; R77-L104 HydrophobicContact CB-CD2 4.37Å; R77-L104 HydrophobicContact CG-CD2 3.99Å; R77-E227 IonicContact CZ-OE2 3.43Å; R77-E227 VanDerWaalsContact NH1-CD 3.29Å; R77-E227 IonicContact NH1-OE1 3.05Å; R77-E227 PolarHBondContact NH1-OE1 3.3Å; R77-E227 IonicContact NH1-OE2 3.3Å; R77-E227 PolarHBondContact NH1-OE2 3.38Å
78	Y	97	Very high	95.5	Very high	45 Å²	45	25.8 Å²	25.8	18%	0.176	14%	0.136	C	C	.	.	H	α-helix	trans	-69.9	-39.4	178.9	-70	-90	0	0	0	111.9	F74 V75 G76 N81 K82 S226 V261	F74-Y78 AromaticContact CD2-CE2 3.95Å; F74-Y78 HydrophobicContact CD2-CE2 3.95Å; F74-Y78 HydrophobicContact CE2-CD2 4.45Å; F74-Y78 AromaticContact CE2-CE2 3.67Å; F74-Y78 HydrophobicContact CE2-CE2 3.67Å; F74-Y78 VanDerWaalsContact O-CD2 3.27Å; F74-Y78 WeakPolarHBondContact O-CD2 3.07Å; V75-Y78 PolarHBondContact O-N 3Å; V75-Y78 VanDerWaalsContact O-N 3.14Å; G76-Y78 PolarHBondContact O-N 2.86Å; Y78-N81 PolarHBondContact O-N 3.09Å; Y78-K82 PolarHBondContact O-N 2.96Å; Y78-K82 VanDerWaalsContact O-N 3.11Å; Y78-S226 VanDerWaalsContact OH-CB 3.31Å; Y78-S226 WeakPolarHBondContact OH-CB 3.48Å; Y78-S226 PolarHBondContact OH-N 3.34Å; Y78-S226 PolarHBondContact OH-O 3.02Å; Y78-S226 VanDerWaalsContact OH-O 3.06Å; Y78-V261 HydrophobicContact CD1-CG1 3.94Å; Y78-V261 HydrophobicContact CD2-CB 4.32Å; Y78-V261 HydrophobicContact CD2-CG1 3.88Å; Y78-V261 HydrophobicContact CD2-CG2 3.44Å; Y78-V261 VanDerWaalsContact CD2-CG2 3.44Å; Y78-V261 HydrophobicContact CE1-CG1 3.67Å; Y78-V261 HydrophobicContact CE2-CB 4.39Å; Y78-V261 HydrophobicContact CE2-CG1 3.63Å; Y78-V261 HydrophobicContact CE2-CG2 3.88Å; Y78-V261 HydrophobicContact CG-CG1 4.04Å; Y78-V261 HydrophobicContact CG-CG2 3.84Å
79	V	97.3	Very high	95.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.7	-50.2	174.9	175.1	0	0	0	0	110.3	V75 G76 N81 K82 L83 I137 L139 A265 I268	V75-V79 HydrophobicContact CG1-CG2 4.1Å; V75-V79 WeakPolarHBondContact O-CG2 2.9Å; V75-V79 PolarHBondContact O-N 3.49Å; V75-V79 VanDerWaalsContact O-N 3.1Å; G76-V79 PolarHBondContact O-N 2.99Å; V79-N81 VanDerWaalsContact C-N 3.35Å; V79-N81 PolarHBondContact O-N 3.27Å; V79-K82 PolarHBondContact O-N 3.01Å; V79-L83 HydrophobicContact CG1-CD1 3.82Å; V79-L83 HydrophobicContact CG1-CG 4.29Å; V79-L83 WeakPolarHBondContact O-CB 3.13Å; V79-L83 WeakPolarHBondContact O-CG 3.3Å; V79-L83 PolarHBondContact O-N 3.2Å; V79-I137 HydrophobicContact CG1-CD1 3.99Å; V79-L139 HydrophobicContact CB-CD1 4.36Å; V79-L139 HydrophobicContact CG2-CD1 4.08Å; V79-A265 HydrophobicContact CG2-CB 3.88Å; V79-I268 HydrophobicContact CG1-CG2 4.14Å; V79-I268 HydrophobicContact CG2-CD1 3.64Å; V79-I268 HydrophobicContact CG2-CG2 4.41Å
80	C	97.1	Very high	95.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-41.3	178.2	-67.2	0	0	0	0	112.4	G76 K82 L83 G84 M90 L92 L104	G76-C80 WeakPolarHBondContact O-CB 3.48Å; G76-C80 PolarHBondContact O-N 3.21Å; G76-C80 PolarHBondContact O-SG 2.77Å; C80-K82 PolarHBondContact O-N 3.22Å; C80-L83 PolarHBondContact O-N 2.89Å; C80-G84 PolarHBondContact O-N 2.83Å; C80-M90 HydrophobicContact CB-CE 4.45Å; C80-M90 HydrophobicContact CB-SD 3.98Å; C80-M90 WeakPolarHBondContact O-CE 3.45Å; C80-L92 WeakPolarHBondContact SG-CD2 3.38Å; C80-L104 HydrophobicContact CB-CD2 4.15Å
81	N	96.1	Very high	95.3	Very high	87 Å²	87	28.7 Å²	28.7	47%	0.465	15%	0.146	S	C	.	.	H	α-helix	trans	-58.7	-50.3	176.4	-175.4	-37.9	0	0	0	111.4	R77 Y78 V79 G84 K85 T107	R77-N81 VanDerWaalsContact O-CB 3.31Å; R77-N81 WeakPolarHBondContact O-CB 3.36Å; R77-N81 PolarHBondContact O-N 2.82Å; Y78-N81 PolarHBondContact O-N 3.09Å; V79-N81 VanDerWaalsContact C-N 3.35Å; V79-N81 PolarHBondContact O-N 3.27Å; N81-G84 PolarHBondContact O-N 3.42Å; N81-K85 WeakPolarHBondContact O-CB 3.32Å; N81-K85 PolarHBondContact O-N 2.76Å; N81-T107 HydrophobicContact CB-CG2 4.42Å
82	K	95.7	Very high	95.4	Very high	45 Å²	45	28.8 Å²	28.8	20%	0.196	15%	0.146	C	C	.	.	H	α-helix	trans	-69.9	-36.5	-179.1	-71.9	179.3	-179.3	-97.1	0	112.9	Y78 V79 C80 K85 S86 S262 A265 Q266 I269	Y78-K82 PolarHBondContact O-N 2.96Å; Y78-K82 VanDerWaalsContact O-N 3.11Å; V79-K82 PolarHBondContact O-N 3.01Å; C80-K82 PolarHBondContact O-N 3.22Å; K82-K85 PolarHBondContact O-N 3.01Å; K82-S86 PolarHBondContact O-N 3.08Å; K82-S262 WeakPolarHBondContact CE-O 3.23Å; K82-S262 VanDerWaalsContact CE-OG 3.22Å; K82-S262 WeakPolarHBondContact CE-OG 3.49Å; K82-S262 PolarHBondContact NZ-O 3.24Å; K82-S262 PolarHBondContact NZ-OG 3.38Å; K82-A265 HydrophobicContact CD-CB 3.9Å; K82-Q266 HydrophobicContact CD-CB 4.4Å; K82-I269 HydrophobicContact CB-CD1 3.07Å; K82-I269 HydrophobicContact CD-CD1 4.01Å; K82-I269 HydrophobicContact CG-CD1 4.2Å
83	L	95.6	Very high	95.5	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.016	13%	0.132	C	C	.	.	H	α-helix	trans	-61.5	-48.7	173	-77.7	175.8	0	0	0	111	A66 V68 V79 C80 K85 S86 G87 T88 M90 I137 I269	A66-L83 HydrophobicContact CB-CD1 4.09Å; V68-L83 HydrophobicContact CG2-CD1 3.89Å; V79-L83 HydrophobicContact CG1-CD1 3.82Å; V79-L83 HydrophobicContact CG1-CG 4.29Å; V79-L83 WeakPolarHBondContact O-CB 3.13Å; V79-L83 WeakPolarHBondContact O-CG 3.3Å; V79-L83 PolarHBondContact O-N 3.2Å; C80-L83 PolarHBondContact O-N 2.89Å; L83-K85 VanDerWaalsContact C-N 3.35Å; L83-K85 PolarHBondContact O-N 3.44Å; L83-S86 PolarHBondContact O-N 3.46Å; L83-S86 PolarHBondContact O-OG 3.32Å; L83-G87 PolarHBondContact O-N 3.11Å; L83-T88 HydrophobicContact CB-CG2 4.39Å; L83-T88 HydrophobicContact CD2-CG2 3.94Å; L83-T88 WeakPolarHBondContact O-CB 3.41Å; L83-T88 PolarHBondContact O-N 3.25Å; L83-T88 VanDerWaalsContact O-N 3.14Å; L83-T88 PolarHBondContact O-OG1 3.45Å; L83-T88 VanDerWaalsContact O-OG1 3.05Å; L83-M90 HydrophobicContact CB-CG 4.06Å; L83-M90 HydrophobicContact CB-SD 3.4Å; L83-M90 WeakPolarHBondContact CB-SD 3.34Å; L83-M90 HydrophobicContact CD1-CG 4.29Å; L83-M90 HydrophobicContact CD1-SD 4.04Å; L83-M90 HydrophobicContact CG-SD 4.39Å; L83-I137 HydrophobicContact CD1-CD1 4Å; L83-I269 HydrophobicContact CD2-CD1 4.21Å; L83-I269 HydrophobicContact CD2-CG1 3.82Å; L83-I269 HydrophobicContact CG-CD1 4.08Å; L83-I269 HydrophobicContact CG-CG1 4.05Å
84	G	95.4	Very high	95.7	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-61.1	-39.7	176.1	0	0	0	0	0	113	C80 N81 S86 G87	C80-G84 PolarHBondContact O-N 2.83Å; N81-G84 PolarHBondContact O-N 3.42Å; G84-S86 PolarHBondContact O-N 3.2Å; G84-G87 PolarHBondContact O-N 2.88Å; G84-G87 VanDerWaalsContact O-N 3.11Å
85	K	94.3	Very high	95.6	Very high	153 Å²	153	32 Å²	32	67%	0.665	14%	0.144	S	C	*	.	H	α-helix	trans	-60.6	-29.3	174	-172	175	-178.3	179.8	0	112.9	G57 R58 N81 K82 L83	G57-K85 CarbonylContact C-O 3.54Å; G57-K85 WeakPolarHBondContact CA-O 3.45Å; R58-K85 PolarHBondContact N-O 3.08Å; N81-K85 WeakPolarHBondContact O-CB 3.32Å; N81-K85 PolarHBondContact O-N 2.76Å; K82-K85 PolarHBondContact O-N 3.01Å; L83-K85 VanDerWaalsContact C-N 3.35Å; L83-K85 PolarHBondContact O-N 3.44Å
86	S	91.7	Very high	95.1	Very high	23 Å²	23	33 Å²	33	16%	0.161	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.1	178.9	72.3	0	0	0	0	114.7	G57 S60 N62 K82 L83 G84 T88	G57-S86 CarbonylContact O-C 3.4Å; S60-S86 PolarHBondContact OG-O 3.31Å; N62-S86 PolarHBondContact ND2-OG 2.94Å; K82-S86 PolarHBondContact O-N 3.08Å; L83-S86 PolarHBondContact O-N 3.46Å; L83-S86 PolarHBondContact O-OG 3.32Å; G84-S86 PolarHBondContact O-N 3.2Å; S86-T88 PolarHBondContact OG-OG1 3.48Å
87	G	92.5	Very high	94.9	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	32.6	-178.2	0	0	0	0	0	113.4	G57 S60 F61 N62 L83 G84	G57-G87 WeakPolarHBondContact O-CA 3.41Å; G57-G87 PolarHBondContact O-N 3.48Å; S60-G87 CarbonylContact O-C 3.51Å; S60-G87 WeakPolarHBondContact O-CA 3.44Å; S60-G87 VanDerWaalsContact O-O 3.13Å; F61-G87 WeakPolarHBondContact CA-O 3.18Å; N62-G87 PolarHBondContact N-O 3.01Å; N62-G87 VanDerWaalsContact N-O 3.1Å; N62-G87 PolarHBondContact OD1-O 3.12Å; L83-G87 PolarHBondContact O-N 3.11Å; G84-G87 PolarHBondContact O-N 2.88Å; G84-G87 VanDerWaalsContact O-N 3.11Å
88	T	94.5	Very high	94.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.198	C	C	.	.			trans	-84.6	135.4	173.8	-50.7	0	0	0	0	109	N62 I64 A66 L83 S86 M90	N62-T88 PolarHBondContact ND2-OG1 3.28Å; I64-T88 HydrophobicContact CB-CG2 3.81Å; I64-T88 HydrophobicContact CG2-CG2 3.68Å; I64-T88 WeakPolarHBondContact O-CG2 3.31Å; A66-T88 HydrophobicContact CB-CG2 3.97Å; L83-T88 HydrophobicContact CB-CG2 4.39Å; L83-T88 HydrophobicContact CD2-CG2 3.94Å; L83-T88 WeakPolarHBondContact O-CB 3.41Å; L83-T88 PolarHBondContact O-N 3.25Å; L83-T88 VanDerWaalsContact O-N 3.14Å; L83-T88 PolarHBondContact O-OG1 3.45Å; L83-T88 VanDerWaalsContact O-OG1 3.05Å; S86-T88 PolarHBondContact OG-OG1 3.48Å; T88-M90 HydrophobicContact CG2-CG 4.39Å
89	Q	95	Very high	94.5	Very high	56 Å²	56	40.9 Å²	40.9	26%	0.262	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	132	165.7	-171.5	172.8	51.7	0	0	108.8	F61 I64 V65 A66 G111 Q112	F61-Q89 HydrophobicContact CE2-CB 3.99Å; I64-Q89 PolarHBondContact O-N 3.45Å; I64-Q89 VanDerWaalsContact O-N 3.1Å; V65-Q89 CarbonylContact C-O 3.48Å; V65-Q89 WeakPolarHBondContact CA-O 3.28Å; V65-Q89 HydrophobicContact CG2-CB 4.31Å; A66-Q89 PolarHBondContact N-O 3.02Å; Q89-G111 PolarHBondContact NE2-O 2.95Å; Q89-G111 VanDerWaalsContact NE2-O 3.12Å; Q89-Q112 CarbonylContact C-O 3.48Å; Q89-Q112 WeakPolarHBondContact CA-O 3.29Å
90	M	96.4	Very high	94.1	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.4	-175.2	-61.5	-177.9	-70.4	0	0	110.1	A66 C80 L83 T88 L92 Q112 V113 L114	A66-M90 CarbonylContact O-C 3.59Å; A66-M90 VanDerWaalsContact O-CA 3.31Å; A66-M90 WeakPolarHBondContact O-CA 3.3Å; C80-M90 HydrophobicContact CB-CE 4.45Å; C80-M90 HydrophobicContact CB-SD 3.98Å; C80-M90 WeakPolarHBondContact O-CE 3.45Å; L83-M90 HydrophobicContact CB-CG 4.06Å; L83-M90 HydrophobicContact CB-SD 3.4Å; L83-M90 WeakPolarHBondContact CB-SD 3.34Å; L83-M90 HydrophobicContact CD1-CG 4.29Å; L83-M90 HydrophobicContact CD1-SD 4.04Å; L83-M90 HydrophobicContact CG-SD 4.39Å; T88-M90 HydrophobicContact CG2-CG 4.39Å; M90-L92 HydrophobicContact CB-CD2 3.91Å; M90-L92 HydrophobicContact CB-CG 4.3Å; M90-Q112 PolarHBondContact N-O 3.47Å; M90-V113 HydrophobicContact CE-CG2 3.88Å; M90-L114 PolarHBondContact O-N 2.87Å
91	I	96.9	Very high	93.9	Very high	19 Å²	19	44.9 Å²	44.9	10%	0.097	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.5	165	-55.1	177	0	0	0	106.2	V65 A66 T67 V68 P93 L114 H116 A129	V65-I91 HydrophobicContact CG1-CD1 4.15Å; V65-I91 HydrophobicContact CG1-CG1 4.39Å; A66-I91 PolarHBondContact O-N 3.07Å; T67-I91 WeakPolarHBondContact CA-O 3.44Å; V68-I91 PolarHBondContact N-O 3.44Å; I91-P93 VanDerWaalsContact O-CD 3.23Å; I91-P93 WeakPolarHBondContact O-CD 3.44Å; I91-L114 CarbonylContact C-O 3.56Å; I91-L114 WeakPolarHBondContact CA-O 3.46Å; I91-H116 HydrophobicContact CG2-CB 4.33Å; I91-A129 WeakPolarHBondContact CD1-O 3.39Å
92	L	97.2	Very high	93.8	Very high	2 Å²	2	46 Å²	46	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	89.9	-173.8	-57.3	-173	0	0	0	110	V68 A71 C80 M90 Y94 L104 V113 L114 F115 H116	V68-L92 HydrophobicContact CB-CD2 4.01Å; V68-L92 HydrophobicContact CG2-CD2 4.3Å; A71-L92 HydrophobicContact CB-CB 4.4Å; A71-L92 HydrophobicContact CB-CD2 3.87Å; C80-L92 WeakPolarHBondContact SG-CD2 3.38Å; M90-L92 HydrophobicContact CB-CD2 3.91Å; M90-L92 HydrophobicContact CB-CG 4.3Å; L92-Y94 PolarHBondContact O-N 2.86Å; L92-L104 HydrophobicContact CD1-CB 3.84Å; L92-L104 HydrophobicContact CD1-CD1 3.92Å; L92-L104 HydrophobicContact CD1-CG 4.48Å; L92-V113 HydrophobicContact CD1-CG1 3.49Å; L92-V113 VanDerWaalsContact CD1-CG1 3.49Å; L92-V113 HydrophobicContact CG-CG1 4.21Å; L92-L114 PolarHBondContact N-O 2.86Å; L92-F115 HydrophobicContact CB-CD1 4.03Å; L92-F115 HydrophobicContact CB-CE1 4.35Å; L92-F115 HydrophobicContact CD1-CD1 4.33Å; L92-F115 HydrophobicContact CD1-CE1 3.84Å; L92-H116 PolarHBondContact O-N 2.89Å; L92-H116 VanDerWaalsContact O-N 3.16Å
93	P	97.1	Very high	93.6	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	130.1	172.6	-22.8	34.9	0	0	0	111.6	T67 F69 I91 H116 Y118 A129	T67-P93 HydrophobicContact CG2-CG 3.55Å; F69-P93 HydrophobicContact CD1-CB 3.82Å; F69-P93 HydrophobicContact CD1-CG 3.86Å; F69-P93 HydrophobicContact CE1-CB 3.8Å; F69-P93 HydrophobicContact CE1-CG 3.67Å; F69-P93 HydrophobicContact CZ-CG 4.21Å; I91-P93 VanDerWaalsContact O-CD 3.23Å; I91-P93 WeakPolarHBondContact O-CD 3.44Å; P93-H116 CarbonylContact C-O 3.46Å; P93-H116 WeakPolarHBondContact CA-O 3.21Å; P93-Y118 VanDerWaalsContact C-CD1 3.43Å; P93-Y118 HydrophobicContact CB-CD1 3.17Å; P93-Y118 HydrophobicContact CB-CD2 4.4Å; P93-Y118 HydrophobicContact CB-CE1 3.43Å; P93-Y118 VanDerWaalsContact CB-CE1 3.43Å; P93-Y118 HydrophobicContact CB-CG 3.7Å; P93-Y118 WeakPolarHBondContact O-CE1 3.37Å; P93-A129 HydrophobicContact CG-CB 3.79Å
94	Y	96.2	Very high	93.6	Very high	30 Å²	30	49.2 Å²	49.2	12%	0.118	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	152.8	174.6	72	-74.1	0	0	0	112.1	L92 G96 D98 V101 F115 H116 F117 Y118	L92-Y94 PolarHBondContact O-N 2.86Å; Y94-G96 WeakPolarHBondContact CD2-O 3.29Å; Y94-D98 WeakPolarHBondContact CE2-OD1 3.23Å; Y94-D98 PolarHBondContact OH-OD1 3.37Å; Y94-V101 VanDerWaalsContact CB-CG1 3.45Å; Y94-V101 HydrophobicContact CD1-CG1 4.35Å; Y94-V101 HydrophobicContact CD1-CG2 4.49Å; Y94-V101 HydrophobicContact CD2-CG1 3.95Å; Y94-V101 HydrophobicContact CD2-CG2 4.32Å; Y94-V101 HydrophobicContact CE2-CG2 4.45Å; Y94-V101 HydrophobicContact CG-CG1 3.66Å; Y94-V101 HydrophobicContact CG-CG2 4.34Å; Y94-F115 HydrophobicContact CD1-CB 4.24Å; Y94-F115 HydrophobicContact CE1-CB 3.82Å; Y94-H116 VanDerWaalsContact CD1-O 3.23Å; Y94-H116 WeakPolarHBondContact CD1-O 3.36Å; Y94-H116 PolarHBondContact N-O 3.27Å; Y94-F117 HydrophobicContact CE2-CD2 4.48Å; Y94-F117 WeakPolarHBondContact O-CA 3.45Å; Y94-Y118 VanDerWaalsContact N-CD1 3.33Å; Y94-Y118 WeakPolarHBondContact O-CD1 3.5Å; Y94-Y118 PolarHBondContact O-N 2.81Å
95	R	92	Very high	93.5	Very high	139 Å²	139	56 Å²	56	53%	0.525	28%	0.278	S	S	.	.	S	Bend	trans	-114.4	-8	-177.4	-165.3	-172	63.3	71.5	-1.3	112.8
96	G	87.2	Confident	93.5	Very high	39 Å²	39	53.7 Å²	53.7	40%	0.402	28%	0.276	S	S	.	.	S	Bend	trans	-104.4	-157.3	-170.8	0	0	0	0	0	112.4	Y94	Y94-G96 WeakPolarHBondContact CD2-O 3.29Å
97	D	92.3	Very high	93.7	Very high	100 Å²	100	53.4 Å²	53.4	54%	0.535	27%	0.273	S	S	.	.			trans	-74.8	153.6	173.9	-175.8	36.5	0	0	0	111.4	S99 D100	D97-S99 PolarHBondContact O-N 3.43Å; D97-S99 VanDerWaalsContact OD2-CB 3.25Å; D97-S99 WeakPolarHBondContact OD2-CB 3.41Å; D97-S99 PolarHBondContact OD2-OG 3.25Å; D97-D100 PolarHBondContact O-N 3.15Å; D97-D100 VanDerWaalsContact O-N 3.15Å
98	D	91.5	Very high	93.7	Very high	95 Å²	95	53.5 Å²	53.5	51%	0.508	27%	0.274	S	S	.	.	H	α-helix	trans	-63.6	-27.7	-179.5	-71.7	-2.6	0	0	0	111.6	Y94 D100 V101 I102	Y94-D98 WeakPolarHBondContact CE2-OD1 3.23Å; Y94-D98 PolarHBondContact OH-OD1 3.37Å; D98-D100 PolarHBondContact O-N 3.49Å; D98-V101 VanDerWaalsContact O-CG2 3.26Å; D98-V101 WeakPolarHBondContact O-CG2 3.48Å; D98-V101 PolarHBondContact O-N 2.92Å; D98-I102 PolarHBondContact O-N 3.48Å; D98-I102 VanDerWaalsContact O-N 3.1Å
99	S	92.1	Very high	93.7	Very high	65 Å²	65	56 Å²	56	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-26.1	177	68.5	0	0	0	0	113.5	D97 V101 I102	D97-S99 PolarHBondContact O-N 3.43Å; D97-S99 VanDerWaalsContact OD2-CB 3.25Å; D97-S99 WeakPolarHBondContact OD2-CB 3.41Å; D97-S99 PolarHBondContact OD2-OG 3.25Å; S99-V101 VanDerWaalsContact C-N 3.35Å; S99-I102 VanDerWaalsContact O-CG2 3.25Å; S99-I102 WeakPolarHBondContact O-CG2 3.38Å
100	D	89.4	Confident	93.6	Very high	78 Å²	78	61.2 Å²	61.2	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-71.5	-34.2	179.1	-79.3	-34.4	0	0	0	111.9	D97 D98 R103	D97-D100 PolarHBondContact O-N 3.15Å; D97-D100 VanDerWaalsContact O-N 3.15Å; D98-D100 PolarHBondContact O-N 3.49Å; D100-R103 PolarHBondContact O-NE 2.95Å
101	V	93.3	Very high	93.4	Very high	6 Å²	6	63.6 Å²	63.6	4%	0.036	34%	0.342	C	S	.	.	H	α-helix	trans	-96.8	-16.5	-173.2	-56.8	0	0	0	0	113.5	T72 Y94 D98 S99 R103 L104 F115	T72-V101 HydrophobicContact CG2-CG1 3.33Å; Y94-V101 VanDerWaalsContact CB-CG1 3.45Å; Y94-V101 HydrophobicContact CD1-CG1 4.35Å; Y94-V101 HydrophobicContact CD1-CG2 4.49Å; Y94-V101 HydrophobicContact CD2-CG1 3.95Å; Y94-V101 HydrophobicContact CD2-CG2 4.32Å; Y94-V101 HydrophobicContact CE2-CG2 4.45Å; Y94-V101 HydrophobicContact CG-CG1 3.66Å; Y94-V101 HydrophobicContact CG-CG2 4.34Å; D98-V101 VanDerWaalsContact O-CG2 3.26Å; D98-V101 WeakPolarHBondContact O-CG2 3.48Å; D98-V101 PolarHBondContact O-N 2.92Å; S99-V101 VanDerWaalsContact C-N 3.35Å; V101-R103 PolarHBondContact O-N 2.97Å; V101-L104 VanDerWaalsContact O-CB 3.31Å; V101-L104 WeakPolarHBondContact O-CB 3.4Å; V101-L104 PolarHBondContact O-N 2.87Å; V101-F115 HydrophobicContact CB-CD1 3.94Å; V101-F115 HydrophobicContact CB-CE1 3.71Å; V101-F115 HydrophobicContact CG2-CD1 3.77Å; V101-F115 HydrophobicContact CG2-CE1 3.84Å; V101-F115 HydrophobicContact CG2-CG 4.33Å; V101-F115 HydrophobicContact CG2-CZ 4.45Å
102	I	92.6	Very high	93.3	Very high	112 Å²	112	64.2 Å²	64.2	57%	0.574	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-52.6	-34.7	-176.7	-160.2	171.4	0	0	0	113	D98 S99 L104 K105	D98-I102 PolarHBondContact O-N 3.48Å; D98-I102 VanDerWaalsContact O-N 3.1Å; S99-I102 VanDerWaalsContact O-CG2 3.25Å; S99-I102 WeakPolarHBondContact O-CG2 3.38Å; I102-L104 PolarHBondContact O-N 3.43Å; I102-K105 WeakPolarHBondContact O-CB 3.26Å; I102-K105 PolarHBondContact O-N 3.26Å
103	R	93	Very high	93.2	Very high	110 Å²	110	65 Å²	65	42%	0.415	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-62.4	-24	177.1	76.4	-175.9	86.1	-148.8	-0.3	113.5	R77 D100 V101 K105 V106	R77-R103 VanDerWaalsContact CZ-CZ 3.43Å; D100-R103 PolarHBondContact O-NE 2.95Å; V101-R103 PolarHBondContact O-N 2.97Å; R103-K105 VanDerWaalsContact C-N 3.32Å; R103-V106 VanDerWaalsContact O-CG2 3.29Å; R103-V106 WeakPolarHBondContact O-CG2 3.43Å
104	L	95.1	Very high	93.2	Very high	4 Å²	4	68.8 Å²	68.8	2%	0.021	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-80.3	-16.9	179	-61.4	174.4	0	0	0	111.8	A71 R77 C80 L92 V101 I102 V106 T107 F115	A71-L104 HydrophobicContact CB-CD1 3.99Å; R77-L104 HydrophobicContact CB-CD2 4.37Å; R77-L104 HydrophobicContact CG-CD2 3.99Å; C80-L104 HydrophobicContact CB-CD2 4.15Å; L92-L104 HydrophobicContact CD1-CB 3.84Å; L92-L104 HydrophobicContact CD1-CD1 3.92Å; L92-L104 HydrophobicContact CD1-CG 4.48Å; V101-L104 VanDerWaalsContact O-CB 3.31Å; V101-L104 WeakPolarHBondContact O-CB 3.4Å; V101-L104 PolarHBondContact O-N 2.87Å; I102-L104 PolarHBondContact O-N 3.43Å; L104-V106 PolarHBondContact O-N 3.49Å; L104-V106 VanDerWaalsContact O-N 3.17Å; L104-T107 HydrophobicContact CD2-CG2 4.22Å; L104-T107 WeakPolarHBondContact O-CB 3.28Å; L104-T107 PolarHBondContact O-N 2.63Å; L104-T107 PolarHBondContact O-OG1 2.85Å; L104-F115 HydrophobicContact CB-CE1 4.12Å; L104-F115 HydrophobicContact CB-CZ 4.29Å
105	K	94.1	Very high	93.1	Very high	145 Å²	145	70.7 Å²	70.7	63%	0.63	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.6	179.4	-170	175.9	-179.3	177.7	0	112.4	I102 R103 T107 F115	I102-K105 WeakPolarHBondContact O-CB 3.26Å; I102-K105 PolarHBondContact O-N 3.26Å; R103-K105 VanDerWaalsContact C-N 3.32Å; K105-T107 VanDerWaalsContact C-N 3.34Å; K105-F115 HydrophobicContact CB-CE2 4.13Å; K105-F115 HydrophobicContact CB-CZ 4.12Å; K105-F115 HydrophobicContact CG-CE2 4.4Å
106	V	94.3	Very high	93.3	Very high	103 Å²	103	67 Å²	67	62%	0.624	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-7.1	-179.5	-60.9	0	0	0	0	114	R58 R103 L104	R58-V106 PolarHBondContact NH1-O 2.91Å; R58-V106 PolarHBondContact NH2-O 2.94Å; R103-V106 VanDerWaalsContact O-CG2 3.29Å; R103-V106 WeakPolarHBondContact O-CG2 3.43Å; L104-V106 PolarHBondContact O-N 3.49Å; L104-V106 VanDerWaalsContact O-N 3.17Å
107	T	94.3	Very high	93.7	Very high	17 Å²	17	71 Å²	71	10%	0.104	37%	0.372	C	S	.	.	S	Bend	trans	-73.3	-30.9	-174.7	60.3	0	0	0	0	113.7	N81 L104 K105	N81-T107 HydrophobicContact CB-CG2 4.42Å; L104-T107 HydrophobicContact CD2-CG2 4.22Å; L104-T107 WeakPolarHBondContact O-CB 3.28Å; L104-T107 PolarHBondContact O-N 2.63Å; L104-T107 PolarHBondContact O-OG1 2.85Å; K105-T107 VanDerWaalsContact C-N 3.34Å
108	G	92.6	Very high	93.8	Very high	2 Å²	2	67 Å²	67	2%	0.021	35%	0.35	C	S	.	.	S	Bend	trans	-120.2	170.9	178	0	0	0	0	0	112.5	R58	R58-G108 PolarHBondContact NH2-O 2.95Å
109	D	94.8	Very high	94	Very high	54 Å²	54	65 Å²	65	29%	0.289	34%	0.34	S	S	.	.			trans	-72.3	173.7	172.7	-150.5	-7.9	0	0	0	112.1	R58 S59 G111 Q112	R58-D109 HydrophobicContact CG-CB 4.25Å; S59-D109 WeakPolarHBondContact CA-OD2 3.43Å; S59-D109 WeakPolarHBondContact CB-OD2 3.3Å; S59-D109 PolarHBondContact OG-OD2 3.47Å; D109-G111 PolarHBondContact O-N 2.81Å; D109-Q112 HydrophobicContact CB-CG 4.02Å; D109-Q112 WeakPolarHBondContact O-CB 3.49Å; D109-Q112 PolarHBondContact O-N 2.83Å
110	L	93.8	Very high	94.1	Very high	164 Å²	164	62.4 Å²	62.4	86%	0.859	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	130.5	175.7	-64.6	172.3	0	0	0	110.9	Q112	L110-Q112 PolarHBondContact O-N 2.92Å
111	G	92.2	Very high	94.3	Very high	51 Å²	51	63.4 Å²	63.4	53%	0.526	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	-7.4	-178.6	0	0	0	0	0	115.7	Q89 D109	Q89-G111 PolarHBondContact NE2-O 2.95Å; Q89-G111 VanDerWaalsContact NE2-O 3.12Å; D109-G111 PolarHBondContact O-N 2.81Å
112	Q	93.8	Very high	94.4	Very high	31 Å²	31	66.3 Å²	66.3	15%	0.145	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-25.3	177	-62.8	-63	-24.5	0	0	112.8	Q89 M90 D109 L110	Q89-Q112 CarbonylContact C-O 3.48Å; Q89-Q112 WeakPolarHBondContact CA-O 3.29Å; M90-Q112 PolarHBondContact N-O 3.47Å; D109-Q112 HydrophobicContact CB-CG 4.02Å; D109-Q112 WeakPolarHBondContact O-CB 3.49Å; D109-Q112 PolarHBondContact O-N 2.83Å; L110-Q112 PolarHBondContact O-N 2.92Å
113	V	96.1	Very high	94.6	Very high	20 Å²	20	63.5 Å²	63.5	12%	0.121	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	114	-179.4	-171.9	0	0	0	0	109.6	M90 L92 F115	M90-V113 HydrophobicContact CE-CG2 3.88Å; L92-V113 HydrophobicContact CD1-CG1 3.49Å; L92-V113 VanDerWaalsContact CD1-CG1 3.49Å; L92-V113 HydrophobicContact CG-CG1 4.21Å; V113-F115 HydrophobicContact CG1-CE1 4.18Å; V113-F115 HydrophobicContact CG1-CE2 4.2Å; V113-F115 HydrophobicContact CG1-CZ 3.85Å
114	L	95.6	Very high	94.8	Very high	79 Å²	79	60.6 Å²	60.6	41%	0.414	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.2	178.6	-61.4	175.5	0	0	0	109.4	M90 I91 L92	M90-L114 PolarHBondContact O-N 2.87Å; I91-L114 CarbonylContact C-O 3.56Å; I91-L114 WeakPolarHBondContact CA-O 3.46Å; L92-L114 PolarHBondContact N-O 2.86Å
115	F	95.8	Very high	94.8	Very high	71 Å²	71	61.1 Å²	61.1	31%	0.311	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	139.7	175.1	-61.2	-71.5	0	0	0	110.1	L92 Y94 V101 L104 K105 V113	L92-F115 HydrophobicContact CB-CD1 4.03Å; L92-F115 HydrophobicContact CB-CE1 4.35Å; L92-F115 HydrophobicContact CD1-CD1 4.33Å; L92-F115 HydrophobicContact CD1-CE1 3.84Å; Y94-F115 HydrophobicContact CD1-CB 4.24Å; Y94-F115 HydrophobicContact CE1-CB 3.82Å; V101-F115 HydrophobicContact CB-CD1 3.94Å; V101-F115 HydrophobicContact CB-CE1 3.71Å; V101-F115 HydrophobicContact CG2-CD1 3.77Å; V101-F115 HydrophobicContact CG2-CE1 3.84Å; V101-F115 HydrophobicContact CG2-CG 4.33Å; V101-F115 HydrophobicContact CG2-CZ 4.45Å; L104-F115 HydrophobicContact CB-CE1 4.12Å; L104-F115 HydrophobicContact CB-CZ 4.29Å; K105-F115 HydrophobicContact CB-CE2 4.13Å; K105-F115 HydrophobicContact CB-CZ 4.12Å; K105-F115 HydrophobicContact CG-CE2 4.4Å; V113-F115 HydrophobicContact CG1-CE1 4.18Å; V113-F115 HydrophobicContact CG1-CE2 4.2Å; V113-F115 HydrophobicContact CG1-CZ 3.85Å
116	H	94.8	Very high	94.9	Very high	60 Å²	60	54.2 Å²	54.2	28%	0.278	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	128.2	177	-167.6	76.6	0	0	0	109.9	I91 L92 P93 Y94	I91-H116 HydrophobicContact CG2-CB 4.33Å; L92-H116 PolarHBondContact O-N 2.89Å; L92-H116 VanDerWaalsContact O-N 3.16Å; P93-H116 CarbonylContact C-O 3.46Å; P93-H116 WeakPolarHBondContact CA-O 3.21Å; Y94-H116 VanDerWaalsContact CD1-O 3.23Å; Y94-H116 WeakPolarHBondContact CD1-O 3.36Å; Y94-H116 PolarHBondContact N-O 3.27Å
117	F	95.5	Very high	95.1	Very high	123 Å²	123	55.4 Å²	55.4	54%	0.539	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	135.4	174.6	-179.3	-95.7	0	0	0	109.8	Y94	Y94-F117 HydrophobicContact CE2-CD2 4.48Å; Y94-F117 WeakPolarHBondContact O-CA 3.45Å
118	Y	95.8	Very high	95.1	Very high	16 Å²	16	59.2 Å²	59.2	6%	0.063	31%	0.314	C	S	.	.			trans	-146.4	158.3	175.3	86.1	-66	0	0	0	112.5	F69 P93 Y94 L120 I126	F69-Y118 HydrophobicContact CD1-CD2 4.14Å; F69-Y118 HydrophobicContact CD1-CE1 4.37Å; F69-Y118 AromaticContact CD1-CE2 3.61Å; F69-Y118 HydrophobicContact CD1-CE2 3.61Å; F69-Y118 AromaticContact CD1-CZ 3.73Å; F69-Y118 AromaticContact CE1-CD2 3.9Å; F69-Y118 HydrophobicContact CE1-CD2 3.9Å; F69-Y118 AromaticContact CE1-CE2 3.84Å; F69-Y118 HydrophobicContact CE1-CE2 3.84Å; F69-Y118 HydrophobicContact CE1-CG 4.42Å; P93-Y118 VanDerWaalsContact C-CD1 3.43Å; P93-Y118 HydrophobicContact CB-CD1 3.17Å; P93-Y118 HydrophobicContact CB-CD2 4.4Å; P93-Y118 HydrophobicContact CB-CE1 3.43Å; P93-Y118 VanDerWaalsContact CB-CE1 3.43Å; P93-Y118 HydrophobicContact CB-CG 3.7Å; P93-Y118 WeakPolarHBondContact O-CE1 3.37Å; Y94-Y118 VanDerWaalsContact N-CD1 3.33Å; Y94-Y118 WeakPolarHBondContact O-CD1 3.5Å; Y94-Y118 PolarHBondContact O-N 2.81Å; Y118-L120 HydrophobicContact CE2-CD1 4.48Å; Y118-I126 HydrophobicContact CD2-CG1 4.13Å
119	N	95.1	Very high	95.3	Very high	54 Å²	54	59.2 Å²	59.2	29%	0.289	31%	0.313	S	S	.	.			trans	-120	138.1	167.8	-170.7	-1.4	0	0	0	109.8	E121 D122 S125	N119-E121 PolarHBondContact O-N 3.32Å; N119-E121 PolarHBondContact OD1-N 2.88Å; N119-D122 HydrophobicContact CB-CB 4.18Å; N119-D122 PolarHBondContact O-N 2.77Å; N119-S125 PolarHBondContact N-OG 3.34Å; N119-S125 VanDerWaalsContact N-OG 3.16Å; N119-S125 PolarHBondContact O-OG 2.89Å
120	L	93.9	Very high	95.3	Very high	11 Å²	11	56.6 Å²	56.6	6%	0.058	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-22.2	-177.7	-169.8	62.8	0	0	0	113	Y118 V140 V154 R161 I162	Y118-L120 HydrophobicContact CE2-CD1 4.48Å; L120-V140 HydrophobicContact CD2-CG1 4.19Å; L120-V154 HydrophobicContact CD2-CG1 4.33Å; L120-R161 PolarHBondContact O-NH1 2.6Å; L120-I162 HydrophobicContact CD1-CD1 3.86Å; L120-I162 HydrophobicContact CD1-CG1 4.32Å
121	E	94.4	Very high	95.3	Very high	99 Å²	99	55.3 Å²	55.3	46%	0.463	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-22	176.1	-64	-174.6	141.9	0	0	113.3	N119 P123 F149	N119-E121 PolarHBondContact O-N 3.32Å; N119-E121 PolarHBondContact OD1-N 2.88Å; E121-P123 VanDerWaalsContact O-CD 3.24Å; E121-P123 WeakPolarHBondContact O-CD 3.27Å; E121-F149 HydrophobicContact CG-CE1 3.95Å
122	D	95.5	Very high	95.2	Very high	66 Å²	66	59.1 Å²	59.1	35%	0.353	29%	0.291	S	S	.	.			trans	-93.8	105.6	-178.1	174.2	32.5	0	0	0	111	N119 A124 S125 I126	N119-D122 HydrophobicContact CB-CB 4.18Å; N119-D122 PolarHBondContact O-N 2.77Å; D122-A124 PolarHBondContact O-N 3.34Å; D122-A124 WeakPolarHBondContact OD1-CB 3.46Å; D122-A124 PolarHBondContact OD1-N 2.83Å; D122-A124 VanDerWaalsContact OD1-N 3.13Å; D122-S125 PolarHBondContact O-OG 3.06Å; D122-S125 VanDerWaalsContact OD2-CB 3.24Å; D122-S125 WeakPolarHBondContact OD2-CB 3.41Å; D122-S125 PolarHBondContact OD2-N 3.32Å; D122-S125 PolarHBondContact OD2-OG 3.1Å; D122-I126 PolarHBondContact O-N 3.31Å
123	P	95.9	Very high	95.2	Very high	54 Å²	54	58.2 Å²	58.2	35%	0.351	29%	0.288	S	S	.	.	H	α-helix	trans	-66	-23.8	-179.6	28.9	-35.8	0	0	0	113.3	E121 R127 I165	E121-P123 VanDerWaalsContact O-CD 3.24Å; E121-P123 WeakPolarHBondContact O-CD 3.27Å; P123-R127 WeakPolarHBondContact O-CB 3.31Å; P123-R127 PolarHBondContact O-N 3.33Å; P123-I165 HydrophobicContact CB-CD1 3.79Å
124	A	96.6	Very high	95.1	Very high	49 Å²	49	57.9 Å²	57.9	41%	0.405	29%	0.285	S	S	.	.	H	α-helix	trans	-67.5	-50.8	179.8	0	0	0	0	0	110.8	D122 I126 R127 D128	D122-A124 PolarHBondContact O-N 3.34Å; D122-A124 WeakPolarHBondContact OD1-CB 3.46Å; D122-A124 PolarHBondContact OD1-N 2.83Å; D122-A124 VanDerWaalsContact OD1-N 3.13Å; A124-I126 VanDerWaalsContact C-N 3.28Å; A124-I126 PolarHBondContact O-N 3.11Å; A124-R127 WeakPolarHBondContact O-CB 3.36Å; A124-R127 PolarHBondContact O-N 3.29Å; A124-D128 PolarHBondContact O-N 3.01Å
125	S	95.9	Very high	95.1	Very high	14 Å²	14	54.3 Å²	54.3	10%	0.098	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-35.7	176	68.2	0	0	0	0	113.6	N119 D122 A129	N119-S125 PolarHBondContact N-OG 3.34Å; N119-S125 VanDerWaalsContact N-OG 3.16Å; N119-S125 PolarHBondContact O-OG 2.89Å; D122-S125 PolarHBondContact O-OG 3.06Å; D122-S125 VanDerWaalsContact OD2-CB 3.24Å; D122-S125 WeakPolarHBondContact OD2-CB 3.41Å; D122-S125 PolarHBondContact OD2-N 3.32Å; D122-S125 PolarHBondContact OD2-OG 3.1Å; S125-A129 PolarHBondContact O-N 3.4Å; S125-A129 VanDerWaalsContact O-N 3.14Å
126	I	97.1	Very high	95.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-42.4	174.8	-62.2	172.1	0	0	0	110.5	F69 Y118 D122 A124 D128 A129 V130 I162 I165	F69-I126 HydrophobicContact CE1-CG2 4.37Å; F69-I126 HydrophobicContact CZ-CG2 3.85Å; Y118-I126 HydrophobicContact CD2-CG1 4.13Å; D122-I126 PolarHBondContact O-N 3.31Å; A124-I126 VanDerWaalsContact C-N 3.28Å; A124-I126 PolarHBondContact O-N 3.11Å; I126-D128 VanDerWaalsContact C-N 3.34Å; I126-A129 PolarHBondContact O-N 3.42Å; I126-V130 WeakPolarHBondContact O-CG2 3.2Å; I126-V130 PolarHBondContact O-N 2.85Å; I126-V130 VanDerWaalsContact O-N 3.15Å; I126-I162 HydrophobicContact CD1-CG1 4.43Å; I126-I162 HydrophobicContact CG2-CG1 4.37Å; I126-I165 HydrophobicContact CB-CD1 3.79Å; I126-I165 HydrophobicContact CD1-CD1 4.29Å; I126-I165 HydrophobicContact CG2-CB 4.16Å; I126-I165 HydrophobicContact CG2-CD1 3.69Å; I126-I165 HydrophobicContact CG2-CG2 4.01Å
127	R	96.6	Very high	95.3	Very high	129 Å²	129	48 Å²	48	49%	0.487	24%	0.238	S	C	.	.	H	α-helix	trans	-63.3	-41.7	178.7	-173.3	178.6	-73.6	156.8	-5	111.5	P123 A124 A129 V130 K131 I165 E168	P123-R127 WeakPolarHBondContact O-CB 3.31Å; P123-R127 PolarHBondContact O-N 3.33Å; A124-R127 WeakPolarHBondContact O-CB 3.36Å; A124-R127 PolarHBondContact O-N 3.29Å; R127-A129 VanDerWaalsContact C-N 3.33Å; R127-A129 PolarHBondContact O-N 3.25Å; R127-V130 PolarHBondContact O-N 2.98Å; R127-K131 PolarHBondContact O-N 3.5Å; R127-I165 HydrophobicContact CB-CG2 3.93Å; R127-I165 HydrophobicContact CG-CG2 4.37Å; R127-E168 IonicContact CZ-OE2 3.12Å; R127-E168 IonicContact NE-OE2 3.36Å; R127-E168 IonicContact NH2-OE2 2.76Å; R127-E168 PolarHBondContact NH2-OE2 3.46Å
128	D	96.2	Very high	95.5	Very high	97 Å²	97	42.3 Å²	42.3	52%	0.519	21%	0.213	S	C	.	.	H	α-helix	trans	-63.5	-39.9	177.7	-71.6	-20.4	0	0	0	111.9	A124 I126	A124-D128 PolarHBondContact O-N 3.01Å; I126-D128 VanDerWaalsContact C-N 3.34Å
129	A	96	Very high	95.5	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-44	174.5	0	0	0	0	0	113.1	T67 F69 I91 P93 S125 I126 R127	T67-A129 HydrophobicContact CG2-CB 4.4Å; T67-A129 PolarHBondContact OG1-O 2.77Å; T67-A129 VanDerWaalsContact OG1-O 3.13Å; F69-A129 HydrophobicContact CZ-CB 4.33Å; I91-A129 WeakPolarHBondContact CD1-O 3.39Å; P93-A129 HydrophobicContact CG-CB 3.79Å; S125-A129 PolarHBondContact O-N 3.4Å; S125-A129 VanDerWaalsContact O-N 3.14Å; I126-A129 PolarHBondContact O-N 3.42Å; R127-A129 VanDerWaalsContact C-N 3.33Å; R127-A129 PolarHBondContact O-N 3.25Å
130	V	95.5	Very high	95.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-86.6	-13	-173.3	-57.6	0	0	0	0	114.5	T67 F69 I126 R127 H132 S133 V136 I165 A169	T67-V130 HydrophobicContact CG2-CG1 4.25Å; F69-V130 HydrophobicContact CE2-CG1 3.76Å; F69-V130 HydrophobicContact CZ-CG1 3.82Å; I126-V130 WeakPolarHBondContact O-CG2 3.2Å; I126-V130 PolarHBondContact O-N 2.85Å; I126-V130 VanDerWaalsContact O-N 3.15Å; R127-V130 PolarHBondContact O-N 2.98Å; V130-H132 PolarHBondContact O-N 3.35Å; V130-S133 WeakPolarHBondContact O-CB 3.27Å; V130-S133 PolarHBondContact O-N 2.9Å; V130-V136 HydrophobicContact CB-CG2 4.31Å; V130-V136 HydrophobicContact CG1-CG2 3.89Å; V130-I165 HydrophobicContact CG2-CG2 3.79Å; V130-A169 HydrophobicContact CG2-CB 3.79Å
131	K	92.2	Very high	95.6	Very high	136 Å²	136	42.1 Å²	42.1	59%	0.591	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.5	-34.6	-169.5	-176.1	179	177.3	-177.8	0	115.5	R127	R127-K131 PolarHBondContact O-N 3.5Å
132	H	91.1	Very high	95.6	Very high	132 Å²	132	42 Å²	42	61%	0.611	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.2	13.4	-176.3	-62.8	-63.1	0	0	0	113.7	V65 V130	V65-H132 WeakPolarHBondContact CG1-O 3.29Å; V130-H132 PolarHBondContact O-N 3.35Å
133	S	93.7	Very high	95.4	Very high	12 Å²	12	39.8 Å²	39.8	8%	0.084	21%	0.205	C	C	.	.			trans	-96.1	138.9	-176.3	-62	0	0	0	0	112.5	V65 T67 V130	V65-S133 VanDerWaalsContact O-CA 3.31Å; V65-S133 WeakPolarHBondContact O-CA 3.35Å; V65-S133 WeakPolarHBondContact O-CB 3.39Å; T67-S133 PolarHBondContact OG1-OG 3.3Å; V130-S133 WeakPolarHBondContact O-CB 3.27Å; V130-S133 PolarHBondContact O-N 2.9Å
134	N	93.6	Very high	95.2	Very high	12 Å²	12	38.2 Å²	38.2	6%	0.064	19%	0.193	C	C	.	.	S	Bend	trans	-93.7	-24	167.6	58.8	-6.2	0	0	0	112.5	G63 V65 V171 E172 R173	G63-N134 PolarHBondContact O-ND2 2.76Å; V65-N134 PolarHBondContact N-OD1 3.42Å; V65-N134 PolarHBondContact O-N 2.9Å; V65-N134 PolarHBondContact O-OD1 3.48Å; N134-V171 VanDerWaalsContact O-CG1 3.28Å; N134-V171 WeakPolarHBondContact O-CG1 3.32Å; N134-E172 HydrophobicContact CB-CG 4.36Å; N134-E172 PolarHBondContact O-N 3.02Å; N134-R173 PolarHBondContact O-N 2.88Å; N134-R173 VanDerWaalsContact O-N 3.17Å
135	V	95.9	Very high	94.9	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.024	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.2	177	-176.6	0	0	0	0	109.8	I64 V65 A66 T67 I137 R173 A272	I64-V135 HydrophobicContact CG2-CB 4.17Å; I64-V135 HydrophobicContact CG2-CG2 3.71Å; V65-V135 PolarHBondContact O-N 3.1Å; A66-V135 CarbonylContact C-O 3.32Å; A66-V135 VanDerWaalsContact CA-O 3.27Å; A66-V135 WeakPolarHBondContact CA-O 3.48Å; A66-V135 HydrophobicContact CB-CB 4.41Å; T67-V135 PolarHBondContact N-O 2.82Å; V135-I137 HydrophobicContact CG1-CG1 4.07Å; V135-R173 CarbonylContact C-O 3.58Å; V135-R173 WeakPolarHBondContact CA-O 3.4Å; V135-R173 HydrophobicContact CG1-CB 4.37Å; V135-R173 HydrophobicContact CG2-CB 4.24Å; V135-A272 HydrophobicContact CG1-CB 4.07Å
136	V	97.4	Very high	94.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.8	171	175.3	0	0	0	0	108.9	T67 F69 V130 I162 A166 V171 R173 L174 I175	T67-V136 WeakPolarHBondContact O-CA 3.49Å; F69-V136 HydrophobicContact CD2-CG1 3.8Å; F69-V136 HydrophobicContact CE2-CG1 3.74Å; V130-V136 HydrophobicContact CB-CG2 4.31Å; V130-V136 HydrophobicContact CG1-CG2 3.89Å; V136-I162 HydrophobicContact CG1-CG2 4.04Å; V136-A166 HydrophobicContact CG2-CB 4.27Å; V136-V171 HydrophobicContact CB-CG1 4.12Å; V136-V171 HydrophobicContact CG2-CB 4.33Å; V136-V171 HydrophobicContact CG2-CG1 3.7Å; V136-V171 HydrophobicContact CG2-CG2 3.73Å; V136-R173 PolarHBondContact N-O 3.01Å; V136-L174 HydrophobicContact CB-CD1 3.76Å; V136-L174 HydrophobicContact CG1-CD1 3.6Å; V136-L174 CarbonylContact O-C 3.57Å; V136-L174 WeakPolarHBondContact O-CA 3.11Å; V136-I175 PolarHBondContact O-N 3.44Å
137	I	98.1	Very high	94.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.9	178.4	-55.6	172.8	0	0	0	107.9	T67 V68 F69 V79 L83 V135 L139 I175 I268	T67-I137 PolarHBondContact O-N 3.44Å; V68-I137 HydrophobicContact CG1-CB 4.47Å; V68-I137 HydrophobicContact CG2-CB 4.47Å; V68-I137 HydrophobicContact CG2-CD1 4.26Å; F69-I137 PolarHBondContact N-O 3.44Å; V79-I137 HydrophobicContact CG1-CD1 3.99Å; L83-I137 HydrophobicContact CD1-CD1 4Å; V135-I137 HydrophobicContact CG1-CG1 4.07Å; I137-L139 HydrophobicContact CG2-CD1 4.3Å; I137-L139 HydrophobicContact CG2-CD2 3.75Å; I137-L139 HydrophobicContact CG2-CG 3.86Å; I137-I175 WeakPolarHBondContact CA-O 3.34Å; I137-I175 HydrophobicContact CG1-CB 4.42Å; I137-I175 HydrophobicContact CG1-CD1 4.44Å; I137-I268 HydrophobicContact CD1-CG2 3.76Å; I137-I268 HydrophobicContact CG1-CG2 4.33Å; I137-I268 HydrophobicContact CG2-CG2 3.94Å
138	N	98.1	Very high	93.9	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	105.6	179.1	-177.5	8.9	0	0	0	111.1	V140 I175 H176 L177	N138-V140 WeakPolarHBondContact OD1-CB 3.46Å; N138-V140 PolarHBondContact OD1-N 3.4Å; N138-I175 PolarHBondContact N-O 2.87Å; N138-H176 PolarHBondContact ND2-ND1 3.29Å; N138-H176 VanDerWaalsContact ND2-ND1 3.19Å; N138-L177 PolarHBondContact O-N 3.45Å; N138-L177 VanDerWaalsContact O-N 3.08Å
139	L	97.6	Very high	93.8	Very high	24 Å²	24	46.7 Å²	46.7	13%	0.126	23%	0.228	C	C	.	.			trans	-111.7	13.8	175.6	-47.8	176.8	0	0	0	112	V68 F69 V75 G76 V79 I137 G141 L177 I268	V68-L139 HydrophobicContact CG1-CD1 4Å; F69-L139 WeakPolarHBondContact O-CA 3.45Å; F69-L139 WeakPolarHBondContact O-CB 3.41Å; F69-L139 PolarHBondContact O-N 3.44Å; V75-L139 HydrophobicContact CG1-CD1 4.3Å; V75-L139 HydrophobicContact CG1-CD2 4.49Å; G76-L139 VanDerWaalsContact CA-CD1 3.48Å; V79-L139 HydrophobicContact CB-CD1 4.36Å; V79-L139 HydrophobicContact CG2-CD1 4.08Å; I137-L139 HydrophobicContact CG2-CD1 4.3Å; I137-L139 HydrophobicContact CG2-CD2 3.75Å; I137-L139 HydrophobicContact CG2-CG 3.86Å; L139-G141 PolarHBondContact O-N 2.92Å; L139-L177 HydrophobicContact CD2-CB 3.76Å; L139-L177 HydrophobicContact CD2-CD2 3.95Å; L139-L177 HydrophobicContact CD2-CG 4.37Å; L139-I268 HydrophobicContact CD2-CD1 4.1Å
140	V	96.9	Very high	93.7	Very high	22 Å²	22	52.6 Å²	52.6	13%	0.133	25%	0.253	C	S	.	.			trans	-69.8	127.7	-177.7	-178.4	0	0	0	0	109.4	F69 L120 N138 V154 I162	F69-V140 HydrophobicContact CB-CG2 3.64Å; L120-V140 HydrophobicContact CD2-CG1 4.19Å; N138-V140 WeakPolarHBondContact OD1-CB 3.46Å; N138-V140 PolarHBondContact OD1-N 3.4Å; V140-V154 HydrophobicContact CG1-CG1 3.78Å; V140-I162 HydrophobicContact CG2-CD1 4.41Å
141	G	94.2	Very high	93.6	Very high	31 Å²	31	53.1 Å²	53.1	32%	0.32	26%	0.256	S	S	.	.			trans	-178.3	154.1	176.9	0	0	0	0	0	111.9	L139	L139-G141 PolarHBondContact O-N 2.92Å
142	R	93.1	Very high	93.8	Very high	96 Å²	96	52.6 Å²	52.6	36%	0.362	25%	0.253	S	S	.	.			trans	-134.2	142.5	176.7	-160.3	67.1	173.3	-178.3	-8.4	109.4	F144 H155 W197	R142-F144 VanDerWaalsContact C-N 3.34Å; R142-F144 HydrophobicContact CG-CD2 4.16Å; R142-F144 HydrophobicContact CG-CE2 4.23Å; R142-F144 HydrophobicContact CG-CG 4.39Å; R142-F144 WeakPolarHBondContact CG-O 3.35Å; R142-H155 PolarHBondContact N-NE2 3.4Å; R142-H155 PolarHBondContact O-CE1 3.11Å; R142-H155 PolarHBondContact O-NE2 3.14Å; R142-W197 PolarHBondContact O-NE1 3.16Å
143	D	91.6	Very high	94	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.107	24%	0.235	C	C	.	.	S	Bend	trans	-81.7	-15.8	179.1	-66.6	-45.2	0	0	0	112.9	R229 H343 R349	D143-R229 WeakPolarHBondContact OD2-CD 3.34Å; D143-R229 IonicContact OD2-CZ 2.64Å; D143-R229 IonicContact OD2-NE 3.18Å; D143-R229 PolarHBondContact OD2-NE 2.93Å; D143-R229 VanDerWaalsContact OD2-NE 3.09Å; D143-R229 IonicContact OD2-NH1 3.62Å; D143-R229 PolarHBondContact OD2-NH1 3.41Å; D143-R229 IonicContact OD2-NH2 2.83Å; D143-H343 PolarHBondContact O-CE1 3.38Å; D143-H343 VanDerWaalsContact O-CE1 3.32Å; D143-H343 PolarHBondContact O-NE2 3.07Å; D143-R349 IonicContact OD1-CZ 3.26Å; D143-R349 IonicContact OD1-NH1 2.68Å; D143-R349 PolarHBondContact OD1-NH1 3.23Å; D143-R349 IonicContact OD1-NH2 3.46Å; D143-R349 PolarHBondContact OD1-NH2 2.55Å; D143-R349 VanDerWaalsContact OD1-NH2 3.12Å
144	F	91	Very high	94.1	Very high	21 Å²	21	48.6 Å²	48.6	9%	0.092	24%	0.236	C	C	.	.	S	Bend	trans	-138	152.8	-177.5	53.4	-100.4	0	0	0	110	R142 T146 G336 T337 P338 H343	R142-F144 VanDerWaalsContact C-N 3.34Å; R142-F144 HydrophobicContact CG-CD2 4.16Å; R142-F144 HydrophobicContact CG-CE2 4.23Å; R142-F144 HydrophobicContact CG-CG 4.39Å; R142-F144 WeakPolarHBondContact CG-O 3.35Å; F144-T146 HydrophobicContact CD2-CG2 4.17Å; F144-T146 HydrophobicContact CE2-CG2 3.98Å; F144-G336 WeakPolarHBondContact CE2-O 3.47Å; F144-G336 VanDerWaalsContact CZ-O 3.32Å; F144-G336 WeakPolarHBondContact CZ-O 3.24Å; F144-T337 HydrophobicContact CZ-CG2 4.37Å; F144-P338 HydrophobicContact CB-CG 4.12Å; F144-P338 HydrophobicContact CD1-CG 4.24Å; F144-P338 HydrophobicContact CG-CG 4.07Å; F144-H343 VanDerWaalsContact CB-CD2 3.44Å; F144-H343 WeakPolarHBondContact CB-CD2 3.28Å; F144-H343 WeakPolarHBondContact CB-NE2 3.34Å
145	E	90.8	Very high	94.3	Very high	77 Å²	77	48.3 Å²	48.3	36%	0.36	23%	0.234	S	C	.	.			trans	-77.4	151.4	174.2	-56.3	-159	130	0	0	110.9	F151	E145-F151 HydrophobicContact CG-CD1 4.02Å; E145-F151 HydrophobicContact CG-CD2 3.32Å; E145-F151 HydrophobicContact CG-CE1 3.99Å; E145-F151 HydrophobicContact CG-CE2 3.32Å; E145-F151 HydrophobicContact CG-CG 3.7Å; E145-F151 HydrophobicContact CG-CZ 3.67Å; E145-F151 WeakPolarHBondContact OE1-CD2 3.43Å; E145-F151 PolarHBondContact OE1-N 2.88Å
146	T	89.8	Confident	94.3	Very high	37 Å²	37	48.2 Å²	48.2	23%	0.227	23%	0.234	C	C	.	.			trans	-118.4	162.7	172	61.7	0	0	0	0	108.9	F144 N148 F149	F144-T146 HydrophobicContact CD2-CG2 4.17Å; F144-T146 HydrophobicContact CE2-CG2 3.98Å; T146-N148 PolarHBondContact O-N 2.96Å; T146-N148 VanDerWaalsContact O-N 3.11Å; T146-F149 PolarHBondContact N-O 3.49Å; T146-F149 CarbonylContact O-C 3.42Å; T146-F149 PolarHBondContact O-N 2.98Å; T146-F149 VanDerWaalsContact O-O 3.09Å; T146-F149 PolarHBondContact OG1-N 3.36Å; T146-F149 VanDerWaalsContact OG1-N 3.16Å; T146-F149 PolarHBondContact OG1-O 2.96Å
147	K	89	Confident	94.3	Very high	196 Å²	196	50.2 Å²	50.2	85%	0.852	25%	0.245	S	C	*	.	S	Bend	trans	-52.8	-36.9	179.7	-174.7	178.5	176.8	-178	0	113.2
148	N	91.2	Very high	94.2	Very high	125 Å²	125	50.3 Å²	50.3	67%	0.668	25%	0.245	S	C	*	.	S	Bend	trans	-94.8	-27.6	-175	-59.3	-9.6	0	0	0	113.1	T146	T146-N148 PolarHBondContact O-N 2.96Å; T146-N148 VanDerWaalsContact O-N 3.11Å
149	F	92.8	Very high	94.2	Very high	32 Å²	32	50.3 Å²	50.3	14%	0.14	25%	0.246	C	C	.	.			trans	-128.1	113.5	-177.4	-67.8	-79	0	0	0	110.6	E121 T146 V154	E121-F149 HydrophobicContact CG-CE1 3.95Å; T146-F149 PolarHBondContact N-O 3.49Å; T146-F149 CarbonylContact O-C 3.42Å; T146-F149 PolarHBondContact O-N 2.98Å; T146-F149 VanDerWaalsContact O-O 3.09Å; T146-F149 PolarHBondContact OG1-N 3.36Å; T146-F149 VanDerWaalsContact OG1-N 3.16Å; T146-F149 PolarHBondContact OG1-O 2.96Å; F149-V154 HydrophobicContact CB-CG2 3.81Å; F149-V154 HydrophobicContact CD1-CG2 4.34Å; F149-V154 HydrophobicContact CG-CG2 4.37Å
150	K	94	Very high	94.2	Very high	125 Å²	125	51.9 Å²	51.9	54%	0.543	25%	0.253	S	S	.	.			trans	-83.8	169	171.6	-60.1	-179.5	-180	-179.6	0	110.7	K152 D153 V154	K150-K152 VanDerWaalsContact C-N 3.3Å; K150-K152 PolarHBondContact O-N 3.28Å; K150-D153 WeakPolarHBondContact CB-OD2 3.33Å; K150-D153 PolarHBondContact N-OD2 3.42Å; K150-D153 PolarHBondContact O-N 3.46Å; K150-V154 PolarHBondContact O-N 3.36Å
151	F	94.3	Very high	94.2	Very high	11 Å²	11	54 Å²	54	5%	0.048	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-40.7	179.3	-71.4	-48.9	0	0	0	112.9	E145 D153 V154 H155 E196 W197	E145-F151 HydrophobicContact CG-CD1 4.02Å; E145-F151 HydrophobicContact CG-CD2 3.32Å; E145-F151 HydrophobicContact CG-CE1 3.99Å; E145-F151 HydrophobicContact CG-CE2 3.32Å; E145-F151 HydrophobicContact CG-CG 3.7Å; E145-F151 HydrophobicContact CG-CZ 3.67Å; E145-F151 WeakPolarHBondContact OE1-CD2 3.43Å; E145-F151 PolarHBondContact OE1-N 2.88Å; F151-D153 VanDerWaalsContact C-N 3.32Å; F151-D153 PolarHBondContact O-N 2.97Å; F151-V154 PolarHBondContact O-N 3.04Å; F151-H155 AromaticContact CD1-CE1 3.75Å; F151-H155 WeakPolarHBondContact O-CB 3.41Å; F151-H155 PolarHBondContact O-N 3.29Å; F151-E196 HydrophobicContact CD2-CB 4.32Å; F151-W197 AromaticContact CD1-CD1 3.95Å; F151-W197 AromaticContact CE1-CD1 3.55Å; F151-W197 HydrophobicContact CE1-CG 4.45Å; F151-W197 HydrophobicContact CE2-CB 4.48Å; F151-W197 HydrophobicContact CZ-CB 4.31Å
152	K	95.2	Very high	94.4	Very high	124 Å²	124	52.6 Å²	52.6	54%	0.539	24%	0.243	S	C	.	.	I	π-helix	trans	-61.8	-39.6	178.7	-170.9	175.4	-178	176.2	0	112.3	K150 V154 V156 N157	K150-K152 VanDerWaalsContact C-N 3.3Å; K150-K152 PolarHBondContact O-N 3.28Å; K152-V154 VanDerWaalsContact C-N 3.31Å; K152-V154 PolarHBondContact O-N 3.03Å; K152-V156 HydrophobicContact CG-CB 4.13Å; K152-V156 HydrophobicContact CG-CG2 4.17Å; K152-V156 WeakPolarHBondContact O-CA 3.45Å; K152-V156 VanDerWaalsContact O-CB 3.29Å; K152-V156 WeakPolarHBondContact O-CB 3.22Å; K152-V156 PolarHBondContact O-N 3.49Å; K152-N157 PolarHBondContact O-N 3.14Å
153	D	96	Very high	94.6	Very high	44 Å²	44	48.1 Å²	48.1	24%	0.235	23%	0.226	C	C	.	.	I	π-helix	trans	-67.3	-36.3	-178.2	-57.4	-40.6	0	0	0	111.8	K150 F151 N157 G158	K150-D153 WeakPolarHBondContact CB-OD2 3.33Å; K150-D153 PolarHBondContact N-OD2 3.42Å; K150-D153 PolarHBondContact O-N 3.46Å; F151-D153 VanDerWaalsContact C-N 3.32Å; F151-D153 PolarHBondContact O-N 2.97Å; D153-N157 PolarHBondContact OD1-ND2 3.04Å; D153-G158 PolarHBondContact O-N 3.15Å
154	V	95.9	Very high	94.9	Very high	17 Å²	17	52.8 Å²	52.8	10%	0.103	24%	0.243	C	C	.	.	I	π-helix	trans	-85	-54.2	-178.4	-176	0	0	0	0	111.8	L120 V140 F149 K150 F151 K152	L120-V154 HydrophobicContact CD2-CG1 4.33Å; V140-V154 HydrophobicContact CG1-CG1 3.78Å; F149-V154 HydrophobicContact CB-CG2 3.81Å; F149-V154 HydrophobicContact CD1-CG2 4.34Å; F149-V154 HydrophobicContact CG-CG2 4.37Å; K150-V154 PolarHBondContact O-N 3.36Å; F151-V154 PolarHBondContact O-N 3.04Å; K152-V154 VanDerWaalsContact C-N 3.31Å; K152-V154 PolarHBondContact O-N 3.03Å
155	H	96.9	Very high	95.2	Very high	5 Å²	5	51.9 Å²	51.9	2%	0.023	24%	0.239	C	C	.	.	I	π-helix	trans	-81.9	-32.8	-170.9	-60.3	156.4	0	0	0	113.3	R142 F151 A159 W197 S200 G204	R142-H155 PolarHBondContact N-NE2 3.4Å; R142-H155 PolarHBondContact O-CE1 3.11Å; R142-H155 PolarHBondContact O-NE2 3.14Å; F151-H155 AromaticContact CD1-CE1 3.75Å; F151-H155 WeakPolarHBondContact O-CB 3.41Å; F151-H155 PolarHBondContact O-N 3.29Å; H155-A159 WeakPolarHBondContact O-CB 3.29Å; H155-W197 AromaticContact CE1-CD1 3.48Å; H155-W197 VanDerWaalsContact CE1-CD1 3.48Å; H155-W197 AromaticContact CE1-NE1 3.3Å; H155-W197 PolarHBondContact CE1-NE1 2.93Å; H155-W197 VanDerWaalsContact CE1-NE1 3.3Å; H155-W197 AromaticContact NE2-NE1 3.89Å; H155-S200 PolarHBondContact ND1-OG 3.22Å; H155-G204 VanDerWaalsContact O-CA 3.25Å; H155-G204 WeakPolarHBondContact O-CA 3.32Å
156	V	97.2	Very high	95.4	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.018	22%	0.221	C	C	.	.	I	π-helix	trans	-97.8	-69.7	-177.8	-171.3	0	0	0	0	109.8	K152 G158 A159 E160 S200 E203 R207	K152-V156 HydrophobicContact CG-CB 4.13Å; K152-V156 HydrophobicContact CG-CG2 4.17Å; K152-V156 WeakPolarHBondContact O-CA 3.45Å; K152-V156 VanDerWaalsContact O-CB 3.29Å; K152-V156 WeakPolarHBondContact O-CB 3.22Å; K152-V156 PolarHBondContact O-N 3.49Å; V156-G158 PolarHBondContact O-N 2.68Å; V156-A159 PolarHBondContact O-N 3.34Å; V156-E160 VanDerWaalsContact O-CB 3.29Å; V156-E160 WeakPolarHBondContact O-CB 3.25Å; V156-E160 PolarHBondContact O-N 2.89Å; V156-S200 WeakPolarHBondContact CG2-O 3.43Å; V156-E203 HydrophobicContact CG2-CB 3.78Å; V156-R207 HydrophobicContact CG1-CG 3.77Å
157	N	97	Very high	95.6	Very high	42 Å²	42	53.4 Å²	53.4	23%	0.225	24%	0.237	C	C	.	.	I	π-helix	trans	-63.3	-44.2	-174.2	-62	-25.9	0	0	0	111.4	K152 D153 R161	K152-N157 PolarHBondContact O-N 3.14Å; D153-N157 PolarHBondContact OD1-ND2 3.04Å; N157-R161 WeakPolarHBondContact O-CB 3.43Å; N157-R161 WeakPolarHBondContact O-CG 3.44Å; N157-R161 PolarHBondContact O-N 3.32Å
158	G	96.8	Very high	95.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.01	22%	0.219	C	C	.	.	I	π-helix	trans	-64.4	-44.6	178.8	0	0	0	0	0	113.3	D153 V156 R161 I162	D153-G158 PolarHBondContact O-N 3.15Å; V156-G158 PolarHBondContact O-N 2.68Å; G158-R161 PolarHBondContact O-N 3.04Å; G158-I162 WeakPolarHBondContact O-CG1 3.32Å; G158-I162 PolarHBondContact O-N 3.13Å; G158-I162 VanDerWaalsContact O-N 3.14Å
159	A	97.5	Very high	96	Very high	3 Å²	3	45 Å²	45	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-67.9	-41.2	178.2	0	0	0	0	0	112.2	H155 V156 I162 A163 V208	H155-A159 WeakPolarHBondContact O-CB 3.29Å; V156-A159 PolarHBondContact O-N 3.34Å; A159-I162 PolarHBondContact O-N 3.03Å; A159-A163 WeakPolarHBondContact O-CB 3.41Å; A159-A163 PolarHBondContact O-N 3.08Å; A159-V208 HydrophobicContact CB-CG2 3.62Å
160	E	97.5	Very high	96	Very high	58 Å²	58	46.3 Å²	46.3	27%	0.271	23%	0.226	S	C	.	.	H	α-helix	trans	-59.8	-46.6	174.7	-174.5	179.5	158.9	0	0	111.6	V156 I162 A163 R164 R207	V156-E160 VanDerWaalsContact O-CB 3.29Å; V156-E160 WeakPolarHBondContact O-CB 3.25Å; V156-E160 PolarHBondContact O-N 2.89Å; E160-I162 PolarHBondContact O-N 3.01Å; E160-A163 PolarHBondContact O-N 3.08Å; E160-R164 WeakPolarHBondContact O-CB 3.42Å; E160-R164 PolarHBondContact O-N 3.19Å; E160-R207 HydrophobicContact CB-CB 3.96Å; E160-R207 HydrophobicContact CG-CB 4.14Å; E160-R207 IonicContact OE1-NH1 2.76Å; E160-R207 IonicContact OE2-CZ 3.85Å; E160-R207 IonicContact OE2-NE 3.62Å; E160-R207 IonicContact OE2-NH1 3.72Å; E160-R207 PolarHBondContact OE2-NH1 3.34Å
161	R	97.4	Very high	95.9	Very high	67 Å²	67	40.7 Å²	40.7	25%	0.253	20%	0.203	S	C	.	.	H	α-helix	trans	-59.1	-47.4	177.7	-75.7	172.3	-166.3	143.2	1.3	111.8	L120 N157 G158 R164 I165	L120-R161 PolarHBondContact O-NH1 2.6Å; N157-R161 WeakPolarHBondContact O-CB 3.43Å; N157-R161 WeakPolarHBondContact O-CG 3.44Å; N157-R161 PolarHBondContact O-N 3.32Å; G158-R161 PolarHBondContact O-N 3.04Å; R161-R164 PolarHBondContact O-N 2.82Å; R161-I165 WeakPolarHBondContact O-CB 3.14Å; R161-I165 WeakPolarHBondContact O-CD1 3.48Å; R161-I165 WeakPolarHBondContact O-CG1 3.38Å; R161-I165 PolarHBondContact O-N 3.13Å
162	I	97.6	Very high	95.8	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-46.9	177.5	-68.3	167.6	0	0	0	110.3	F69 L120 I126 V136 V140 G158 A159 E160 I165 A166	F69-I162 HydrophobicContact CB-CD1 4.22Å; F69-I162 HydrophobicContact CD1-CD1 4.22Å; F69-I162 HydrophobicContact CD2-CD1 4.12Å; F69-I162 HydrophobicContact CD2-CG1 4.41Å; F69-I162 HydrophobicContact CD2-CG2 3.82Å; F69-I162 HydrophobicContact CE2-CG1 4.39Å; F69-I162 HydrophobicContact CE2-CG2 3.78Å; F69-I162 HydrophobicContact CG-CD1 3.94Å; L120-I162 HydrophobicContact CD1-CD1 3.86Å; L120-I162 HydrophobicContact CD1-CG1 4.32Å; I126-I162 HydrophobicContact CD1-CG1 4.43Å; I126-I162 HydrophobicContact CG2-CG1 4.37Å; V136-I162 HydrophobicContact CG1-CG2 4.04Å; V140-I162 HydrophobicContact CG2-CD1 4.41Å; G158-I162 WeakPolarHBondContact O-CG1 3.32Å; G158-I162 PolarHBondContact O-N 3.13Å; G158-I162 VanDerWaalsContact O-N 3.14Å; A159-I162 PolarHBondContact O-N 3.03Å; E160-I162 PolarHBondContact O-N 3.01Å; I162-I165 PolarHBondContact O-N 3.3Å; I162-A166 VanDerWaalsContact O-CB 3.23Å; I162-A166 WeakPolarHBondContact O-CB 3.29Å; I162-A166 PolarHBondContact O-N 3.41Å
163	A	97.5	Very high	95.8	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-44.5	-178.9	0	0	0	0	0	112.5	A159 E160 A166 R167 L174 V208 A211 F212	A159-A163 WeakPolarHBondContact O-CB 3.41Å; A159-A163 PolarHBondContact O-N 3.08Å; E160-A163 PolarHBondContact O-N 3.08Å; A163-A166 PolarHBondContact O-N 2.86Å; A163-R167 PolarHBondContact O-N 2.97Å; A163-L174 HydrophobicContact CB-CD2 3.65Å; A163-V208 HydrophobicContact CB-CB 4.36Å; A163-V208 HydrophobicContact CB-CG1 4.14Å; A163-V208 HydrophobicContact CB-CG2 4.25Å; A163-A211 HydrophobicContact CB-CB 3.81Å; A163-F212 HydrophobicContact CB-CB 4.27Å
164	R	97.3	Very high	95.8	Very high	119 Å²	119	39.5 Å²	39.5	45%	0.449	20%	0.195	S	C	.	.	H	α-helix	trans	-61.9	-48.3	176.4	-175.4	-175.6	65.8	167.3	1.7	111.6	E160 R161 R167 E168 A211	E160-R164 WeakPolarHBondContact O-CB 3.42Å; E160-R164 PolarHBondContact O-N 3.19Å; R161-R164 PolarHBondContact O-N 2.82Å; R164-R167 WeakPolarHBondContact O-CB 3.36Å; R164-R167 PolarHBondContact O-N 2.84Å; R164-E168 IonicContact NE-OE1 3.43Å; R164-E168 WeakPolarHBondContact O-CG 3.24Å; R164-E168 PolarHBondContact O-N 3.2Å; R164-A211 HydrophobicContact CB-CB 4.47Å
165	I	96.7	Very high	95.9	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-37.6	-178.7	-66	166.6	0	0	0	111	P123 I126 R127 V130 R161 I162 R167 E168 A169	P123-I165 HydrophobicContact CB-CD1 3.79Å; I126-I165 HydrophobicContact CB-CD1 3.79Å; I126-I165 HydrophobicContact CD1-CD1 4.29Å; I126-I165 HydrophobicContact CG2-CB 4.16Å; I126-I165 HydrophobicContact CG2-CD1 3.69Å; I126-I165 HydrophobicContact CG2-CG2 4.01Å; R127-I165 HydrophobicContact CB-CG2 3.93Å; R127-I165 HydrophobicContact CG-CG2 4.37Å; V130-I165 HydrophobicContact CG2-CG2 3.79Å; R161-I165 WeakPolarHBondContact O-CB 3.14Å; R161-I165 WeakPolarHBondContact O-CD1 3.48Å; R161-I165 WeakPolarHBondContact O-CG1 3.38Å; R161-I165 PolarHBondContact O-N 3.13Å; I162-I165 PolarHBondContact O-N 3.3Å; I165-R167 VanDerWaalsContact C-N 3.31Å; I165-R167 PolarHBondContact O-N 2.84Å; I165-E168 PolarHBondContact O-N 3.44Å; I165-A169 WeakPolarHBondContact O-CB 3.48Å; I165-A169 PolarHBondContact O-N 2.64Å
166	A	95.8	Very high	96	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-40	173.4	0	0	0	0	0	111.8	V136 I162 A163 A169 G170 V171 L174	V136-A166 HydrophobicContact CG2-CB 4.27Å; I162-A166 VanDerWaalsContact O-CB 3.23Å; I162-A166 WeakPolarHBondContact O-CB 3.29Å; I162-A166 PolarHBondContact O-N 3.41Å; A163-A166 PolarHBondContact O-N 2.86Å; A166-A169 PolarHBondContact O-N 2.84Å; A166-G170 PolarHBondContact O-N 2.88Å; A166-V171 HydrophobicContact CB-CB 4.2Å; A166-V171 HydrophobicContact CB-CG2 4.01Å; A166-V171 WeakPolarHBondContact O-CB 3.4Å; A166-V171 VanDerWaalsContact O-CG2 3.3Å; A166-V171 WeakPolarHBondContact O-CG2 3.49Å; A166-V171 PolarHBondContact O-N 2.84Å; A166-L174 HydrophobicContact CB-CD1 4.38Å
167	R	94.7	Very high	96	Very high	147 Å²	147	39.4 Å²	39.4	56%	0.555	19%	0.194	S	C	*	.	H	α-helix	trans	-64.2	-46.4	173.3	-178	172.2	173.8	-177.9	-0	112.1	A163 R164 I165 A169 G170 A211 F212	A163-R167 PolarHBondContact O-N 2.97Å; R164-R167 WeakPolarHBondContact O-CB 3.36Å; R164-R167 PolarHBondContact O-N 2.84Å; I165-R167 VanDerWaalsContact C-N 3.31Å; I165-R167 PolarHBondContact O-N 2.84Å; R167-A169 VanDerWaalsContact C-N 3.26Å; R167-A169 PolarHBondContact O-N 3.22Å; R167-G170 PolarHBondContact O-N 3.14Å; R167-G170 VanDerWaalsContact O-N 3.12Å; R167-A211 WeakPolarHBondContact CD-O 3.24Å; R167-A211 PolarHBondContact NH1-O 3.04Å; R167-F212 HydrophobicContact CB-CD2 3.8Å; R167-F212 HydrophobicContact CB-CE2 4.34Å
168	E	95	Very high	95.9	Very high	100 Å²	100	37.7 Å²	37.7	47%	0.467	19%	0.185	S	C	.	.	H	α-helix	trans	-59.6	-36.6	177	-72.4	171.9	-162.7	0	0	112.3	R127 R164 I165 G170	R127-E168 IonicContact CZ-OE2 3.12Å; R127-E168 IonicContact NE-OE2 3.36Å; R127-E168 IonicContact NH2-OE2 2.76Å; R127-E168 PolarHBondContact NH2-OE2 3.46Å; R164-E168 IonicContact NE-OE1 3.43Å; R164-E168 WeakPolarHBondContact O-CG 3.24Å; R164-E168 PolarHBondContact O-N 3.2Å; I165-E168 PolarHBondContact O-N 3.44Å; E168-G170 VanDerWaalsContact C-N 3.27Å; E168-G170 PolarHBondContact O-N 3.44Å
169	A	93.5	Very high	95.9	Very high	44 Å²	44	38.2 Å²	38.2	36%	0.364	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.8	178.2	0	0	0	0	0	114	V130 I165 A166 R167 V171	V130-A169 HydrophobicContact CG2-CB 3.79Å; I165-A169 WeakPolarHBondContact O-CB 3.48Å; I165-A169 PolarHBondContact O-N 2.64Å; A166-A169 PolarHBondContact O-N 2.84Å; R167-A169 VanDerWaalsContact C-N 3.26Å; R167-A169 PolarHBondContact O-N 3.22Å; A169-V171 HydrophobicContact CB-CG2 4.29Å
170	G	92.1	Very high	95.7	Very high	59 Å²	59	38.6 Å²	38.6	61%	0.608	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.4	29	-179.5	0	0	0	0	0	114.3	A166 R167 E168 E172	A166-G170 PolarHBondContact O-N 2.88Å; R167-G170 PolarHBondContact O-N 3.14Å; R167-G170 VanDerWaalsContact O-N 3.12Å; E168-G170 VanDerWaalsContact C-N 3.27Å; E168-G170 PolarHBondContact O-N 3.44Å; G170-E172 PolarHBondContact O-N 2.87Å
171	V	93.1	Very high	95.5	Very high	8 Å²	8	36.5 Å²	36.5	5%	0.048	18%	0.181	C	C	.	.			trans	-62.1	132.7	177.2	175.8	0	0	0	0	110.2	N134 V136 A166 A169 R173 F212	N134-V171 VanDerWaalsContact O-CG1 3.28Å; N134-V171 WeakPolarHBondContact O-CG1 3.32Å; V136-V171 HydrophobicContact CB-CG1 4.12Å; V136-V171 HydrophobicContact CG2-CB 4.33Å; V136-V171 HydrophobicContact CG2-CG1 3.7Å; V136-V171 HydrophobicContact CG2-CG2 3.73Å; A166-V171 HydrophobicContact CB-CB 4.2Å; A166-V171 HydrophobicContact CB-CG2 4.01Å; A166-V171 WeakPolarHBondContact O-CB 3.4Å; A166-V171 VanDerWaalsContact O-CG2 3.3Å; A166-V171 WeakPolarHBondContact O-CG2 3.49Å; A166-V171 PolarHBondContact O-N 2.84Å; A169-V171 HydrophobicContact CB-CG2 4.29Å; V171-R173 VanDerWaalsContact CG1-O 3.26Å; V171-R173 WeakPolarHBondContact CG1-O 3.49Å; V171-F212 WeakPolarHBondContact O-CZ 3.49Å
172	E	92	Very high	95.3	Very high	92 Å²	92	33.7 Å²	33.7	43%	0.43	17%	0.172	S	C	.	.	S	Bend	trans	-74	-34.9	-176.1	-61.2	178	176.7	0	0	112.8	N134 G170	N134-E172 HydrophobicContact CB-CG 4.36Å; N134-E172 PolarHBondContact O-N 3.02Å; G170-E172 PolarHBondContact O-N 2.87Å
173	R	94	Very high	95	Very high	59 Å²	59	36.8 Å²	36.8	22%	0.223	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	126.3	-177.3	-65.9	-66.4	-175.8	-100.2	11.6	111.8	N134 V135 V136 V171 P275	N134-R173 PolarHBondContact O-N 2.88Å; N134-R173 VanDerWaalsContact O-N 3.17Å; V135-R173 CarbonylContact C-O 3.58Å; V135-R173 WeakPolarHBondContact CA-O 3.4Å; V135-R173 HydrophobicContact CG1-CB 4.37Å; V135-R173 HydrophobicContact CG2-CB 4.24Å; V136-R173 PolarHBondContact N-O 3.01Å; V171-R173 VanDerWaalsContact CG1-O 3.26Å; V171-R173 WeakPolarHBondContact CG1-O 3.49Å; R173-P275 PolarHBondContact NH2-O 3.04Å; R173-P275 VanDerWaalsContact NH2-O 3.12Å
174	L	96.9	Very high	94.7	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	123.3	169.8	179.3	67.5	0	0	0	109.1	V136 A163 A166 V208 F212 A215 T216	V136-L174 HydrophobicContact CB-CD1 3.76Å; V136-L174 HydrophobicContact CG1-CD1 3.6Å; V136-L174 CarbonylContact O-C 3.57Å; V136-L174 WeakPolarHBondContact O-CA 3.11Å; A163-L174 HydrophobicContact CB-CD2 3.65Å; A166-L174 HydrophobicContact CB-CD1 4.38Å; L174-V208 HydrophobicContact CD2-CG1 4.07Å; L174-F212 HydrophobicContact CB-CD1 3.96Å; L174-F212 HydrophobicContact CB-CD2 4.19Å; L174-F212 HydrophobicContact CB-CE1 3.95Å; L174-F212 HydrophobicContact CB-CE2 4.21Å; L174-F212 HydrophobicContact CB-CG 4.09Å; L174-F212 HydrophobicContact CB-CZ 4.09Å; L174-F212 HydrophobicContact CD2-CB 3.75Å; L174-F212 HydrophobicContact CD2-CD1 4.34Å; L174-F212 HydrophobicContact CD2-CD2 4.12Å; L174-F212 HydrophobicContact CD2-CG 3.82Å; L174-A215 HydrophobicContact CB-CB 4.23Å; L174-A215 HydrophobicContact CD2-CB 4.05Å; L174-A215 HydrophobicContact CG-CB 4.29Å; L174-A215 CarbonylContact O-C 3.37Å; L174-A215 WeakPolarHBondContact O-CA 3.41Å; L174-T216 PolarHBondContact O-N 3.24Å
175	I	97.5	Very high	94.4	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.8	174.7	-55.9	177.3	0	0	0	108.7	V136 I137 N138 T216 I218 I268 A271 A272	V136-I175 PolarHBondContact O-N 3.44Å; I137-I175 WeakPolarHBondContact CA-O 3.34Å; I137-I175 HydrophobicContact CG1-CB 4.42Å; I137-I175 HydrophobicContact CG1-CD1 4.44Å; N138-I175 PolarHBondContact N-O 2.87Å; I175-T216 CarbonylContact C-O 3.52Å; I175-T216 WeakPolarHBondContact CA-O 3.46Å; I175-I218 HydrophobicContact CG2-CD1 3.97Å; I175-I218 HydrophobicContact CG2-CG1 4.46Å; I175-I268 HydrophobicContact CD1-CG2 4.18Å; I175-I268 WeakPolarHBondContact CD1-O 3.4Å; I175-I268 HydrophobicContact CG2-CG2 4.37Å; I175-A271 HydrophobicContact CD1-CB 4.14Å; I175-A272 HydrophobicContact CD1-CB 3.8Å
176	H	98	Very high	93.9	Very high	4 Å²	4	40 Å²	40	2%	0.019	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.5	179.4	-176.7	66.9	0	0	0	111.5	N138 V208 T216 I217 I218	N138-H176 PolarHBondContact ND2-ND1 3.29Å; N138-H176 VanDerWaalsContact ND2-ND1 3.19Å; H176-V208 HydrophobicContact CB-CG1 3.99Å; H176-T216 PolarHBondContact N-O 3.16Å; H176-I217 HydrophobicContact CB-CG1 4.47Å; H176-I217 WeakPolarHBondContact O-CA 3.33Å; H176-I218 PolarHBondContact O-N 3.03Å
177	L	97.6	Very high	93.5	Very high	18 Å²	18	47.5 Å²	47.5	9%	0.094	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	106.9	176.4	-162.1	76.2	0	0	0	111.3	V75 N138 L139 K201 I218 P220 V264 I268	V75-L177 HydrophobicContact CG1-CD2 4.22Å; V75-L177 HydrophobicContact CG2-CD2 4.36Å; N138-L177 PolarHBondContact O-N 3.45Å; N138-L177 VanDerWaalsContact O-N 3.08Å; L139-L177 HydrophobicContact CD2-CB 3.76Å; L139-L177 HydrophobicContact CD2-CD2 3.95Å; L139-L177 HydrophobicContact CD2-CG 4.37Å; L177-K201 PolarHBondContact O-NZ 2.74Å; L177-I218 HydrophobicContact CD1-CB 3.98Å; L177-I218 HydrophobicContact CD1-CG2 3.94Å; L177-P220 HydrophobicContact CD1-CG 3.8Å; L177-P220 HydrophobicContact CD2-CG 4.33Å; L177-P220 HydrophobicContact CG-CG 3.96Å; L177-V264 HydrophobicContact CD1-CG1 4.26Å; L177-I268 HydrophobicContact CD1-CD1 4.45Å
178	S	96.5	Very high	93	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.035	25%	0.246	C	C	.	.			trans	-93.2	-138.8	177.1	-173.7	0	0	0	0	109.8	E205 I218 P220	S178-E205 WeakPolarHBondContact CB-OE2 3.5Å; S178-E205 PolarHBondContact OG-OE2 2.86Å; S178-I218 PolarHBondContact N-O 3.12Å; S178-P220 WeakPolarHBondContact O-CD 3.31Å
179	S	95.3	Very high	92.4	Very high	13 Å²	13	42.1 Å²	42.1	9%	0.091	24%	0.236	C	C	.	.			trans	-147.2	159.2	171.1	-173.5	0	0	0	0	109.9	V182 W197 R219 P220	S179-V182 WeakPolarHBondContact O-CG1 3.34Å; S179-V182 VanDerWaalsContact O-CG2 3.29Å; S179-V182 WeakPolarHBondContact O-CG2 3.49Å; S179-W197 WeakPolarHBondContact OG-CZ3 3.44Å; S179-R219 WeakPolarHBondContact O-CB 3.44Å; S179-R219 WeakPolarHBondContact O-CG 3.19Å; S179-P220 CarbonylContact C-O 3.59Å
180	L	94.8	Very high	91.8	Very high	10 Å²	10	42.7 Å²	42.7	5%	0.052	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-53.3	-177.3	-173.2	70	0	0	0	112.8	V182 P220 A221 Q283 V285 D354	L180-V182 PolarHBondContact O-N 3.26Å; L180-P220 WeakPolarHBondContact CB-O 3.48Å; L180-P220 PolarHBondContact N-O 2.91Å; L180-A221 HydrophobicContact CD2-CB 3.98Å; L180-Q283 HydrophobicContact CD1-CB 4.08Å; L180-Q283 HydrophobicContact CD1-CG 3.88Å; L180-V285 HydrophobicContact CD1-CG1 3.75Å; L180-V285 HydrophobicContact CD2-CG1 3.88Å; L180-V285 HydrophobicContact CG-CG1 4.47Å; L180-D354 HydrophobicContact CD2-CB 3.84Å
181	N	92.6	Very high	91.2	Very high	15 Å²	15	41.8 Å²	41.8	8%	0.08	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	36.2	-169.5	-57.3	-35.3	0	0	0	113	L198 V352 D354 K355	N181-L198 HydrophobicContact CB-CD1 4.28Å; N181-L198 HydrophobicContact CB-CD2 4.23Å; N181-V352 HydrophobicContact CB-CG1 4.04Å; N181-D354 PolarHBondContact ND2-OD1 3.31Å; N181-D354 WeakPolarHBondContact OD1-CA 3.34Å; N181-K355 PolarHBondContact OD1-N 3.16Å; N181-K355 VanDerWaalsContact OD1-N 3.08Å
182	V	92.7	Very high	90.7	Very high	8 Å²	8	50.8 Å²	50.8	5%	0.048	25%	0.25	C	S	.	.			trans	-78.3	121.2	179.8	-69.3	0	0	0	0	110.5	S179 L180 K201 Y202	S179-V182 WeakPolarHBondContact O-CG1 3.34Å; S179-V182 VanDerWaalsContact O-CG2 3.29Å; S179-V182 WeakPolarHBondContact O-CG2 3.49Å; L180-V182 PolarHBondContact O-N 3.26Å; V182-K201 HydrophobicContact CG1-CB 3.75Å; V182-Y202 HydrophobicContact CB-CD2 4.14Å; V182-Y202 HydrophobicContact CG2-CD2 4.29Å
183	E	91.7	Very high	90.3	Very high	66 Å²	66	48.4 Å²	48.4	31%	0.308	25%	0.251	S	S	.	.			trans	-141	150.8	179.3	-67.3	-179.3	177.8	0	0	109.2	N185 K355	E183-N185 VanDerWaalsContact C-N 3.3Å; E183-N185 PolarHBondContact O-N 2.82Å; E183-K355 WeakPolarHBondContact OE1-CD 3.18Å; E183-K355 IonicContact OE1-NZ 3.49Å; E183-K355 PolarHBondContact OE1-NZ 3.37Å; E183-K355 IonicContact OE2-NZ 3.15Å; E183-K355 PolarHBondContact OE2-NZ 3.32Å
184	A	90.9	Very high	90.1	Very high	43 Å²	43	45.7 Å²	45.7	36%	0.355	24%	0.241	S	C	.	.	S	Bend	trans	-62.2	-40	178.4	0	0	0	0	0	112.3	Y202	A184-Y202 HydrophobicContact CB-CD1 3.93Å; A184-Y202 HydrophobicContact CB-CE1 3.51Å
185	N	90.3	Very high	89.8	Confident	135 Å²	135	45.7 Å²	45.7	72%	0.722	24%	0.241	S	C	*	.	S	Bend	trans	-126.1	82.1	179.7	-64.7	-37.8	0	0	0	108.2	E183	E183-N185 VanDerWaalsContact C-N 3.3Å; E183-N185 PolarHBondContact O-N 2.82Å
186	P	88.2	Confident	89.6	Confident	9 Å²	9	51.2 Å²	51.2	6%	0.058	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-61.1	141.5	177.7	27	-33.7	0	0	0	109.9	D188 K199	P186-D188 PolarHBondContact O-N 3.32Å; P186-K199 HydrophobicContact CG-CB 4.18Å
187	K	86.1	Confident	89.3	Confident	158 Å²	158	52 Å²	52	69%	0.687	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-62.6	128.6	-179.8	-176.1	177.8	-179.1	177.4	0	111.3	L189	K187-L189 HydrophobicContact CD-CD2 4.42Å; K187-L189 PolarHBondContact O-N 2.74Å
188	D	83.9	Confident	89.2	Confident	86 Å²	86	51.2 Å²	51.2	46%	0.46	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-65.9	119	170.5	-61.2	15.7	0	0	0	110.3	P186 G193 G194	P186-D188 PolarHBondContact O-N 3.32Å; D188-G193 WeakPolarHBondContact OD1-CA 3.46Å; D188-G193 PolarHBondContact OD1-N 2.9Å; D188-G193 VanDerWaalsContact OD1-N 3.11Å; D188-G193 PolarHBondContact OD2-N 3.45Å; D188-G194 PolarHBondContact OD1-N 2.94Å
189	L	82.5	Confident	89.1	Confident	48 Å²	48	54.8 Å²	54.8	25%	0.251	28%	0.28	S	S	.	.	S	Bend	trans	-106.9	-64.4	170.5	-59.9	172.9	0	0	0	110.2	K187 W248 E348 A351 V352	K187-L189 HydrophobicContact CD-CD2 4.42Å; K187-L189 PolarHBondContact O-N 2.74Å; L189-W248 HydrophobicContact CB-CZ2 4.32Å; L189-W248 WeakPolarHBondContact O-CH2 3.34Å; L189-E348 WeakPolarHBondContact CA-OE1 3.38Å; L189-E348 VanDerWaalsContact CB-OE1 3.3Å; L189-E348 WeakPolarHBondContact CB-OE1 3.45Å; L189-E348 PolarHBondContact N-OE1 3.23Å; L189-A351 HydrophobicContact CD1-CB 3.59Å; L189-V352 HydrophobicContact CD1-CG2 4.01Å
190	Y	80.4	Confident	89.1	Confident	57 Å²	57	54.5 Å²	54.5	22%	0.224	28%	0.279	C	S	.	.	S	Bend	trans	-119.5	-38.8	178.7	145.9	-98.3	0	0	0	111.7	L324 K328 P344 E348	Y190-L324 HydrophobicContact CD2-CD1 4.09Å; Y190-L324 HydrophobicContact CD2-CD2 4.01Å; Y190-L324 HydrophobicContact CE1-CD2 4.34Å; Y190-L324 HydrophobicContact CE2-CD1 3.87Å; Y190-L324 HydrophobicContact CE2-CD2 3.67Å; Y190-L324 HydrophobicContact CE2-CG 4.31Å; Y190-L324 HydrophobicContact CG-CD2 4.49Å; Y190-K328 WeakPolarHBondContact OH-CE 3.32Å; Y190-P344 HydrophobicContact CE1-CB 3.91Å; Y190-E348 WeakPolarHBondContact CA-OE2 3.35Å; Y190-E348 WeakPolarHBondContact CB-OE2 3.36Å; Y190-E348 PolarHBondContact N-OE1 2.88Å; Y190-E348 PolarHBondContact N-OE2 3.2Å
191	V	81.5	Confident	89.2	Confident	39 Å²	39	54.7 Å²	54.7	24%	0.236	28%	0.279	C	S	.	.	S	Bend	trans	-85.2	127	173.9	-175	0	0	0	0	109.2	G193 G194 E348	V191-G193 PolarHBondContact O-N 3.44Å; V191-G194 PolarHBondContact O-N 2.95Å; V191-E348 HydrophobicContact CB-CG 4.31Å; V191-E348 HydrophobicContact CG2-CB 4.1Å; V191-E348 HydrophobicContact CG2-CG 4.27Å; V191-E348 PolarHBondContact N-OE2 3.44Å
192	K	82.6	Confident	89.4	Confident	197 Å²	197	57 Å²	57	86%	0.857	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	128.2	171.8	-66.8	-173.8	176.5	-174.8	0	109.3
193	G	82.6	Confident	89.6	Confident	43 Å²	43	60 Å²	60	44%	0.443	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	3.7	-172.3	0	0	0	0	0	115.3	D188 V191	D188-G193 WeakPolarHBondContact OD1-CA 3.46Å; D188-G193 PolarHBondContact OD1-N 2.9Å; D188-G193 VanDerWaalsContact OD1-N 3.11Å; D188-G193 PolarHBondContact OD2-N 3.45Å; V191-G193 PolarHBondContact O-N 3.44Å
194	G	88.9	Confident	89.8	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.01	29%	0.286	C	S	.	.	S	Bend	trans	70.9	-160.4	178.5	0	0	0	0	0	113.2	D188 V191 E196	D188-G194 PolarHBondContact OD1-N 2.94Å; V191-G194 PolarHBondContact O-N 2.95Å; G194-E196 PolarHBondContact O-N 3.44Å
195	S	91.5	Very high	90.1	Very high	2 Å²	2	55 Å²	55	1%	0.014	27%	0.27	C	S	.	.			trans	-78.2	105.7	-179.4	-171.7	0	0	0	0	111.5	W197 L198 K199	S195-W197 PolarHBondContact O-N 3.05Å; S195-W197 VanDerWaalsContact O-N 3.14Å; S195-L198 PolarHBondContact O-N 2.72Å; S195-K199 PolarHBondContact O-N 3.14Å; S195-K199 VanDerWaalsContact O-N 3.1Å
196	E	92.1	Very high	90.4	Very high	118 Å²	118	50.9 Å²	50.9	55%	0.551	25%	0.247	S	C	*	.	H	α-helix	trans	-55.2	-30.1	172	-65.6	-176.2	159.6	0	0	112.6	F151 G194 K199 S200	F151-E196 HydrophobicContact CD2-CB 4.32Å; G194-E196 PolarHBondContact O-N 3.44Å; E196-K199 PolarHBondContact O-N 3.07Å; E196-S200 WeakPolarHBondContact O-CB 3.06Å; E196-S200 PolarHBondContact O-N 2.77Å; E196-S200 PolarHBondContact O-OG 3.37Å
197	W	93.7	Very high	90.8	Very high	20 Å²	20	55.9 Å²	55.9	8%	0.076	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-46.4	175	-174.7	90.6	0	0	0	112	R142 F151 H155 S179 S195 S200 K201 R349	R142-W197 PolarHBondContact O-NE1 3.16Å; F151-W197 AromaticContact CD1-CD1 3.95Å; F151-W197 AromaticContact CE1-CD1 3.55Å; F151-W197 HydrophobicContact CE1-CG 4.45Å; F151-W197 HydrophobicContact CE2-CB 4.48Å; F151-W197 HydrophobicContact CZ-CB 4.31Å; H155-W197 AromaticContact CE1-CD1 3.48Å; H155-W197 VanDerWaalsContact CE1-CD1 3.48Å; H155-W197 AromaticContact CE1-NE1 3.3Å; H155-W197 PolarHBondContact CE1-NE1 2.93Å; H155-W197 VanDerWaalsContact CE1-NE1 3.3Å; H155-W197 AromaticContact NE2-NE1 3.89Å; S179-W197 WeakPolarHBondContact OG-CZ3 3.44Å; S195-W197 PolarHBondContact O-N 3.05Å; S195-W197 VanDerWaalsContact O-N 3.14Å; W197-S200 PolarHBondContact O-OG 3.05Å; W197-K201 HydrophobicContact CD2-CG 4.43Å; W197-K201 HydrophobicContact CH2-CG 4.28Å; W197-K201 HydrophobicContact CZ2-CG 4.16Å; W197-K201 HydrophobicContact CZ3-CG 4.46Å; W197-K201 WeakPolarHBondContact O-CG 3.21Å; W197-K201 PolarHBondContact O-N 3.5Å; W197-K201 VanDerWaalsContact O-N 3.11Å; W197-R349 VanDerWaalsContact CE2-NH1 3.34Å; W197-R349 VanDerWaalsContact CZ2-NH1 3.33Å
198	L	94.3	Very high	91.4	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-66.7	-41.2	177.4	-69.1	173.7	0	0	0	111.2	N181 S195 K201 Y202 V352	N181-L198 HydrophobicContact CB-CD1 4.28Å; N181-L198 HydrophobicContact CB-CD2 4.23Å; S195-L198 PolarHBondContact O-N 2.72Å; L198-K201 PolarHBondContact O-N 2.71Å; L198-Y202 PolarHBondContact O-N 3.33Å; L198-V352 HydrophobicContact CD1-CG1 4.46Å; L198-V352 HydrophobicContact CD1-CG2 4.23Å
199	K	94.6	Very high	92	Very high	80 Å²	80	49.8 Å²	49.8	35%	0.348	23%	0.231	S	C	.	.	H	α-helix	trans	-61.7	-48.2	176.9	-174.8	175.5	-179.5	176.2	0	112.3	P186 S195 E196 K201 Y202 E203	P186-K199 HydrophobicContact CG-CB 4.18Å; S195-K199 PolarHBondContact O-N 3.14Å; S195-K199 VanDerWaalsContact O-N 3.1Å; E196-K199 PolarHBondContact O-N 3.07Å; K199-K201 VanDerWaalsContact C-N 3.3Å; K199-K201 PolarHBondContact O-N 3.46Å; K199-Y202 WeakPolarHBondContact O-CB 3.41Å; K199-Y202 PolarHBondContact O-N 3.42Å; K199-Y202 VanDerWaalsContact O-N 3.16Å; K199-E203 WeakPolarHBondContact CE-OE1 3.32Å; K199-E203 PolarHBondContact O-N 3.2Å
200	S	95.6	Very high	92.7	Very high	8 Å²	8	52.5 Å²	52.5	6%	0.056	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-33.6	178.5	61.3	0	0	0	0	112.8	H155 V156 E196 W197 G204	H155-S200 PolarHBondContact ND1-OG 3.22Å; V156-S200 WeakPolarHBondContact CG2-O 3.43Å; E196-S200 WeakPolarHBondContact O-CB 3.06Å; E196-S200 PolarHBondContact O-N 2.77Å; E196-S200 PolarHBondContact O-OG 3.37Å; W197-S200 PolarHBondContact O-OG 3.05Å; S200-G204 PolarHBondContact O-N 3.02Å
201	K	96.1	Very high	93.4	Very high	14 Å²	14	50.6 Å²	50.6	6%	0.061	24%	0.242	C	C	.	.	H	α-helix	trans	-67.5	-40.8	172.1	-81.3	-73.6	-170.6	174.8	0	112.1	L177 V182 W197 L198 K199 G204 E205	L177-K201 PolarHBondContact O-NZ 2.74Å; V182-K201 HydrophobicContact CG1-CB 3.75Å; W197-K201 HydrophobicContact CD2-CG 4.43Å; W197-K201 HydrophobicContact CH2-CG 4.28Å; W197-K201 HydrophobicContact CZ2-CG 4.16Å; W197-K201 HydrophobicContact CZ3-CG 4.46Å; W197-K201 WeakPolarHBondContact O-CG 3.21Å; W197-K201 PolarHBondContact O-N 3.5Å; W197-K201 VanDerWaalsContact O-N 3.11Å; L198-K201 PolarHBondContact O-N 2.71Å; K199-K201 VanDerWaalsContact C-N 3.3Å; K199-K201 PolarHBondContact O-N 3.46Å; K201-G204 PolarHBondContact O-N 3Å; K201-E205 WeakPolarHBondContact O-CB 3.48Å; K201-E205 PolarHBondContact O-N 3.38Å
202	Y	96.3	Very high	94.1	Very high	64 Å²	64	49.5 Å²	49.5	25%	0.251	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-49.3	173.6	-177.9	-99.6	0	0	0	111.9	V182 A184 L198 K199 G204 E205 L206	V182-Y202 HydrophobicContact CB-CD2 4.14Å; V182-Y202 HydrophobicContact CG2-CD2 4.29Å; A184-Y202 HydrophobicContact CB-CD1 3.93Å; A184-Y202 HydrophobicContact CB-CE1 3.51Å; L198-Y202 PolarHBondContact O-N 3.33Å; K199-Y202 WeakPolarHBondContact O-CB 3.41Å; K199-Y202 PolarHBondContact O-N 3.42Å; K199-Y202 VanDerWaalsContact O-N 3.16Å; Y202-G204 VanDerWaalsContact C-N 3.33Å; Y202-G204 PolarHBondContact O-N 3.19Å; Y202-E205 WeakPolarHBondContact O-CB 3.18Å; Y202-E205 PolarHBondContact O-N 3.3Å; Y202-L206 HydrophobicContact CD1-CD1 4.11Å; Y202-L206 HydrophobicContact CE1-CD1 3.54Å; Y202-L206 HydrophobicContact CE1-CG 4.23Å; Y202-L206 PolarHBondContact O-N 3.13Å; Y202-L206 VanDerWaalsContact O-N 3.15Å
203	E	96.9	Very high	94.7	Very high	70 Å²	70	43.7 Å²	43.7	33%	0.327	22%	0.217	S	C	.	.	H	α-helix	trans	-60.5	-42.3	176.6	-71.8	178.3	-167.7	0	0	111.8	V156 K199 E205 L206 R207	V156-E203 HydrophobicContact CG2-CB 3.78Å; K199-E203 WeakPolarHBondContact CE-OE1 3.32Å; K199-E203 PolarHBondContact O-N 3.2Å; E203-E205 VanDerWaalsContact C-N 3.34Å; E203-E205 PolarHBondContact O-N 2.8Å; E203-L206 PolarHBondContact O-N 2.94Å; E203-R207 WeakPolarHBondContact O-CG 3.12Å; E203-R207 PolarHBondContact O-N 3.44Å; E203-R207 VanDerWaalsContact O-N 3.08Å
204	G	97	Very high	95.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-40.6	176.5	0	0	0	0	0	112.9	H155 S200 K201 Y202 L206 R207 V208	H155-G204 VanDerWaalsContact O-CA 3.25Å; H155-G204 WeakPolarHBondContact O-CA 3.32Å; S200-G204 PolarHBondContact O-N 3.02Å; K201-G204 PolarHBondContact O-N 3Å; Y202-G204 VanDerWaalsContact C-N 3.33Å; Y202-G204 PolarHBondContact O-N 3.19Å; G204-L206 PolarHBondContact O-N 2.99Å; G204-R207 PolarHBondContact O-N 3.34Å; G204-V208 VanDerWaalsContact O-CG2 3.29Å; G204-V208 WeakPolarHBondContact O-CG2 3.22Å; G204-V208 PolarHBondContact O-N 3.11Å
205	E	96.7	Very high	95.6	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.019	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-44.7	175.9	-170.7	-175.7	126.4	0	0	112.1	S178 K201 Y202 E203 V208 R209 I217 R219	S178-E205 WeakPolarHBondContact CB-OE2 3.5Å; S178-E205 PolarHBondContact OG-OE2 2.86Å; K201-E205 WeakPolarHBondContact O-CB 3.48Å; K201-E205 PolarHBondContact O-N 3.38Å; Y202-E205 WeakPolarHBondContact O-CB 3.18Å; Y202-E205 PolarHBondContact O-N 3.3Å; E203-E205 VanDerWaalsContact C-N 3.34Å; E203-E205 PolarHBondContact O-N 2.8Å; E205-V208 PolarHBondContact O-N 3.22Å; E205-R209 WeakPolarHBondContact O-CB 3.33Å; E205-R209 PolarHBondContact O-N 3.33Å; E205-I217 HydrophobicContact CG-CD1 3.57Å; E205-I217 HydrophobicContact CG-CG1 4.18Å; E205-I217 HydrophobicContact CG-CG2 3.79Å; E205-R219 IonicContact OE1-CZ 3.79Å; E205-R219 IonicContact OE1-NE 3.34Å; E205-R219 PolarHBondContact OE1-NE 3.37Å; E205-R219 IonicContact OE1-NH2 3.95Å; E205-R219 PolarHBondContact OE1-NH2 3.03Å; E205-R219 IonicContact OE2-CZ 3.99Å; E205-R219 IonicContact OE2-NE 3.55Å; E205-R219 PolarHBondContact OE2-NE 3.1Å; E205-R219 IonicContact OE2-NH2 2.81Å; E205-R219 PolarHBondContact OE2-NH2 3.14Å
206	L	96.9	Very high	95.8	Very high	49 Å²	49	46.5 Å²	46.5	26%	0.257	22%	0.222	S	C	.	.	H	α-helix	trans	-59.8	-47.8	175.8	-66.6	177.9	0	0	0	111.1	Y202 E203 G204 V208 R209 D210	Y202-L206 HydrophobicContact CD1-CD1 4.11Å; Y202-L206 HydrophobicContact CE1-CD1 3.54Å; Y202-L206 HydrophobicContact CE1-CG 4.23Å; Y202-L206 PolarHBondContact O-N 3.13Å; Y202-L206 VanDerWaalsContact O-N 3.15Å; E203-L206 PolarHBondContact O-N 2.94Å; G204-L206 PolarHBondContact O-N 2.99Å; L206-V208 PolarHBondContact O-N 3.46Å; L206-R209 PolarHBondContact O-N 3.42Å; L206-D210 PolarHBondContact O-N 3.23Å
207	R	97.3	Very high	96.1	Very high	114 Å²	114	41 Å²	41	43%	0.43	20%	0.196	S	C	.	.	H	α-helix	trans	-62.7	-39	178.9	-66	-57	-175.1	109.1	-9.5	113.3	V156 E160 E203 G204 R209 D210 A211	V156-R207 HydrophobicContact CG1-CG 3.77Å; E160-R207 HydrophobicContact CB-CB 3.96Å; E160-R207 HydrophobicContact CG-CB 4.14Å; E160-R207 IonicContact OE1-NH1 2.76Å; E160-R207 IonicContact OE2-CZ 3.85Å; E160-R207 IonicContact OE2-NE 3.62Å; E160-R207 IonicContact OE2-NH1 3.72Å; E160-R207 PolarHBondContact OE2-NH1 3.34Å; E203-R207 WeakPolarHBondContact O-CG 3.12Å; E203-R207 PolarHBondContact O-N 3.44Å; E203-R207 VanDerWaalsContact O-N 3.08Å; G204-R207 PolarHBondContact O-N 3.34Å; R207-R209 VanDerWaalsContact C-N 3.35Å; R207-D210 PolarHBondContact O-N 2.85Å; R207-A211 VanDerWaalsContact O-CB 3.27Å; R207-A211 WeakPolarHBondContact O-CB 3.4Å; R207-A211 PolarHBondContact O-N 3.38Å
208	V	97.6	Very high	96.3	Very high	1 Å²	1	40 Å²	40	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-44.4	175.8	168.4	0	0	0	0	110.4	A159 A163 L174 H176 G204 E205 L206 A211 F212 A215	A159-V208 HydrophobicContact CB-CG2 3.62Å; A163-V208 HydrophobicContact CB-CB 4.36Å; A163-V208 HydrophobicContact CB-CG1 4.14Å; A163-V208 HydrophobicContact CB-CG2 4.25Å; L174-V208 HydrophobicContact CD2-CG1 4.07Å; H176-V208 HydrophobicContact CB-CG1 3.99Å; G204-V208 VanDerWaalsContact O-CG2 3.29Å; G204-V208 WeakPolarHBondContact O-CG2 3.22Å; G204-V208 PolarHBondContact O-N 3.11Å; E205-V208 PolarHBondContact O-N 3.22Å; L206-V208 PolarHBondContact O-N 3.46Å; V208-A211 PolarHBondContact O-N 3.46Å; V208-F212 PolarHBondContact O-N 3.27Å; V208-A215 HydrophobicContact CG1-CB 4.06Å
209	R	96.4	Very high	96.4	Very high	115 Å²	115	41.2 Å²	41.2	43%	0.434	20%	0.197	S	C	.	.	H	α-helix	trans	-65.3	-39.7	178.3	-168.9	178.9	64.8	173.5	1	112.1	E205 L206 R207 F212 P213 I217	E205-R209 WeakPolarHBondContact O-CB 3.33Å; E205-R209 PolarHBondContact O-N 3.33Å; L206-R209 PolarHBondContact O-N 3.42Å; R207-R209 VanDerWaalsContact C-N 3.35Å; R209-F212 CarbonylContact O-C 3.49Å; R209-F212 VanDerWaalsContact O-C 3.29Å; R209-P213 VanDerWaalsContact O-CA 3.23Å; R209-P213 WeakPolarHBondContact O-CA 3.38Å; R209-I217 HydrophobicContact CB-CD1 4.4Å
210	D	97	Very high	96.5	Very high	105 Å²	105	37.8 Å²	37.8	56%	0.561	18%	0.182	S	C	*	.	H	α-helix	trans	-67.6	-41.5	177.3	-64	-16.3	0	0	0	111.3	L206 R207	L206-D210 PolarHBondContact O-N 3.23Å; R207-D210 PolarHBondContact O-N 2.85Å
211	A	96.8	Very high	96.5	Very high	17 Å²	17	37.7 Å²	37.7	14%	0.14	18%	0.182	C	C	.	.	H	α-helix	trans	-70.7	-41.8	178.4	0	0	0	0	0	112.3	A163 R164 R167 R207 V208	A163-A211 HydrophobicContact CB-CB 3.81Å; R164-A211 HydrophobicContact CB-CB 4.47Å; R167-A211 WeakPolarHBondContact CD-O 3.24Å; R167-A211 PolarHBondContact NH1-O 3.04Å; R207-A211 VanDerWaalsContact O-CB 3.27Å; R207-A211 WeakPolarHBondContact O-CB 3.4Å; R207-A211 PolarHBondContact O-N 3.38Å; V208-A211 PolarHBondContact O-N 3.46Å
212	F	95.2	Very high	96.5	Very high	15 Å²	15	37.9 Å²	37.9	7%	0.066	18%	0.184	C	C	.	.			trans	-133.1	90.3	-178	-162.4	-68.4	0	0	0	109.7	A163 R167 V171 L174 V208 R209 N214 A215	A163-F212 HydrophobicContact CB-CB 4.27Å; R167-F212 HydrophobicContact CB-CD2 3.8Å; R167-F212 HydrophobicContact CB-CE2 4.34Å; V171-F212 WeakPolarHBondContact O-CZ 3.49Å; L174-F212 HydrophobicContact CB-CD1 3.96Å; L174-F212 HydrophobicContact CB-CD2 4.19Å; L174-F212 HydrophobicContact CB-CE1 3.95Å; L174-F212 HydrophobicContact CB-CE2 4.21Å; L174-F212 HydrophobicContact CB-CG 4.09Å; L174-F212 HydrophobicContact CB-CZ 4.09Å; L174-F212 HydrophobicContact CD2-CB 3.75Å; L174-F212 HydrophobicContact CD2-CD1 4.34Å; L174-F212 HydrophobicContact CD2-CD2 4.12Å; L174-F212 HydrophobicContact CD2-CG 3.82Å; V208-F212 PolarHBondContact O-N 3.27Å; R209-F212 CarbonylContact O-C 3.49Å; R209-F212 VanDerWaalsContact O-C 3.29Å; F212-N214 VanDerWaalsContact C-N 3.26Å; F212-N214 HydrophobicContact CD1-CB 4.26Å; F212-N214 HydrophobicContact CE1-CB 3.85Å; F212-N214 PolarHBondContact O-N 2.99Å; F212-A215 HydrophobicContact CB-CB 4.3Å; F212-A215 HydrophobicContact CD1-CB 3.84Å; F212-A215 HydrophobicContact CG-CB 4.42Å; F212-A215 WeakPolarHBondContact O-CB 3.48Å; F212-A215 PolarHBondContact O-N 3.33Å; F212-A215 VanDerWaalsContact O-N 3.09Å
213	P	94.6	Very high	96.6	Very high	75 Å²	75	36 Å²	36	49%	0.487	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.7	-174	-28.4	36.4	0	0	0	115.1	R209 A215	R209-P213 VanDerWaalsContact O-CA 3.23Å; R209-P213 WeakPolarHBondContact O-CA 3.38Å; P213-A215 PolarHBondContact O-N 3.45Å
214	N	93.9	Very high	96.6	Very high	101 Å²	101	32.7 Å²	32.7	54%	0.54	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	14.2	-179.5	-65.1	-18.3	0	0	0	113.1	F212 G279	F212-N214 VanDerWaalsContact C-N 3.26Å; F212-N214 HydrophobicContact CD1-CB 4.26Å; F212-N214 HydrophobicContact CE1-CB 3.85Å; F212-N214 PolarHBondContact O-N 2.99Å; N214-G279 VanDerWaalsContact C-N 3.32Å; N214-G279 PolarHBondContact O-N 3.19Å
215	A	96.5	Very high	96.5	Very high	3 Å²	3	32.7 Å²	32.7	3%	0.025	16%	0.163	C	C	.	.			trans	-73.5	134.3	-176	0	0	0	0	0	110.2	L174 V208 F212 P213 G279	L174-A215 HydrophobicContact CB-CB 4.23Å; L174-A215 HydrophobicContact CD2-CB 4.05Å; L174-A215 HydrophobicContact CG-CB 4.29Å; L174-A215 CarbonylContact O-C 3.37Å; L174-A215 WeakPolarHBondContact O-CA 3.41Å; V208-A215 HydrophobicContact CG1-CB 4.06Å; F212-A215 HydrophobicContact CB-CB 4.3Å; F212-A215 HydrophobicContact CD1-CB 3.84Å; F212-A215 HydrophobicContact CG-CB 4.42Å; F212-A215 WeakPolarHBondContact O-CB 3.48Å; F212-A215 PolarHBondContact O-N 3.33Å; F212-A215 VanDerWaalsContact O-N 3.09Å; P213-A215 PolarHBondContact O-N 3.45Å; A215-G279 WeakPolarHBondContact O-CA 3.49Å
216	T	97.4	Very high	96.1	Very high	1 Å²	1	35 Å²	35	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	123	172.3	-51.1	0	0	0	0	108.8	L174 I175 H176 A271 S277 Y282	L174-T216 PolarHBondContact O-N 3.24Å; I175-T216 CarbonylContact C-O 3.52Å; I175-T216 WeakPolarHBondContact CA-O 3.46Å; H176-T216 PolarHBondContact N-O 3.16Å; T216-A271 HydrophobicContact CG2-CB 4.23Å; T216-S277 WeakPolarHBondContact CG2-O 3.4Å; T216-S277 PolarHBondContact OG1-O 3.47Å; T216-Y282 HydrophobicContact CG2-CD2 3.76Å; T216-Y282 HydrophobicContact CG2-CE2 3.78Å
217	I	97.5	Very high	95.7	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.8	-179.4	-64.9	156.3	0	0	0	108.5	H176 E205 R209 R219 R280 I281 Y282	H176-I217 HydrophobicContact CB-CG1 4.47Å; H176-I217 WeakPolarHBondContact O-CA 3.33Å; E205-I217 HydrophobicContact CG-CD1 3.57Å; E205-I217 HydrophobicContact CG-CG1 4.18Å; E205-I217 HydrophobicContact CG-CG2 3.79Å; R209-I217 HydrophobicContact CB-CD1 4.4Å; I217-R219 HydrophobicContact CG2-CG 4.21Å; I217-R280 PolarHBondContact N-O 3.12Å; I217-I281 HydrophobicContact CB-CG1 4.25Å; I217-I281 HydrophobicContact CD1-CG1 4.35Å; I217-I281 HydrophobicContact CG2-CG2 4.44Å; I217-I281 CarbonylContact O-C 3.02Å; I217-I281 VanDerWaalsContact O-CA 3.3Å; I217-I281 WeakPolarHBondContact O-CA 3.02Å; I217-Y282 PolarHBondContact O-N 3.36Å
218	I	97.2	Very high	95.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124	174.9	-60	173.9	0	0	0	108.1	I175 H176 L177 S178 P220 I268 A284	I175-I218 HydrophobicContact CG2-CD1 3.97Å; I175-I218 HydrophobicContact CG2-CG1 4.46Å; H176-I218 PolarHBondContact O-N 3.03Å; L177-I218 HydrophobicContact CD1-CB 3.98Å; L177-I218 HydrophobicContact CD1-CG2 3.94Å; S178-I218 PolarHBondContact N-O 3.12Å; I218-P220 WeakPolarHBondContact O-CD 3.17Å; I218-I268 HydrophobicContact CD1-CB 4.45Å; I218-I268 HydrophobicContact CD1-CG1 3.66Å; I218-A284 HydrophobicContact CG2-CB 3.77Å
219	R	97.2	Very high	95.3	Very high	27 Å²	27	35.8 Å²	35.8	10%	0.102	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	87.1	-179.4	-71.8	-171.4	-178.4	174	2.8	110.1	S179 E205 I217 I281 Y282 A284	S179-R219 WeakPolarHBondContact O-CB 3.44Å; S179-R219 WeakPolarHBondContact O-CG 3.19Å; E205-R219 IonicContact OE1-CZ 3.79Å; E205-R219 IonicContact OE1-NE 3.34Å; E205-R219 PolarHBondContact OE1-NE 3.37Å; E205-R219 IonicContact OE1-NH2 3.95Å; E205-R219 PolarHBondContact OE1-NH2 3.03Å; E205-R219 IonicContact OE2-CZ 3.99Å; E205-R219 IonicContact OE2-NE 3.55Å; E205-R219 PolarHBondContact OE2-NE 3.1Å; E205-R219 IonicContact OE2-NH2 2.81Å; E205-R219 PolarHBondContact OE2-NH2 3.14Å; I217-R219 HydrophobicContact CG2-CG 4.21Å; R219-I281 HydrophobicContact CG-CG2 4.12Å; R219-Y282 PolarHBondContact N-O 3.09Å; R219-A284 PolarHBondContact O-N 3.37Å
220	P	96.9	Very high	95.2	Very high	7 Å²	7	30.4 Å²	30.4	5%	0.045	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	142.4	178.2	32.3	-37.5	0	0	0	112.6	L177 S178 S179 L180 I218 I223 V259 A284	L177-P220 HydrophobicContact CD1-CG 3.8Å; L177-P220 HydrophobicContact CD2-CG 4.33Å; L177-P220 HydrophobicContact CG-CG 3.96Å; S178-P220 WeakPolarHBondContact O-CD 3.31Å; S179-P220 CarbonylContact C-O 3.59Å; L180-P220 WeakPolarHBondContact CB-O 3.48Å; L180-P220 PolarHBondContact N-O 2.91Å; I218-P220 WeakPolarHBondContact O-CD 3.17Å; P220-I223 HydrophobicContact CB-CD1 3.74Å; P220-I223 HydrophobicContact CB-CG1 3.76Å; P220-I223 HydrophobicContact CG-CD1 3.93Å; P220-I223 HydrophobicContact CG-CG1 4.35Å; P220-V259 HydrophobicContact CB-CG1 4.39Å; P220-A284 WeakPolarHBondContact CA-O 3.23Å; P220-A284 HydrophobicContact CB-CB 3.95Å
221	A	96	Very high	95	Very high	6 Å²	6	25.5 Å²	25.5	5%	0.05	14%	0.136	C	C	.	.			trans	-64.8	-172	159.1	0	0	0	0	0	110.4	L180 I223 Q257 A284	L180-A221 HydrophobicContact CD2-CB 3.98Å; A221-I223 WeakPolarHBondContact O-CG1 3.47Å; A221-I223 PolarHBondContact O-N 3.39Å; A221-Q257 WeakPolarHBondContact CB-O 3.3Å; A221-A284 PolarHBondContact N-O 3.16Å
222	D	95.9	Very high	94.9	Very high	19 Å²	19	29.7 Å²	29.7	10%	0.102	15%	0.148	C	C	.	.	S	Bend	trans	-59.3	112.5	173.8	-75.8	-47.6	0	0	0	110.5	F230 K256 P258 V259	D222-F230 HydrophobicContact CB-CD2 3.76Å; D222-F230 HydrophobicContact CB-CE2 3.96Å; D222-F230 HydrophobicContact CB-CG 4.15Å; D222-K256 WeakPolarHBondContact OD2-CD 3.22Å; D222-K256 WeakPolarHBondContact OD2-CE 3.39Å; D222-K256 IonicContact OD2-NZ 2.85Å; D222-K256 PolarHBondContact OD2-NZ 3.49Å; D222-P258 HydrophobicContact CB-CB 4.34Å; D222-P258 CarbonylContact O-C 3.52Å; D222-P258 WeakPolarHBondContact O-CA 3.44Å; D222-P258 WeakPolarHBondContact O-CB 3.35Å; D222-V259 PolarHBondContact O-N 2.96Å
223	I	97	Very high	94.8	Very high	24 Å²	24	29.2 Å²	29.2	12%	0.123	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	129	-176.8	-50.6	177.3	0	0	0	109.3	F74 V75 P220 A221 V259 V261 V264	F74-I223 HydrophobicContact CE1-CB 4.13Å; F74-I223 HydrophobicContact CE1-CG2 3.69Å; F74-I223 HydrophobicContact CZ-CG2 4.28Å; V75-I223 HydrophobicContact CG2-CD1 3.69Å; P220-I223 HydrophobicContact CB-CD1 3.74Å; P220-I223 HydrophobicContact CB-CG1 3.76Å; P220-I223 HydrophobicContact CG-CD1 3.93Å; P220-I223 HydrophobicContact CG-CG1 4.35Å; A221-I223 WeakPolarHBondContact O-CG1 3.47Å; A221-I223 PolarHBondContact O-N 3.39Å; I223-V259 WeakPolarHBondContact CA-O 3.39Å; I223-V259 HydrophobicContact CB-CG1 4.41Å; I223-V259 HydrophobicContact CG1-CG1 3.91Å; I223-V261 HydrophobicContact CG2-CB 3.58Å; I223-V261 HydrophobicContact CG2-CG2 3.93Å; I223-V264 HydrophobicContact CD1-CG1 4.34Å; I223-V264 HydrophobicContact CD1-CG2 4.4Å; I223-V264 HydrophobicContact CG1-CG2 4.45Å
224	Y	96.7	Very high	94.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	156.4	174.9	74.2	-87.6	0	0	0	113	D228 L231 P258 V259 Y260 V261 T371 T372 M373 Q376 V377	Y224-D228 WeakPolarHBondContact CA-OD2 3.18Å; Y224-D228 WeakPolarHBondContact CB-OD2 3.08Å; Y224-L231 HydrophobicContact CD2-CD1 4.17Å; Y224-L231 HydrophobicContact CG-CD1 4.48Å; Y224-P258 HydrophobicContact CD1-CB 3.94Å; Y224-P258 HydrophobicContact CD1-CG 4.46Å; Y224-P258 HydrophobicContact CE1-CB 4.44Å; Y224-V259 VanDerWaalsContact CD1-C 3.44Å; Y224-V259 WeakPolarHBondContact CD1-O 3.43Å; Y224-V259 PolarHBondContact N-O 3.23Å; Y224-Y260 HydrophobicContact CD2-CD2 4.06Å; Y224-Y260 AromaticContact CE2-CD2 3.63Å; Y224-Y260 HydrophobicContact CE2-CD2 3.63Å; Y224-Y260 HydrophobicContact CE2-CE2 4.49Å; Y224-Y260 HydrophobicContact CE2-CG 4.3Å; Y224-V261 WeakPolarHBondContact O-CB 3.49Å; Y224-V261 PolarHBondContact O-N 2.88Å; Y224-T371 PolarHBondContact OH-O 3.44Å; Y224-T372 PolarHBondContact OH-O 2.82Å; Y224-M373 HydrophobicContact CD1-CE 4.35Å; Y224-M373 HydrophobicContact CD1-CG 4.42Å; Y224-M373 HydrophobicContact CE1-CE 4.48Å; Y224-M373 HydrophobicContact CE1-CG 3.66Å; Y224-M373 HydrophobicContact CE2-CG 4.44Å; Y224-M373 HydrophobicContact CG-CE 4.49Å; Y224-M373 WeakPolarHBondContact OH-CA 3.5Å; Y224-M373 PolarHBondContact OH-N 3.41Å; Y224-Q376 HydrophobicContact CE2-CB 4.13Å; Y224-V377 HydrophobicContact CD2-CG2 4.09Å; Y224-V377 HydrophobicContact CE2-CG2 3.98Å
225	G	94.9	Very high	94.7	Very high	1 Å²	1	21 Å²	21	1%	0.01	10%	0.098	C	C	.	.	S	Bend	trans	156.3	-172.9	-179.6	0	0	0	0	0	112.6	E227 D228 E380	G225-E227 PolarHBondContact O-N 3.35Å; G225-D228 VanDerWaalsContact O-CB 3.27Å; G225-D228 WeakPolarHBondContact O-CB 3.5Å; G225-D228 PolarHBondContact O-N 2.9Å; G225-E380 VanDerWaalsContact C-CD 3.45Å; G225-E380 WeakPolarHBondContact CA-OE1 3.47Å
226	S	88.4	Confident	94.5	Very high	51 Å²	51	23.9 Å²	23.9	36%	0.357	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	118.7	179.4	-42.6	0	0	0	0	110.2	F74 Y78 E380	F74-S226 VanDerWaalsContact CE2-O 3.23Å; F74-S226 WeakPolarHBondContact CE2-O 3.42Å; Y78-S226 VanDerWaalsContact OH-CB 3.31Å; Y78-S226 WeakPolarHBondContact OH-CB 3.48Å; Y78-S226 PolarHBondContact OH-N 3.34Å; Y78-S226 PolarHBondContact OH-O 3.02Å; Y78-S226 VanDerWaalsContact OH-O 3.06Å; S226-E380 WeakPolarHBondContact CA-OE2 3.46Å; S226-E380 VanDerWaalsContact CB-OE2 3.28Å; S226-E380 WeakPolarHBondContact CB-OE2 3.49Å; S226-E380 PolarHBondContact N-OE1 3.25Å; S226-E380 PolarHBondContact N-OE2 3.11Å; S226-E380 PolarHBondContact OG-OE1 3.01Å; S226-E380 PolarHBondContact OG-OE2 2.96Å
227	E	89.6	Confident	94.1	Very high	74 Å²	74	30.1 Å²	30.1	35%	0.346	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	16.9	-172.7	-43.7	176.1	150.3	0	0	116	F74 R77 G225	F74-E227 HydrophobicContact CD2-CB 4.2Å; R77-E227 IonicContact CZ-OE2 3.43Å; R77-E227 VanDerWaalsContact NH1-CD 3.29Å; R77-E227 IonicContact NH1-OE1 3.05Å; R77-E227 PolarHBondContact NH1-OE1 3.3Å; R77-E227 IonicContact NH1-OE2 3.3Å; R77-E227 PolarHBondContact NH1-OE2 3.38Å; G225-E227 PolarHBondContact O-N 3.35Å
228	D	93.9	Very high	93.7	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	16%	0.163	C	C	.	.			trans	-62.1	169.5	174.4	81.4	-4.7	0	0	0	113.5	F74 Y224 G225 L231 R232	F74-D228 HydrophobicContact CE1-CB 3.9Å; F74-D228 HydrophobicContact CE2-CB 4.11Å; F74-D228 HydrophobicContact CZ-CB 3.59Å; Y224-D228 WeakPolarHBondContact CA-OD2 3.18Å; Y224-D228 WeakPolarHBondContact CB-OD2 3.08Å; G225-D228 VanDerWaalsContact O-CB 3.27Å; G225-D228 WeakPolarHBondContact O-CB 3.5Å; G225-D228 PolarHBondContact O-N 2.9Å; D228-L231 VanDerWaalsContact CG-N 3.33Å; D228-L231 WeakPolarHBondContact OD1-CB 3.33Å; D228-L231 PolarHBondContact OD1-N 2.88Å; D228-L231 VanDerWaalsContact OD2-CB 3.25Å; D228-L231 WeakPolarHBondContact OD2-CB 3.08Å; D228-L231 WeakPolarHBondContact OD2-CG 3.34Å; D228-L231 PolarHBondContact OD2-N 2.99Å; D228-R232 WeakPolarHBondContact O-CB 3.45Å; D228-R232 VanDerWaalsContact O-CD 3.32Å; D228-R232 WeakPolarHBondContact O-CD 3.44Å; D228-R232 WeakPolarHBondContact O-CG 3.47Å; D228-R232 WeakPolarHBondContact OD1-CG 3.14Å; D228-R232 PolarHBondContact OD1-N 3.29Å
229	R	92.2	Very high	93.4	Very high	104 Å²	104	35.7 Å²	35.7	39%	0.392	16%	0.164	S	C	.	.	S	Bend	trans	-111.2	14.2	172.1	-68.1	-177.4	-85.5	-162.6	-1.2	111.7	D143 Y233 R346	D143-R229 WeakPolarHBondContact OD2-CD 3.34Å; D143-R229 IonicContact OD2-CZ 2.64Å; D143-R229 IonicContact OD2-NE 3.18Å; D143-R229 PolarHBondContact OD2-NE 2.93Å; D143-R229 VanDerWaalsContact OD2-NE 3.09Å; D143-R229 IonicContact OD2-NH1 3.62Å; D143-R229 PolarHBondContact OD2-NH1 3.41Å; D143-R229 IonicContact OD2-NH2 2.83Å; R229-Y233 VanDerWaalsContact O-CB 3.28Å; R229-Y233 WeakPolarHBondContact O-CB 3.48Å; R229-R346 PolarHBondContact O-NH1 3.4Å; R229-R346 PolarHBondContact O-NH2 3.04Å
230	F	94	Very high	93	Very high	1 Å²	1	34.9 Å²	34.9	0%	0.004	16%	0.16	C	C	.	.	S	Bend	trans	-107.3	-65.7	-179.6	177.4	-106.7	0	0	0	110.6	D222 R232 Y233 Y234 P258 L295 F299 M373	D222-F230 HydrophobicContact CB-CD2 3.76Å; D222-F230 HydrophobicContact CB-CE2 3.96Å; D222-F230 HydrophobicContact CB-CG 4.15Å; F230-R232 PolarHBondContact O-N 2.85Å; F230-Y233 WeakPolarHBondContact O-CB 3.41Å; F230-Y233 PolarHBondContact O-N 3.47Å; F230-Y233 VanDerWaalsContact O-N 3.17Å; F230-Y234 AromaticContact CD2-CE2 3.97Å; F230-Y234 HydrophobicContact CD2-CE2 3.97Å; F230-Y234 HydrophobicContact CE2-CD2 4.39Å; F230-Y234 AromaticContact CE2-CE2 3.64Å; F230-Y234 HydrophobicContact CE2-CE2 3.64Å; F230-Y234 HydrophobicContact CZ-CE2 4.13Å; F230-Y234 VanDerWaalsContact O-CD2 3.27Å; F230-Y234 WeakPolarHBondContact O-CD2 3.4Å; F230-Y234 PolarHBondContact O-N 3.26Å; F230-P258 HydrophobicContact CE1-CB 4.08Å; F230-P258 HydrophobicContact CE1-CG 4.35Å; F230-P258 HydrophobicContact CZ-CB 4.49Å; F230-L295 HydrophobicContact CE1-CD2 4.12Å; F230-L295 HydrophobicContact CZ-CD2 3.81Å; F230-F299 HydrophobicContact CE1-CE2 4.27Å; F230-F299 HydrophobicContact CE1-CZ 4.07Å; F230-M373 HydrophobicContact CE1-CE 4.44Å
231	L	94.2	Very high	92.4	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-46.9	174.8	-62.5	174.6	0	0	0	111.1	Y224 D228 Y233 Y234 A235 F299 M373 V377 E380 L381	Y224-L231 HydrophobicContact CD2-CD1 4.17Å; Y224-L231 HydrophobicContact CG-CD1 4.48Å; D228-L231 VanDerWaalsContact CG-N 3.33Å; D228-L231 WeakPolarHBondContact OD1-CB 3.33Å; D228-L231 PolarHBondContact OD1-N 2.88Å; D228-L231 VanDerWaalsContact OD2-CB 3.25Å; D228-L231 WeakPolarHBondContact OD2-CB 3.08Å; D228-L231 WeakPolarHBondContact OD2-CG 3.34Å; D228-L231 PolarHBondContact OD2-N 2.99Å; L231-Y233 PolarHBondContact O-N 2.78Å; L231-Y234 PolarHBondContact O-N 2.76Å; L231-A235 WeakPolarHBondContact O-CB 3.48Å; L231-A235 PolarHBondContact O-N 2.88Å; L231-F299 HydrophobicContact CD2-CD1 4.16Å; L231-F299 HydrophobicContact CD2-CD2 4.35Å; L231-F299 HydrophobicContact CD2-CE1 3.51Å; L231-F299 HydrophobicContact CD2-CE2 3.72Å; L231-F299 HydrophobicContact CD2-CZ 3.24Å; L231-M373 HydrophobicContact CD2-CE 4.25Å; L231-V377 HydrophobicContact CD1-CG1 4.31Å; L231-V377 HydrophobicContact CD1-CG2 4.22Å; L231-V377 HydrophobicContact CD2-CG1 4.02Å; L231-V377 HydrophobicContact CD2-CG2 4.37Å; L231-E380 HydrophobicContact CD1-CB 3.83Å; L231-E380 HydrophobicContact CD1-CG 4.37Å; L231-L381 HydrophobicContact CB-CD2 4.05Å
232	R	93.6	Very high	91.9	Very high	104 Å²	104	45 Å²	45	39%	0.392	20%	0.204	S	C	.	.	H	α-helix	trans	-60.1	-33.8	177.5	-67.5	-167.3	170.6	-167.6	-0.6	112.6	D228 F230 A235 H236 Y384	D228-R232 WeakPolarHBondContact O-CB 3.45Å; D228-R232 VanDerWaalsContact O-CD 3.32Å; D228-R232 WeakPolarHBondContact O-CD 3.44Å; D228-R232 WeakPolarHBondContact O-CG 3.47Å; D228-R232 WeakPolarHBondContact OD1-CG 3.14Å; D228-R232 PolarHBondContact OD1-N 3.29Å; F230-R232 PolarHBondContact O-N 2.85Å; R232-A235 PolarHBondContact O-N 2.86Å; R232-H236 VanDerWaalsContact O-CB 3.27Å; R232-H236 WeakPolarHBondContact O-CB 3.47Å; R232-H236 PolarHBondContact O-N 2.79Å; R232-Y384 WeakPolarHBondContact CD-OH 3.36Å; R232-Y384 HydrophobicContact CG-CE2 4.11Å; R232-Y384 WeakPolarHBondContact CG-OH 3.45Å; R232-Y384 PolarHBondContact NE-OH 3.32Å
233	Y	94	Very high	91.6	Very high	6 Å²	6	49.9 Å²	49.9	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-46.4	178.3	174.3	-104.8	0	0	0	111.4	R229 F230 L231 H236 R239 G340 R346 E350	R229-Y233 VanDerWaalsContact O-CB 3.28Å; R229-Y233 WeakPolarHBondContact O-CB 3.48Å; F230-Y233 WeakPolarHBondContact O-CB 3.41Å; F230-Y233 PolarHBondContact O-N 3.47Å; F230-Y233 VanDerWaalsContact O-N 3.17Å; L231-Y233 PolarHBondContact O-N 2.78Å; Y233-H236 PolarHBondContact O-N 2.83Å; Y233-R239 HydrophobicContact CD1-CG 4.44Å; Y233-R239 HydrophobicContact CE1-CG 4.18Å; Y233-R239 HydrophobicContact CE2-CG 4.45Å; Y233-R239 WeakPolarHBondContact O-CB 3.17Å; Y233-R239 WeakPolarHBondContact O-CG 3.18Å; Y233-R239 WeakPolarHBondContact OH-CD 3.38Å; Y233-R239 PolarHBondContact OH-NE 3.48Å; Y233-G340 WeakPolarHBondContact CD2-O 3.42Å; Y233-R346 HydrophobicContact CD2-CG 4.27Å; Y233-R346 HydrophobicContact CE1-CG 4.23Å; Y233-R346 HydrophobicContact CE2-CG 3.73Å; Y233-E350 HydrophobicContact CD1-CG 4.4Å; Y233-E350 HydrophobicContact CE1-CG 3.84Å
234	Y	94	Very high	91.3	Very high	0 Å²	0	50 Å²	50	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-73.6	-27.4	175.9	-68.1	-69.6	0	0	0	113.6	F230 L231 M245 L247 L292 V296 F299 E350	F230-Y234 AromaticContact CD2-CE2 3.97Å; F230-Y234 HydrophobicContact CD2-CE2 3.97Å; F230-Y234 HydrophobicContact CE2-CD2 4.39Å; F230-Y234 AromaticContact CE2-CE2 3.64Å; F230-Y234 HydrophobicContact CE2-CE2 3.64Å; F230-Y234 HydrophobicContact CZ-CE2 4.13Å; F230-Y234 VanDerWaalsContact O-CD2 3.27Å; F230-Y234 WeakPolarHBondContact O-CD2 3.4Å; F230-Y234 PolarHBondContact O-N 3.26Å; L231-Y234 PolarHBondContact O-N 2.76Å; Y234-M245 VanDerWaalsContact O-CE 3.28Å; Y234-M245 WeakPolarHBondContact O-CE 3.38Å; Y234-L247 HydrophobicContact CE1-CD2 3.91Å; Y234-L292 HydrophobicContact CE2-CD1 4.37Å; Y234-V296 HydrophobicContact CD1-CG1 4.27Å; Y234-V296 HydrophobicContact CD1-CG2 3.67Å; Y234-V296 HydrophobicContact CD2-CG2 4.49Å; Y234-V296 HydrophobicContact CE1-CG2 3.73Å; Y234-V296 HydrophobicContact CG-CG2 4.09Å; Y234-F299 HydrophobicContact CD2-CD2 4.49Å; Y234-F299 HydrophobicContact CD2-CE2 4.15Å; Y234-F299 HydrophobicContact CG-CD2 4.48Å; Y234-E350 WeakPolarHBondContact CE2-OE2 3.41Å; Y234-E350 PolarHBondContact OH-OE2 2.76Å
235	A	92.4	Very high	91.2	Very high	3 Å²	3	50 Å²	50	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-73.9	-28.2	175	0	0	0	0	0	113	L231 R232 R240 M303 L381 Y384	L231-A235 WeakPolarHBondContact O-CB 3.48Å; L231-A235 PolarHBondContact O-N 2.88Å; R232-A235 PolarHBondContact O-N 2.86Å; A235-R240 PolarHBondContact O-NH2 3.28Å; A235-M303 HydrophobicContact CB-CE 4.39Å; A235-M303 HydrophobicContact CB-SD 3.72Å; A235-L381 HydrophobicContact CB-CD2 4.26Å; A235-Y384 HydrophobicContact CB-CD1 3.99Å; A235-Y384 HydrophobicContact CB-CD2 3.97Å; A235-Y384 HydrophobicContact CB-CE1 4.36Å; A235-Y384 HydrophobicContact CB-CE2 4.34Å; A235-Y384 HydrophobicContact CB-CG 3.78Å
236	H	91.2	Very high	91.1	Very high	63 Å²	63	50 Å²	50	29%	0.292	22%	0.223	S	C	.	.	S	Bend	trans	-67.2	142.4	-171	-163	-101.3	0	0	0	113.7	R232 Y233 W238 R239 G340	R232-H236 VanDerWaalsContact O-CB 3.27Å; R232-H236 WeakPolarHBondContact O-CB 3.47Å; R232-H236 PolarHBondContact O-N 2.79Å; Y233-H236 PolarHBondContact O-N 2.83Å; H236-W238 AromaticContact CE1-CD1 3.23Å; H236-W238 AromaticContact CE1-CG 3.72Å; H236-W238 WeakPolarHBondContact ND1-CB 3.38Å; H236-W238 AromaticContact ND1-CD1 3.78Å; H236-W238 AromaticContact ND1-CG 3.95Å; H236-W238 PolarHBondContact ND1-N 3.24Å; H236-W238 PolarHBondContact O-N 2.86Å; H236-R239 PolarHBondContact O-N 2.96Å; H236-G340 WeakPolarHBondContact CE1-CA 3.47Å; H236-G340 WeakPolarHBondContact ND1-CA 3.47Å
237	I	90.1	Very high	91.3	Very high	132 Å²	132	47.7 Å²	47.7	68%	0.677	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-65.7	-40.5	-176.4	-61.1	166.6	0	0	0	111.2	R239 R240	I237-R239 PolarHBondContact O-N 3.42Å; I237-R240 WeakPolarHBondContact O-CB 3.41Å; I237-R240 PolarHBondContact O-N 3.14Å
238	W	87.7	Confident	91.4	Very high	116 Å²	116	46.3 Å²	46.3	44%	0.439	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-64.7	-24.4	-178.9	-74.3	77.9	0	0	0	114	H236 R240 K326 I339	H236-W238 AromaticContact CE1-CD1 3.23Å; H236-W238 AromaticContact CE1-CG 3.72Å; H236-W238 WeakPolarHBondContact ND1-CB 3.38Å; H236-W238 AromaticContact ND1-CD1 3.78Å; H236-W238 AromaticContact ND1-CG 3.95Å; H236-W238 PolarHBondContact ND1-N 3.24Å; H236-W238 PolarHBondContact O-N 2.86Å; W238-R240 PolarHBondContact O-N 3Å; W238-K326 WeakPolarHBondContact O-CE 3.27Å; W238-K326 PolarHBondContact O-NZ 3.5Å; W238-I339 HydrophobicContact CD2-CG2 3.8Å; W238-I339 HydrophobicContact CG-CG2 3.75Å; W238-I339 HydrophobicContact CZ2-CD1 4.43Å; W238-I339 HydrophobicContact CZ2-CG2 4.4Å
239	R	90.9	Very high	91.2	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.019	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-70.8	-20.6	176.5	-179.2	53.9	-179.4	83	-2.7	112.6	Y233 H236 I237 M245 P246 F323	Y233-R239 HydrophobicContact CD1-CG 4.44Å; Y233-R239 HydrophobicContact CE1-CG 4.18Å; Y233-R239 HydrophobicContact CE2-CG 4.45Å; Y233-R239 WeakPolarHBondContact O-CB 3.17Å; Y233-R239 WeakPolarHBondContact O-CG 3.18Å; Y233-R239 WeakPolarHBondContact OH-CD 3.38Å; Y233-R239 PolarHBondContact OH-NE 3.48Å; H236-R239 PolarHBondContact O-N 2.96Å; I237-R239 PolarHBondContact O-N 3.42Å; R239-M245 HydrophobicContact CG-CE 4.26Å; R239-M245 HydrophobicContact CG-SD 3.89Å; R239-M245 PolarHBondContact NH1-SD 3.29Å; R239-M245 VanDerWaalsContact NH1-SD 3.41Å; R239-P246 VanDerWaalsContact NH1-CG 3.32Å; R239-P246 PolarHBondContact NH1-O 3.4Å; R239-P246 PolarHBondContact NH2-O 3.22Å; R239-F323 WeakPolarHBondContact O-CE2 3.25Å
240	R	88.9	Confident	91.1	Very high	9 Å²	9	47.6 Å²	47.6	3%	0.034	21%	0.207	C	C	.	.	S	Bend	trans	-86.6	156.5	179.2	-55	172.4	-172.9	-141.9	-6.1	110.5	A235 I237 W238 F242 M245 H300 K326	A235-R240 PolarHBondContact O-NH2 3.28Å; I237-R240 WeakPolarHBondContact O-CB 3.41Å; I237-R240 PolarHBondContact O-N 3.14Å; W238-R240 PolarHBondContact O-N 3Å; R240-F242 WeakPolarHBondContact CB-O 3.04Å; R240-M245 HydrophobicContact CG-CE 3.78Å; R240-H300 PolarHBondContact NH2-NE2 3.47Å; R240-K326 PolarHBondContact O-NZ 3.01Å
241	Q	85.3	Confident	91	Very high	40 Å²	40	47.6 Å²	47.6	19%	0.187	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-110.5	101.2	162.7	-170.5	68.1	-34.1	0	0	107.3	R243 S244 Y315 T322	Q241-R243 PolarHBondContact O-N 3.1Å; Q241-S244 PolarHBondContact N-O 3.41Å; Q241-S244 PolarHBondContact O-N 2.86Å; Q241-Y315 HydrophobicContact CB-CE1 4.17Å; Q241-Y315 WeakPolarHBondContact CB-OH 3.48Å; Q241-T322 PolarHBondContact NE2-OG1 3.2Å
242	F	85.7	Confident	90.8	Very high	187 Å²	187	51.6 Å²	51.6	82%	0.82	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	-116.5	-165.2	-59.2	-80	0	0	0	111.9	R240	R240-F242 WeakPolarHBondContact CB-O 3.04Å
243	R	88.4	Confident	90.6	Very high	121 Å²	121	51.9 Å²	51.9	46%	0.457	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-2.4	-179.9	-56.8	173.5	84.2	175.3	4.4	112.2	Q241 W310 Y312	Q241-R243 PolarHBondContact O-N 3.1Å; R243-W310 VanDerWaalsContact CZ-C 3.45Å; R243-W310 PolarHBondContact NE-O 3.29Å; R243-W310 PolarHBondContact NH2-O 3.08Å; R243-Y312 WeakPolarHBondContact O-CA 3.22Å
244	S	91	Very high	90.5	Very high	27 Å²	27	51.7 Å²	51.7	19%	0.189	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	150.5	-173.2	-52	0	0	0	0	112.4	Q241 M313	Q241-S244 PolarHBondContact N-O 3.41Å; Q241-S244 PolarHBondContact O-N 2.86Å; S244-M313 CarbonylContact C-O 3.44Å; S244-M313 WeakPolarHBondContact CA-O 3.27Å; S244-M313 VanDerWaalsContact CB-O 3.3Å; S244-M313 WeakPolarHBondContact CB-O 3.42Å
245	M	93.9	Very high	90.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	112.1	-179.7	-173.7	59	77.1	0	0	111.2	Y234 R239 R240 L247 V296 H300 Y312 M313 R314 Y315	Y234-M245 VanDerWaalsContact O-CE 3.28Å; Y234-M245 WeakPolarHBondContact O-CE 3.38Å; R239-M245 HydrophobicContact CG-CE 4.26Å; R239-M245 HydrophobicContact CG-SD 3.89Å; R239-M245 PolarHBondContact NH1-SD 3.29Å; R239-M245 VanDerWaalsContact NH1-SD 3.41Å; R240-M245 HydrophobicContact CG-CE 3.78Å; M245-L247 HydrophobicContact CG-CD2 4.22Å; M245-L247 HydrophobicContact CG-CG 4.13Å; M245-L247 PolarHBondContact O-N 3.23Å; M245-V296 HydrophobicContact CG-CG1 3.89Å; M245-H300 VanDerWaalsContact CE-CE1 3.47Å; M245-H300 WeakPolarHBondContact CE-CE1 3.26Å; M245-Y312 HydrophobicContact CB-CE2 3.7Å; M245-M313 PolarHBondContact N-O 2.9Å; M245-R314 WeakPolarHBondContact O-CA 3.36Å; M245-Y315 PolarHBondContact O-N 2.82Å; M245-Y315 VanDerWaalsContact O-N 3.15Å
246	P	93.2	Very high	90.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123.9	174.2	13.3	-12.9	0	0	0	110.3	R239 Y315 M317 F323	R239-P246 VanDerWaalsContact NH1-CG 3.32Å; R239-P246 PolarHBondContact NH1-O 3.4Å; R239-P246 PolarHBondContact NH2-O 3.22Å; P246-Y315 HydrophobicContact CB-CE1 4.01Å; P246-Y315 HydrophobicContact CB-CE2 3.85Å; P246-Y315 VanDerWaalsContact CB-CZ 3.48Å; P246-Y315 VanDerWaalsContact CB-OH 3.3Å; P246-Y315 WeakPolarHBondContact CB-OH 3.27Å; P246-Y315 HydrophobicContact CG-CE1 4.18Å; P246-Y315 VanDerWaalsContact CG-OH 3.24Å; P246-Y315 WeakPolarHBondContact CG-OH 3.41Å; P246-M317 HydrophobicContact CB-CB 3.76Å; P246-F323 HydrophobicContact CB-CD1 3.82Å; P246-F323 HydrophobicContact CB-CD2 4.29Å; P246-F323 HydrophobicContact CB-CE1 3.99Å; P246-F323 HydrophobicContact CB-CE2 4.46Å; P246-F323 HydrophobicContact CB-CG 3.97Å; P246-F323 HydrophobicContact CB-CZ 4.31Å; P246-F323 HydrophobicContact CG-CB 4.45Å; P246-F323 HydrophobicContact CG-CD1 3.81Å; P246-F323 HydrophobicContact CG-CD2 3.42Å; P246-F323 VanDerWaalsContact CG-CD2 3.42Å; P246-F323 HydrophobicContact CG-CE1 3.81Å; P246-F323 HydrophobicContact CG-CE2 3.44Å; P246-F323 VanDerWaalsContact CG-CE2 3.44Å; P246-F323 HydrophobicContact CG-CG 3.61Å; P246-F323 HydrophobicContact CG-CZ 3.63Å
247	L	93.4	Very high	90.8	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.9	172.5	-63	173.6	0	0	0	110	Y234 M245 H249 K250 L292 V296 R314 Y315 D316 M317	Y234-L247 HydrophobicContact CE1-CD2 3.91Å; M245-L247 HydrophobicContact CG-CD2 4.22Å; M245-L247 HydrophobicContact CG-CG 4.13Å; M245-L247 PolarHBondContact O-N 3.23Å; L247-H249 PolarHBondContact O-N 3.05Å; L247-K250 VanDerWaalsContact CB-C 3.48Å; L247-K250 PolarHBondContact O-N 2.92Å; L247-K250 VanDerWaalsContact O-N 3.12Å; L247-L292 HydrophobicContact CD2-CD2 4.39Å; L247-V296 HydrophobicContact CD1-CB 4.19Å; L247-V296 HydrophobicContact CD1-CG1 4.28Å; L247-V296 HydrophobicContact CD1-CG2 4.25Å; L247-V296 HydrophobicContact CD2-CG2 4.31Å; L247-R314 HydrophobicContact CD1-CG 4.28Å; L247-Y315 PolarHBondContact N-O 2.88Å; L247-D316 WeakPolarHBondContact O-CA 3.37Å; L247-M317 PolarHBondContact O-N 3.25Å
248	W	90.6	Very high	91.1	Very high	46 Å²	46	43.2 Å²	43.2	17%	0.174	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-64.4	121.3	175	-175.2	-108.1	0	0	0	110.1	L189 K250 G251 M317 R318 A351	L189-W248 HydrophobicContact CB-CZ2 4.32Å; L189-W248 WeakPolarHBondContact O-CH2 3.34Å; W248-K250 PolarHBondContact O-N 3.29Å; W248-K250 VanDerWaalsContact O-N 3.17Å; W248-G251 WeakPolarHBondContact O-CA 3.37Å; W248-G251 PolarHBondContact O-N 3.11Å; W248-M317 HydrophobicContact CB-CG 4.43Å; W248-M317 HydrophobicContact CB-SD 4.08Å; W248-M317 HydrophobicContact CE3-CG 4.06Å; W248-M317 HydrophobicContact CE3-SD 4.21Å; W248-R318 HydrophobicContact CD2-CG 4.19Å; W248-R318 HydrophobicContact CE3-CG 3.56Å; W248-R318 HydrophobicContact CH2-CG 3.69Å; W248-R318 HydrophobicContact CZ2-CG 4.27Å; W248-R318 HydrophobicContact CZ3-CG 3.31Å; W248-A351 HydrophobicContact CB-CB 3.71Å; W248-A351 HydrophobicContact CG-CB 3.83Å
249	H	90.9	Very high	91.5	Very high	41 Å²	41	37.7 Å²	37.7	19%	0.19	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	50	37.8	-171	-69.1	-79.3	0	0	0	112.9	L247 G251 E252 K253 D316 R318	L247-H249 PolarHBondContact O-N 3.05Å; H249-G251 PolarHBondContact O-N 3.34Å; H249-E252 PolarHBondContact O-N 2.94Å; H249-K253 HydrophobicContact CB-CB 4.18Å; H249-K253 HydrophobicContact CB-CD 4.36Å; H249-K253 HydrophobicContact CB-CG 4.08Å; H249-D316 PolarHBondContact N-OD1 3.05Å; H249-D316 VanDerWaalsContact N-OD1 3.08Å; H249-R318 PolarHBondContact CE1-NH1 3.22Å; H249-R318 PolarHBondContact ND1-NE 3.45Å; H249-R318 PolarHBondContact ND1-NH2 3.03Å; H249-R318 VanDerWaalsContact ND1-NH2 3.16Å
250	K	90.5	Very high	91.8	Very high	94 Å²	94	39 Å²	39	41%	0.409	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	57.8	12.8	-173.3	-55	178.4	-178.9	175	0	114.8	L247 W248 E252 S293 D316	L247-K250 VanDerWaalsContact CB-C 3.48Å; L247-K250 PolarHBondContact O-N 2.92Å; L247-K250 VanDerWaalsContact O-N 3.12Å; W248-K250 PolarHBondContact O-N 3.29Å; W248-K250 VanDerWaalsContact O-N 3.17Å; K250-E252 VanDerWaalsContact C-N 3.26Å; K250-E252 HydrophobicContact CB-CG 4.3Å; K250-S293 VanDerWaalsContact O-CB 3.26Å; K250-S293 WeakPolarHBondContact O-CB 3.32Å; K250-D316 HydrophobicContact CG-CB 3.98Å
251	G	90.8	Very high	92.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	78	5.3	-174.1	0	0	0	0	0	113.9	W248 H249 S293	W248-G251 WeakPolarHBondContact O-CA 3.37Å; W248-G251 PolarHBondContact O-N 3.11Å; H249-G251 PolarHBondContact O-N 3.34Å; G251-S293 PolarHBondContact O-N 2.75Å
252	E	90.7	Very high	92.8	Very high	88 Å²	88	38 Å²	38	41%	0.411	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-25.7	-174.4	-68.1	172.6	-177.2	0	0	112.2	H249 K250 Q291	H249-E252 PolarHBondContact O-N 2.94Å; K250-E252 VanDerWaalsContact C-N 3.26Å; K250-E252 HydrophobicContact CB-CG 4.3Å; E252-Q291 VanDerWaalsContact CA-NE2 3.26Å; E252-Q291 PolarHBondContact O-NE2 3.35Å
253	K	89.2	Confident	93.3	Very high	110 Å²	110	29.7 Å²	29.7	48%	0.478	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	12.5	178.1	-61.5	-164.2	175.1	-158.1	0	114	H249 T353	H249-K253 HydrophobicContact CB-CB 4.18Å; H249-K253 HydrophobicContact CB-CD 4.36Å; H249-K253 HydrophobicContact CB-CG 4.08Å; K253-T353 PolarHBondContact O-OG1 3.38Å
254	T	92.2	Very high	93.7	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	11%	0.112	C	C	.	.			trans	-123.1	126.6	-177.3	-56.1	0	0	0	0	110	K256 L292 E350 A351 T353	T254-K256 HydrophobicContact CG2-CG 4.49Å; T254-L292 HydrophobicContact CG2-CB 4.14Å; T254-L292 HydrophobicContact CG2-CD2 3.94Å; T254-L292 WeakPolarHBondContact O-CB 3.38Å; T254-L292 PolarHBondContact O-N 3.15Å; T254-E350 WeakPolarHBondContact CG2-O 3.35Å; T254-A351 WeakPolarHBondContact CG2-O 3.48Å; T254-A351 PolarHBondContact OG1-O 3.05Å; T254-T353 WeakPolarHBondContact CA-OG1 3.34Å
255	V	94.1	Very high	94	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	135.7	177.5	179.9	0	0	0	0	109.7	R289 Y290 T353 D354 I406 L414 F415	V255-R289 HydrophobicContact CG1-CB 4.07Å; V255-Y290 WeakPolarHBondContact CA-O 3.23Å; V255-T353 HydrophobicContact CB-CG2 3.86Å; V255-T353 PolarHBondContact N-OG1 2.9Å; V255-T353 WeakPolarHBondContact O-CA 3.29Å; V255-D354 PolarHBondContact O-N 3.23Å; V255-I406 HydrophobicContact CB-CD1 4.19Å; V255-I406 HydrophobicContact CG1-CD1 3.87Å; V255-I406 HydrophobicContact CG2-CD1 3.42Å; V255-I406 VanDerWaalsContact CG2-CD1 3.42Å; V255-L414 HydrophobicContact CG2-CD1 4.1Å; V255-F415 HydrophobicContact CG2-CE2 4.29Å; V255-F415 HydrophobicContact CG2-CZ 4.13Å
256	K	95.1	Very high	94.1	Very high	1 Å²	1	25.5 Å²	25.5	0%	0.004	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.6	-179.6	-68.1	-62.9	-171.5	168.5	0	111.2	D222 T254 P258 Y290 L292 R349 E350 V352 D354	D222-K256 WeakPolarHBondContact OD2-CD 3.22Å; D222-K256 WeakPolarHBondContact OD2-CE 3.39Å; D222-K256 IonicContact OD2-NZ 2.85Å; D222-K256 PolarHBondContact OD2-NZ 3.49Å; T254-K256 HydrophobicContact CG2-CG 4.49Å; K256-P258 VanDerWaalsContact C-CD 3.45Å; K256-Y290 PolarHBondContact N-O 2.64Å; K256-Y290 PolarHBondContact O-N 3.5Å; K256-L292 HydrophobicContact CG-CD1 4.24Å; K256-R349 PolarHBondContact NZ-O 3.18Å; K256-E350 VanDerWaalsContact CE-O 3.29Å; K256-E350 WeakPolarHBondContact CE-O 3.47Å; K256-V352 WeakPolarHBondContact CE-O 3.29Å; K256-V352 PolarHBondContact NZ-O 2.94Å; K256-D354 WeakPolarHBondContact CA-OD2 3.46Å; K256-D354 WeakPolarHBondContact CD-OD2 3.49Å; K256-D354 IonicContact NZ-OD1 2.89Å; K256-D354 PolarHBondContact NZ-OD1 2.8Å
257	Q	94.7	Very high	94.3	Very high	18 Å²	18	25.5 Å²	25.5	8%	0.084	12%	0.117	C	C	.	.			trans	-127.7	62.6	178.5	-167.1	170.8	-3.3	0	0	110.6	A221 V285 G286 R289 D354	A221-Q257 WeakPolarHBondContact CB-O 3.3Å; Q257-V285 HydrophobicContact CG-CB 4.09Å; Q257-G286 WeakPolarHBondContact CG-O 3.26Å; Q257-G286 PolarHBondContact NE2-O 2.61Å; Q257-G286 PolarHBondContact O-N 3.42Å; Q257-R289 HydrophobicContact CB-CG 4.04Å; Q257-R289 VanDerWaalsContact CD-CG 3.42Å; Q257-R289 HydrophobicContact CG-CG 3.82Å; Q257-R289 VanDerWaalsContact OE1-CG 3.27Å; Q257-D354 PolarHBondContact N-OD2 2.9Å
258	P	96.1	Very high	94.5	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	12%	0.116	C	C	.	.			trans	-67.5	149.8	-169.9	33.6	-39.7	0	0	0	111.6	D222 Y224 F230 K256 G286 Y290 M373	D222-P258 HydrophobicContact CB-CB 4.34Å; D222-P258 CarbonylContact O-C 3.52Å; D222-P258 WeakPolarHBondContact O-CA 3.44Å; D222-P258 WeakPolarHBondContact O-CB 3.35Å; Y224-P258 HydrophobicContact CD1-CB 3.94Å; Y224-P258 HydrophobicContact CD1-CG 4.46Å; Y224-P258 HydrophobicContact CE1-CB 4.44Å; F230-P258 HydrophobicContact CE1-CB 4.08Å; F230-P258 HydrophobicContact CE1-CG 4.35Å; F230-P258 HydrophobicContact CZ-CB 4.49Å; K256-P258 VanDerWaalsContact C-CD 3.45Å; P258-G286 VanDerWaalsContact O-CA 3.32Å; P258-G286 WeakPolarHBondContact O-CA 3.17Å; P258-Y290 HydrophobicContact CG-CD2 4.49Å; P258-M373 HydrophobicContact CB-SD 4.38Å; P258-M373 HydrophobicContact CG-CE 3.76Å; P258-M373 HydrophobicContact CG-CG 4.16Å; P258-M373 HydrophobicContact CG-SD 3.17Å; P258-M373 WeakPolarHBondContact CG-SD 3.42Å
259	V	96.8	Very high	94.7	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.006	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	142.1	-172.1	65.5	0	0	0	0	111.5	P220 D222 I223 Y224 V264 A284 L363	P220-V259 HydrophobicContact CB-CG1 4.39Å; D222-V259 PolarHBondContact O-N 2.96Å; I223-V259 WeakPolarHBondContact CA-O 3.39Å; I223-V259 HydrophobicContact CB-CG1 4.41Å; I223-V259 HydrophobicContact CG1-CG1 3.91Å; Y224-V259 VanDerWaalsContact CD1-C 3.44Å; Y224-V259 WeakPolarHBondContact CD1-O 3.43Å; Y224-V259 PolarHBondContact N-O 3.23Å; V259-V264 HydrophobicContact CB-CG2 4.28Å; V259-V264 HydrophobicContact CG1-CG2 3.54Å; V259-V264 HydrophobicContact CG2-CG2 3.73Å; V259-A284 WeakPolarHBondContact CG1-O 3.31Å; V259-L363 HydrophobicContact CG2-CD1 3.87Å
260	Y	97.3	Very high	94.9	Very high	31 Å²	31	23.1 Å²	23.1	12%	0.122	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.9	179.6	-174.6	-131	0	0	0	111.4	Y224 S262 D263 V264 T371 Q376	Y224-Y260 HydrophobicContact CD2-CD2 4.06Å; Y224-Y260 AromaticContact CE2-CD2 3.63Å; Y224-Y260 HydrophobicContact CE2-CD2 3.63Å; Y224-Y260 HydrophobicContact CE2-CE2 4.49Å; Y224-Y260 HydrophobicContact CE2-CG 4.3Å; Y260-S262 VanDerWaalsContact C-N 3.28Å; Y260-S262 PolarHBondContact O-N 3.11Å; Y260-D263 WeakPolarHBondContact O-CB 3.29Å; Y260-D263 PolarHBondContact O-N 3.21Å; Y260-V264 PolarHBondContact O-N 3.45Å; Y260-T371 HydrophobicContact CD1-CG2 4.28Å; Y260-Q376 HydrophobicContact CD2-CG 4.38Å; Y260-Q376 HydrophobicContact CE1-CG 4.39Å; Y260-Q376 HydrophobicContact CE2-CB 4.31Å; Y260-Q376 HydrophobicContact CE2-CG 4.11Å
261	V	97.1	Very high	95.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-58.9	-34.8	-175	65.9	0	0	0	0	114	F74 V75 Y78 I223 Y224 D263 V264 A265	F74-V261 HydrophobicContact CD1-CG2 4.46Å; F74-V261 HydrophobicContact CE1-CB 4.11Å; F74-V261 HydrophobicContact CE1-CG2 3.89Å; F74-V261 HydrophobicContact CE2-CB 4.28Å; F74-V261 HydrophobicContact CE2-CG1 4.19Å; F74-V261 HydrophobicContact CE2-CG2 4.1Å; F74-V261 HydrophobicContact CZ-CB 3.62Å; F74-V261 HydrophobicContact CZ-CG1 3.91Å; F74-V261 HydrophobicContact CZ-CG2 3.68Å; V75-V261 HydrophobicContact CG2-CG2 4.43Å; Y78-V261 HydrophobicContact CD1-CG1 3.94Å; Y78-V261 HydrophobicContact CD2-CB 4.32Å; Y78-V261 HydrophobicContact CD2-CG1 3.88Å; Y78-V261 HydrophobicContact CD2-CG2 3.44Å; Y78-V261 VanDerWaalsContact CD2-CG2 3.44Å; Y78-V261 HydrophobicContact CE1-CG1 3.67Å; Y78-V261 HydrophobicContact CE2-CB 4.39Å; Y78-V261 HydrophobicContact CE2-CG1 3.63Å; Y78-V261 HydrophobicContact CE2-CG2 3.88Å; Y78-V261 HydrophobicContact CG-CG1 4.04Å; Y78-V261 HydrophobicContact CG-CG2 3.84Å; I223-V261 HydrophobicContact CG2-CB 3.58Å; I223-V261 HydrophobicContact CG2-CG2 3.93Å; Y224-V261 WeakPolarHBondContact O-CB 3.49Å; Y224-V261 PolarHBondContact O-N 2.88Å; V261-D263 VanDerWaalsContact C-N 3.29Å; V261-D263 PolarHBondContact O-N 2.67Å; V261-V264 PolarHBondContact O-N 3.43Å; V261-A265 WeakPolarHBondContact O-CB 3.34Å; V261-A265 PolarHBondContact O-N 3.21Å
262	S	96.3	Very high	95.2	Very high	29 Å²	29	19.2 Å²	19.2	20%	0.203	9%	0.094	C	C	.	.	H	α-helix	trans	-67.2	-32.9	178.2	-165.9	0	0	0	0	111.7	K82 Y260 A265 Q266	K82-S262 WeakPolarHBondContact CE-O 3.23Å; K82-S262 VanDerWaalsContact CE-OG 3.22Å; K82-S262 WeakPolarHBondContact CE-OG 3.49Å; K82-S262 PolarHBondContact NZ-O 3.24Å; K82-S262 PolarHBondContact NZ-OG 3.38Å; Y260-S262 VanDerWaalsContact C-N 3.28Å; Y260-S262 PolarHBondContact O-N 3.11Å; S262-A265 PolarHBondContact O-N 3.23Å; S262-Q266 WeakPolarHBondContact O-CB 3.48Å; S262-Q266 PolarHBondContact O-N 2.61Å
263	D	97.1	Very high	95.2	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.064	10%	0.098	C	C	.	.	H	α-helix	trans	-72.5	-42.7	179.8	-59.5	-10.6	0	0	0	109.6	Y260 V261 A265 Q266 A267 L363 V368 L370 T371	Y260-D263 WeakPolarHBondContact O-CB 3.29Å; Y260-D263 PolarHBondContact O-N 3.21Å; V261-D263 VanDerWaalsContact C-N 3.29Å; V261-D263 PolarHBondContact O-N 2.67Å; D263-A265 VanDerWaalsContact C-N 3.34Å; D263-A265 PolarHBondContact O-N 2.96Å; D263-Q266 PolarHBondContact O-N 3.44Å; D263-A267 WeakPolarHBondContact O-CB 3.33Å; D263-A267 PolarHBondContact O-N 3.46Å; D263-L363 HydrophobicContact CB-CD1 4.44Å; D263-V368 HydrophobicContact CB-CG1 3.82Å; D263-L370 HydrophobicContact CB-CD2 4.5Å; D263-T371 PolarHBondContact OD1-OG1 3.43Å; D263-T371 WeakPolarHBondContact OD2-CB 3.04Å; D263-T371 PolarHBondContact OD2-N 3.46Å; D263-T371 PolarHBondContact OD2-OG1 3.27Å
264	V	97.3	Very high	95.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.7	-44.8	172.4	-177.4	0	0	0	0	111.1	L177 I223 V259 Y260 V261 Q266 A267 I268 A284	L177-V264 HydrophobicContact CD1-CG1 4.26Å; I223-V264 HydrophobicContact CD1-CG1 4.34Å; I223-V264 HydrophobicContact CD1-CG2 4.4Å; I223-V264 HydrophobicContact CG1-CG2 4.45Å; V259-V264 HydrophobicContact CB-CG2 4.28Å; V259-V264 HydrophobicContact CG1-CG2 3.54Å; V259-V264 HydrophobicContact CG2-CG2 3.73Å; Y260-V264 PolarHBondContact O-N 3.45Å; V261-V264 PolarHBondContact O-N 3.43Å; V264-Q266 VanDerWaalsContact C-N 3.32Å; V264-Q266 PolarHBondContact O-N 3.47Å; V264-A267 WeakPolarHBondContact O-CB 3.48Å; V264-A267 PolarHBondContact O-N 3.23Å; V264-I268 HydrophobicContact CG1-CD1 4.16Å; V264-I268 WeakPolarHBondContact O-CG1 3.45Å; V264-I268 PolarHBondContact O-N 3.28Å; V264-A284 HydrophobicContact CG2-CB 4.39Å
265	A	97.1	Very high	95.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.3	-35.6	177.9	0	0	0	0	0	112.4	V79 K82 V261 S262 D263 I269	V79-A265 HydrophobicContact CG2-CB 3.88Å; K82-A265 HydrophobicContact CD-CB 3.9Å; V261-A265 WeakPolarHBondContact O-CB 3.34Å; V261-A265 PolarHBondContact O-N 3.21Å; S262-A265 PolarHBondContact O-N 3.23Å; D263-A265 VanDerWaalsContact C-N 3.34Å; D263-A265 PolarHBondContact O-N 2.96Å; A265-I269 WeakPolarHBondContact O-CG1 3.39Å; A265-I269 PolarHBondContact O-N 2.85Å
266	Q	96.6	Very high	95	Very high	60 Å²	60	25.7 Å²	25.7	28%	0.28	14%	0.135	S	C	.	.	H	α-helix	trans	-66.4	-43.6	173.9	-168.9	60	48.7	0	0	111.4	K82 S262 D263 V264 I268 I269 N270 V368	K82-Q266 HydrophobicContact CD-CB 4.4Å; S262-Q266 WeakPolarHBondContact O-CB 3.48Å; S262-Q266 PolarHBondContact O-N 2.61Å; D263-Q266 PolarHBondContact O-N 3.44Å; V264-Q266 VanDerWaalsContact C-N 3.32Å; V264-Q266 PolarHBondContact O-N 3.47Å; Q266-I268 VanDerWaalsContact C-N 3.34Å; Q266-I268 PolarHBondContact O-N 2.91Å; Q266-I269 PolarHBondContact O-N 2.96Å; Q266-I269 VanDerWaalsContact O-N 3.11Å; Q266-N270 PolarHBondContact NE2-OD1 3.19Å; Q266-N270 VanDerWaalsContact O-CG 3.31Å; Q266-N270 PolarHBondContact O-N 2.87Å; Q266-N270 PolarHBondContact O-OD1 2.79Å; Q266-V368 HydrophobicContact CB-CG1 4.26Å; Q266-V368 HydrophobicContact CB-CG2 4.09Å; Q266-V368 HydrophobicContact CG-CG2 3.98Å
267	A	96.7	Very high	94.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60	-43.1	177.9	0	0	0	0	0	112	D263 V264 I269 N270 A271 L363 L366 V368	D263-A267 WeakPolarHBondContact O-CB 3.33Å; D263-A267 PolarHBondContact O-N 3.46Å; V264-A267 WeakPolarHBondContact O-CB 3.48Å; V264-A267 PolarHBondContact O-N 3.23Å; A267-I269 VanDerWaalsContact C-N 3.26Å; A267-I269 PolarHBondContact O-N 3.14Å; A267-N270 PolarHBondContact O-N 2.99Å; A267-A271 VanDerWaalsContact O-CB 3.27Å; A267-A271 WeakPolarHBondContact O-CB 3.34Å; A267-A271 PolarHBondContact O-N 2.76Å; A267-L363 HydrophobicContact CB-CD1 4.45Å; A267-L363 HydrophobicContact CB-CD2 3.37Å; A267-L363 HydrophobicContact CB-CG 4.32Å; A267-L366 HydrophobicContact CB-CD1 3.94Å; A267-V368 HydrophobicContact CB-CG2 3.96Å
268	I	96.7	Very high	94.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.3	-41.4	175	-70.9	163.4	0	0	0	111	V75 V79 I137 L139 I175 L177 I218 V264 Q266 A272	V75-I268 HydrophobicContact CG1-CD1 4.34Å; V79-I268 HydrophobicContact CG1-CG2 4.14Å; V79-I268 HydrophobicContact CG2-CD1 3.64Å; V79-I268 HydrophobicContact CG2-CG2 4.41Å; I137-I268 HydrophobicContact CD1-CG2 3.76Å; I137-I268 HydrophobicContact CG1-CG2 4.33Å; I137-I268 HydrophobicContact CG2-CG2 3.94Å; L139-I268 HydrophobicContact CD2-CD1 4.1Å; I175-I268 HydrophobicContact CD1-CG2 4.18Å; I175-I268 WeakPolarHBondContact CD1-O 3.4Å; I175-I268 HydrophobicContact CG2-CG2 4.37Å; L177-I268 HydrophobicContact CD1-CD1 4.45Å; I218-I268 HydrophobicContact CD1-CB 4.45Å; I218-I268 HydrophobicContact CD1-CG1 3.66Å; V264-I268 HydrophobicContact CG1-CD1 4.16Å; V264-I268 WeakPolarHBondContact O-CG1 3.45Å; V264-I268 PolarHBondContact O-N 3.28Å; Q266-I268 VanDerWaalsContact C-N 3.34Å; Q266-I268 PolarHBondContact O-N 2.91Å; I268-A272 PolarHBondContact O-N 3.32Å
269	I	95.1	Very high	94.6	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-73.9	-38.3	-178.9	-68.2	169.6	0	0	0	111.8	K82 L83 A265 Q266 A267 A272 K273	K82-I269 HydrophobicContact CB-CD1 3.07Å; K82-I269 HydrophobicContact CD-CD1 4.01Å; K82-I269 HydrophobicContact CG-CD1 4.2Å; L83-I269 HydrophobicContact CD2-CD1 4.21Å; L83-I269 HydrophobicContact CD2-CG1 3.82Å; L83-I269 HydrophobicContact CG-CD1 4.08Å; L83-I269 HydrophobicContact CG-CG1 4.05Å; A265-I269 WeakPolarHBondContact O-CG1 3.39Å; A265-I269 PolarHBondContact O-N 2.85Å; Q266-I269 PolarHBondContact O-N 2.96Å; Q266-I269 VanDerWaalsContact O-N 3.11Å; A267-I269 VanDerWaalsContact C-N 3.26Å; A267-I269 PolarHBondContact O-N 3.14Å; I269-A272 PolarHBondContact O-N 2.79Å; I269-K273 WeakPolarHBondContact O-CG 3.23Å; I269-K273 PolarHBondContact O-N 3.01Å
270	N	95.5	Very high	94.5	Very high	35 Å²	35	33.6 Å²	33.6	19%	0.187	18%	0.183	C	C	.	.	H	α-helix	trans	-66.5	-43.7	176.3	-67.8	1.1	0	0	0	109.9	Q266 A267 A272 K273 D274 L366	Q266-N270 PolarHBondContact NE2-OD1 3.19Å; Q266-N270 VanDerWaalsContact O-CG 3.31Å; Q266-N270 PolarHBondContact O-N 2.87Å; Q266-N270 PolarHBondContact O-OD1 2.79Å; A267-N270 PolarHBondContact O-N 2.99Å; N270-A272 VanDerWaalsContact C-N 3.29Å; N270-A272 PolarHBondContact O-N 2.94Å; N270-K273 PolarHBondContact O-N 3.43Å; N270-D274 VanDerWaalsContact O-CB 3.32Å; N270-D274 WeakPolarHBondContact O-CB 3.27Å; N270-D274 PolarHBondContact O-N 3.35Å; N270-L366 HydrophobicContact CB-CB 4.43Å; N270-L366 WeakPolarHBondContact CB-O 3.35Å; N270-L366 PolarHBondContact ND2-O 3.31Å
271	A	95	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.5	-36.8	172.6	0	0	0	0	0	112.5	I175 T216 A267 K273 S277 L366	I175-A271 HydrophobicContact CD1-CB 4.14Å; T216-A271 HydrophobicContact CG2-CB 4.23Å; A267-A271 VanDerWaalsContact O-CB 3.27Å; A267-A271 WeakPolarHBondContact O-CB 3.34Å; A267-A271 PolarHBondContact O-N 2.76Å; A271-K273 PolarHBondContact O-N 3.16Å; A271-S277 PolarHBondContact O-OG 3.36Å; A271-L366 HydrophobicContact CB-CD1 4.31Å; A271-L366 HydrophobicContact CB-CD2 4.18Å
272	A	92.7	Very high	94.5	Very high	11 Å²	11	34.2 Å²	34.2	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-24.5	175.7	0	0	0	0	0	113.6	V135 I175 I268 I269 N270	V135-A272 HydrophobicContact CG1-CB 4.07Å; I175-A272 HydrophobicContact CD1-CB 3.8Å; I268-A272 PolarHBondContact O-N 3.32Å; I269-A272 PolarHBondContact O-N 2.79Å; N270-A272 VanDerWaalsContact C-N 3.29Å; N270-A272 PolarHBondContact O-N 2.94Å
273	K	90.5	Very high	94.5	Very high	113 Å²	113	32.9 Å²	32.9	49%	0.491	18%	0.179	S	C	.	.	H	α-helix	trans	-99	-29.4	-179.2	-66.2	176.7	-174.3	177.3	0	113	I64 I269 N270 A271 P275	I64-K273 HydrophobicContact CD1-CG 4Å; I269-K273 WeakPolarHBondContact O-CG 3.23Å; I269-K273 PolarHBondContact O-N 3.01Å; N270-K273 PolarHBondContact O-N 3.43Å; A271-K273 PolarHBondContact O-N 3.16Å; K273-P275 WeakPolarHBondContact O-CD 3.31Å
274	D	91.5	Very high	94.4	Very high	43 Å²	43	32.3 Å²	32.3	23%	0.23	18%	0.176	C	C	.	.			trans	-78.3	116.3	-176.2	-179.5	14.6	0	0	0	110.6	N270 D276 S277	N270-D274 VanDerWaalsContact O-CB 3.32Å; N270-D274 WeakPolarHBondContact O-CB 3.27Å; N270-D274 PolarHBondContact O-N 3.35Å; D274-D276 PolarHBondContact O-N 3.31Å; D274-D276 WeakPolarHBondContact OD1-CB 3.31Å; D274-D276 PolarHBondContact OD1-N 3.34Å; D274-S277 PolarHBondContact O-N 3.12Å; D274-S277 PolarHBondContact O-OG 3.37Å
275	P	88.7	Confident	94.3	Very high	81 Å²	81	32.8 Å²	32.8	53%	0.526	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-62.7	-30.3	177.3	25.9	-34.2	0	0	0	112.9	R173 K273 S277	R173-P275 PolarHBondContact NH2-O 3.04Å; R173-P275 VanDerWaalsContact NH2-O 3.12Å; K273-P275 WeakPolarHBondContact O-CD 3.31Å; P275-S277 PolarHBondContact O-N 3.14Å
276	D	92.3	Very high	94.2	Very high	98 Å²	98	32.9 Å²	32.9	52%	0.524	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-74.9	-14.7	-174.7	-69.7	-19.8	0	0	0	113.1	D274 A278 R280	D274-D276 PolarHBondContact O-N 3.31Å; D274-D276 WeakPolarHBondContact OD1-CB 3.31Å; D274-D276 PolarHBondContact OD1-N 3.34Å; D276-A278 PolarHBondContact O-N 2.91Å; D276-R280 WeakPolarHBondContact O-CD 3.39Å; D276-R280 PolarHBondContact O-NE 2.76Å
277	S	91.5	Very high	94	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-72.5	-13.1	179	72.9	0	0	0	0	114.1	T216 A271 D274 P275 G279 R280 Y282	T216-S277 WeakPolarHBondContact CG2-O 3.4Å; T216-S277 PolarHBondContact OG1-O 3.47Å; A271-S277 PolarHBondContact O-OG 3.36Å; D274-S277 PolarHBondContact O-N 3.12Å; D274-S277 PolarHBondContact O-OG 3.37Å; P275-S277 PolarHBondContact O-N 3.14Å; S277-G279 PolarHBondContact O-N 3.43Å; S277-R280 PolarHBondContact O-N 3.09Å; S277-Y282 WeakPolarHBondContact CA-OH 3.48Å
278	A	92.1	Very high	93.8	Very high	31 Å²	31	36.1 Å²	36.1	26%	0.256	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	126	-176	0	0	0	0	0	111.5	D276 R280	D276-A278 PolarHBondContact O-N 2.91Å; A278-R280 PolarHBondContact O-N 3.37Å
279	G	93.4	Very high	93.6	Very high	40 Å²	40	38.7 Å²	38.7	41%	0.412	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	3.7	-179.7	0	0	0	0	0	115.4	N214 A215 S277	N214-G279 VanDerWaalsContact C-N 3.32Å; N214-G279 PolarHBondContact O-N 3.19Å; A215-G279 WeakPolarHBondContact O-CA 3.49Å; S277-G279 PolarHBondContact O-N 3.43Å
280	R	95.3	Very high	93.6	Very high	116 Å²	116	38.6 Å²	38.6	44%	0.438	21%	0.207	S	C	.	.			trans	-91.1	151.5	178.6	-64.4	-171.1	-178	168.2	7.6	112.1	I217 D276 S277 A278 Y282	I217-R280 PolarHBondContact N-O 3.12Å; D276-R280 WeakPolarHBondContact O-CD 3.39Å; D276-R280 PolarHBondContact O-NE 2.76Å; S277-R280 PolarHBondContact O-N 3.09Å; A278-R280 PolarHBondContact O-N 3.37Å; R280-Y282 HydrophobicContact CB-CD2 4.31Å; R280-Y282 HydrophobicContact CB-CE2 3.65Å
281	I	96.1	Very high	93.5	Very high	41 Å²	41	38.4 Å²	38.4	21%	0.21	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	128.3	171.1	-56.5	176.6	0	0	0	107.5	I217 R219 V360 P361	I217-I281 HydrophobicContact CB-CG1 4.25Å; I217-I281 HydrophobicContact CD1-CG1 4.35Å; I217-I281 HydrophobicContact CG2-CG2 4.44Å; I217-I281 CarbonylContact O-C 3.02Å; I217-I281 VanDerWaalsContact O-CA 3.3Å; I217-I281 WeakPolarHBondContact O-CA 3.02Å; R219-I281 HydrophobicContact CG-CG2 4.12Å; I281-V360 HydrophobicContact CB-CG1 4.42Å; I281-V360 HydrophobicContact CG2-CG1 4.29Å; I281-V360 WeakPolarHBondContact O-CG1 3.31Å; I281-P361 VanDerWaalsContact O-CD 3.31Å; I281-P361 WeakPolarHBondContact O-CD 3.32Å; I281-P361 VanDerWaalsContact O-CG 3.28Å; I281-P361 WeakPolarHBondContact O-CG 3.25Å
282	Y	96.7	Very high	93.5	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.4	176.5	-68.1	-91.2	0	0	0	110.6	T216 I217 R219 S277 R280 P361 L366	T216-Y282 HydrophobicContact CG2-CD2 3.76Å; T216-Y282 HydrophobicContact CG2-CE2 3.78Å; I217-Y282 PolarHBondContact O-N 3.36Å; R219-Y282 PolarHBondContact N-O 3.09Å; S277-Y282 WeakPolarHBondContact CA-OH 3.48Å; R280-Y282 HydrophobicContact CB-CD2 4.31Å; R280-Y282 HydrophobicContact CB-CE2 3.65Å; Y282-P361 CarbonylContact C-O 3.29Å; Y282-P361 WeakPolarHBondContact CA-O 3.35Å; Y282-P361 HydrophobicContact CD1-CB 3.67Å; Y282-P361 HydrophobicContact CD1-CG 3.62Å; Y282-P361 HydrophobicContact CE1-CB 3.68Å; Y282-P361 HydrophobicContact CE1-CG 3.68Å; Y282-P361 HydrophobicContact CG-CG 4.22Å; Y282-L366 HydrophobicContact CD1-CD1 3.75Å; Y282-L366 HydrophobicContact CD1-CD2 4.3Å; Y282-L366 HydrophobicContact CD1-CG 3.77Å; Y282-L366 HydrophobicContact CD2-CD1 4.25Å; Y282-L366 HydrophobicContact CE1-CD1 4Å; Y282-L366 HydrophobicContact CE1-CD2 3.66Å; Y282-L366 HydrophobicContact CE1-CG 3.55Å; Y282-L366 HydrophobicContact CE2-CD1 4.48Å; Y282-L366 HydrophobicContact CE2-CD2 4.16Å; Y282-L366 HydrophobicContact CG-CD1 3.89Å; Y282-L366 HydrophobicContact CG-CG 4.37Å
283	Q	96	Very high	93.5	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.009	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.9	172.1	-72.7	179	34.4	0	0	110.3	L180 V285 L357 V360 P361 T362	L180-Q283 HydrophobicContact CD1-CB 4.08Å; L180-Q283 HydrophobicContact CD1-CG 3.88Å; Q283-V285 HydrophobicContact CB-CG1 4.33Å; Q283-V285 PolarHBondContact O-N 2.91Å; Q283-L357 PolarHBondContact NE2-O 3.48Å; Q283-L357 VanDerWaalsContact OE1-N 3.07Å; Q283-V360 HydrophobicContact CG-CB 4.28Å; Q283-V360 HydrophobicContact CG-CG1 3.87Å; Q283-V360 VanDerWaalsContact NE2-CB 3.27Å; Q283-P361 PolarHBondContact N-O 2.95Å; Q283-T362 WeakPolarHBondContact O-CA 3.4Å
284	A	96	Very high	93.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	82.1	178.8	0	0	0	0	0	110.3	I218 R219 P220 A221 V259 V264 L363	I218-A284 HydrophobicContact CG2-CB 3.77Å; R219-A284 PolarHBondContact O-N 3.37Å; P220-A284 WeakPolarHBondContact CA-O 3.23Å; P220-A284 HydrophobicContact CB-CB 3.95Å; A221-A284 PolarHBondContact N-O 3.16Å; V259-A284 WeakPolarHBondContact CG1-O 3.31Å; V264-A284 HydrophobicContact CG2-CB 4.39Å; A284-L363 HydrophobicContact CB-CD1 3.87Å; A284-L363 HydrophobicContact CB-CD2 3.58Å; A284-L363 HydrophobicContact CB-CG 3.88Å
285	V	95.3	Very high	93.8	Very high	9 Å²	9	32.8 Å²	32.8	6%	0.055	18%	0.178	C	C	.	.			trans	-110.4	146.5	-177.9	-61.4	0	0	0	0	110.9	L180 Q257 Q283 V356	L180-V285 HydrophobicContact CD1-CG1 3.75Å; L180-V285 HydrophobicContact CD2-CG1 3.88Å; L180-V285 HydrophobicContact CG-CG1 4.47Å; Q257-V285 HydrophobicContact CG-CB 4.09Å; Q283-V285 HydrophobicContact CB-CG1 4.33Å; Q283-V285 PolarHBondContact O-N 2.91Å; V285-V356 HydrophobicContact CG1-CG2 4.11Å
286	G	93.7	Very high	94.1	Very high	2 Å²	2	28.9 Å²	28.9	2%	0.021	15%	0.153	C	C	.	.			trans	-71.7	170.5	174.3	0	0	0	0	0	113.1	Q257 P258 K288	Q257-G286 WeakPolarHBondContact CG-O 3.26Å; Q257-G286 PolarHBondContact NE2-O 2.61Å; Q257-G286 PolarHBondContact O-N 3.42Å; P258-G286 VanDerWaalsContact O-CA 3.32Å; P258-G286 WeakPolarHBondContact O-CA 3.17Å; G286-K288 VanDerWaalsContact C-N 3.3Å; G286-K288 PolarHBondContact O-N 2.72Å
287	P	92.7	Very high	94.1	Very high	54 Å²	54	25.3 Å²	25.3	35%	0.351	13%	0.134	S	C	.	.	S	Bend	trans	-72.3	-19.9	-174.3	27.3	-33.8	0	0	0	114.3	L370 T372	P287-L370 HydrophobicContact CB-CB 4.17Å; P287-L370 HydrophobicContact CB-CD1 4.31Å; P287-L370 HydrophobicContact CG-CB 4.3Å; P287-T372 HydrophobicContact CG-CG2 3.89Å
288	K	93	Very high	94.3	Very high	75 Å²	75	25.6 Å²	25.6	33%	0.326	14%	0.135	S	C	.	.	S	Bend	trans	-135.9	143.7	-171.8	-71.6	172.2	168.9	-163.1	0	111.4	G286 Y290 E374 C405	G286-K288 VanDerWaalsContact C-N 3.3Å; G286-K288 PolarHBondContact O-N 2.72Å; K288-Y290 HydrophobicContact CB-CE1 4.09Å; K288-Y290 HydrophobicContact CB-CE2 3.89Å; K288-Y290 WeakPolarHBondContact CB-OH 3.28Å; K288-Y290 HydrophobicContact CD-CE1 4.49Å; K288-Y290 VanDerWaalsContact CD-OH 3.27Å; K288-Y290 WeakPolarHBondContact CD-OH 3.11Å; K288-Y290 WeakPolarHBondContact O-CE2 3.03Å; K288-E374 WeakPolarHBondContact CD-OE1 3.3Å; K288-E374 IonicContact NZ-OE1 3.23Å; K288-E374 PolarHBondContact NZ-OE1 3.39Å; K288-C405 VanDerWaalsContact CD-SG 3.59Å
289	R	93.4	Very high	94.4	Very high	53 Å²	53	24.2 Å²	24.2	20%	0.2	12%	0.123	C	C	.	.			trans	-99.5	132	176.7	-61.3	-173.4	78.9	-171.1	-8.8	110.1	V255 Q257 D354 C405 I406 E411	V255-R289 HydrophobicContact CG1-CB 4.07Å; Q257-R289 HydrophobicContact CB-CG 4.04Å; Q257-R289 VanDerWaalsContact CD-CG 3.42Å; Q257-R289 HydrophobicContact CG-CG 3.82Å; Q257-R289 VanDerWaalsContact OE1-CG 3.27Å; R289-D354 PolarHBondContact NH2-O 3.26Å; R289-C405 WeakPolarHBondContact O-CA 3.37Å; R289-I406 PolarHBondContact O-N 3.1Å; R289-E411 WeakPolarHBondContact CD-OE1 3.03Å; R289-E411 IonicContact CZ-OE1 3.08Å; R289-E411 IonicContact CZ-OE2 3.09Å; R289-E411 VanDerWaalsContact CZ-OE2 3.22Å; R289-E411 IonicContact NE-OE1 3.19Å; R289-E411 PolarHBondContact NE-OE1 3.14Å; R289-E411 IonicContact NH1-OE1 2.68Å; R289-E411 PolarHBondContact NH1-OE1 2.94Å; R289-E411 IonicContact NH1-OE2 2.72Å; R289-E411 PolarHBondContact NH1-OE2 2.63Å; R289-E411 IonicContact NH2-OE1 2.64Å; R289-E411 PolarHBondContact NH2-OE1 3.18Å; R289-E411 IonicContact NH2-OE2 3.78Å; R289-E411 PolarHBondContact NH2-OE2 2.98Å
290	Y	94	Very high	94.4	Very high	3 Å²	3	22.3 Å²	22.3	1%	0.012	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.3	-176	-57	-71.8	0	0	0	111.2	V255 K256 P258 K288 L295 M373 E374 P403	V255-Y290 WeakPolarHBondContact CA-O 3.23Å; K256-Y290 PolarHBondContact N-O 2.64Å; K256-Y290 PolarHBondContact O-N 3.5Å; P258-Y290 HydrophobicContact CG-CD2 4.49Å; K288-Y290 HydrophobicContact CB-CE1 4.09Å; K288-Y290 HydrophobicContact CB-CE2 3.89Å; K288-Y290 WeakPolarHBondContact CB-OH 3.28Å; K288-Y290 HydrophobicContact CD-CE1 4.49Å; K288-Y290 VanDerWaalsContact CD-OH 3.27Å; K288-Y290 WeakPolarHBondContact CD-OH 3.11Å; K288-Y290 WeakPolarHBondContact O-CE2 3.03Å; Y290-L295 HydrophobicContact CD2-CD1 4.16Å; Y290-L295 HydrophobicContact CG-CD1 4.1Å; Y290-M373 HydrophobicContact CD2-SD 3.79Å; Y290-M373 HydrophobicContact CE2-CB 4.26Å; Y290-M373 HydrophobicContact CE2-CG 3.93Å; Y290-M373 HydrophobicContact CE2-SD 3.47Å; Y290-M373 WeakPolarHBondContact CE2-SD 3.37Å; Y290-E374 VanDerWaalsContact OH-CD 3.24Å; Y290-E374 PolarHBondContact OH-OE1 2.91Å; Y290-E374 PolarHBondContact OH-OE2 2.91Å; Y290-P403 HydrophobicContact CD1-CB 4.08Å; Y290-P403 HydrophobicContact CD1-CG 3.64Å; Y290-P403 HydrophobicContact CE1-CB 4.48Å; Y290-P403 HydrophobicContact CE1-CG 3.64Å; Y290-P403 HydrophobicContact CG-CG 4.48Å
291	Q	93.9	Very high	94.2	Very high	31 Å²	31	21.2 Å²	21.2	15%	0.145	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	132.4	165	-153.7	176.1	15.6	0	0	108.7	E252 S293 E294 L295 I406	E252-Q291 VanDerWaalsContact CA-NE2 3.26Å; E252-Q291 PolarHBondContact O-NE2 3.35Å; Q291-S293 VanDerWaalsContact CD-OG 3.25Å; Q291-S293 WeakPolarHBondContact CG-OG 2.97Å; Q291-S293 PolarHBondContact O-N 3.29Å; Q291-S293 PolarHBondContact OE1-OG 2.95Å; Q291-E294 HydrophobicContact CB-CB 4.37Å; Q291-E294 HydrophobicContact CB-CG 4.26Å; Q291-E294 PolarHBondContact O-N 3.45Å; Q291-L295 VanDerWaalsContact O-CB 3.32Å; Q291-L295 WeakPolarHBondContact O-CB 3.44Å; Q291-L295 PolarHBondContact O-N 3.26Å; Q291-I406 HydrophobicContact CB-CD1 3.76Å; Q291-I406 HydrophobicContact CB-CG1 4.26Å; Q291-I406 HydrophobicContact CG-CD1 4.22Å
292	L	94.3	Very high	94	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-59.2	-38.1	-178.4	179.7	63.4	0	0	0	111.4	Y234 L247 T254 K256 L295 V296	Y234-L292 HydrophobicContact CE2-CD1 4.37Å; L247-L292 HydrophobicContact CD2-CD2 4.39Å; T254-L292 HydrophobicContact CG2-CB 4.14Å; T254-L292 HydrophobicContact CG2-CD2 3.94Å; T254-L292 WeakPolarHBondContact O-CB 3.38Å; T254-L292 PolarHBondContact O-N 3.15Å; K256-L292 HydrophobicContact CG-CD1 4.24Å; L292-L295 PolarHBondContact O-N 3.16Å; L292-V296 HydrophobicContact CD1-CG2 3.86Å; L292-V296 HydrophobicContact CG-CG2 4.27Å; L292-V296 WeakPolarHBondContact O-CB 3.44Å; L292-V296 VanDerWaalsContact O-CG2 3.25Å; L292-V296 WeakPolarHBondContact O-CG2 3.5Å; L292-V296 PolarHBondContact O-N 3.36Å
293	S	93.6	Very high	93.7	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-55.3	-56.2	176.1	66.8	0	0	0	0	111	K250 G251 Q291 L295 V296 D297 R314	K250-S293 VanDerWaalsContact O-CB 3.26Å; K250-S293 WeakPolarHBondContact O-CB 3.32Å; G251-S293 PolarHBondContact O-N 2.75Å; Q291-S293 VanDerWaalsContact CD-OG 3.25Å; Q291-S293 WeakPolarHBondContact CG-OG 2.97Å; Q291-S293 PolarHBondContact O-N 3.29Å; Q291-S293 PolarHBondContact OE1-OG 2.95Å; S293-L295 VanDerWaalsContact C-N 3.35Å; S293-L295 PolarHBondContact O-N 3.06Å; S293-V296 PolarHBondContact O-N 3.24Å; S293-D297 PolarHBondContact O-N 2.89Å; S293-D297 VanDerWaalsContact O-N 3.11Å; S293-R314 PolarHBondContact O-NH1 3.17Å
294	E	93.6	Very high	93.4	Very high	42 Å²	42	20.6 Å²	20.6	20%	0.196	10%	0.095	C	C	.	.	H	α-helix	trans	-66.2	-37.4	-178.5	-65.4	-159.5	161.9	0	0	112.7	Q291 D297 W298 P403 K404	Q291-E294 HydrophobicContact CB-CB 4.37Å; Q291-E294 HydrophobicContact CB-CG 4.26Å; Q291-E294 PolarHBondContact O-N 3.45Å; E294-D297 PolarHBondContact O-N 2.95Å; E294-W298 WeakPolarHBondContact O-CB 3.06Å; E294-W298 PolarHBondContact O-N 3.07Å; E294-P403 HydrophobicContact CB-CB 4.35Å; E294-K404 VanDerWaalsContact OE2-CA 3.25Å; E294-K404 WeakPolarHBondContact OE2-CA 3.36Å; E294-K404 WeakPolarHBondContact OE2-CB 3.37Å; E294-K404 WeakPolarHBondContact OE2-CG 3.34Å; E294-K404 PolarHBondContact OE2-N 3.03Å
295	L	94.3	Very high	93	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.7	-47.9	178	-172.6	66.9	0	0	0	111.3	F230 Y290 Q291 L292 S293 W298 F299 M373 P403	F230-L295 HydrophobicContact CE1-CD2 4.12Å; F230-L295 HydrophobicContact CZ-CD2 3.81Å; Y290-L295 HydrophobicContact CD2-CD1 4.16Å; Y290-L295 HydrophobicContact CG-CD1 4.1Å; Q291-L295 VanDerWaalsContact O-CB 3.32Å; Q291-L295 WeakPolarHBondContact O-CB 3.44Å; Q291-L295 PolarHBondContact O-N 3.26Å; L292-L295 PolarHBondContact O-N 3.16Å; S293-L295 VanDerWaalsContact C-N 3.35Å; S293-L295 PolarHBondContact O-N 3.06Å; L295-W298 HydrophobicContact CD1-CE3 4.18Å; L295-W298 HydrophobicContact CD1-CZ3 4.48Å; L295-W298 PolarHBondContact O-N 2.64Å; L295-F299 HydrophobicContact CD1-CE1 3.69Å; L295-F299 HydrophobicContact CD1-CZ 3.66Å; L295-F299 HydrophobicContact CD2-CE2 4.29Å; L295-F299 HydrophobicContact CD2-CZ 3.86Å; L295-F299 HydrophobicContact CG-CE1 3.88Å; L295-F299 HydrophobicContact CG-CE2 3.9Å; L295-F299 HydrophobicContact CG-CZ 3.4Å; L295-F299 WeakPolarHBondContact O-CD1 3.12Å; L295-F299 VanDerWaalsContact O-CG 3.27Å; L295-F299 WeakPolarHBondContact O-CG 3.5Å; L295-F299 PolarHBondContact O-N 3.21Å; L295-M373 HydrophobicContact CD1-CE 3.95Å; L295-M373 HydrophobicContact CD1-SD 3.78Å; L295-P403 HydrophobicContact CD1-CG 4.35Å
296	V	94.3	Very high	92.6	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-67.3	-37.7	179.1	175.5	0	0	0	0	111.5	Y234 M245 L247 L292 S293 W298 F299 H300	Y234-V296 HydrophobicContact CD1-CG1 4.27Å; Y234-V296 HydrophobicContact CD1-CG2 3.67Å; Y234-V296 HydrophobicContact CD2-CG2 4.49Å; Y234-V296 HydrophobicContact CE1-CG2 3.73Å; Y234-V296 HydrophobicContact CG-CG2 4.09Å; M245-V296 HydrophobicContact CG-CG1 3.89Å; L247-V296 HydrophobicContact CD1-CB 4.19Å; L247-V296 HydrophobicContact CD1-CG1 4.28Å; L247-V296 HydrophobicContact CD1-CG2 4.25Å; L247-V296 HydrophobicContact CD2-CG2 4.31Å; L292-V296 HydrophobicContact CD1-CG2 3.86Å; L292-V296 HydrophobicContact CG-CG2 4.27Å; L292-V296 WeakPolarHBondContact O-CB 3.44Å; L292-V296 VanDerWaalsContact O-CG2 3.25Å; L292-V296 WeakPolarHBondContact O-CG2 3.5Å; L292-V296 PolarHBondContact O-N 3.36Å; S293-V296 PolarHBondContact O-N 3.24Å; V296-W298 VanDerWaalsContact C-N 3.34Å; V296-F299 PolarHBondContact O-N 2.94Å; V296-H300 PolarHBondContact O-N 3.02Å; V296-H300 VanDerWaalsContact O-N 3.12Å; V296-H300 PolarHBondContact O-ND1 3.13Å
297	D	93.7	Very high	92.2	Very high	23 Å²	23	30 Å²	30	12%	0.123	14%	0.139	C	C	.	.	H	α-helix	trans	-62.2	-43.7	173.1	-83.4	7.2	0	0	0	111.8	S293 E294 F299 H300 R301 Y312 R314	S293-D297 PolarHBondContact O-N 2.89Å; S293-D297 VanDerWaalsContact O-N 3.11Å; E294-D297 PolarHBondContact O-N 2.95Å; D297-F299 VanDerWaalsContact C-N 3.32Å; D297-F299 PolarHBondContact O-N 3.06Å; D297-H300 PolarHBondContact O-N 2.77Å; D297-H300 VanDerWaalsContact O-N 3.16Å; D297-R301 WeakPolarHBondContact O-CG 3.28Å; D297-R301 PolarHBondContact O-N 3.17Å; D297-Y312 WeakPolarHBondContact OD1-CE1 3.29Å; D297-Y312 PolarHBondContact OD1-OH 3.15Å; D297-R314 WeakPolarHBondContact OD1-CD 3.28Å; D297-R314 WeakPolarHBondContact OD1-CG 3.06Å; D297-R314 IonicContact OD1-CZ 2.87Å; D297-R314 IonicContact OD1-NE 2.67Å; D297-R314 PolarHBondContact OD1-NE 3.25Å; D297-R314 IonicContact OD1-NH1 3.29Å; D297-R314 PolarHBondContact OD1-NH1 3.12Å; D297-R314 IonicContact OD2-CZ 3.44Å; D297-R314 IonicContact OD2-NE 2.83Å; D297-R314 PolarHBondContact OD2-NE 2.59Å; D297-R314 IonicContact OD2-NH1 3.26Å; D297-R314 PolarHBondContact OD2-NH1 3.01Å; D297-R314 IonicContact OD2-NH2 3.02Å; D297-R314 PolarHBondContact OD2-NH2 3Å; D297-R314 VanDerWaalsContact OD2-NH2 3.14Å
298	W	94.4	Very high	91.8	Very high	6 Å²	6	36.2 Å²	36.2	2%	0.023	16%	0.161	C	C	.	.	H	α-helix	trans	-61.5	-41.1	177.1	178.7	64.8	0	0	0	111.7	E294 L295 V296 H300 R301 L302 M373 E374 V377 S401 P403	E294-W298 WeakPolarHBondContact O-CB 3.06Å; E294-W298 PolarHBondContact O-N 3.07Å; L295-W298 HydrophobicContact CD1-CE3 4.18Å; L295-W298 HydrophobicContact CD1-CZ3 4.48Å; L295-W298 PolarHBondContact O-N 2.64Å; V296-W298 VanDerWaalsContact C-N 3.34Å; W298-H300 VanDerWaalsContact C-N 3.32Å; W298-H300 PolarHBondContact O-N 3.18Å; W298-R301 PolarHBondContact O-N 3.11Å; W298-L302 HydrophobicContact CD2-CD1 3.84Å; W298-L302 HydrophobicContact CD2-CG 4.43Å; W298-L302 HydrophobicContact CE3-CD1 4.15Å; W298-L302 HydrophobicContact CH2-CD1 3.99Å; W298-L302 HydrophobicContact CZ2-CD1 3.66Å; W298-L302 HydrophobicContact CZ2-CG 4.46Å; W298-L302 HydrophobicContact CZ3-CD1 4.23Å; W298-L302 WeakPolarHBondContact O-CG 3.37Å; W298-L302 PolarHBondContact O-N 3.46Å; W298-M373 HydrophobicContact CH2-CB 4.45Å; W298-M373 HydrophobicContact CZ3-CB 4.36Å; W298-E374 HydrophobicContact CH2-CG 4.48Å; W298-E374 HydrophobicContact CZ2-CG 4.45Å; W298-V377 HydrophobicContact CH2-CB 3.76Å; W298-V377 HydrophobicContact CH2-CG1 4Å; W298-V377 HydrophobicContact CH2-CG2 4.3Å; W298-V377 HydrophobicContact CZ3-CB 3.89Å; W298-V377 HydrophobicContact CZ3-CG1 3.76Å; W298-V377 HydrophobicContact CZ3-CG2 4.16Å; W298-S401 PolarHBondContact NE1-O 2.78Å; W298-P403 HydrophobicContact CB-CB 4.14Å; W298-P403 HydrophobicContact CB-CG 4.4Å; W298-P403 VanDerWaalsContact CD2-CD 3.5Å; W298-P403 HydrophobicContact CD2-CG 4Å; W298-P403 HydrophobicContact CE3-CG 3.9Å; W298-P403 HydrophobicContact CG-CB 4.4Å; W298-P403 HydrophobicContact CG-CG 4.22Å; W298-P403 HydrophobicContact CZ3-CG 4.41Å
299	F	94.4	Very high	91.4	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-58.2	-42.9	172.8	-59.4	-19.8	0	0	0	112.3	F230 L231 Y234 L295 V296 D297 L302 M303 M373 V377 L381	F230-F299 HydrophobicContact CE1-CE2 4.27Å; F230-F299 HydrophobicContact CE1-CZ 4.07Å; L231-F299 HydrophobicContact CD2-CD1 4.16Å; L231-F299 HydrophobicContact CD2-CD2 4.35Å; L231-F299 HydrophobicContact CD2-CE1 3.51Å; L231-F299 HydrophobicContact CD2-CE2 3.72Å; L231-F299 HydrophobicContact CD2-CZ 3.24Å; Y234-F299 HydrophobicContact CD2-CD2 4.49Å; Y234-F299 HydrophobicContact CD2-CE2 4.15Å; Y234-F299 HydrophobicContact CG-CD2 4.48Å; L295-F299 HydrophobicContact CD1-CE1 3.69Å; L295-F299 HydrophobicContact CD1-CZ 3.66Å; L295-F299 HydrophobicContact CD2-CE2 4.29Å; L295-F299 HydrophobicContact CD2-CZ 3.86Å; L295-F299 HydrophobicContact CG-CE1 3.88Å; L295-F299 HydrophobicContact CG-CE2 3.9Å; L295-F299 HydrophobicContact CG-CZ 3.4Å; L295-F299 WeakPolarHBondContact O-CD1 3.12Å; L295-F299 VanDerWaalsContact O-CG 3.27Å; L295-F299 WeakPolarHBondContact O-CG 3.5Å; L295-F299 PolarHBondContact O-N 3.21Å; V296-F299 PolarHBondContact O-N 2.94Å; D297-F299 VanDerWaalsContact C-N 3.32Å; D297-F299 PolarHBondContact O-N 3.06Å; F299-L302 PolarHBondContact O-N 3.31Å; F299-M303 HydrophobicContact CB-CE 4.31Å; F299-M303 WeakPolarHBondContact O-CB 3.26Å; F299-M303 WeakPolarHBondContact O-CE 3.27Å; F299-M303 WeakPolarHBondContact O-CG 3.46Å; F299-M303 PolarHBondContact O-N 2.82Å; F299-M373 HydrophobicContact CE1-CE 3.96Å; F299-M373 HydrophobicContact CZ-CE 3.89Å; F299-V377 HydrophobicContact CD1-CG1 4.05Å; F299-V377 HydrophobicContact CE1-CG1 3.92Å; F299-L381 HydrophobicContact CB-CD1 3.81Å; F299-L381 HydrophobicContact CD1-CD1 3.78Å; F299-L381 HydrophobicContact CG-CD1 3.96Å
300	H	92.8	Very high	90.9	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-67.2	-37.8	178.7	-76.3	79.1	0	0	0	112.5	R240 M245 V296 D297 W298 M303 R304 K305 Y312	R240-H300 PolarHBondContact NH2-NE2 3.47Å; M245-H300 VanDerWaalsContact CE-CE1 3.47Å; M245-H300 WeakPolarHBondContact CE-CE1 3.26Å; V296-H300 PolarHBondContact O-N 3.02Å; V296-H300 VanDerWaalsContact O-N 3.12Å; V296-H300 PolarHBondContact O-ND1 3.13Å; D297-H300 PolarHBondContact O-N 2.77Å; D297-H300 VanDerWaalsContact O-N 3.16Å; W298-H300 VanDerWaalsContact C-N 3.32Å; W298-H300 PolarHBondContact O-N 3.18Å; H300-M303 PolarHBondContact O-N 3.14Å; H300-R304 PolarHBondContact O-N 2.86Å; H300-K305 CarbonylContact O-C 3.58Å; H300-K305 PolarHBondContact O-N 3.26Å; H300-Y312 HydrophobicContact CB-CD1 4.2Å; H300-Y312 HydrophobicContact CB-CD2 4.24Å; H300-Y312 HydrophobicContact CB-CE1 4.11Å; H300-Y312 HydrophobicContact CB-CE2 4.12Å; H300-Y312 HydrophobicContact CB-CG 4.25Å; H300-Y312 AromaticContact CD2-CD2 3.27Å; H300-Y312 WeakPolarHBondContact CD2-CD2 3.27Å; H300-Y312 AromaticContact CD2-CE2 3.32Å; H300-Y312 WeakPolarHBondContact CD2-CE2 3.16Å; H300-Y312 AromaticContact CD2-CG 4Å; H300-Y312 AromaticContact CE1-CE2 3.53Å; H300-Y312 AromaticContact CG-CD2 3.65Å; H300-Y312 AromaticContact CG-CE2 3.36Å; H300-Y312 AromaticContact CG-CZ 3.67Å; H300-Y312 AromaticContact ND1-CE2 3.48Å; H300-Y312 WeakPolarHBondContact ND1-CE2 3.35Å; H300-Y312 AromaticContact ND1-CZ 3.69Å; H300-Y312 AromaticContact NE2-CD2 3.72Å; H300-Y312 AromaticContact NE2-CE2 3.47Å; H300-Y312 WeakPolarHBondContact NE2-CE2 3.34Å
301	R	91.9	Very high	90.7	Very high	92 Å²	92	42.7 Å²	42.7	35%	0.347	19%	0.194	S	C	.	.	H	α-helix	trans	-63.8	-45.5	172.4	-65.2	178.1	-133.7	160.3	2.3	111.5	D297 W298 M303 R304 P400	D297-R301 WeakPolarHBondContact O-CG 3.28Å; D297-R301 PolarHBondContact O-N 3.17Å; W298-R301 PolarHBondContact O-N 3.11Å; R301-M303 VanDerWaalsContact C-N 3.33Å; R301-M303 PolarHBondContact O-N 3.3Å; R301-R304 PolarHBondContact O-N 3.16Å; R301-P400 HydrophobicContact CB-CB 3.68Å; R301-P400 HydrophobicContact CB-CG 4.26Å
302	L	91.9	Very high	90.5	Very high	22 Å²	22	41.8 Å²	41.8	12%	0.115	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-43.2	175.6	-76.9	174.1	0	0	0	112.2	W298 F299 R304 V377 P378 L381 R385 P400	W298-L302 HydrophobicContact CD2-CD1 3.84Å; W298-L302 HydrophobicContact CD2-CG 4.43Å; W298-L302 HydrophobicContact CE3-CD1 4.15Å; W298-L302 HydrophobicContact CH2-CD1 3.99Å; W298-L302 HydrophobicContact CZ2-CD1 3.66Å; W298-L302 HydrophobicContact CZ2-CG 4.46Å; W298-L302 HydrophobicContact CZ3-CD1 4.23Å; W298-L302 WeakPolarHBondContact O-CG 3.37Å; W298-L302 PolarHBondContact O-N 3.46Å; F299-L302 PolarHBondContact O-N 3.31Å; L302-R304 PolarHBondContact O-N 3.13Å; L302-R304 VanDerWaalsContact O-N 3.16Å; L302-V377 HydrophobicContact CD1-CG1 3.88Å; L302-P378 HydrophobicContact CD1-CG 4.42Å; L302-P378 HydrophobicContact CD2-CB 4.21Å; L302-P378 HydrophobicContact CD2-CG 4.07Å; L302-L381 HydrophobicContact CB-CD1 4.35Å; L302-L381 HydrophobicContact CD1-CD1 4.09Å; L302-R385 PolarHBondContact O-NE 3.1Å; L302-P400 HydrophobicContact CD2-CG 3.48Å; L302-P400 VanDerWaalsContact CD2-CG 3.48Å; L302-P400 HydrophobicContact CG-CG 3.89Å
303	M	91.4	Very high	90.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-0.6	175.7	-70.1	-175	-72.3	0	0	113.8	A235 F299 H300 R301 K305 L381 R385 A386	A235-M303 HydrophobicContact CB-CE 4.39Å; A235-M303 HydrophobicContact CB-SD 3.72Å; F299-M303 HydrophobicContact CB-CE 4.31Å; F299-M303 WeakPolarHBondContact O-CB 3.26Å; F299-M303 WeakPolarHBondContact O-CE 3.27Å; F299-M303 WeakPolarHBondContact O-CG 3.46Å; F299-M303 PolarHBondContact O-N 2.82Å; H300-M303 PolarHBondContact O-N 3.14Å; R301-M303 VanDerWaalsContact C-N 3.33Å; R301-M303 PolarHBondContact O-N 3.3Å; M303-K305 HydrophobicContact CB-CD 4.43Å; M303-K305 HydrophobicContact CB-CG 4.37Å; M303-K305 PolarHBondContact O-N 3.1Å; M303-L381 HydrophobicContact CG-CB 4.42Å; M303-R385 CarbonylContact O-C 3.56Å; M303-R385 WeakPolarHBondContact O-CA 3.25Å; M303-A386 PolarHBondContact O-N 3.21Å
304	R	89.4	Confident	90.4	Very high	11 Å²	11	49.8 Å²	49.8	4%	0.042	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	29.3	-172	-59.1	172	172.4	153.9	-3.6	113.7	H300 R301 L302 R385 A386 A387 F397	H300-R304 PolarHBondContact O-N 2.86Å; R301-R304 PolarHBondContact O-N 3.16Å; L302-R304 PolarHBondContact O-N 3.13Å; L302-R304 VanDerWaalsContact O-N 3.16Å; R304-R385 HydrophobicContact CB-CG 4.42Å; R304-R385 HydrophobicContact CG-CG 3.9Å; R304-R385 VanDerWaalsContact CZ-NE 3.28Å; R304-R385 VanDerWaalsContact NE-NH2 3.15Å; R304-A386 HydrophobicContact CB-CB 4.17Å; R304-A386 VanDerWaalsContact CD-O 3.31Å; R304-A386 WeakPolarHBondContact CD-O 3.18Å; R304-A386 PolarHBondContact NH1-O 3.48Å; R304-A386 VanDerWaalsContact NH1-O 3.08Å; R304-A387 PolarHBondContact NH1-O 3.24Å; R304-F397 VanDerWaalsContact CD-CE1 3.45Å; R304-F397 HydrophobicContact CG-CD1 3.85Å; R304-F397 HydrophobicContact CG-CE1 4.19Å; R304-F397 VanDerWaalsContact CZ-CD2 3.48Å
305	K	87.5	Confident	90.3	Very high	30 Å²	30	49.7 Å²	49.7	13%	0.13	22%	0.223	C	C	.	.			trans	-110.2	49.4	175.3	-64.4	177.6	-172.1	166.6	0	109.2	H300 M303 W310 Y312 Y384	H300-K305 CarbonylContact O-C 3.58Å; H300-K305 PolarHBondContact O-N 3.26Å; M303-K305 HydrophobicContact CB-CD 4.43Å; M303-K305 HydrophobicContact CB-CG 4.37Å; M303-K305 PolarHBondContact O-N 3.1Å; K305-W310 HydrophobicContact CB-CB 3.99Å; K305-W310 HydrophobicContact CB-CD2 4.45Å; K305-W310 HydrophobicContact CB-CG 3.98Å; K305-W310 HydrophobicContact CG-CD2 4.17Å; K305-W310 HydrophobicContact CG-CE3 4.39Å; K305-W310 HydrophobicContact CG-CG 4.22Å; K305-Y312 WeakPolarHBondContact O-CB 3.42Å; K305-Y384 PolarHBondContact NZ-O 3.21Å
306	D	86	Confident	90.2	Very high	31 Å²	31	50.6 Å²	50.6	17%	0.166	23%	0.228	C	C	.	.			trans	-78.5	176	-177.8	62.8	-3.1	0	0	0	112	K308 R309 W310 G311 Y312	D306-K308 VanDerWaalsContact C-N 3.32Å; D306-K308 PolarHBondContact O-N 3.27Å; D306-R309 WeakPolarHBondContact OD1-CB 3.42Å; D306-R309 WeakPolarHBondContact OD1-CG 3.47Å; D306-R309 PolarHBondContact OD1-N 3.23Å; D306-W310 CarbonylContact O-C 3.56Å; D306-W310 VanDerWaalsContact O-CA 3.28Å; D306-W310 WeakPolarHBondContact O-CA 3.18Å; D306-W310 WeakPolarHBondContact O-CB 3.25Å; D306-W310 PolarHBondContact O-N 2.68Å; D306-G311 PolarHBondContact O-N 2.89Å; D306-Y312 PolarHBondContact O-N 3.32Å
307	Q	86.2	Confident	90	Very high	147 Å²	147	50.7 Å²	50.7	69%	0.687	23%	0.229	S	C	*	.	H	α-helix	trans	-62.6	-39.3	178.5	-171.8	174.4	-0.1	0	0	111.9	G311 Y312	Q307-G311 VanDerWaalsContact O-CA 3.23Å; Q307-G311 WeakPolarHBondContact O-CA 3.43Å; Q307-G311 PolarHBondContact O-N 3.24Å; Q307-Y312 WeakPolarHBondContact CB-O 3.45Å; Q307-Y312 WeakPolarHBondContact CG-O 3.32Å
308	K	84.6	Confident	89.8	Confident	186 Å²	186	54.4 Å²	54.4	81%	0.809	24%	0.241	S	C	*	.	H	α-helix	trans	-67.8	-47.5	-176.6	-67.4	-177.6	-178.9	177.7	0	112.8	D306	D306-K308 VanDerWaalsContact C-N 3.32Å; D306-K308 PolarHBondContact O-N 3.27Å
309	R	82.9	Confident	89.4	Confident	125 Å²	125	63.7 Å²	63.7	47%	0.472	28%	0.276	S	S	.	.	H	α-helix	trans	-91.3	-37.7	-177.2	-57.7	-172.7	170.8	112.1	-10.1	112.5	D306	D306-R309 WeakPolarHBondContact OD1-CB 3.42Å; D306-R309 WeakPolarHBondContact OD1-CG 3.47Å; D306-R309 PolarHBondContact OD1-N 3.23Å
310	W	84.2	Confident	89.1	Confident	105 Å²	105	64.8 Å²	64.8	40%	0.398	28%	0.282	S	S	.	.	H	α-helix	trans	-110.6	4.5	-172.6	-158.1	-90.3	0	0	0	114.2	R243 K305 D306 Y312	R243-W310 VanDerWaalsContact CZ-C 3.45Å; R243-W310 PolarHBondContact NE-O 3.29Å; R243-W310 PolarHBondContact NH2-O 3.08Å; K305-W310 HydrophobicContact CB-CB 3.99Å; K305-W310 HydrophobicContact CB-CD2 4.45Å; K305-W310 HydrophobicContact CB-CG 3.98Å; K305-W310 HydrophobicContact CG-CD2 4.17Å; K305-W310 HydrophobicContact CG-CE3 4.39Å; K305-W310 HydrophobicContact CG-CG 4.22Å; D306-W310 CarbonylContact O-C 3.56Å; D306-W310 VanDerWaalsContact O-CA 3.28Å; D306-W310 WeakPolarHBondContact O-CA 3.18Å; D306-W310 WeakPolarHBondContact O-CB 3.25Å; D306-W310 PolarHBondContact O-N 2.68Å; W310-Y312 PolarHBondContact O-N 2.97Å
311	G	88.4	Confident	88.9	Confident	36 Å²	36	69.1 Å²	69.1	37%	0.371	31%	0.31	S	S	.	.			trans	56.6	27.5	-179.8	0	0	0	0	0	113	D306 Q307	D306-G311 PolarHBondContact O-N 2.89Å; Q307-G311 VanDerWaalsContact O-CA 3.23Å; Q307-G311 WeakPolarHBondContact O-CA 3.43Å; Q307-G311 PolarHBondContact O-N 3.24Å
312	Y	91.3	Very high	88.8	Confident	13 Å²	13	68.3 Å²	68.3	5%	0.051	32%	0.315	C	S	.	.			trans	-65.7	133.9	179.4	162.3	-96.3	0	0	0	111	R243 M245 D297 H300 K305 D306 Q307 W310 R314	R243-Y312 WeakPolarHBondContact O-CA 3.22Å; M245-Y312 HydrophobicContact CB-CE2 3.7Å; D297-Y312 WeakPolarHBondContact OD1-CE1 3.29Å; D297-Y312 PolarHBondContact OD1-OH 3.15Å; H300-Y312 HydrophobicContact CB-CD1 4.2Å; H300-Y312 HydrophobicContact CB-CD2 4.24Å; H300-Y312 HydrophobicContact CB-CE1 4.11Å; H300-Y312 HydrophobicContact CB-CE2 4.12Å; H300-Y312 HydrophobicContact CB-CG 4.25Å; H300-Y312 AromaticContact CD2-CD2 3.27Å; H300-Y312 WeakPolarHBondContact CD2-CD2 3.27Å; H300-Y312 AromaticContact CD2-CE2 3.32Å; H300-Y312 WeakPolarHBondContact CD2-CE2 3.16Å; H300-Y312 AromaticContact CD2-CG 4Å; H300-Y312 AromaticContact CE1-CE2 3.53Å; H300-Y312 AromaticContact CG-CD2 3.65Å; H300-Y312 AromaticContact CG-CE2 3.36Å; H300-Y312 AromaticContact CG-CZ 3.67Å; H300-Y312 AromaticContact ND1-CE2 3.48Å; H300-Y312 WeakPolarHBondContact ND1-CE2 3.35Å; H300-Y312 AromaticContact ND1-CZ 3.69Å; H300-Y312 AromaticContact NE2-CD2 3.72Å; H300-Y312 AromaticContact NE2-CE2 3.47Å; H300-Y312 WeakPolarHBondContact NE2-CE2 3.34Å; K305-Y312 WeakPolarHBondContact O-CB 3.42Å; D306-Y312 PolarHBondContact O-N 3.32Å; Q307-Y312 WeakPolarHBondContact CB-O 3.45Å; Q307-Y312 WeakPolarHBondContact CG-O 3.32Å; W310-Y312 PolarHBondContact O-N 2.97Å; Y312-R314 HydrophobicContact CE1-CG 4.27Å; Y312-R314 WeakPolarHBondContact OH-CG 3.28Å
313	M	92	Very high	88.8	Confident	110 Å²	110	67.2 Å²	67.2	54%	0.542	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	137.5	175.9	-174.8	172.4	68.4	0	0	110.4	S244 M245	S244-M313 CarbonylContact C-O 3.44Å; S244-M313 WeakPolarHBondContact CA-O 3.27Å; S244-M313 VanDerWaalsContact CB-O 3.3Å; S244-M313 WeakPolarHBondContact CB-O 3.42Å; M245-M313 PolarHBondContact N-O 2.9Å
314	R	92.7	Very high	88.6	Confident	64 Å²	64	68.7 Å²	68.7	24%	0.242	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	140.1	167.7	-63.2	175	-67.5	-167.3	8.6	109.6	M245 L247 S293 D297 Y312	M245-R314 WeakPolarHBondContact O-CA 3.36Å; L247-R314 HydrophobicContact CD1-CG 4.28Å; S293-R314 PolarHBondContact O-NH1 3.17Å; D297-R314 WeakPolarHBondContact OD1-CD 3.28Å; D297-R314 WeakPolarHBondContact OD1-CG 3.06Å; D297-R314 IonicContact OD1-CZ 2.87Å; D297-R314 IonicContact OD1-NE 2.67Å; D297-R314 PolarHBondContact OD1-NE 3.25Å; D297-R314 IonicContact OD1-NH1 3.29Å; D297-R314 PolarHBondContact OD1-NH1 3.12Å; D297-R314 IonicContact OD2-CZ 3.44Å; D297-R314 IonicContact OD2-NE 2.83Å; D297-R314 PolarHBondContact OD2-NE 2.59Å; D297-R314 IonicContact OD2-NH1 3.26Å; D297-R314 PolarHBondContact OD2-NH1 3.01Å; D297-R314 IonicContact OD2-NH2 3.02Å; D297-R314 PolarHBondContact OD2-NH2 3Å; D297-R314 VanDerWaalsContact OD2-NH2 3.14Å; Y312-R314 HydrophobicContact CE1-CG 4.27Å; Y312-R314 WeakPolarHBondContact OH-CG 3.28Å
315	Y	92.6	Very high	88.7	Confident	40 Å²	40	73.7 Å²	73.7	16%	0.157	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	161.8	171.1	69.1	-81.9	0	0	0	110.7	Q241 M245 P246 L247 M317 D320	Q241-Y315 HydrophobicContact CB-CE1 4.17Å; Q241-Y315 WeakPolarHBondContact CB-OH 3.48Å; M245-Y315 PolarHBondContact O-N 2.82Å; M245-Y315 VanDerWaalsContact O-N 3.15Å; P246-Y315 HydrophobicContact CB-CE1 4.01Å; P246-Y315 HydrophobicContact CB-CE2 3.85Å; P246-Y315 VanDerWaalsContact CB-CZ 3.48Å; P246-Y315 VanDerWaalsContact CB-OH 3.3Å; P246-Y315 WeakPolarHBondContact CB-OH 3.27Å; P246-Y315 HydrophobicContact CG-CE1 4.18Å; P246-Y315 VanDerWaalsContact CG-OH 3.24Å; P246-Y315 WeakPolarHBondContact CG-OH 3.41Å; L247-Y315 PolarHBondContact N-O 2.88Å; Y315-M317 PolarHBondContact O-N 3.23Å; Y315-D320 HydrophobicContact CD2-CB 4.42Å; Y315-D320 HydrophobicContact CE2-CB 3.63Å; Y315-D320 PolarHBondContact OH-OD2 2.79Å
316	D	91.9	Very high	88.9	Confident	19 Å²	19	74.6 Å²	74.6	10%	0.102	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	115.1	-179	-166.4	-11.4	0	0	0	109.8	L247 H249 K250 R318 W319	L247-D316 WeakPolarHBondContact O-CA 3.37Å; H249-D316 PolarHBondContact N-OD1 3.05Å; H249-D316 VanDerWaalsContact N-OD1 3.08Å; K250-D316 HydrophobicContact CG-CB 3.98Å; D316-R318 PolarHBondContact O-N 3.1Å; D316-R318 WeakPolarHBondContact OD1-CG 3.44Å; D316-R318 PolarHBondContact OD1-N 3.01Å; D316-R318 IonicContact OD1-NE 2.83Å; D316-R318 PolarHBondContact OD1-NE 3.28Å; D316-R318 IonicContact OD2-CZ 3.46Å; D316-R318 IonicContact OD2-NE 2.64Å; D316-R318 PolarHBondContact OD2-NE 2.98Å; D316-R318 IonicContact OD2-NH2 3.22Å; D316-R318 PolarHBondContact OD2-NH2 3.44Å; D316-W319 PolarHBondContact O-N 3.31Å
317	M	90.3	Very high	89.2	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.015	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-66.4	-17.4	-177.2	69.4	176.5	-72.3	0	0	113.5	P246 L247 W248 Y315 W319 D320 F323 L324 I347	P246-M317 HydrophobicContact CB-CB 3.76Å; L247-M317 PolarHBondContact O-N 3.25Å; W248-M317 HydrophobicContact CB-CG 4.43Å; W248-M317 HydrophobicContact CB-SD 4.08Å; W248-M317 HydrophobicContact CE3-CG 4.06Å; W248-M317 HydrophobicContact CE3-SD 4.21Å; Y315-M317 PolarHBondContact O-N 3.23Å; M317-W319 PolarHBondContact O-N 3.17Å; M317-D320 PolarHBondContact O-N 3.46Å; M317-D320 VanDerWaalsContact O-N 3.11Å; M317-F323 HydrophobicContact CE-CD1 4.13Å; M317-F323 HydrophobicContact CE-CE1 4.12Å; M317-L324 HydrophobicContact CE-CD2 3.49Å; M317-L324 VanDerWaalsContact CE-CD2 3.49Å; M317-L324 HydrophobicContact CE-CG 4.3Å; M317-I347 HydrophobicContact CE-CG2 3.36Å; M317-I347 HydrophobicContact SD-CG2 3.76Å
318	R	88.2	Confident	89.4	Confident	100 Å²	100	71.6 Å²	71.6	38%	0.377	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-57.5	-32.1	-179.7	-70.7	-176.8	-58.2	149	3.3	112.9	W248 H249 D316	W248-R318 HydrophobicContact CD2-CG 4.19Å; W248-R318 HydrophobicContact CE3-CG 3.56Å; W248-R318 HydrophobicContact CH2-CG 3.69Å; W248-R318 HydrophobicContact CZ2-CG 4.27Å; W248-R318 HydrophobicContact CZ3-CG 3.31Å; H249-R318 PolarHBondContact CE1-NH1 3.22Å; H249-R318 PolarHBondContact ND1-NE 3.45Å; H249-R318 PolarHBondContact ND1-NH2 3.03Å; H249-R318 VanDerWaalsContact ND1-NH2 3.16Å; D316-R318 PolarHBondContact O-N 3.1Å; D316-R318 WeakPolarHBondContact OD1-CG 3.44Å; D316-R318 PolarHBondContact OD1-N 3.01Å; D316-R318 IonicContact OD1-NE 2.83Å; D316-R318 PolarHBondContact OD1-NE 3.28Å; D316-R318 IonicContact OD2-CZ 3.46Å; D316-R318 IonicContact OD2-NE 2.64Å; D316-R318 PolarHBondContact OD2-NE 2.98Å; D316-R318 IonicContact OD2-NH2 3.22Å; D316-R318 PolarHBondContact OD2-NH2 3.44Å
319	W	86.5	Confident	89.7	Confident	201 Å²	201	67 Å²	67	76%	0.761	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-97.3	-0.1	-177	-51.6	114	0	0	0	113.1	D316 M317 P321	D316-W319 PolarHBondContact O-N 3.31Å; M317-W319 PolarHBondContact O-N 3.17Å; W319-P321 WeakPolarHBondContact O-CD 3.47Å
320	D	87.8	Confident	90	Very high	24 Å²	24	61.5 Å²	61.5	13%	0.128	30%	0.295	C	S	.	.			trans	-108.8	91.1	179.2	-175.6	8	0	0	0	111.7	Y315 M317 T322 F323	Y315-D320 HydrophobicContact CD2-CB 4.42Å; Y315-D320 HydrophobicContact CE2-CB 3.63Å; Y315-D320 PolarHBondContact OH-OD2 2.79Å; M317-D320 PolarHBondContact O-N 3.46Å; M317-D320 VanDerWaalsContact O-N 3.11Å; D320-T322 PolarHBondContact O-N 2.99Å; D320-T322 WeakPolarHBondContact OD1-CA 3.33Å; D320-T322 VanDerWaalsContact OD1-CB 3.31Å; D320-T322 WeakPolarHBondContact OD1-CB 3.3Å; D320-T322 PolarHBondContact OD1-N 3.02Å; D320-T322 PolarHBondContact OD1-OG1 2.64Å; D320-T322 PolarHBondContact OD2-OG1 3.18Å; D320-F323 PolarHBondContact OD1-N 2.82Å; D320-F323 WeakPolarHBondContact OD2-CB 3.45Å
321	P	88.2	Confident	90.1	Very high	93 Å²	93	58.5 Å²	58.5	60%	0.604	29%	0.291	S	S	*	.	H	α-helix	trans	-65.5	-23.5	175.7	27.6	-34.5	0	0	0	112.3	W319 L324 L325	W319-P321 WeakPolarHBondContact O-CD 3.47Å; P321-L324 PolarHBondContact O-N 3.04Å; P321-L325 WeakPolarHBondContact O-CB 3.47Å; P321-L325 PolarHBondContact O-N 3.18Å
322	T	91.1	Very high	90	Very high	74 Å²	74	65 Å²	65	45%	0.454	31%	0.309	S	S	.	.	H	α-helix	trans	-69.7	-39	-176.2	73.4	0	0	0	0	111.5	Q241 D320 L325 K326	Q241-T322 PolarHBondContact NE2-OG1 3.2Å; D320-T322 PolarHBondContact O-N 2.99Å; D320-T322 WeakPolarHBondContact OD1-CA 3.33Å; D320-T322 VanDerWaalsContact OD1-CB 3.31Å; D320-T322 WeakPolarHBondContact OD1-CB 3.3Å; D320-T322 PolarHBondContact OD1-N 3.02Å; D320-T322 PolarHBondContact OD1-OG1 2.64Å; D320-T322 PolarHBondContact OD2-OG1 3.18Å; T322-L325 PolarHBondContact O-N 2.89Å; T322-K326 WeakPolarHBondContact O-CB 3.17Å; T322-K326 PolarHBondContact O-N 3.11Å
323	F	90.6	Very high	89.9	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-42.1	175.8	178.5	-105.8	0	0	0	112.3	R239 P246 M317 D320 K326 A327 L342 I347	R239-F323 WeakPolarHBondContact O-CE2 3.25Å; P246-F323 HydrophobicContact CB-CD1 3.82Å; P246-F323 HydrophobicContact CB-CD2 4.29Å; P246-F323 HydrophobicContact CB-CE1 3.99Å; P246-F323 HydrophobicContact CB-CE2 4.46Å; P246-F323 HydrophobicContact CB-CG 3.97Å; P246-F323 HydrophobicContact CB-CZ 4.31Å; P246-F323 HydrophobicContact CG-CB 4.45Å; P246-F323 HydrophobicContact CG-CD1 3.81Å; P246-F323 HydrophobicContact CG-CD2 3.42Å; P246-F323 VanDerWaalsContact CG-CD2 3.42Å; P246-F323 HydrophobicContact CG-CE1 3.81Å; P246-F323 HydrophobicContact CG-CE2 3.44Å; P246-F323 VanDerWaalsContact CG-CE2 3.44Å; P246-F323 HydrophobicContact CG-CG 3.61Å; P246-F323 HydrophobicContact CG-CZ 3.63Å; M317-F323 HydrophobicContact CE-CD1 4.13Å; M317-F323 HydrophobicContact CE-CE1 4.12Å; D320-F323 PolarHBondContact OD1-N 2.82Å; D320-F323 WeakPolarHBondContact OD2-CB 3.45Å; F323-K326 WeakPolarHBondContact O-CB 3.49Å; F323-K326 PolarHBondContact O-N 3.48Å; F323-A327 PolarHBondContact O-N 3.21Å; F323-L342 HydrophobicContact CE1-CD1 4.48Å; F323-L342 HydrophobicContact CE2-CD1 3.97Å; F323-L342 HydrophobicContact CE2-CD2 4.24Å; F323-L342 HydrophobicContact CZ-CD1 3.58Å; F323-I347 HydrophobicContact CE1-CD1 3.75Å; F323-I347 HydrophobicContact CE1-CG1 4.42Å; F323-I347 HydrophobicContact CZ-CD1 4.18Å
324	L	88.7	Confident	89.5	Confident	30 Å²	30	66 Å²	66	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-41.6	176.3	-71	176.3	0	0	0	111.7	Y190 M317 P321 A327 K328	Y190-L324 HydrophobicContact CD2-CD1 4.09Å; Y190-L324 HydrophobicContact CD2-CD2 4.01Å; Y190-L324 HydrophobicContact CE1-CD2 4.34Å; Y190-L324 HydrophobicContact CE2-CD1 3.87Å; Y190-L324 HydrophobicContact CE2-CD2 3.67Å; Y190-L324 HydrophobicContact CE2-CG 4.31Å; Y190-L324 HydrophobicContact CG-CD2 4.49Å; M317-L324 HydrophobicContact CE-CD2 3.49Å; M317-L324 VanDerWaalsContact CE-CD2 3.49Å; M317-L324 HydrophobicContact CE-CG 4.3Å; P321-L324 PolarHBondContact O-N 3.04Å; L324-A327 PolarHBondContact O-N 3.14Å; L324-K328 WeakPolarHBondContact O-CG 3.25Å; L324-K328 PolarHBondContact O-N 2.73Å
325	L	91.2	Very high	88.9	Confident	117 Å²	117	66 Å²	66	61%	0.613	33%	0.327	S	S	*	.	H	α-helix	trans	-61.2	-44.4	174	-179.3	61.2	0	0	0	111.2	P321 T322 A327 K328 L329	P321-L325 WeakPolarHBondContact O-CB 3.47Å; P321-L325 PolarHBondContact O-N 3.18Å; T322-L325 PolarHBondContact O-N 2.89Å; L325-A327 VanDerWaalsContact C-N 3.34Å; L325-A327 PolarHBondContact O-N 3.43Å; L325-K328 PolarHBondContact O-N 2.89Å; L325-L329 VanDerWaalsContact O-CB 3.29Å; L325-L329 WeakPolarHBondContact O-CB 3.34Å; L325-L329 PolarHBondContact O-N 3.4Å
326	K	91.7	Very high	88.2	Confident	49 Å²	49	65.8 Å²	65.8	21%	0.213	34%	0.336	C	S	.	.	H	α-helix	trans	-57.5	-45.1	174.6	179.4	-172.6	-177.8	-176.3	0	111.8	W238 R240 T322 F323 L329 N330 L342	W238-K326 WeakPolarHBondContact O-CE 3.27Å; W238-K326 PolarHBondContact O-NZ 3.5Å; R240-K326 PolarHBondContact O-NZ 3.01Å; T322-K326 WeakPolarHBondContact O-CB 3.17Å; T322-K326 PolarHBondContact O-N 3.11Å; F323-K326 WeakPolarHBondContact O-CB 3.49Å; F323-K326 PolarHBondContact O-N 3.48Å; K326-L329 PolarHBondContact O-N 3.03Å; K326-N330 VanDerWaalsContact O-CB 3.32Å; K326-N330 WeakPolarHBondContact O-CB 3.11Å; K326-N330 PolarHBondContact O-N 2.97Å; K326-L342 HydrophobicContact CD-CD2 4.33Å; K326-L342 HydrophobicContact CG-CD2 4.29Å
327	A	91.1	Very high	87.8	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-41	178.4	0	0	0	0	0	112.4	F323 L324 L325 S331 L342 I347	F323-A327 PolarHBondContact O-N 3.21Å; L324-A327 PolarHBondContact O-N 3.14Å; L325-A327 VanDerWaalsContact C-N 3.34Å; L325-A327 PolarHBondContact O-N 3.43Å; A327-S331 PolarHBondContact O-N 3.46Å; A327-L342 HydrophobicContact CB-CD1 4.11Å; A327-L342 HydrophobicContact CB-CD2 4.35Å; A327-L342 HydrophobicContact CB-CG 3.96Å; A327-I347 HydrophobicContact CB-CD1 3.55Å
328	K	90.5	Very high	87.5	Confident	114 Å²	114	69.6 Å²	69.6	50%	0.496	36%	0.361	S	S	.	.	H	α-helix	trans	-64.8	-46.5	174.5	-72.6	-179	-178.2	-177.4	0	111.7	Y190 L324 L325 N330 S331 F332 P344	Y190-K328 WeakPolarHBondContact OH-CE 3.32Å; L324-K328 WeakPolarHBondContact O-CG 3.25Å; L324-K328 PolarHBondContact O-N 2.73Å; L325-K328 PolarHBondContact O-N 2.89Å; K328-N330 VanDerWaalsContact C-N 3.34Å; K328-N330 PolarHBondContact O-N 3.35Å; K328-S331 WeakPolarHBondContact O-CB 3.4Å; K328-S331 PolarHBondContact O-N 3.27Å; K328-F332 PolarHBondContact O-N 2.67Å; K328-P344 HydrophobicContact CG-CG 3.87Å
329	L	91.2	Very high	87.4	Confident	90 Å²	90	67.9 Å²	67.9	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-61.8	-42.2	178.9	-174.7	66.5	0	0	0	111.4	L325 K326 S331 F332 I333	L325-L329 VanDerWaalsContact O-CB 3.29Å; L325-L329 WeakPolarHBondContact O-CB 3.34Å; L325-L329 PolarHBondContact O-N 3.4Å; K326-L329 PolarHBondContact O-N 3.03Å; L329-S331 VanDerWaalsContact C-N 3.32Å; L329-S331 PolarHBondContact O-N 3.01Å; L329-F332 PolarHBondContact O-N 3.26Å; L329-F332 VanDerWaalsContact O-N 3.13Å; L329-I333 HydrophobicContact CD1-CD1 3.86Å; L329-I333 HydrophobicContact CD1-CG1 4.14Å; L329-I333 HydrophobicContact CD2-CD1 4.21Å; L329-I333 HydrophobicContact CG-CD1 3.66Å; L329-I333 HydrophobicContact CG-CG1 4.27Å; L329-I333 WeakPolarHBondContact O-CG1 2.96Å; L329-I333 PolarHBondContact O-N 2.91Å
330	N	89	Confident	87.2	Confident	9 Å²	9	59.4 Å²	59.4	5%	0.048	33%	0.334	C	S	.	.	H	α-helix	trans	-60.2	-41.9	175.7	-169.9	42.1	0	0	0	112.1	K326 K328 F332 C334 I339 L342	K326-N330 VanDerWaalsContact O-CB 3.32Å; K326-N330 WeakPolarHBondContact O-CB 3.11Å; K326-N330 PolarHBondContact O-N 2.97Å; K328-N330 VanDerWaalsContact C-N 3.34Å; K328-N330 PolarHBondContact O-N 3.35Å; N330-F332 VanDerWaalsContact C-N 3.31Å; N330-F332 PolarHBondContact O-N 2.99Å; N330-C334 PolarHBondContact O-N 3.39Å; N330-I339 PolarHBondContact ND2-N 3.43Å; N330-I339 VanDerWaalsContact ND2-N 3.11Å; N330-I339 PolarHBondContact ND2-O 3.19Å; N330-I339 WeakPolarHBondContact OD1-CB 3.39Å; N330-I339 WeakPolarHBondContact OD1-CG1 3.32Å; N330-I339 PolarHBondContact OD1-N 3.21Å; N330-L342 PolarHBondContact ND2-O 3.3Å
331	S	86.6	Confident	87.1	Confident	43 Å²	43	59.6 Å²	59.6	30%	0.301	34%	0.342	S	S	.	.	H	α-helix	trans	-66.5	-33	175.6	-167.6	0	0	0	0	112.7	A327 K328 L329	A327-S331 PolarHBondContact O-N 3.46Å; K328-S331 WeakPolarHBondContact O-CB 3.4Å; K328-S331 PolarHBondContact O-N 3.27Å; L329-S331 VanDerWaalsContact C-N 3.32Å; L329-S331 PolarHBondContact O-N 3.01Å
332	F	87.1	Confident	87.3	Confident	172 Å²	172	55.2 Å²	55.2	75%	0.754	31%	0.313	S	S	*	.	H	α-helix	trans	-74.7	-44.9	179.1	179.7	-100.6	0	0	0	112.3	K328 L329 N330	K328-F332 PolarHBondContact O-N 2.67Å; L329-F332 PolarHBondContact O-N 3.26Å; L329-F332 VanDerWaalsContact O-N 3.13Å; N330-F332 VanDerWaalsContact C-N 3.31Å; N330-F332 PolarHBondContact O-N 2.99Å
333	I	88.4	Confident	87.2	Confident	110 Å²	110	52.1 Å²	52.1	56%	0.564	29%	0.293	S	S	*	.	H	α-helix	trans	-71.9	-42.3	-178.9	-63.3	172.8	0	0	0	110.9	L329 P335	L329-I333 HydrophobicContact CD1-CD1 3.86Å; L329-I333 HydrophobicContact CD1-CG1 4.14Å; L329-I333 HydrophobicContact CD2-CD1 4.21Å; L329-I333 HydrophobicContact CG-CD1 3.66Å; L329-I333 HydrophobicContact CG-CG1 4.27Å; L329-I333 WeakPolarHBondContact O-CG1 2.96Å; L329-I333 PolarHBondContact O-N 2.91Å; I333-P335 VanDerWaalsContact C-CD 3.46Å; I333-P335 WeakPolarHBondContact O-CD 3.48Å
334	C	84.4	Confident	87.1	Confident	34 Å²	34	53.3 Å²	53.3	23%	0.23	30%	0.301	C	S	.	.			trans	-122.6	69.7	-174.7	-64.1	0	0	0	0	111.6	N330 G336 T337	N330-C334 PolarHBondContact O-N 3.39Å; C334-G336 VanDerWaalsContact C-N 3.28Å; C334-G336 PolarHBondContact O-N 3.45Å; C334-T337 CarbonylContact O-C 3.43Å; C334-T337 PolarHBondContact O-N 3.2Å
335	P	79.6	Confident	87.2	Confident	64 Å²	64	52.9 Å²	52.9	42%	0.416	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-32.7	-178.3	26	-34.1	0	0	0	112.2	I333	I333-P335 VanDerWaalsContact C-CD 3.46Å; I333-P335 WeakPolarHBondContact O-CD 3.48Å
336	G	77.7	Confident	87.2	Confident	35 Å²	35	47.9 Å²	47.9	36%	0.361	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-21.9	-176.4	0	0	0	0	0	115.2	F144 C334	F144-G336 WeakPolarHBondContact CE2-O 3.47Å; F144-G336 VanDerWaalsContact CZ-O 3.32Å; F144-G336 WeakPolarHBondContact CZ-O 3.24Å; C334-G336 VanDerWaalsContact C-N 3.28Å; C334-G336 PolarHBondContact O-N 3.45Å
337	T	84.4	Confident	87.3	Confident	93 Å²	93	45.8 Å²	45.8	57%	0.571	27%	0.266	S	S	*	.	S	Bend	trans	-161.7	85.1	179.8	48.4	0	0	0	0	109.3	F144 C334 I339	F144-T337 HydrophobicContact CZ-CG2 4.37Å; C334-T337 CarbonylContact O-C 3.43Å; C334-T337 PolarHBondContact O-N 3.2Å; T337-I339 PolarHBondContact O-N 2.98Å
338	P	84.3	Confident	87.3	Confident	9 Å²	9	45.9 Å²	45.9	6%	0.058	27%	0.266	C	S	.	.			trans	-56.5	128.4	177.6	-25.3	34.1	0	0	0	110.6	F144 G340 G341 H343	F144-P338 HydrophobicContact CB-CG 4.12Å; F144-P338 HydrophobicContact CD1-CG 4.24Å; F144-P338 HydrophobicContact CG-CG 4.07Å; P338-G340 PolarHBondContact O-N 3.13Å; P338-G341 PolarHBondContact O-N 3.49Å; P338-H343 HydrophobicContact CB-CB 4.28Å; P338-H343 HydrophobicContact CG-CB 4.27Å
339	I	85.6	Confident	87.4	Confident	64 Å²	64	41.2 Å²	41.2	33%	0.328	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-59.3	126.5	-176.2	-57.5	172.3	0	0	0	109.2	W238 N330 T337 G341 L342	W238-I339 HydrophobicContact CD2-CG2 3.8Å; W238-I339 HydrophobicContact CG-CG2 3.75Å; W238-I339 HydrophobicContact CZ2-CD1 4.43Å; W238-I339 HydrophobicContact CZ2-CG2 4.4Å; N330-I339 PolarHBondContact ND2-N 3.43Å; N330-I339 VanDerWaalsContact ND2-N 3.11Å; N330-I339 PolarHBondContact ND2-O 3.19Å; N330-I339 WeakPolarHBondContact OD1-CB 3.39Å; N330-I339 WeakPolarHBondContact OD1-CG1 3.32Å; N330-I339 PolarHBondContact OD1-N 3.21Å; T337-I339 PolarHBondContact O-N 2.98Å; I339-G341 PolarHBondContact O-N 3.33Å; I339-L342 PolarHBondContact O-N 3.11Å
340	G	82.8	Confident	87.4	Confident	24 Å²	24	37.1 Å²	37.1	25%	0.247	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	64.6	13.8	-177	0	0	0	0	0	115.4	Y233 H236 P338 L342	Y233-G340 WeakPolarHBondContact CD2-O 3.42Å; H236-G340 WeakPolarHBondContact CE1-CA 3.47Å; H236-G340 WeakPolarHBondContact ND1-CA 3.47Å; P338-G340 PolarHBondContact O-N 3.13Å; G340-L342 PolarHBondContact O-N 3.29Å
341	G	85.5	Confident	87.6	Confident	28 Å²	28	37.1 Å²	37.1	29%	0.289	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	66.5	18.2	-173.9	0	0	0	0	0	113.8	P338 I339 H343	P338-G341 PolarHBondContact O-N 3.49Å; I339-G341 PolarHBondContact O-N 3.33Å; G341-H343 PolarHBondContact O-N 2.98Å
342	L	91.3	Very high	87.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.218	C	C	.	.			trans	-83.8	102.2	-179.5	-180	68.4	0	0	0	110.5	F323 K326 A327 N330 I339 G340 I347	F323-L342 HydrophobicContact CE1-CD1 4.48Å; F323-L342 HydrophobicContact CE2-CD1 3.97Å; F323-L342 HydrophobicContact CE2-CD2 4.24Å; F323-L342 HydrophobicContact CZ-CD1 3.58Å; K326-L342 HydrophobicContact CD-CD2 4.33Å; K326-L342 HydrophobicContact CG-CD2 4.29Å; A327-L342 HydrophobicContact CB-CD1 4.11Å; A327-L342 HydrophobicContact CB-CD2 4.35Å; A327-L342 HydrophobicContact CB-CG 3.96Å; N330-L342 PolarHBondContact ND2-O 3.3Å; I339-L342 PolarHBondContact O-N 3.11Å; G340-L342 PolarHBondContact O-N 3.29Å; L342-I347 HydrophobicContact CD1-CD1 3.9Å; L342-I347 HydrophobicContact CD1-CG1 4.22Å
343	H	90.1	Very high	88.2	Confident	9 Å²	9	29.1 Å²	29.1	4%	0.042	19%	0.189	C	C	.	.			trans	-145	161.1	169.9	66.7	-21	0	0	0	110.6	D143 F144 P338 G341 A345 R346 I347	D143-H343 PolarHBondContact O-CE1 3.38Å; D143-H343 VanDerWaalsContact O-CE1 3.32Å; D143-H343 PolarHBondContact O-NE2 3.07Å; F144-H343 VanDerWaalsContact CB-CD2 3.44Å; F144-H343 WeakPolarHBondContact CB-CD2 3.28Å; F144-H343 WeakPolarHBondContact CB-NE2 3.34Å; P338-H343 HydrophobicContact CB-CB 4.28Å; P338-H343 HydrophobicContact CG-CB 4.27Å; G341-H343 PolarHBondContact O-N 2.98Å; H343-A345 VanDerWaalsContact C-N 3.28Å; H343-A345 PolarHBondContact O-N 3.18Å; H343-R346 WeakPolarHBondContact CE1-CB 3.37Å; H343-R346 PolarHBondContact CE1-N 3.2Å; H343-R346 WeakPolarHBondContact ND1-CB 3.38Å; H343-R346 PolarHBondContact ND1-N 3.47Å; H343-R346 VanDerWaalsContact ND1-N 3.14Å; H343-R346 PolarHBondContact O-N 3.44Å; H343-R346 VanDerWaalsContact O-N 3.13Å; H343-I347 PolarHBondContact O-N 3.44Å
344	P	89.1	Confident	88.4	Confident	25 Å²	25	24 Å²	24	16%	0.162	16%	0.163	C	C	.	.	H	α-helix	trans	-52.4	-42.3	-177.1	-31.7	39.5	0	0	0	113.9	Y190 K328 R346 I347 E348	Y190-P344 HydrophobicContact CE1-CB 3.91Å; K328-P344 HydrophobicContact CG-CG 3.87Å; P344-R346 PolarHBondContact O-N 3.19Å; P344-I347 PolarHBondContact O-N 3.34Å; P344-E348 PolarHBondContact O-N 2.75Å; P344-E348 VanDerWaalsContact O-N 3.1Å
345	A	89.7	Confident	88.7	Confident	22 Å²	22	27.1 Å²	27.1	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-66.8	-33.6	-179	0	0	0	0	0	113.3	H343 R349	H343-A345 VanDerWaalsContact C-N 3.28Å; H343-A345 PolarHBondContact O-N 3.18Å; A345-R349 PolarHBondContact O-N 3.25Å
346	R	91.9	Very high	89.3	Confident	11 Å²	11	26.6 Å²	26.6	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-47.9	172.8	-173	71.4	-166	-136.9	3.6	110	R229 Y233 H343 P344 E348 R349 E350	R229-R346 PolarHBondContact O-NH1 3.4Å; R229-R346 PolarHBondContact O-NH2 3.04Å; Y233-R346 HydrophobicContact CD2-CG 4.27Å; Y233-R346 HydrophobicContact CE1-CG 4.23Å; Y233-R346 HydrophobicContact CE2-CG 3.73Å; H343-R346 WeakPolarHBondContact CE1-CB 3.37Å; H343-R346 PolarHBondContact CE1-N 3.2Å; H343-R346 WeakPolarHBondContact ND1-CB 3.38Å; H343-R346 PolarHBondContact ND1-N 3.47Å; H343-R346 VanDerWaalsContact ND1-N 3.14Å; H343-R346 PolarHBondContact O-N 3.44Å; H343-R346 VanDerWaalsContact O-N 3.13Å; P344-R346 PolarHBondContact O-N 3.19Å; R346-E348 VanDerWaalsContact C-N 3.27Å; R346-E348 PolarHBondContact O-N 3.24Å; R346-R349 WeakPolarHBondContact O-CB 3.39Å; R346-R349 PolarHBondContact O-N 2.92Å; R346-R349 VanDerWaalsContact O-N 3.09Å; R346-E350 HydrophobicContact CG-CG 4.12Å; R346-E350 IonicContact CZ-OE1 3.14Å; R346-E350 IonicContact NE-OE1 3.37Å; R346-E350 PolarHBondContact NE-OE1 3.46Å; R346-E350 IonicContact NH2-OE1 2.89Å; R346-E350 PolarHBondContact NH2-OE1 2.76Å; R346-E350 WeakPolarHBondContact O-CG 3.14Å; R346-E350 PolarHBondContact O-N 3.15Å
347	I	92.3	Very high	89.8	Confident	6 Å²	6	29.3 Å²	29.3	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-43.6	-175.4	-63.9	166.5	0	0	0	110.2	M317 F323 A327 L342 H343 P344 E350 A351	M317-I347 HydrophobicContact CE-CG2 3.36Å; M317-I347 HydrophobicContact SD-CG2 3.76Å; F323-I347 HydrophobicContact CE1-CD1 3.75Å; F323-I347 HydrophobicContact CE1-CG1 4.42Å; F323-I347 HydrophobicContact CZ-CD1 4.18Å; A327-I347 HydrophobicContact CB-CD1 3.55Å; L342-I347 HydrophobicContact CD1-CD1 3.9Å; L342-I347 HydrophobicContact CD1-CG1 4.22Å; H343-I347 PolarHBondContact O-N 3.44Å; P344-I347 PolarHBondContact O-N 3.34Å; I347-E350 PolarHBondContact O-N 3.05Å; I347-A351 PolarHBondContact O-N 3.41Å; I347-A351 VanDerWaalsContact O-N 3.14Å
348	E	91.8	Very high	90	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-56.4	-51	173.5	-169.4	70.9	-172.3	0	0	111.2	L189 Y190 V191 P344 R346 E350 A351 V352	L189-E348 WeakPolarHBondContact CA-OE1 3.38Å; L189-E348 VanDerWaalsContact CB-OE1 3.3Å; L189-E348 WeakPolarHBondContact CB-OE1 3.45Å; L189-E348 PolarHBondContact N-OE1 3.23Å; Y190-E348 WeakPolarHBondContact CA-OE2 3.35Å; Y190-E348 WeakPolarHBondContact CB-OE2 3.36Å; Y190-E348 PolarHBondContact N-OE1 2.88Å; Y190-E348 PolarHBondContact N-OE2 3.2Å; V191-E348 HydrophobicContact CB-CG 4.31Å; V191-E348 HydrophobicContact CG2-CB 4.1Å; V191-E348 HydrophobicContact CG2-CG 4.27Å; V191-E348 PolarHBondContact N-OE2 3.44Å; P344-E348 PolarHBondContact O-N 2.75Å; P344-E348 VanDerWaalsContact O-N 3.1Å; R346-E348 VanDerWaalsContact C-N 3.27Å; R346-E348 PolarHBondContact O-N 3.24Å; E348-E350 VanDerWaalsContact C-N 3.33Å; E348-E350 PolarHBondContact O-N 3.29Å; E348-A351 PolarHBondContact O-N 3.47Å; E348-A351 VanDerWaalsContact O-N 3.12Å; E348-V352 WeakPolarHBondContact O-CG2 3.49Å; E348-V352 PolarHBondContact O-N 2.65Å
349	R	92.1	Very high	90.2	Very high	16 Å²	16	35.4 Å²	35.4	6%	0.06	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-39.5	-179.8	-176.1	176.2	76	-172.8	4.8	113	D143 W197 K256 A345 R346 A351 V352	D143-R349 IonicContact OD1-CZ 3.26Å; D143-R349 IonicContact OD1-NH1 2.68Å; D143-R349 PolarHBondContact OD1-NH1 3.23Å; D143-R349 IonicContact OD1-NH2 3.46Å; D143-R349 PolarHBondContact OD1-NH2 2.55Å; D143-R349 VanDerWaalsContact OD1-NH2 3.12Å; W197-R349 VanDerWaalsContact CE2-NH1 3.34Å; W197-R349 VanDerWaalsContact CZ2-NH1 3.33Å; K256-R349 PolarHBondContact NZ-O 3.18Å; A345-R349 PolarHBondContact O-N 3.25Å; R346-R349 WeakPolarHBondContact O-CB 3.39Å; R346-R349 PolarHBondContact O-N 2.92Å; R346-R349 VanDerWaalsContact O-N 3.09Å; R349-A351 VanDerWaalsContact C-N 3.28Å; R349-A351 PolarHBondContact O-N 3.3Å; R349-V352 PolarHBondContact O-N 3.33Å
350	E	92.2	Very high	90.5	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-67.8	-30	178.3	-69	-57.2	139.6	0	0	112.5	Y233 Y234 T254 K256 R346 I347 E348 V352	Y233-E350 HydrophobicContact CD1-CG 4.4Å; Y233-E350 HydrophobicContact CE1-CG 3.84Å; Y234-E350 WeakPolarHBondContact CE2-OE2 3.41Å; Y234-E350 PolarHBondContact OH-OE2 2.76Å; T254-E350 WeakPolarHBondContact CG2-O 3.35Å; K256-E350 VanDerWaalsContact CE-O 3.29Å; K256-E350 WeakPolarHBondContact CE-O 3.47Å; R346-E350 HydrophobicContact CG-CG 4.12Å; R346-E350 IonicContact CZ-OE1 3.14Å; R346-E350 IonicContact NE-OE1 3.37Å; R346-E350 PolarHBondContact NE-OE1 3.46Å; R346-E350 IonicContact NH2-OE1 2.89Å; R346-E350 PolarHBondContact NH2-OE1 2.76Å; R346-E350 WeakPolarHBondContact O-CG 3.14Å; R346-E350 PolarHBondContact O-N 3.15Å; I347-E350 PolarHBondContact O-N 3.05Å; E348-E350 VanDerWaalsContact C-N 3.33Å; E348-E350 PolarHBondContact O-N 3.29Å; E350-V352 VanDerWaalsContact C-N 3.32Å
351	A	92.1	Very high	91	Very high	9 Å²	9	34.7 Å²	34.7	7%	0.074	22%	0.223	C	C	.	.	H	α-helix	trans	-77.3	-18.9	178.4	0	0	0	0	0	113	L189 W248 T254 I347 E348 R349	L189-A351 HydrophobicContact CD1-CB 3.59Å; W248-A351 HydrophobicContact CB-CB 3.71Å; W248-A351 HydrophobicContact CG-CB 3.83Å; T254-A351 WeakPolarHBondContact CG2-O 3.48Å; T254-A351 PolarHBondContact OG1-O 3.05Å; I347-A351 PolarHBondContact O-N 3.41Å; I347-A351 VanDerWaalsContact O-N 3.14Å; E348-A351 PolarHBondContact O-N 3.47Å; E348-A351 VanDerWaalsContact O-N 3.12Å; R349-A351 VanDerWaalsContact C-N 3.28Å; R349-A351 PolarHBondContact O-N 3.3Å
352	V	92.9	Very high	91.5	Very high	25 Å²	25	35 Å²	35	15%	0.152	22%	0.218	C	C	.	.	S	Bend	trans	-71.1	127.9	176.1	176.7	0	0	0	0	110.5	N181 L189 L198 K256 E348 R349 E350	N181-V352 HydrophobicContact CB-CG1 4.04Å; L189-V352 HydrophobicContact CD1-CG2 4.01Å; L198-V352 HydrophobicContact CD1-CG1 4.46Å; L198-V352 HydrophobicContact CD1-CG2 4.23Å; K256-V352 WeakPolarHBondContact CE-O 3.29Å; K256-V352 PolarHBondContact NZ-O 2.94Å; E348-V352 WeakPolarHBondContact O-CG2 3.49Å; E348-V352 PolarHBondContact O-N 2.65Å; R349-V352 PolarHBondContact O-N 3.33Å; E350-V352 VanDerWaalsContact C-N 3.32Å
353	T	93.3	Very high	91.5	Very high	23 Å²	23	35 Å²	35	14%	0.141	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-72.1	137.1	172.6	-70.8	0	0	0	0	111.3	K253 T254 V255 K355 F415	K253-T353 PolarHBondContact O-OG1 3.38Å; T254-T353 WeakPolarHBondContact CA-OG1 3.34Å; V255-T353 HydrophobicContact CB-CG2 3.86Å; V255-T353 PolarHBondContact N-OG1 2.9Å; V255-T353 WeakPolarHBondContact O-CA 3.29Å; T353-K355 PolarHBondContact O-N 3.12Å; T353-F415 HydrophobicContact CG2-CE1 4.47Å; T353-F415 HydrophobicContact CG2-CE2 4.3Å; T353-F415 HydrophobicContact CG2-CZ 3.67Å
354	D	94	Very high	91.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-69.1	121.8	174.3	-68	-9.2	0	0	0	111.2	L180 N181 V255 K256 Q257 R289	L180-D354 HydrophobicContact CD2-CB 3.84Å; N181-D354 PolarHBondContact ND2-OD1 3.31Å; N181-D354 WeakPolarHBondContact OD1-CA 3.34Å; V255-D354 PolarHBondContact O-N 3.23Å; K256-D354 WeakPolarHBondContact CA-OD2 3.46Å; K256-D354 WeakPolarHBondContact CD-OD2 3.49Å; K256-D354 IonicContact NZ-OD1 2.89Å; K256-D354 PolarHBondContact NZ-OD1 2.8Å; Q257-D354 PolarHBondContact N-OD2 2.9Å; R289-D354 PolarHBondContact NH2-O 3.26Å
355	K	90.9	Very high	91.9	Very high	100 Å²	100	44.1 Å²	44.1	44%	0.435	26%	0.262	S	S	.	.			trans	-105.6	120.2	177.8	-62.2	-179.7	-171.2	171.3	0	109.9	N181 E183 T353	N181-K355 PolarHBondContact OD1-N 3.16Å; N181-K355 VanDerWaalsContact OD1-N 3.08Å; E183-K355 WeakPolarHBondContact OE1-CD 3.18Å; E183-K355 IonicContact OE1-NZ 3.49Å; E183-K355 PolarHBondContact OE1-NZ 3.37Å; E183-K355 IonicContact OE2-NZ 3.15Å; E183-K355 PolarHBondContact OE2-NZ 3.32Å; T353-K355 PolarHBondContact O-N 3.12Å
356	V	90.7	Very high	92.1	Very high	54 Å²	54	43.5 Å²	43.5	33%	0.327	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-96.5	120.3	172.7	-173.8	0	0	0	0	108.5	V285	V285-V356 HydrophobicContact CG1-CG2 4.11Å
357	L	89.8	Confident	92.1	Very high	91 Å²	91	46 Å²	46	48%	0.476	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-84.2	127.8	177.9	-49.5	167.5	0	0	0	109.7	Q283 G359 V360	Q283-L357 PolarHBondContact NE2-O 3.48Å; Q283-L357 VanDerWaalsContact OE1-N 3.07Å; L357-G359 PolarHBondContact O-N 2.93Å; L357-V360 HydrophobicContact CB-CG2 4.07Å; L357-V360 HydrophobicContact CD1-CG2 4.44Å
358	T	87.1	Confident	92.2	Very high	145 Å²	145	46 Å²	46	89%	0.89	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	128.7	174.1	53.1	0	0	0	0	110.6
359	G	88.6	Confident	92.4	Very high	86 Å²	86	52 Å²	52	89%	0.887	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.7	-1.2	176.1	0	0	0	0	0	115.7	L357	L357-G359 PolarHBondContact O-N 2.93Å
360	V	92.4	Very high	92.5	Very high	40 Å²	40	52.9 Å²	52.9	24%	0.242	33%	0.328	C	S	.	.	S	Bend	trans	-95.8	134.2	170.4	-176.6	0	0	0	0	108.5	I281 Q283 L357	I281-V360 HydrophobicContact CB-CG1 4.42Å; I281-V360 HydrophobicContact CG2-CG1 4.29Å; I281-V360 WeakPolarHBondContact O-CG1 3.31Å; Q283-V360 HydrophobicContact CG-CB 4.28Å; Q283-V360 HydrophobicContact CG-CG1 3.87Å; Q283-V360 VanDerWaalsContact NE2-CB 3.27Å; L357-V360 HydrophobicContact CB-CG2 4.07Å; L357-V360 HydrophobicContact CD1-CG2 4.44Å
361	P	94.3	Very high	92.7	Very high	33 Å²	33	53.9 Å²	53.9	21%	0.214	33%	0.334	C	S	.	.			trans	-63.6	150.3	-177.9	26.8	-35.8	0	0	0	112.2	I281 Y282 Q283 D365	I281-P361 VanDerWaalsContact O-CD 3.31Å; I281-P361 WeakPolarHBondContact O-CD 3.32Å; I281-P361 VanDerWaalsContact O-CG 3.28Å; I281-P361 WeakPolarHBondContact O-CG 3.25Å; Y282-P361 CarbonylContact C-O 3.29Å; Y282-P361 WeakPolarHBondContact CA-O 3.35Å; Y282-P361 HydrophobicContact CD1-CB 3.67Å; Y282-P361 HydrophobicContact CD1-CG 3.62Å; Y282-P361 HydrophobicContact CE1-CB 3.68Å; Y282-P361 HydrophobicContact CE1-CG 3.68Å; Y282-P361 HydrophobicContact CG-CG 4.22Å; Q283-P361 PolarHBondContact N-O 2.95Å; P361-D365 WeakPolarHBondContact CA-OD2 3.47Å; P361-D365 HydrophobicContact CB-CB 4.07Å; P361-D365 WeakPolarHBondContact CB-OD2 3.43Å
362	T	94	Very high	92.8	Very high	33 Å²	33	54.8 Å²	54.8	20%	0.202	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-104.9	-174.9	-179.6	72.2	0	0	0	0	111.3	Q283 E364 D365	Q283-T362 WeakPolarHBondContact O-CA 3.4Å; T362-E364 PolarHBondContact O-N 2.97Å; T362-E364 PolarHBondContact OG1-N 3.41Å; T362-D365 PolarHBondContact N-OD2 3.37Å; T362-D365 PolarHBondContact O-N 3.24Å
363	L	92.6	Very high	92.8	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	33%	0.332	C	S	.	.	S	Bend	trans	-68.2	-24.2	175.5	-59.8	-174.1	0	0	0	113.4	V259 D263 A267 A284 D365 L366 V368 L370	V259-L363 HydrophobicContact CG2-CD1 3.87Å; D263-L363 HydrophobicContact CB-CD1 4.44Å; A267-L363 HydrophobicContact CB-CD1 4.45Å; A267-L363 HydrophobicContact CB-CD2 3.37Å; A267-L363 HydrophobicContact CB-CG 4.32Å; A284-L363 HydrophobicContact CB-CD1 3.87Å; A284-L363 HydrophobicContact CB-CD2 3.58Å; A284-L363 HydrophobicContact CB-CG 3.88Å; L363-D365 VanDerWaalsContact C-N 3.27Å; L363-D365 PolarHBondContact O-N 3.44Å; L363-L366 WeakPolarHBondContact O-CB 3.46Å; L363-L366 PolarHBondContact O-N 3.16Å; L363-L366 VanDerWaalsContact O-N 3.11Å; L363-V368 HydrophobicContact CB-CB 4.27Å; L363-V368 WeakPolarHBondContact O-CB 3.32Å; L363-V368 PolarHBondContact O-N 2.89Å; L363-L370 HydrophobicContact CB-CD2 4.01Å; L363-L370 HydrophobicContact CD1-CD2 3.98Å; L363-L370 HydrophobicContact CG-CD2 4.48Å
364	E	93.8	Very high	92.8	Very high	120 Å²	120	54.4 Å²	54.4	56%	0.561	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-65.8	-35.3	179	-62.3	-177.9	154.7	0	0	110.6	T362 L366 G367 L370	T362-E364 PolarHBondContact O-N 2.97Å; T362-E364 PolarHBondContact OG1-N 3.41Å; E364-L366 PolarHBondContact O-N 3.45Å; E364-G367 WeakPolarHBondContact O-CA 3.37Å; E364-G367 PolarHBondContact O-N 3.29Å; E364-L370 HydrophobicContact CG-CD1 3.92Å; E364-L370 HydrophobicContact CG-CG 4.06Å
365	D	93.5	Very high	92.7	Very high	105 Å²	105	60 Å²	60	56%	0.561	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-65	-22.1	174.5	-60.3	-44.2	0	0	0	112.8	P361 T362 L363 G367	P361-D365 WeakPolarHBondContact CA-OD2 3.47Å; P361-D365 HydrophobicContact CB-CB 4.07Å; P361-D365 WeakPolarHBondContact CB-OD2 3.43Å; T362-D365 PolarHBondContact N-OD2 3.37Å; T362-D365 PolarHBondContact O-N 3.24Å; L363-D365 VanDerWaalsContact C-N 3.27Å; L363-D365 PolarHBondContact O-N 3.44Å; D365-G367 VanDerWaalsContact C-N 3.27Å
366	L	92.9	Very high	92.9	Very high	9 Å²	9	57.9 Å²	57.9	5%	0.047	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-88.1	9.2	171.8	-69.5	172.1	0	0	0	112.5	A267 N270 A271 Y282 L363 E364	A267-L366 HydrophobicContact CB-CD1 3.94Å; N270-L366 HydrophobicContact CB-CB 4.43Å; N270-L366 WeakPolarHBondContact CB-O 3.35Å; N270-L366 PolarHBondContact ND2-O 3.31Å; A271-L366 HydrophobicContact CB-CD1 4.31Å; A271-L366 HydrophobicContact CB-CD2 4.18Å; Y282-L366 HydrophobicContact CD1-CD1 3.75Å; Y282-L366 HydrophobicContact CD1-CD2 4.3Å; Y282-L366 HydrophobicContact CD1-CG 3.77Å; Y282-L366 HydrophobicContact CD2-CD1 4.25Å; Y282-L366 HydrophobicContact CE1-CD1 4Å; Y282-L366 HydrophobicContact CE1-CD2 3.66Å; Y282-L366 HydrophobicContact CE1-CG 3.55Å; Y282-L366 HydrophobicContact CE2-CD1 4.48Å; Y282-L366 HydrophobicContact CE2-CD2 4.16Å; Y282-L366 HydrophobicContact CG-CD1 3.89Å; Y282-L366 HydrophobicContact CG-CG 4.37Å; L363-L366 WeakPolarHBondContact O-CB 3.46Å; L363-L366 PolarHBondContact O-N 3.16Å; L363-L366 VanDerWaalsContact O-N 3.11Å; E364-L366 PolarHBondContact O-N 3.45Å
367	G	92.9	Very high	93	Very high	63 Å²	63	55.3 Å²	55.3	65%	0.649	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	29.6	179.3	0	0	0	0	0	113.9	E364 D365	E364-G367 WeakPolarHBondContact O-CA 3.37Å; E364-G367 PolarHBondContact O-N 3.29Å; D365-G367 VanDerWaalsContact C-N 3.27Å
368	V	94.6	Very high	93.1	Very high	8 Å²	8	53.3 Å²	53.3	5%	0.048	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-101.2	123.9	177.1	-176	0	0	0	0	110.3	D263 Q266 A267 L363 L370	D263-V368 HydrophobicContact CB-CG1 3.82Å; Q266-V368 HydrophobicContact CB-CG1 4.26Å; Q266-V368 HydrophobicContact CB-CG2 4.09Å; Q266-V368 HydrophobicContact CG-CG2 3.98Å; A267-V368 HydrophobicContact CB-CG2 3.96Å; L363-V368 HydrophobicContact CB-CB 4.27Å; L363-V368 WeakPolarHBondContact O-CB 3.32Å; L363-V368 PolarHBondContact O-N 2.89Å; V368-L370 PolarHBondContact O-N 3.48Å
369	T	94.9	Very high	93.4	Very high	126 Å²	126	54.4 Å²	54.4	77%	0.773	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-76.7	116.1	169.5	53.8	0	0	0	0	109.9
370	L	95.5	Very high	93.6	Very high	35 Å²	35	51.5 Å²	51.5	18%	0.183	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-71.7	134	-177.5	-66.2	179.3	0	0	0	112.4	D263 P287 L363 E364 V368	D263-L370 HydrophobicContact CB-CD2 4.5Å; P287-L370 HydrophobicContact CB-CB 4.17Å; P287-L370 HydrophobicContact CB-CD1 4.31Å; P287-L370 HydrophobicContact CG-CB 4.3Å; L363-L370 HydrophobicContact CB-CD2 4.01Å; L363-L370 HydrophobicContact CD1-CD2 3.98Å; L363-L370 HydrophobicContact CG-CD2 4.48Å; E364-L370 HydrophobicContact CG-CD1 3.92Å; E364-L370 HydrophobicContact CG-CG 4.06Å; V368-L370 PolarHBondContact O-N 3.48Å
371	T	95.2	Very high	93.6	Very high	24 Å²	24	49.8 Å²	49.8	15%	0.147	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-90.3	134.7	175.4	-51.8	0	0	0	0	110.3	Y224 Y260 D263 Q376	Y224-T371 PolarHBondContact OH-O 3.44Å; Y260-T371 HydrophobicContact CD1-CG2 4.28Å; D263-T371 PolarHBondContact OD1-OG1 3.43Å; D263-T371 WeakPolarHBondContact OD2-CB 3.04Å; D263-T371 PolarHBondContact OD2-N 3.46Å; D263-T371 PolarHBondContact OD2-OG1 3.27Å; T371-Q376 HydrophobicContact CG2-CG 3.5Å; T371-Q376 VanDerWaalsContact CG2-CG 3.5Å
372	T	94.2	Very high	93.4	Very high	29 Å²	29	54.9 Å²	54.9	18%	0.178	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-79.3	151.5	178.1	63.3	0	0	0	0	111.7	Y224 P287 E374 Q375	Y224-T372 PolarHBondContact OH-O 2.82Å; P287-T372 HydrophobicContact CG-CG2 3.89Å; T372-E374 VanDerWaalsContact C-N 3.31Å; T372-E374 WeakPolarHBondContact CB-OE2 3.5Å; T372-E374 PolarHBondContact O-N 3.45Å; T372-Q375 PolarHBondContact O-N 3.01Å; T372-Q375 VanDerWaalsContact OG1-CG 3.23Å; T372-Q375 WeakPolarHBondContact OG1-CG 3.24Å; T372-Q375 PolarHBondContact OG1-OE1 2.89Å
373	M	93.7	Very high	93.2	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-39.7	178.7	-78.3	-165.4	89	0	0	111.9	Y224 F230 L231 P258 Y290 L295 W298 F299 Q375 Q376 V377	Y224-M373 HydrophobicContact CD1-CE 4.35Å; Y224-M373 HydrophobicContact CD1-CG 4.42Å; Y224-M373 HydrophobicContact CE1-CE 4.48Å; Y224-M373 HydrophobicContact CE1-CG 3.66Å; Y224-M373 HydrophobicContact CE2-CG 4.44Å; Y224-M373 HydrophobicContact CG-CE 4.49Å; Y224-M373 WeakPolarHBondContact OH-CA 3.5Å; Y224-M373 PolarHBondContact OH-N 3.41Å; F230-M373 HydrophobicContact CE1-CE 4.44Å; L231-M373 HydrophobicContact CD2-CE 4.25Å; P258-M373 HydrophobicContact CB-SD 4.38Å; P258-M373 HydrophobicContact CG-CE 3.76Å; P258-M373 HydrophobicContact CG-CG 4.16Å; P258-M373 HydrophobicContact CG-SD 3.17Å; P258-M373 WeakPolarHBondContact CG-SD 3.42Å; Y290-M373 HydrophobicContact CD2-SD 3.79Å; Y290-M373 HydrophobicContact CE2-CB 4.26Å; Y290-M373 HydrophobicContact CE2-CG 3.93Å; Y290-M373 HydrophobicContact CE2-SD 3.47Å; Y290-M373 WeakPolarHBondContact CE2-SD 3.37Å; L295-M373 HydrophobicContact CD1-CE 3.95Å; L295-M373 HydrophobicContact CD1-SD 3.78Å; W298-M373 HydrophobicContact CH2-CB 4.45Å; W298-M373 HydrophobicContact CZ3-CB 4.36Å; F299-M373 HydrophobicContact CE1-CE 3.96Å; F299-M373 HydrophobicContact CZ-CE 3.89Å; M373-Q375 PolarHBondContact O-N 3.39Å; M373-Q376 PolarHBondContact O-N 2.55Å; M373-Q376 VanDerWaalsContact O-N 3.13Å; M373-V377 HydrophobicContact CB-CG2 3.87Å; M373-V377 HydrophobicContact CE-CG2 3.55Å; M373-V377 HydrophobicContact CG-CG2 4.24Å; M373-V377 VanDerWaalsContact O-CB 3.26Å; M373-V377 WeakPolarHBondContact O-CB 3.44Å; M373-V377 WeakPolarHBondContact O-CG2 3.12Å; M373-V377 PolarHBondContact O-N 2.9Å
374	E	92.8	Very high	93.1	Very high	39 Å²	39	60.4 Å²	60.4	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-57.8	-32.1	-177.1	-59.6	93.5	138.3	0	0	112.2	K288 Y290 W298 T372 P378 P402	K288-E374 WeakPolarHBondContact CD-OE1 3.3Å; K288-E374 IonicContact NZ-OE1 3.23Å; K288-E374 PolarHBondContact NZ-OE1 3.39Å; Y290-E374 VanDerWaalsContact OH-CD 3.24Å; Y290-E374 PolarHBondContact OH-OE1 2.91Å; Y290-E374 PolarHBondContact OH-OE2 2.91Å; W298-E374 HydrophobicContact CH2-CG 4.48Å; W298-E374 HydrophobicContact CZ2-CG 4.45Å; T372-E374 VanDerWaalsContact C-N 3.31Å; T372-E374 WeakPolarHBondContact CB-OE2 3.5Å; T372-E374 PolarHBondContact O-N 3.45Å; E374-P378 VanDerWaalsContact O-CD 3.28Å; E374-P378 WeakPolarHBondContact O-CD 3.27Å; E374-P378 WeakPolarHBondContact O-CG 3.4Å; E374-P402 HydrophobicContact CG-CB 3.63Å
375	Q	92.9	Very high	92.8	Very high	119 Å²	119	58 Å²	58	56%	0.556	30%	0.299	S	S	*	.	H	α-helix	trans	-76.3	-37.1	178.8	-72.3	167.1	-19.5	0	0	113	T372 M373 W379	T372-Q375 PolarHBondContact O-N 3.01Å; T372-Q375 VanDerWaalsContact OG1-CG 3.23Å; T372-Q375 WeakPolarHBondContact OG1-CG 3.24Å; T372-Q375 PolarHBondContact OG1-OE1 2.89Å; M373-Q375 PolarHBondContact O-N 3.39Å; Q375-W379 VanDerWaalsContact O-CD1 3.26Å; Q375-W379 PolarHBondContact O-NE1 2.93Å
376	Q	93.9	Very high	92.5	Very high	55 Å²	55	54.4 Å²	54.4	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-103.6	-40.7	-169.8	-70.5	-62.8	-15.1	0	0	114.1	Y224 Y260 T371 M373 P378 W379 E380	Y224-Q376 HydrophobicContact CE2-CB 4.13Å; Y260-Q376 HydrophobicContact CD2-CG 4.38Å; Y260-Q376 HydrophobicContact CE1-CG 4.39Å; Y260-Q376 HydrophobicContact CE2-CB 4.31Å; Y260-Q376 HydrophobicContact CE2-CG 4.11Å; T371-Q376 HydrophobicContact CG2-CG 3.5Å; T371-Q376 VanDerWaalsContact CG2-CG 3.5Å; M373-Q376 PolarHBondContact O-N 2.55Å; M373-Q376 VanDerWaalsContact O-N 3.13Å; Q376-P378 VanDerWaalsContact C-CD 3.43Å; Q376-W379 WeakPolarHBondContact O-CB 3.39Å; Q376-W379 PolarHBondContact O-N 2.9Å; Q376-E380 PolarHBondContact O-N 2.95Å
377	V	93.3	Very high	92.1	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-36.4	-173.5	175.8	0	0	0	0	113.9	Y224 L231 W298 F299 L302 M373 W379 E380 L381	Y224-V377 HydrophobicContact CD2-CG2 4.09Å; Y224-V377 HydrophobicContact CE2-CG2 3.98Å; L231-V377 HydrophobicContact CD1-CG1 4.31Å; L231-V377 HydrophobicContact CD1-CG2 4.22Å; L231-V377 HydrophobicContact CD2-CG1 4.02Å; L231-V377 HydrophobicContact CD2-CG2 4.37Å; W298-V377 HydrophobicContact CH2-CB 3.76Å; W298-V377 HydrophobicContact CH2-CG1 4Å; W298-V377 HydrophobicContact CH2-CG2 4.3Å; W298-V377 HydrophobicContact CZ3-CB 3.89Å; W298-V377 HydrophobicContact CZ3-CG1 3.76Å; W298-V377 HydrophobicContact CZ3-CG2 4.16Å; F299-V377 HydrophobicContact CD1-CG1 4.05Å; F299-V377 HydrophobicContact CE1-CG1 3.92Å; L302-V377 HydrophobicContact CD1-CG1 3.88Å; M373-V377 HydrophobicContact CB-CG2 3.87Å; M373-V377 HydrophobicContact CE-CG2 3.55Å; M373-V377 HydrophobicContact CG-CG2 4.24Å; M373-V377 VanDerWaalsContact O-CB 3.26Å; M373-V377 WeakPolarHBondContact O-CB 3.44Å; M373-V377 WeakPolarHBondContact O-CG2 3.12Å; M373-V377 PolarHBondContact O-N 2.9Å; V377-W379 PolarHBondContact O-N 3.46Å; V377-E380 PolarHBondContact O-N 2.91Å; V377-L381 HydrophobicContact CG1-CD1 3.59Å; V377-L381 HydrophobicContact CG1-CG 3.96Å; V377-L381 WeakPolarHBondContact O-CB 3.27Å; V377-L381 PolarHBondContact O-N 3.31Å
378	P	92.2	Very high	91.6	Very high	49 Å²	49	57.3 Å²	57.3	32%	0.318	29%	0.293	S	S	.	.	H	α-helix	trans	-56.6	-35.1	174	-27.6	36.7	0	0	0	113.6	L302 E374 Q376 R382	L302-P378 HydrophobicContact CD1-CG 4.42Å; L302-P378 HydrophobicContact CD2-CB 4.21Å; L302-P378 HydrophobicContact CD2-CG 4.07Å; E374-P378 VanDerWaalsContact O-CD 3.28Å; E374-P378 WeakPolarHBondContact O-CD 3.27Å; E374-P378 WeakPolarHBondContact O-CG 3.4Å; Q376-P378 VanDerWaalsContact C-CD 3.43Å; P378-R382 PolarHBondContact O-N 3.41Å
379	W	92.2	Very high	91.1	Very high	167 Å²	167	67.6 Å²	67.6	63%	0.633	33%	0.332	S	S	*	.	H	α-helix	trans	-74.4	-42.9	176.4	-57.9	103	0	0	0	111.6	Q375 Q376 V377 L381 R382	Q375-W379 VanDerWaalsContact O-CD1 3.26Å; Q375-W379 PolarHBondContact O-NE1 2.93Å; Q376-W379 WeakPolarHBondContact O-CB 3.39Å; Q376-W379 PolarHBondContact O-N 2.9Å; V377-W379 PolarHBondContact O-N 3.46Å; W379-L381 PolarHBondContact O-N 2.92Å; W379-R382 VanDerWaalsContact O-CB 3.29Å; W379-R382 WeakPolarHBondContact O-CB 3.22Å; W379-R382 PolarHBondContact O-N 2.86Å
380	E	93.2	Very high	90.4	Very high	26 Å²	26	63.6 Å²	63.6	12%	0.121	30%	0.303	C	S	.	.	H	α-helix	trans	-67.2	-34.6	-178.9	-59.1	-66.1	-170.1	0	0	112.9	G225 S226 L231 Q376 V377 P383	G225-E380 VanDerWaalsContact C-CD 3.45Å; G225-E380 WeakPolarHBondContact CA-OE1 3.47Å; S226-E380 WeakPolarHBondContact CA-OE2 3.46Å; S226-E380 VanDerWaalsContact CB-OE2 3.28Å; S226-E380 WeakPolarHBondContact CB-OE2 3.49Å; S226-E380 PolarHBondContact N-OE1 3.25Å; S226-E380 PolarHBondContact N-OE2 3.11Å; S226-E380 PolarHBondContact OG-OE1 3.01Å; S226-E380 PolarHBondContact OG-OE2 2.96Å; L231-E380 HydrophobicContact CD1-CB 3.83Å; L231-E380 HydrophobicContact CD1-CG 4.37Å; Q376-E380 PolarHBondContact O-N 2.95Å; V377-E380 PolarHBondContact O-N 2.91Å; E380-P383 WeakPolarHBondContact O-CD 3.45Å
381	L	92.6	Very high	89.5	Confident	3 Å²	3	66 Å²	66	2%	0.016	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-7	178.1	-70.6	-179.4	0	0	0	113.8	L231 A235 F299 L302 M303 V377 W379 P383 Y384 R385	L231-L381 HydrophobicContact CB-CD2 4.05Å; A235-L381 HydrophobicContact CB-CD2 4.26Å; F299-L381 HydrophobicContact CB-CD1 3.81Å; F299-L381 HydrophobicContact CD1-CD1 3.78Å; F299-L381 HydrophobicContact CG-CD1 3.96Å; L302-L381 HydrophobicContact CB-CD1 4.35Å; L302-L381 HydrophobicContact CD1-CD1 4.09Å; M303-L381 HydrophobicContact CG-CB 4.42Å; V377-L381 HydrophobicContact CG1-CD1 3.59Å; V377-L381 HydrophobicContact CG1-CG 3.96Å; V377-L381 WeakPolarHBondContact O-CB 3.27Å; V377-L381 PolarHBondContact O-N 3.31Å; W379-L381 PolarHBondContact O-N 2.92Å; L381-P383 VanDerWaalsContact C-CD 3.41Å; L381-P383 VanDerWaalsContact C-N 3.33Å; L381-Y384 HydrophobicContact CD2-CD2 4.26Å; L381-Y384 PolarHBondContact O-N 2.9Å; L381-R385 PolarHBondContact O-N 3.01Å
382	R	89.8	Confident	88.6	Confident	140 Å²	140	68.1 Å²	68.1	53%	0.528	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-50.2	-45.2	179.5	-174.7	178.5	179.2	174.2	1.6	112.9	P378 W379 Y384 R385 L388	P378-R382 PolarHBondContact O-N 3.41Å; W379-R382 VanDerWaalsContact O-CB 3.29Å; W379-R382 WeakPolarHBondContact O-CB 3.22Å; W379-R382 PolarHBondContact O-N 2.86Å; R382-Y384 PolarHBondContact O-N 3.05Å; R382-Y384 VanDerWaalsContact O-N 3.14Å; R382-R385 WeakPolarHBondContact O-CB 3.41Å; R382-R385 PolarHBondContact O-N 3.45Å; R382-R385 VanDerWaalsContact O-N 3.13Å; R382-L388 HydrophobicContact CG-CD1 4.39Å; R382-L388 WeakPolarHBondContact O-CD1 3.28Å
383	P	90.5	Very high	87.9	Confident	84 Å²	84	75.1 Å²	75.1	55%	0.545	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-61.5	-23.2	179.6	-23.7	35.7	0	0	0	114.5	E380 L381	E380-P383 WeakPolarHBondContact O-CD 3.45Å; L381-P383 VanDerWaalsContact C-CD 3.41Å; L381-P383 VanDerWaalsContact C-N 3.33Å
384	Y	90.2	Very high	87.3	Confident	67 Å²	67	80.3 Å²	80.3	26%	0.263	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-94.7	-0.9	-177.8	-60.2	-75.7	0	0	0	113.6	R232 A235 K305 L381 R382	R232-Y384 WeakPolarHBondContact CD-OH 3.36Å; R232-Y384 HydrophobicContact CG-CE2 4.11Å; R232-Y384 WeakPolarHBondContact CG-OH 3.45Å; R232-Y384 PolarHBondContact NE-OH 3.32Å; A235-Y384 HydrophobicContact CB-CD1 3.99Å; A235-Y384 HydrophobicContact CB-CD2 3.97Å; A235-Y384 HydrophobicContact CB-CE1 4.36Å; A235-Y384 HydrophobicContact CB-CE2 4.34Å; A235-Y384 HydrophobicContact CB-CG 3.78Å; K305-Y384 PolarHBondContact NZ-O 3.21Å; L381-Y384 HydrophobicContact CD2-CD2 4.26Å; L381-Y384 PolarHBondContact O-N 2.9Å; R382-Y384 PolarHBondContact O-N 3.05Å; R382-Y384 VanDerWaalsContact O-N 3.14Å
385	R	88.6	Confident	86.8	Confident	70 Å²	70	81.1 Å²	81.1	26%	0.264	41%	0.413	S	S	.	.	S	Bend	trans	-67.9	135.1	-178.6	-161.7	175.1	-163.5	-167.4	-3.4	110.8	L302 M303 R304 L381 R382	L302-R385 PolarHBondContact O-NE 3.1Å; M303-R385 CarbonylContact O-C 3.56Å; M303-R385 WeakPolarHBondContact O-CA 3.25Å; R304-R385 HydrophobicContact CB-CG 4.42Å; R304-R385 HydrophobicContact CG-CG 3.9Å; R304-R385 VanDerWaalsContact CZ-NE 3.28Å; R304-R385 VanDerWaalsContact NE-NH2 3.15Å; L381-R385 PolarHBondContact O-N 3.01Å; R382-R385 WeakPolarHBondContact O-CB 3.41Å; R382-R385 PolarHBondContact O-N 3.45Å; R382-R385 VanDerWaalsContact O-N 3.13Å
386	A	86.3	Confident	86.2	Confident	29 Å²	29	81.5 Å²	81.5	24%	0.24	42%	0.415	C	S	.	.	S	Bend	trans	-64.8	140.7	168.9	0	0	0	0	0	109.9	M303 R304	M303-A386 PolarHBondContact O-N 3.21Å; R304-A386 HydrophobicContact CB-CB 4.17Å; R304-A386 VanDerWaalsContact CD-O 3.31Å; R304-A386 WeakPolarHBondContact CD-O 3.18Å; R304-A386 PolarHBondContact NH1-O 3.48Å; R304-A386 VanDerWaalsContact NH1-O 3.08Å
387	A	85.1	Confident	85.6	Confident	63 Å²	63	80.7 Å²	80.7	52%	0.521	41%	0.411	S	S	.	.	S	Bend	trans	54.5	62.1	-170.2	0	0	0	0	0	112.1	R304 Y389 Y390	R304-A387 PolarHBondContact NH1-O 3.24Å; A387-Y389 PolarHBondContact O-N 3.47Å; A387-Y390 WeakPolarHBondContact O-CB 3.38Å; A387-Y390 PolarHBondContact O-N 3.32Å
388	L	82.7	Confident	85	Confident	70 Å²	70	88.7 Å²	88.7	37%	0.366	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-37.4	-176.1	-179.8	63.4	0	0	0	113.4	R382 Y390	R382-L388 HydrophobicContact CG-CD1 4.39Å; R382-L388 WeakPolarHBondContact O-CD1 3.28Å; L388-Y390 VanDerWaalsContact C-N 3.31Å
389	Y	83.1	Confident	84.6	Confident	223 Å²	223	92.6 Å²	92.6	88%	0.875	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	5.4	-178.7	-56.8	-74.8	0	0	0	114	A387 D391	A387-Y389 PolarHBondContact O-N 3.47Å; Y389-D391 PolarHBondContact O-N 3.06Å
390	Y	81.2	Confident	84.3	Confident	43 Å²	43	86.3 Å²	86.3	17%	0.169	45%	0.452	C	S	.	.			trans	-65.2	133.1	175.1	176.3	-89.3	0	0	0	110.5	A387 L388 A392 L394 E396 F397	A387-Y390 WeakPolarHBondContact O-CB 3.38Å; A387-Y390 PolarHBondContact O-N 3.32Å; L388-Y390 VanDerWaalsContact C-N 3.31Å; Y390-A392 PolarHBondContact O-N 3.27Å; Y390-L394 HydrophobicContact CE1-CB 4.4Å; Y390-L394 HydrophobicContact CE2-CB 4.41Å; Y390-L394 HydrophobicContact CE2-CD1 3.99Å; Y390-L394 WeakPolarHBondContact OH-CB 3.2Å; Y390-E396 HydrophobicContact CE2-CB 4.48Å; Y390-E396 HydrophobicContact CE2-CG 4.42Å; Y390-E396 VanDerWaalsContact CE2-OE2 3.26Å; Y390-E396 WeakPolarHBondContact CE2-OE2 3.19Å; Y390-E396 WeakPolarHBondContact OH-CB 3.23Å; Y390-E396 WeakPolarHBondContact OH-CG 3.31Å; Y390-E396 PolarHBondContact OH-N 3.27Å; Y390-E396 PolarHBondContact OH-OE2 2.85Å; Y390-F397 AromaticContact CD1-CD2 3.73Å; Y390-F397 HydrophobicContact CD1-CD2 3.73Å; Y390-F397 AromaticContact CD1-CE2 3.72Å; Y390-F397 HydrophobicContact CD1-CE2 3.72Å; Y390-F397 HydrophobicContact CD2-CD2 4.38Å; Y390-F397 AromaticContact CD2-CE2 3.63Å; Y390-F397 HydrophobicContact CD2-CE2 3.63Å; Y390-F397 AromaticContact CE1-CD2 3.33Å; Y390-F397 HydrophobicContact CE1-CD2 3.33Å; Y390-F397 AromaticContact CE1-CE2 3.61Å; Y390-F397 HydrophobicContact CE1-CE2 3.61Å; Y390-F397 HydrophobicContact CE2-CD2 4.1Å; Y390-F397 AromaticContact CE2-CE2 3.58Å; Y390-F397 HydrophobicContact CE2-CE2 3.58Å; Y390-F397 HydrophobicContact CG-CD2 4.19Å; Y390-F397 AromaticContact CG-CE2 3.68Å; Y390-F397 HydrophobicContact CG-CE2 3.68Å; Y390-F397 AromaticContact CZ-CD2 3.55Å; Y390-F397 AromaticContact CZ-CE2 3.54Å
391	D	74.9	Confident	84.1	Confident	84 Å²	84	88.8 Å²	88.8	45%	0.449	47%	0.472	S	S	.	.			trans	-74.1	109.9	177.8	-165.2	-16.3	0	0	0	111	Y389 E393 L394	Y389-D391 PolarHBondContact O-N 3.06Å; D391-E393 PolarHBondContact O-N 2.86Å; D391-E393 VanDerWaalsContact O-N 3.15Å; D391-E393 WeakPolarHBondContact OD1-CB 3.45Å; D391-E393 PolarHBondContact OD1-N 2.85Å; D391-E393 VanDerWaalsContact OD1-N 3.14Å; D391-L394 HydrophobicContact CB-CD1 4.02Å; D391-L394 HydrophobicContact CB-CG 4.11Å; D391-L394 WeakPolarHBondContact O-CB 3.1Å; D391-L394 PolarHBondContact O-N 3.46Å
392	A	77.2	Confident	84	Confident	69 Å²	69	92.2 Å²	92.2	57%	0.57	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-62.4	-22.5	-176.6	0	0	0	0	0	112.9	Y390 L394 G395	Y390-A392 PolarHBondContact O-N 3.27Å; A392-L394 PolarHBondContact O-N 3.14Å; A392-G395 PolarHBondContact O-N 2.97Å
393	E	78.5	Confident	83.9	Confident	177 Å²	177	85.8 Å²	85.8	83%	0.827	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-67.1	-24	-179.8	-61.5	-176.8	-178.1	0	0	112.6	D391 G395	D391-E393 PolarHBondContact O-N 2.86Å; D391-E393 VanDerWaalsContact O-N 3.15Å; D391-E393 WeakPolarHBondContact OD1-CB 3.45Å; D391-E393 PolarHBondContact OD1-N 2.85Å; D391-E393 VanDerWaalsContact OD1-N 3.14Å; E393-G395 PolarHBondContact O-N 2.85Å
394	L	82.7	Confident	83.7	Confident	109 Å²	109	89 Å²	89	57%	0.571	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-68.1	-16.9	176.3	-66.9	174.5	0	0	0	113.4	Y390 D391 A392 E396	Y390-L394 HydrophobicContact CE1-CB 4.4Å; Y390-L394 HydrophobicContact CE2-CB 4.41Å; Y390-L394 HydrophobicContact CE2-CD1 3.99Å; Y390-L394 WeakPolarHBondContact OH-CB 3.2Å; D391-L394 HydrophobicContact CB-CD1 4.02Å; D391-L394 HydrophobicContact CB-CG 4.11Å; D391-L394 WeakPolarHBondContact O-CB 3.1Å; D391-L394 PolarHBondContact O-N 3.46Å; A392-L394 PolarHBondContact O-N 3.14Å; L394-E396 VanDerWaalsContact C-N 3.26Å; L394-E396 PolarHBondContact O-N 3.27Å; L394-E396 VanDerWaalsContact O-N 3.1Å
395	G	81.8	Confident	83.6	Confident	57 Å²	57	87.9 Å²	87.9	59%	0.588	48%	0.478	S	S	*	.			trans	68	8.9	169.9	0	0	0	0	0	116.9	A392 E393 F397	A392-G395 PolarHBondContact O-N 2.97Å; E393-G395 PolarHBondContact O-N 2.85Å; G395-F397 PolarHBondContact O-N 3.13Å
396	E	80.4	Confident	83.4	Confident	127 Å²	127	85.6 Å²	85.6	59%	0.593	47%	0.47	S	S	*	.			trans	-70.1	-13.2	-177.9	-59.3	163.4	-161.5	0	0	113.6	Y390 L394	Y390-E396 HydrophobicContact CE2-CB 4.48Å; Y390-E396 HydrophobicContact CE2-CG 4.42Å; Y390-E396 VanDerWaalsContact CE2-OE2 3.26Å; Y390-E396 WeakPolarHBondContact CE2-OE2 3.19Å; Y390-E396 WeakPolarHBondContact OH-CB 3.23Å; Y390-E396 WeakPolarHBondContact OH-CG 3.31Å; Y390-E396 PolarHBondContact OH-N 3.27Å; Y390-E396 PolarHBondContact OH-OE2 2.85Å; L394-E396 VanDerWaalsContact C-N 3.26Å; L394-E396 PolarHBondContact O-N 3.27Å; L394-E396 VanDerWaalsContact O-N 3.1Å
397	F	80.5	Confident	83.2	Confident	38 Å²	38	89.5 Å²	89.5	17%	0.167	48%	0.484	C	S	.	.	S	Bend	trans	-111.2	116.4	-179.5	-64.4	-93.8	0	0	0	110.5	R304 Y390 G395 T399	R304-F397 VanDerWaalsContact CD-CE1 3.45Å; R304-F397 HydrophobicContact CG-CD1 3.85Å; R304-F397 HydrophobicContact CG-CE1 4.19Å; R304-F397 VanDerWaalsContact CZ-CD2 3.48Å; Y390-F397 AromaticContact CD1-CD2 3.73Å; Y390-F397 HydrophobicContact CD1-CD2 3.73Å; Y390-F397 AromaticContact CD1-CE2 3.72Å; Y390-F397 HydrophobicContact CD1-CE2 3.72Å; Y390-F397 HydrophobicContact CD2-CD2 4.38Å; Y390-F397 AromaticContact CD2-CE2 3.63Å; Y390-F397 HydrophobicContact CD2-CE2 3.63Å; Y390-F397 AromaticContact CE1-CD2 3.33Å; Y390-F397 HydrophobicContact CE1-CD2 3.33Å; Y390-F397 AromaticContact CE1-CE2 3.61Å; Y390-F397 HydrophobicContact CE1-CE2 3.61Å; Y390-F397 HydrophobicContact CE2-CD2 4.1Å; Y390-F397 AromaticContact CE2-CE2 3.58Å; Y390-F397 HydrophobicContact CE2-CE2 3.58Å; Y390-F397 HydrophobicContact CG-CD2 4.19Å; Y390-F397 AromaticContact CG-CE2 3.68Å; Y390-F397 HydrophobicContact CG-CE2 3.68Å; Y390-F397 AromaticContact CZ-CD2 3.55Å; Y390-F397 AromaticContact CZ-CE2 3.54Å; G395-F397 PolarHBondContact O-N 3.13Å; F397-T399 PolarHBondContact O-N 3.03Å
398	E	80.3	Confident	82.6	Confident	168 Å²	168	90.1 Å²	90.1	79%	0.785	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-52.3	134.7	170.4	-65.6	173.2	-169.7	0	0	111.2	P400	E398-P400 WeakPolarHBondContact O-CD 3.01Å
399	T	84.2	Confident	82.2	Confident	131 Å²	131	95.1 Å²	95.1	80%	0.804	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-73.2	118.6	169.4	43.2	0	0	0	0	108.2	F397 S401	F397-T399 PolarHBondContact O-N 3.03Å; T399-S401 PolarHBondContact O-N 3.17Å
400	P	86.5	Confident	81.8	Confident	35 Å²	35	86.6 Å²	86.6	23%	0.227	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-68.2	134.7	-175.4	28	-34	0	0	0	110.2	R301 L302 E398	R301-P400 HydrophobicContact CB-CB 3.68Å; R301-P400 HydrophobicContact CB-CG 4.26Å; L302-P400 HydrophobicContact CD2-CG 3.48Å; L302-P400 VanDerWaalsContact CD2-CG 3.48Å; L302-P400 HydrophobicContact CG-CG 3.89Å; E398-P400 WeakPolarHBondContact O-CD 3.01Å
401	S	89.1	Confident	81.5	Confident	77 Å²	77	85.8 Å²	85.8	54%	0.538	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-56.9	143.9	172.2	52.5	0	0	0	0	110.8	W298 T399	W298-S401 PolarHBondContact NE1-O 2.78Å; T399-S401 PolarHBondContact O-N 3.17Å
402	P	89.9	Confident	81.3	Confident	75 Å²	75	88.2 Å²	88.2	49%	0.487	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-60.8	155.7	178.3	28	-35.7	0	0	0	111.2	E374	E374-P402 HydrophobicContact CG-CB 3.63Å
403	P	89.2	Confident	81.2	Confident	6 Å²	6	93.8 Å²	93.8	4%	0.039	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-64.3	147.5	177.3	28.9	-31.2	0	0	0	109.1	Y290 E294 L295 W298 C405	Y290-P403 HydrophobicContact CD1-CB 4.08Å; Y290-P403 HydrophobicContact CD1-CG 3.64Å; Y290-P403 HydrophobicContact CE1-CB 4.48Å; Y290-P403 HydrophobicContact CE1-CG 3.64Å; Y290-P403 HydrophobicContact CG-CG 4.48Å; E294-P403 HydrophobicContact CB-CB 4.35Å; L295-P403 HydrophobicContact CD1-CG 4.35Å; W298-P403 HydrophobicContact CB-CB 4.14Å; W298-P403 HydrophobicContact CB-CG 4.4Å; W298-P403 VanDerWaalsContact CD2-CD 3.5Å; W298-P403 HydrophobicContact CD2-CG 4Å; W298-P403 HydrophobicContact CE3-CG 3.9Å; W298-P403 HydrophobicContact CG-CB 4.4Å; W298-P403 HydrophobicContact CG-CG 4.22Å; W298-P403 HydrophobicContact CZ3-CG 4.41Å; P403-C405 PolarHBondContact O-N 3.05Å
404	K	86	Confident	80.9	Confident	150 Å²	150	87.6 Å²	87.6	65%	0.652	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-70.4	133.8	177.5	-51	178.1	-179.6	171.2	0	107.7	E294	E294-K404 VanDerWaalsContact OE2-CA 3.25Å; E294-K404 WeakPolarHBondContact OE2-CA 3.36Å; E294-K404 WeakPolarHBondContact OE2-CB 3.37Å; E294-K404 WeakPolarHBondContact OE2-CG 3.34Å; E294-K404 PolarHBondContact OE2-N 3.03Å
405	C	87.1	Confident	80.2	Confident	44 Å²	44	87.7 Å²	87.7	30%	0.297	46%	0.457	S	S	.	.	B	Isolated β-bridge	trans	-76.3	143	172	-59.7	0	0	0	0	108.1	K288 R289 P403	K288-C405 VanDerWaalsContact CD-SG 3.59Å; R289-C405 WeakPolarHBondContact O-CA 3.37Å; P403-C405 PolarHBondContact O-N 3.05Å
406	I	85.8	Confident	79.2	Confident	22 Å²	22	91.2 Å²	91.2	11%	0.113	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-85.7	119.9	171.5	-55.3	169	0	0	0	107.3	V255 R289 Q291 D410 E411 L414	V255-I406 HydrophobicContact CB-CD1 4.19Å; V255-I406 HydrophobicContact CG1-CD1 3.87Å; V255-I406 HydrophobicContact CG2-CD1 3.42Å; V255-I406 VanDerWaalsContact CG2-CD1 3.42Å; R289-I406 PolarHBondContact O-N 3.1Å; Q291-I406 HydrophobicContact CB-CD1 3.76Å; Q291-I406 HydrophobicContact CB-CG1 4.26Å; Q291-I406 HydrophobicContact CG-CD1 4.22Å; I406-D410 HydrophobicContact CG2-CB 3.9Å; I406-E411 HydrophobicContact CB-CG 4.34Å; I406-E411 HydrophobicContact CG2-CB 4.43Å; I406-E411 HydrophobicContact CG2-CG 3.43Å; I406-E411 VanDerWaalsContact CG2-CG 3.43Å; I406-L414 HydrophobicContact CD1-CD1 3.73Å; I406-L414 HydrophobicContact CG1-CD1 4.48Å; I406-L414 HydrophobicContact CG2-CD1 4.19Å
407	E	80.1	Confident	79.1	Confident	112 Å²	112	89.5 Å²	89.5	52%	0.523	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-73.2	149.3	169.5	-66.7	-62.5	151.1	0	0	109.7	R409 D410 E411	E407-R409 HydrophobicContact CB-CG 3.95Å; E407-R409 PolarHBondContact O-N 3.35Å; E407-D410 PolarHBondContact O-N 3.27Å; E407-E411 PolarHBondContact O-N 3.27Å
408	A	74.3	Confident	79	Confident	76 Å²	76	92.2 Å²	92.2	63%	0.628	49%	0.492	S	S	*	.	H	α-helix	trans	-53.1	-31.3	-178.4	0	0	0	0	0	113.5	D410	A408-D410 VanDerWaalsContact C-N 3.35Å; A408-D410 PolarHBondContact O-N 3.24Å
409	R	73	Confident	79	Confident	175 Å²	175	87.9 Å²	87.9	66%	0.66	48%	0.475	S	S	*	.	H	α-helix	trans	-65.4	-33.6	175.2	69.3	-178.4	-177.8	-172.9	-6.3	113.8	E407	E407-R409 HydrophobicContact CB-CG 3.95Å; E407-R409 PolarHBondContact O-N 3.35Å
410	D	76	Confident	78.7	Confident	44 Å²	44	85.4 Å²	85.4	24%	0.235	46%	0.456	C	S	.	.	H	α-helix	trans	-84.3	-24.6	-174.5	-68	-46.7	0	0	0	110.7	I406 E407 A408 L412 R413 L414	I406-D410 HydrophobicContact CG2-CB 3.9Å; E407-D410 PolarHBondContact O-N 3.27Å; A408-D410 VanDerWaalsContact C-N 3.35Å; A408-D410 PolarHBondContact O-N 3.24Å; D410-L412 VanDerWaalsContact C-N 3.33Å; D410-L412 PolarHBondContact O-N 2.93Å; D410-R413 WeakPolarHBondContact O-CB 3.26Å; D410-R413 PolarHBondContact O-N 3.08Å; D410-R413 VanDerWaalsContact O-N 3.14Å; D410-R413 IonicContact OD1-NH1 2.63Å; D410-R413 PolarHBondContact OD1-NH1 3.45Å; D410-L414 PolarHBondContact O-N 3.25Å
411	E	73.8	Confident	78.2	Confident	26 Å²	26	88.6 Å²	88.6	12%	0.121	47%	0.47	C	S	.	.	H	α-helix	trans	-60.6	-41.5	172	-65.8	-169.2	172.3	0	0	112.8	R289 I406 E407 R413 L414 F415	R289-E411 WeakPolarHBondContact CD-OE1 3.03Å; R289-E411 IonicContact CZ-OE1 3.08Å; R289-E411 IonicContact CZ-OE2 3.09Å; R289-E411 VanDerWaalsContact CZ-OE2 3.22Å; R289-E411 IonicContact NE-OE1 3.19Å; R289-E411 PolarHBondContact NE-OE1 3.14Å; R289-E411 IonicContact NH1-OE1 2.68Å; R289-E411 PolarHBondContact NH1-OE1 2.94Å; R289-E411 IonicContact NH1-OE2 2.72Å; R289-E411 PolarHBondContact NH1-OE2 2.63Å; R289-E411 IonicContact NH2-OE1 2.64Å; R289-E411 PolarHBondContact NH2-OE1 3.18Å; R289-E411 IonicContact NH2-OE2 3.78Å; R289-E411 PolarHBondContact NH2-OE2 2.98Å; I406-E411 HydrophobicContact CB-CG 4.34Å; I406-E411 HydrophobicContact CG2-CB 4.43Å; I406-E411 HydrophobicContact CG2-CG 3.43Å; I406-E411 VanDerWaalsContact CG2-CG 3.43Å; E407-E411 PolarHBondContact O-N 3.27Å; E411-R413 PolarHBondContact O-N 3.05Å; E411-L414 PolarHBondContact O-N 3.39Å; E411-F415 VanDerWaalsContact O-CD2 3.24Å; E411-F415 WeakPolarHBondContact O-CD2 3.11Å; E411-F415 PolarHBondContact O-N 3.15Å
412	L	72	Confident	77.4	Confident	135 Å²	135	89.3 Å²	89.3	71%	0.707	47%	0.466	S	S	*	.	H	α-helix	trans	-59.2	-32.6	177	-67.5	174.9	0	0	0	111.7	D410 A416	D410-L412 VanDerWaalsContact C-N 3.33Å; D410-L412 PolarHBondContact O-N 2.93Å; L412-A416 WeakPolarHBondContact O-CB 3.44Å; L412-A416 PolarHBondContact O-N 3.2Å; L412-A416 VanDerWaalsContact O-N 3.13Å
413	R	73.3	Confident	76.6	Confident	186 Å²	186	90.4 Å²	90.4	70%	0.702	46%	0.464	S	S	*	.	H	α-helix	trans	-76.5	-26.5	177.2	-64.3	175.7	172.2	168.3	-8.5	113.3	D410 E411	D410-R413 WeakPolarHBondContact O-CB 3.26Å; D410-R413 PolarHBondContact O-N 3.08Å; D410-R413 VanDerWaalsContact O-N 3.14Å; D410-R413 IonicContact OD1-NH1 2.63Å; D410-R413 PolarHBondContact OD1-NH1 3.45Å; E411-R413 PolarHBondContact O-N 3.05Å
414	L	72.2	Confident	75.6	Confident	46 Å²	46	96.8 Å²	96.8	24%	0.241	50%	0.497	C	S	.	.	H	α-helix	trans	-75.8	-28	179.1	-70.5	172.5	0	0	0	112.6	V255 I406 D410 E411	V255-L414 HydrophobicContact CG2-CD1 4.1Å; I406-L414 HydrophobicContact CD1-CD1 3.73Å; I406-L414 HydrophobicContact CG1-CD1 4.48Å; I406-L414 HydrophobicContact CG2-CD1 4.19Å; D410-L414 PolarHBondContact O-N 3.25Å; E411-L414 PolarHBondContact O-N 3.39Å
415	F	69.8	Low	74.7	Confident	111 Å²	111	92.4 Å²	92.4	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-106.2	-8.8	-177.8	-62	-65.3	0	0	0	114.8	V255 T353 E411	V255-F415 HydrophobicContact CG2-CE2 4.29Å; V255-F415 HydrophobicContact CG2-CZ 4.13Å; T353-F415 HydrophobicContact CG2-CE1 4.47Å; T353-F415 HydrophobicContact CG2-CE2 4.3Å; T353-F415 HydrophobicContact CG2-CZ 3.67Å; E411-F415 VanDerWaalsContact O-CD2 3.24Å; E411-F415 WeakPolarHBondContact O-CD2 3.11Å; E411-F415 PolarHBondContact O-N 3.15Å
416	A	59.2	Low	73.6	Confident	132 Å²	132	96.8 Å²	96.8	100%	1.091	50%	0.501	S	S	*	.			trans	-67.6	0	161.5	0	0	0	0	0	110.2	L412	L412-A416 WeakPolarHBondContact O-CB 3.44Å; L412-A416 PolarHBondContact O-N 3.2Å; L412-A416 VanDerWaalsContact O-N 3.13Å

Retrieved 416 of 416 residues in 359.9 ms (Link to these results)

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