G4VCW4_SCHMA Loading...

FAD-dependent oxidoreductase domain-containing protein 1

Required for the assembly of the mitochondrial membrane respiratory chain NADH dehydrogenase (Complex I). Involved in mid-late stages of complex I assembly.

AlphaFold DB , UniProt , Accession G4VCW4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 481 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	36.2	Very low	33.1	Very low	247 Å²	247	174.6 Å²	174.6	100%	1.217	86%	0.859	S	S	*	*				0	90	0	-79.3	-178.4	176.9	0	0	108.8
2	L	31.6	Very low	33	Very low	159 Å²	159	168.6 Å²	168.6	83%	0.832	86%	0.858	S	S	*	*			trans	-122.3	99.5	177.1	-91.8	147.9	0	0	0	107.3
3	K	33	Very low	33.1	Very low	216 Å²	216	165.5 Å²	165.5	94%	0.939	85%	0.851	S	S	*	*			trans	-86.5	104.5	175.5	-83.5	179.5	169.6	178	0	108.1	G5	K3-G5 PolarHBondContact O-N 2.73Å
4	F	35.3	Very low	33	Very low	185 Å²	185	161.4 Å²	161.4	81%	0.811	85%	0.845	S	S	*	*			trans	-74.7	121.2	168.7	-81.1	-85	0	0	0	109.7	L6	F4-L6 PolarHBondContact O-N 2.94Å
5	G	32.1	Very low	32.7	Very low	73 Å²	73	159.5 Å²	159.5	75%	0.753	85%	0.85	S	S	*	*			trans	-74.9	117	176.8	0	0	0	0	0	111.5	K3 N7	K3-G5 PolarHBondContact O-N 2.73Å; G5-N7 PolarHBondContact O-N 3.17Å
6	L	33.5	Very low	32.7	Very low	160 Å²	160	153.2 Å²	153.2	84%	0.838	84%	0.835	S	S	*	*			trans	-82.9	95.9	164.9	-94.7	127.7	0	0	0	109	F4 R8	F4-L6 PolarHBondContact O-N 2.94Å; L6-R8 PolarHBondContact O-N 3.35Å; L6-R8 VanDerWaalsContact O-N 3.09Å
7	N	34.4	Very low	32.5	Very low	156 Å²	156	153.8 Å²	153.8	83%	0.834	84%	0.836	S	S	*	*			trans	-70.2	94.3	166.7	-84.6	-26.3	0	0	0	109.3	G5 L9	G5-N7 PolarHBondContact O-N 3.17Å; N7-L9 PolarHBondContact O-N 3.21Å
8	R	32.4	Very low	32.5	Very low	222 Å²	222	152.8 Å²	152.8	84%	0.838	84%	0.835	S	S	*	*			trans	-73.9	102	166.1	-79.3	-174.8	172.2	-172.8	-2	109	L6 N10	L6-R8 PolarHBondContact O-N 3.35Å; L6-R8 VanDerWaalsContact O-N 3.09Å; R8-N10 PolarHBondContact O-N 3.04Å
9	L	32.7	Very low	32.6	Very low	146 Å²	146	155.6 Å²	155.6	76%	0.764	84%	0.839	S	S	*	*			trans	-65	108.1	167.6	-93.5	133.8	0	0	0	109.7	N7 Y11	N7-L9 PolarHBondContact O-N 3.21Å; L9-Y11 PolarHBondContact O-N 2.9Å
10	N	30.9	Very low	32.7	Very low	155 Å²	155	152.1 Å²	152.1	83%	0.829	83%	0.827	S	S	*	*			trans	-72.7	101.2	171.3	-77.4	-40.2	0	0	0	110	R8 A12	R8-N10 PolarHBondContact O-N 3.04Å; N10-A12 PolarHBondContact O-N 2.79Å
11	Y	32.4	Very low	32.8	Very low	202 Å²	202	152.6 Å²	152.6	79%	0.792	82%	0.824	S	S	*	*			trans	-84	97.1	162.6	-89.7	-87.8	0	0	0	109.5	L9 V13	L9-Y11 PolarHBondContact O-N 2.9Å; Y11-V13 PolarHBondContact O-N 2.9Å
12	A	31.5	Very low	32.6	Very low	102 Å²	102	150.3 Å²	150.3	84%	0.843	81%	0.807	S	S	*	*			trans	-78	91.7	165.6	0	0	0	0	0	108.7	N10	N10-A12 PolarHBondContact O-N 2.79Å
13	V	34.3	Very low	32.6	Very low	128 Å²	128	153.4 Å²	153.4	78%	0.776	81%	0.807	S	S	*	*			trans	-85.7	113.7	170.7	-176.3	0	0	0	0	107.8	Y11 S15	Y11-V13 PolarHBondContact O-N 2.9Å; V13-S15 PolarHBondContact O-N 2.88Å
14	S	31.5	Very low	32.6	Very low	109 Å²	109	146.5 Å²	146.5	76%	0.762	79%	0.786	S	S	*	*			trans	-61.6	127.2	-177.1	54.8	0	0	0	0	111.8	G16	S14-G16 PolarHBondContact O-N 3.42Å; S14-G16 VanDerWaalsContact O-N 3.09Å
15	S	29.6	Very low	32.6	Very low	132 Å²	132	142 Å²	142	92%	0.923	78%	0.783	S	S	*	*			trans	-74.1	89.8	172.6	54.4	0	0	0	0	109.9	V13	V13-S15 PolarHBondContact O-N 2.88Å
16	G	31.3	Very low	32.6	Very low	59 Å²	59	148.9 Å²	148.9	61%	0.608	79%	0.788	S	S	*	*			trans	-153.7	113.9	177.7	0	0	0	0	0	112.8	S14	S14-G16 PolarHBondContact O-N 3.42Å; S14-G16 VanDerWaalsContact O-N 3.09Å
17	L	30.2	Very low	32.6	Very low	164 Å²	164	147.4 Å²	147.4	86%	0.859	79%	0.786	S	S	*	*			trans	79.3	73.5	156.2	-57.5	157.8	0	0	0	118.2
18	V	32.1	Very low	32.6	Very low	135 Å²	135	150.6 Å²	150.6	82%	0.818	79%	0.786	S	S	*	*			trans	-132.4	93.9	137.5	-173.8	0	0	0	0	108.6	S20	V18-S20 PolarHBondContact O-N 2.78Å
19	K	34.1	Very low	32.7	Very low	206 Å²	206	146.6 Å²	146.6	90%	0.896	78%	0.781	S	S	*	*			trans	-70.5	66.8	164.1	-78.3	-178.5	174.9	177.1	0	108.8	Q21	K19-Q21 PolarHBondContact O-N 2.61Å
20	S	35	Very low	32.8	Very low	86 Å²	86	144.8 Å²	144.8	60%	0.601	78%	0.777	S	S	*	*			trans	-75	114.3	168	168	0	0	0	0	107.2	V18 K22	V18-S20 PolarHBondContact O-N 2.78Å; S20-K22 VanDerWaalsContact C-N 3.31Å; S20-K22 PolarHBondContact O-N 3.29Å
21	Q	34.2	Very low	32.9	Very low	163 Å²	163	145.2 Å²	145.2	76%	0.762	78%	0.779	S	S	*	*			trans	-56.4	96.8	169.8	-71.8	179.8	-2.4	0	0	108.1	K19 R23	K19-Q21 PolarHBondContact O-N 2.61Å; Q21-R23 PolarHBondContact O-N 2.69Å
22	K	33.6	Very low	33.1	Very low	199 Å²	199	143.4 Å²	143.4	87%	0.865	78%	0.783	S	S	*	*			trans	-62.4	83.5	166	-78.5	-175.1	174.8	-177.7	0	107.9	S20 S24	S20-K22 VanDerWaalsContact C-N 3.31Å; S20-K22 PolarHBondContact O-N 3.29Å; K22-S24 PolarHBondContact O-N 2.9Å
23	R	30	Very low	33.1	Very low	223 Å²	223	148.8 Å²	148.8	84%	0.842	78%	0.781	S	S	*	*			trans	-64.6	92.2	158.6	-80.3	-175.4	174.2	-176.7	-1.5	106	Q21 A25	Q21-R23 PolarHBondContact O-N 2.69Å; R23-A25 PolarHBondContact O-N 3.4Å; R23-A25 VanDerWaalsContact O-N 3.09Å
24	S	34.1	Very low	33.3	Very low	71 Å²	71	146 Å²	146	50%	0.497	77%	0.768	S	S	.	*			trans	-48.6	111	170.8	170.7	0	0	0	0	109	K22 Y26	K22-S24 PolarHBondContact O-N 2.9Å; S24-Y26 PolarHBondContact O-N 2.67Å; S24-Y26 VanDerWaalsContact O-N 3.14Å; S24-Y26 WeakPolarHBondContact OG-CD2 2.99Å
25	A	33.9	Very low	33.7	Very low	90 Å²	90	144.5 Å²	144.5	74%	0.744	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-68.5	-2.1	176.3	0	0	0	0	0	112.8	R23 T27	R23-A25 PolarHBondContact O-N 3.4Å; R23-A25 VanDerWaalsContact O-N 3.09Å; A25-T27 VanDerWaalsContact C-N 3.25Å; A25-T27 PolarHBondContact O-N 3.13Å
26	Y	33.2	Very low	34.2	Very low	219 Å²	219	143 Å²	143	86%	0.859	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-74	-3.3	-175.1	-66.8	-76.9	0	0	0	115.1	S24	S24-Y26 PolarHBondContact O-N 2.67Å; S24-Y26 VanDerWaalsContact O-N 3.14Å; S24-Y26 WeakPolarHBondContact OG-CD2 2.99Å
27	T	32.7	Very low	34.4	Very low	128 Å²	128	148 Å²	148	79%	0.785	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-100.6	7.5	-179.3	30	0	0	0	0	115.6	A25	A25-T27 VanDerWaalsContact C-N 3.25Å; A25-T27 PolarHBondContact O-N 3.13Å
28	R	34.1	Very low	34.8	Very low	223 Å²	223	144.1 Å²	144.1	84%	0.842	73%	0.73	S	S	*	*	S	Bend	trans	-141.4	86.3	170.7	-63.6	-173.3	-164.1	-165.1	3	110.5
29	L	34.5	Very low	35	Very low	139 Å²	139	144 Å²	144	73%	0.728	73%	0.731	S	S	*	*			trans	-176.3	124.1	141.8	-94.2	160.2	0	0	0	107.7	L31	L29-L31 PolarHBondContact O-N 3.18Å
30	P	34.8	Very low	35.5	Very low	107 Å²	107	138.6 Å²	138.6	70%	0.695	71%	0.705	S	S	*	*			trans	-65.8	125.5	173.4	9.9	-4.7	0	0	0	109.9	N32	P30-N32 PolarHBondContact O-N 2.89Å
31	L	34.6	Very low	36.3	Very low	164 Å²	164	141.9 Å²	141.9	86%	0.859	70%	0.704	S	S	*	*	S	Bend	trans	-58.6	102.5	167.1	-77.7	108.8	0	0	0	108.7	L29	L29-L31 PolarHBondContact O-N 3.18Å
32	N	36.4	Very low	37.2	Very low	164 Å²	164	137.7 Å²	137.7	88%	0.877	69%	0.685	S	S	*	*			trans	170.1	62.2	153.8	-86.2	-15.1	0	0	0	108.6	P30	P30-N32 PolarHBondContact O-N 2.89Å
33	W	31.8	Very low	38.3	Very low	215 Å²	215	135.7 Å²	135.7	81%	0.814	68%	0.683	S	S	*	*			trans	-98.8	106.7	166.1	-76.1	77.3	0	0	0	107.4
34	S	36.7	Very low	40.5	Very low	71 Å²	71	131.4 Å²	131.4	50%	0.497	67%	0.673	S	S	.	*			trans	-95.4	120.3	173.7	175.4	0	0	0	0	107.8	S36 Q37	S34-S36 PolarHBondContact O-N 3.31Å; S34-S36 VanDerWaalsContact O-N 3.08Å; S34-S36 PolarHBondContact OG-OG 3.26Å; S34-Q37 PolarHBondContact O-N 2.79Å
35	T	40.5	Very low	43.2	Very low	77 Å²	77	130.2 Å²	130.2	47%	0.472	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-58.9	-18.9	178.1	44.4	0	0	0	0	113.9	Q37 I38 E126	T35-Q37 PolarHBondContact O-N 2.87Å; T35-I38 PolarHBondContact O-N 3.35Å; T35-I38 VanDerWaalsContact O-N 3.13Å; T35-E126 HydrophobicContact CG2-CG 4.43Å; T35-E126 WeakPolarHBondContact CG2-OE1 3.47Å
36	S	40.3	Very low	46.1	Very low	101 Å²	101	127 Å²	127	71%	0.706	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-62.6	-9.8	175.8	61.4	0	0	0	0	114.6	S34	S34-S36 PolarHBondContact O-N 3.31Å; S34-S36 VanDerWaalsContact O-N 3.08Å; S34-S36 PolarHBondContact OG-OG 3.26Å
37	Q	36.2	Very low	49.1	Very low	163 Å²	163	127 Å²	127	76%	0.762	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-102.2	4.3	175.2	-77	-170	-10.9	0	0	115.1	S34 T35 T39	S34-Q37 PolarHBondContact O-N 2.79Å; T35-Q37 PolarHBondContact O-N 2.87Å; Q37-T39 PolarHBondContact O-N 2.86Å; Q37-T39 PolarHBondContact O-OG1 2.62Å
38	I	38.3	Very low	52.2	Low	82 Å²	82	126.6 Å²	126.6	42%	0.421	63%	0.626	S	S	.	*			trans	-71.6	84.8	170.1	-56.1	177.5	0	0	0	107.7	T35 Y40	T35-I38 PolarHBondContact O-N 3.35Å; T35-I38 VanDerWaalsContact O-N 3.13Å; I38-Y40 VanDerWaalsContact C-N 3.33Å; I38-Y40 HydrophobicContact CG2-CD1 3.89Å; I38-Y40 HydrophobicContact CG2-CE1 3.71Å; I38-Y40 HydrophobicContact CG2-CG 4.41Å; I38-Y40 PolarHBondContact O-N 3.36Å
39	T	37	Very low	55.3	Low	134 Å²	134	116.3 Å²	116.3	82%	0.822	59%	0.588	S	S	*	*			trans	-70	97.1	165.5	-3	0	0	0	0	105.5	Q37 R41	Q37-T39 PolarHBondContact O-N 2.86Å; Q37-T39 PolarHBondContact O-OG1 2.62Å; T39-R41 PolarHBondContact O-N 3.28Å
40	Y	43.6	Very low	58.3	Low	91 Å²	91	112 Å²	112	36%	0.357	57%	0.565	S	S	.	*			trans	-54.8	140.1	172.2	-67.3	-66.2	0	0	0	108.7	I38 E42 H214	I38-Y40 VanDerWaalsContact C-N 3.33Å; I38-Y40 HydrophobicContact CG2-CD1 3.89Å; I38-Y40 HydrophobicContact CG2-CE1 3.71Å; I38-Y40 HydrophobicContact CG2-CG 4.41Å; I38-Y40 PolarHBondContact O-N 3.36Å; Y40-E42 PolarHBondContact O-N 3.07Å; Y40-H214 HydrophobicContact CD1-CB 3.44Å; Y40-H214 VanDerWaalsContact CD1-CB 3.44Å; Y40-H214 AromaticContact CD1-CE1 3.98Å; Y40-H214 AromaticContact CD1-CG 3.5Å; Y40-H214 AromaticContact CD1-ND1 2.99Å; Y40-H214 WeakPolarHBondContact CD1-ND1 3.36Å; Y40-H214 HydrophobicContact CE1-CB 3.29Å; Y40-H214 AromaticContact CE1-CG 3.68Å; Y40-H214 AromaticContact CE1-ND1 3.27Å; Y40-H214 VanDerWaalsContact CE1-ND1 3.27Å; Y40-H214 WeakPolarHBondContact CE1-ND1 3.39Å; Y40-H214 AromaticContact CG-ND1 3.46Å; Y40-H214 AromaticContact CZ-ND1 3.95Å
41	R	51.6	Low	61.4	Low	156 Å²	156	107 Å²	107	59%	0.589	53%	0.533	S	S	*	.	S	Bend	trans	-71.3	40.2	178.9	-68.3	-176.8	173.5	179.1	-3	112.1	T39 D43 Q44	T39-R41 PolarHBondContact O-N 3.28Å; R41-D43 PolarHBondContact O-N 2.9Å; R41-D43 VanDerWaalsContact O-N 3.14Å; R41-Q44 PolarHBondContact O-N 2.9Å
42	E	52.7	Low	64.4	Low	75 Å²	75	99.1 Å²	99.1	35%	0.35	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.3	-175.4	-51.1	-162.8	140.1	0	0	111.7	Y40 K210 H214 Y220	Y40-E42 PolarHBondContact O-N 3.07Å; E42-K210 IonicContact OE1-NZ 3.19Å; E42-H214 IonicContact OE1-CE1 2.71Å; E42-Y220 HydrophobicContact CB-CD1 4.29Å; E42-Y220 HydrophobicContact CG-CD1 3.87Å; E42-Y220 WeakPolarHBondContact OE1-CD1 3.32Å
43	D	57.5	Low	67.4	Low	156 Å²	156	91.3 Å²	91.3	83%	0.834	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-0.5	-175.5	-59	-30.2	0	0	0	115.1	R41	R41-D43 PolarHBondContact O-N 2.9Å; R41-D43 VanDerWaalsContact O-N 3.14Å
44	Q	76	Confident	70.6	Confident	133 Å²	133	81.5 Å²	81.5	62%	0.621	41%	0.413	S	S	*	.			trans	-102.8	90.3	177.9	-71.1	-165.5	-6.2	0	0	111.1	R41 P46	R41-Q44 PolarHBondContact O-N 2.9Å; Q44-P46 VanDerWaalsContact O-CD 3.27Å; Q44-P46 WeakPolarHBondContact O-CD 3.33Å
45	V	90.8	Very high	73.5	Confident	46 Å²	46	78.6 Å²	78.6	28%	0.279	40%	0.395	S	S	.	.			trans	-66.5	115.7	171.1	-174	0	0	0	0	109.4	V221 L260 V266 I268	V45-V221 HydrophobicContact CG1-CG2 4.45Å; V45-V221 HydrophobicContact CG2-CG1 4.1Å; V45-V221 HydrophobicContact CG2-CG2 4.41Å; V45-L260 HydrophobicContact CG2-CD1 4.1Å; V45-L260 HydrophobicContact CG2-CD2 4.07Å; V45-V266 HydrophobicContact CB-CG2 4.44Å; V45-V266 HydrophobicContact CG1-CB 4.2Å; V45-V266 HydrophobicContact CG1-CG2 3.62Å; V45-V266 HydrophobicContact CG2-CG2 4.32Å; V45-I268 HydrophobicContact CG1-CD1 3.73Å; V45-I268 HydrophobicContact CG1-CG1 3.82Å
46	P	95.1	Very high	76.2	Confident	23 Å²	23	74.9 Å²	74.9	15%	0.149	37%	0.372	C	S	.	.			trans	-72.7	142.2	178.4	30.4	-33	0	0	0	110.4	Q44 N48 T76 N219	Q44-P46 VanDerWaalsContact O-CD 3.27Å; Q44-P46 WeakPolarHBondContact O-CD 3.33Å; P46-N48 VanDerWaalsContact C-N 3.31Å; P46-T76 HydrophobicContact CG-CG2 3.93Å; P46-T76 WeakPolarHBondContact CG-OG1 3.41Å; P46-N219 HydrophobicContact CG-CB 4.41Å
47	R	95.9	Very high	78.9	Confident	218 Å²	218	70.7 Å²	70.7	82%	0.823	35%	0.345	S	S	*	.	S	Bend	trans	-67.1	-33.9	172.6	-69.4	-175.8	-179.8	176.4	-0.1	112.4	G269	R47-G269 PolarHBondContact O-N 2.78Å
48	N	98	Very high	81.9	Confident	121 Å²	121	63.2 Å²	63.2	65%	0.647	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.2	150.3	178	-60	-75.2	0	0	0	110.5	P46 G269	P46-N48 VanDerWaalsContact C-N 3.31Å; N48-G269 CarbonylContact C-O 3.6Å; N48-G269 VanDerWaalsContact CA-O 3.23Å; N48-G269 WeakPolarHBondContact CA-O 3.41Å
49	T	98.4	Very high	84.7	Confident	6 Å²	6	60 Å²	60	4%	0.037	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	153.4	173.8	-169.9	0	0	0	0	108.9	V51 L52 S74 T76 I268 G269 F270	T49-V51 WeakPolarHBondContact CG2-O 3.43Å; T49-V51 PolarHBondContact OG1-O 2.89Å; T49-V51 VanDerWaalsContact OG1-O 3.08Å; T49-L52 HydrophobicContact CG2-CB 3.96Å; T49-L52 HydrophobicContact CG2-CD1 4.4Å; T49-S74 PolarHBondContact OG1-O 2.92Å; T49-T76 VanDerWaalsContact CB-OG1 3.24Å; T49-T76 WeakPolarHBondContact CB-OG1 3.47Å; T49-T76 PolarHBondContact OG1-N 2.85Å; T49-T76 PolarHBondContact OG1-OG1 2.96Å; T49-I268 HydrophobicContact CG2-CG2 4.01Å; T49-G269 PolarHBondContact N-O 3.23Å; T49-F270 HydrophobicContact CG2-CB 3.92Å; T49-F270 WeakPolarHBondContact O-CA 3.39Å
50	D	98.6	Very high	87.7	Confident	48 Å²	48	53.6 Å²	53.6	26%	0.257	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-46.7	174.9	-63.5	-62.6	0	0	0	109.9	F73 S74 N271 S272	D50-F73 HydrophobicContact CB-CB 3.77Å; D50-F73 HydrophobicContact CB-CD1 3.94Å; D50-F73 HydrophobicContact CB-CG 4.11Å; D50-F73 WeakPolarHBondContact OD2-CA 3.48Å; D50-S74 WeakPolarHBondContact CB-O 3.18Å; D50-S74 VanDerWaalsContact CG-OG 3.3Å; D50-S74 PolarHBondContact N-O 3.41Å; D50-S74 PolarHBondContact N-OG 2.9Å; D50-S74 PolarHBondContact OD2-N 3.24Å; D50-S74 PolarHBondContact OD2-OG 3.08Å; D50-N271 WeakPolarHBondContact O-CB 3.45Å; D50-N271 PolarHBondContact O-N 2.89Å; D50-N271 VanDerWaalsContact O-N 3.13Å; D50-N271 PolarHBondContact OD1-ND2 3.31Å; D50-S272 PolarHBondContact O-N 2.78Å
51	V	98.8	Very high	90.3	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.4	177.3	-175	0	0	0	0	110.5	T49 V53 M67 S74 V75 T76 S272 V274 I451	T49-V51 WeakPolarHBondContact CG2-O 3.43Å; T49-V51 PolarHBondContact OG1-O 2.89Å; T49-V51 VanDerWaalsContact OG1-O 3.08Å; V51-V53 HydrophobicContact CG1-CG2 4.27Å; V51-M67 HydrophobicContact CG2-CE 3.62Å; V51-M67 HydrophobicContact CG2-SD 4.42Å; V51-S74 PolarHBondContact N-O 2.77Å; V51-V75 HydrophobicContact CB-CG2 4.44Å; V51-V75 WeakPolarHBondContact O-CA 3.47Å; V51-T76 PolarHBondContact O-N 2.7Å; V51-S272 WeakPolarHBondContact CA-O 3.42Å; V51-V274 HydrophobicContact CG1-CG2 4.04Å; V51-I451 HydrophobicContact CG1-CD1 3.98Å; V51-I451 HydrophobicContact CG2-CD1 4.43Å; V51-I451 HydrophobicContact CG2-CG2 3.94Å
52	L	98.9	Very high	92.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.5	169.3	-177.2	66.7	0	0	0	109	T49 V54 T76 V78 A256 I268 F270 S272 V273 V274	T49-L52 HydrophobicContact CG2-CB 3.96Å; T49-L52 HydrophobicContact CG2-CD1 4.4Å; L52-V54 HydrophobicContact CD2-CG2 4.35Å; L52-V54 HydrophobicContact CG-CG2 4.35Å; L52-T76 CarbonylContact C-O 3.56Å; L52-T76 WeakPolarHBondContact CA-O 3.28Å; L52-T76 HydrophobicContact CD1-CG2 4.15Å; L52-V78 HydrophobicContact CD1-CG2 3.65Å; L52-A256 HydrophobicContact CD2-CB 3.6Å; L52-I268 HydrophobicContact CD1-CG2 4.41Å; L52-F270 HydrophobicContact CB-CB 4Å; L52-F270 HydrophobicContact CB-CD1 3.84Å; L52-F270 HydrophobicContact CB-CG 3.99Å; L52-F270 HydrophobicContact CD2-CD1 3.47Å; L52-F270 VanDerWaalsContact CD2-CD1 3.47Å; L52-F270 HydrophobicContact CD2-CE1 3.61Å; L52-F270 HydrophobicContact CD2-CG 4.43Å; L52-F270 HydrophobicContact CG-CD1 4.29Å; L52-S272 PolarHBondContact N-O 3.35Å; L52-V273 HydrophobicContact CB-CB 4.36Å; L52-V273 HydrophobicContact CB-CG2 4.21Å; L52-V273 HydrophobicContact CD2-CG2 4.17Å; L52-V273 HydrophobicContact CG-CG2 4.3Å; L52-V273 CarbonylContact O-C 3.51Å; L52-V273 VanDerWaalsContact O-CA 3.24Å; L52-V273 WeakPolarHBondContact O-CA 3.18Å; L52-V274 PolarHBondContact O-N 2.91Å
53	V	98.9	Very high	94.7	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.3	174.2	-176.7	0	0	0	0	107.9	V51 T63 V75 T76 V77 V78 V274 A276	V51-V53 HydrophobicContact CG1-CG2 4.27Å; V53-T63 HydrophobicContact CG2-CG2 4.31Å; V53-V75 HydrophobicContact CG2-CG1 4Å; V53-T76 PolarHBondContact N-O 2.88Å; V53-V77 HydrophobicContact CB-CG2 4.1Å; V53-V77 HydrophobicContact CG2-CG2 4.47Å; V53-V77 WeakPolarHBondContact O-CA 3.47Å; V53-V78 PolarHBondContact O-N 3.18Å; V53-V274 HydrophobicContact CG1-CB 4.45Å; V53-V274 HydrophobicContact CG2-CB 4.35Å; V53-V274 HydrophobicContact CG2-CG2 4.48Å; V53-A276 HydrophobicContact CG1-CB 4.02Å
54	V	98.9	Very high	96.7	Very high	8 Å²	8	30.9 Å²	30.9	5%	0.048	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	110.7	179.8	-173.4	0	0	0	0	108.6	L52 V225 F228 V273 V274 A276 A277 V284	L52-V54 HydrophobicContact CD2-CG2 4.35Å; L52-V54 HydrophobicContact CG-CG2 4.35Å; V54-V225 HydrophobicContact CB-CG2 4.4Å; V54-V225 HydrophobicContact CG1-CB 4.03Å; V54-V225 HydrophobicContact CG1-CG2 3.71Å; V54-V225 HydrophobicContact CG2-CG2 3.83Å; V54-F228 HydrophobicContact CG2-CZ 4.43Å; V54-V273 HydrophobicContact CG2-CG2 3.81Å; V54-V274 PolarHBondContact N-O 2.94Å; V54-A276 CarbonylContact O-C 3.24Å; V54-A276 VanDerWaalsContact O-CA 3.31Å; V54-A276 WeakPolarHBondContact O-CA 3.21Å; V54-A276 PolarHBondContact O-N 3.05Å; V54-A277 PolarHBondContact O-N 2.92Å; V54-A277 VanDerWaalsContact O-N 3.12Å; V54-V284 HydrophobicContact CB-CG1 4.38Å; V54-V284 HydrophobicContact CG1-CG1 3.95Å; V54-V284 HydrophobicContact CG1-CG2 4.11Å
55	G	98.6	Very high	97.8	Very high	10 Å²	10	24.6 Å²	24.6	10%	0.103	12%	0.124	C	C	.	.			trans	106.8	116.8	-171.8	0	0	0	0	0	111.5	G57 G60 V78	G55-G57 VanDerWaalsContact C-N 3.35Å; G55-G60 WeakPolarHBondContact O-CA 3.11Å; G55-V78 PolarHBondContact N-O 2.78Å
56	G	97	Very high	98.2	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.112	C	C	.	.			trans	-95.4	29.8	175.5	0	0	0	0	0	113.1	W61 E79 Y84	G56-W61 PolarHBondContact O-NE1 3.15Å; G56-E79 WeakPolarHBondContact CA-OE2 3.43Å; G56-E79 PolarHBondContact N-OE2 3.25Å; G56-Y84 WeakPolarHBondContact O-CE1 3.36Å; G56-Y84 PolarHBondContact O-OH 3.37Å
57	G	97	Very high	98.3	Very high	13 Å²	13	21.8 Å²	21.8	13%	0.134	11%	0.105	C	C	.	.	S	Bend	trans	-72.7	-175.1	168.9	0	0	0	0	0	112.5	G55 I59 G60 W61	G55-G57 VanDerWaalsContact C-N 3.35Å; G57-I59 VanDerWaalsContact C-N 3.3Å; G57-I59 PolarHBondContact O-N 3.33Å; G57-G60 PolarHBondContact O-N 3.25Å; G57-G60 VanDerWaalsContact O-N 3.13Å; G57-W61 PolarHBondContact O-N 2.99Å
58	I	97.8	Very high	98.4	Very high	5 Å²	5	13.9 Å²	13.9	3%	0.026	8%	0.075	C	C	.	.	H	α-helix	trans	-57.1	-41.2	-177.9	-166.9	71.2	0	0	0	113.2	A62 T89 L205 L206 L209 A440	I58-A62 WeakPolarHBondContact O-CB 3.35Å; I58-A62 PolarHBondContact O-N 2.78Å; I58-T89 HydrophobicContact CB-CG2 3.71Å; I58-T89 WeakPolarHBondContact CB-OG1 3.32Å; I58-T89 HydrophobicContact CG2-CG2 4.2Å; I58-T89 VanDerWaalsContact CG2-OG1 3.31Å; I58-T89 WeakPolarHBondContact CG2-OG1 3.43Å; I58-T89 PolarHBondContact N-OG1 3.11Å; I58-L205 HydrophobicContact CD1-CB 4.23Å; I58-L205 HydrophobicContact CD1-CD2 3.86Å; I58-L205 HydrophobicContact CD1-CG 3.8Å; I58-L205 HydrophobicContact CG1-CD2 4.47Å; I58-L206 HydrophobicContact CD1-CB 4.13Å; I58-L206 HydrophobicContact CD1-CD1 4.45Å; I58-L209 HydrophobicContact CD1-CD1 3.54Å; I58-L209 HydrophobicContact CG1-CD1 4.37Å; I58-A440 HydrophobicContact CB-CB 4.19Å; I58-A440 HydrophobicContact CG1-CB 3.6Å; I58-A440 HydrophobicContact CG2-CB 3.73Å
59	I	98.6	Very high	98.3	Very high	15 Å²	15	12.9 Å²	12.9	8%	0.077	6%	0.062	C	C	.	.	H	α-helix	trans	-67	-44.5	178	-63.7	177.8	0	0	0	110.3	G57 W61 A62 T63 A276 C429 A440 I443	G57-I59 VanDerWaalsContact C-N 3.3Å; G57-I59 PolarHBondContact O-N 3.33Å; I59-W61 PolarHBondContact O-N 2.83Å; I59-A62 PolarHBondContact O-N 3.13Å; I59-T63 WeakPolarHBondContact O-CB 3.36Å; I59-T63 PolarHBondContact O-N 2.93Å; I59-T63 PolarHBondContact O-OG1 3.15Å; I59-T63 VanDerWaalsContact O-OG1 3.1Å; I59-A276 HydrophobicContact CG2-CB 4.44Å; I59-C429 WeakPolarHBondContact CD1-O 3.27Å; I59-C429 HydrophobicContact CG2-CB 3.81Å; I59-C429 VanDerWaalsContact CG2-SG 3.54Å; I59-A440 HydrophobicContact CG1-CB 3.98Å; I59-I443 HydrophobicContact CD1-CD1 4.2Å; I59-I443 HydrophobicContact CG2-CG2 3.82Å
60	G	98.6	Very high	98.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-59.4	-47.8	179.2	0	0	0	0	0	112.7	G55 G57 T63 A64	G55-G60 WeakPolarHBondContact O-CA 3.11Å; G57-G60 PolarHBondContact O-N 3.25Å; G57-G60 VanDerWaalsContact O-N 3.13Å; G60-T63 PolarHBondContact O-N 3.01Å; G60-A64 PolarHBondContact O-N 2.99Å
61	W	98.6	Very high	98	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-70.2	-34.8	176	-70.8	109.7	0	0	0	113.3	G56 G57 I59 A64 F65 V77 Y84 L206 L209 K210 C213 H214 V218 Y220	G56-W61 PolarHBondContact O-NE1 3.15Å; G57-W61 PolarHBondContact O-N 2.99Å; I59-W61 PolarHBondContact O-N 2.83Å; W61-A64 HydrophobicContact CE3-CB 4.39Å; W61-A64 PolarHBondContact O-N 3.45Å; W61-F65 VanDerWaalsContact O-CB 3.3Å; W61-F65 WeakPolarHBondContact O-CB 3.46Å; W61-F65 PolarHBondContact O-N 3.1Å; W61-V77 HydrophobicContact CE3-CG2 4.06Å; W61-V77 HydrophobicContact CH2-CB 4.05Å; W61-V77 HydrophobicContact CH2-CG1 4.2Å; W61-V77 HydrophobicContact CH2-CG2 4.28Å; W61-V77 HydrophobicContact CZ2-CB 4.42Å; W61-V77 HydrophobicContact CZ2-CG1 4.07Å; W61-V77 HydrophobicContact CZ3-CB 4.15Å; W61-V77 HydrophobicContact CZ3-CG1 4.49Å; W61-V77 HydrophobicContact CZ3-CG2 3.86Å; W61-Y84 PolarHBondContact NE1-OH 2.87Å; W61-Y84 VanDerWaalsContact NE1-OH 3.09Å; W61-L206 HydrophobicContact CG-CD1 4.32Å; W61-L209 HydrophobicContact CB-CB 3.94Å; W61-K210 HydrophobicContact CD2-CB 3.97Å; W61-K210 HydrophobicContact CD2-CG 4.29Å; W61-K210 HydrophobicContact CE3-CB 4.38Å; W61-K210 HydrophobicContact CG-CB 4.36Å; W61-K210 HydrophobicContact CH2-CD 4.36Å; W61-K210 HydrophobicContact CH2-CG 3.88Å; W61-K210 HydrophobicContact CZ2-CB 4.2Å; W61-K210 HydrophobicContact CZ2-CD 3.72Å; W61-K210 HydrophobicContact CZ2-CG 3.62Å; W61-K210 HydrophobicContact CZ3-CG 4.32Å; W61-C213 HydrophobicContact CE3-CB 3.62Å; W61-C213 HydrophobicContact CZ3-CB 3.72Å; W61-H214 AromaticContact CH2-CD2 3.99Å; W61-H214 AromaticContact CH2-NE2 3.63Å; W61-V218 HydrophobicContact CZ3-CG1 3.99Å; W61-Y220 AromaticContact CH2-CD2 3.63Å; W61-Y220 HydrophobicContact CH2-CD2 3.63Å; W61-Y220 HydrophobicContact CH2-CE2 4.33Å; W61-Y220 HydrophobicContact CH2-CG 4.08Å; W61-Y220 AromaticContact CZ2-CD2 3.6Å; W61-Y220 HydrophobicContact CZ2-CD2 3.6Å; W61-Y220 AromaticContact CZ2-CE2 3.82Å; W61-Y220 HydrophobicContact CZ2-CE2 3.82Å; W61-Y220 HydrophobicContact CZ2-CG 4.34Å
62	A	98.8	Very high	97.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-62.2	-43.8	172.8	0	0	0	0	0	111.4	I58 I59 F65 W66 L209 A440 I441	I58-A62 WeakPolarHBondContact O-CB 3.35Å; I58-A62 PolarHBondContact O-N 2.78Å; I59-A62 PolarHBondContact O-N 3.13Å; A62-F65 PolarHBondContact O-N 2.96Å; A62-W66 PolarHBondContact O-N 2.9Å; A62-L209 HydrophobicContact CB-CD1 4.43Å; A62-A440 VanDerWaalsContact CB-O 3.27Å; A62-A440 WeakPolarHBondContact CB-O 3.44Å; A62-I441 HydrophobicContact CB-CD1 4.25Å
63	T	98.8	Very high	97.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59	-49.2	172.2	-62.7	0	0	0	0	110.7	V53 I59 G60 F65 W66 M67 V274 G444 I447	V53-T63 HydrophobicContact CG2-CG2 4.31Å; I59-T63 WeakPolarHBondContact O-CB 3.36Å; I59-T63 PolarHBondContact O-N 2.93Å; I59-T63 PolarHBondContact O-OG1 3.15Å; I59-T63 VanDerWaalsContact O-OG1 3.1Å; G60-T63 PolarHBondContact O-N 3.01Å; T63-F65 VanDerWaalsContact C-N 3.31Å; T63-F65 PolarHBondContact O-N 2.87Å; T63-W66 PolarHBondContact O-N 3.13Å; T63-M67 HydrophobicContact CG2-CG 4.11Å; T63-M67 VanDerWaalsContact O-CB 3.32Å; T63-M67 WeakPolarHBondContact O-CB 3.48Å; T63-M67 WeakPolarHBondContact O-CG 3.45Å; T63-M67 PolarHBondContact O-N 3.14Å; T63-V274 HydrophobicContact CG2-CG1 4.34Å; T63-V274 HydrophobicContact CG2-CG2 4.17Å; T63-G444 WeakPolarHBondContact OG1-CA 3.38Å; T63-I447 HydrophobicContact CG2-CB 4.12Å; T63-I447 HydrophobicContact CG2-CG2 3.63Å
64	A	98.8	Very high	97.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.6	-41.2	-179.3	0	0	0	0	0	112.3	G60 W61 R68 V75 V77 V218	G60-A64 PolarHBondContact O-N 2.99Å; W61-A64 HydrophobicContact CE3-CB 4.39Å; W61-A64 PolarHBondContact O-N 3.45Å; A64-R68 WeakPolarHBondContact O-CB 3.41Å; A64-R68 PolarHBondContact O-N 2.72Å; A64-V75 HydrophobicContact CB-CG1 3.94Å; A64-V77 HydrophobicContact CB-CG2 3.63Å; A64-V218 HydrophobicContact CB-CG1 4.16Å; A64-V218 HydrophobicContact CB-CG2 4.16Å
65	F	98.8	Very high	97.7	Very high	2 Å²	2	28 Å²	28	1%	0.009	14%	0.135	C	C	.	.	H	α-helix	trans	-59	-55.1	176.3	168	-100.9	0	0	0	111.2	W61 A62 T63 M67 R68 R69 F115 Y122 L123 L209 K212 C213 M216	W61-F65 VanDerWaalsContact O-CB 3.3Å; W61-F65 WeakPolarHBondContact O-CB 3.46Å; W61-F65 PolarHBondContact O-N 3.1Å; A62-F65 PolarHBondContact O-N 2.96Å; T63-F65 VanDerWaalsContact C-N 3.31Å; T63-F65 PolarHBondContact O-N 2.87Å; F65-M67 PolarHBondContact O-N 2.93Å; F65-R68 PolarHBondContact O-N 3.23Å; F65-R69 VanDerWaalsContact O-CB 3.24Å; F65-R69 WeakPolarHBondContact O-CB 3.18Å; F65-R69 PolarHBondContact O-N 3.44Å; F65-F115 HydrophobicContact CD1-CE2 4.45Å; F65-F115 AromaticContact CE1-CE2 3.63Å; F65-F115 HydrophobicContact CE1-CE2 3.63Å; F65-F115 AromaticContact CE1-CZ 3.97Å; F65-F115 HydrophobicContact CE1-CZ 3.97Å; F65-F115 HydrophobicContact CZ-CE2 4.04Å; F65-F115 HydrophobicContact CZ-CZ 4.24Å; F65-Y122 WeakPolarHBondContact CE2-O 3.33Å; F65-L123 HydrophobicContact CD2-CD2 3.84Å; F65-L123 HydrophobicContact CE2-CD2 3.62Å; F65-L123 HydrophobicContact CG-CD2 4.47Å; F65-L123 HydrophobicContact CZ-CD2 4.09Å; F65-L209 HydrophobicContact CB-CD2 3.96Å; F65-L209 HydrophobicContact CD1-CD2 4.4Å; F65-L209 HydrophobicContact CG-CD2 4.07Å; F65-K212 HydrophobicContact CD2-CG 3.92Å; F65-K212 HydrophobicContact CE2-CG 3.88Å; F65-C213 VanDerWaalsContact CA-SG 3.55Å; F65-C213 PolarHBondContact N-SG 3.26Å; F65-C213 VanDerWaalsContact N-SG 3.39Å; F65-M216 HydrophobicContact CD2-SD 4.08Å; F65-M216 HydrophobicContact CE2-SD 4.27Å
66	W	98.7	Very high	97.7	Very high	9 Å²	9	27.6 Å²	27.6	3%	0.034	13%	0.13	C	C	.	.	H	α-helix	trans	-65.7	-39.5	-178.6	-73.6	117.3	0	0	0	112.4	A62 T63 R68 R69 D70 F111 F115 I441 G444 K445 S448	A62-W66 PolarHBondContact O-N 2.9Å; T63-W66 PolarHBondContact O-N 3.13Å; W66-R68 PolarHBondContact O-N 3.2Å; W66-R69 VanDerWaalsContact CH2-NH1 3.27Å; W66-R69 PolarHBondContact O-N 3.17Å; W66-D70 WeakPolarHBondContact O-CB 3.46Å; W66-D70 PolarHBondContact O-N 3.44Å; W66-F111 AromaticContact CH2-CZ 4Å; W66-F111 HydrophobicContact CH2-CZ 4Å; W66-F111 AromaticContact CZ2-CE1 3.91Å; W66-F111 HydrophobicContact CZ2-CE1 3.91Å; W66-F111 AromaticContact CZ2-CZ 3.64Å; W66-F111 HydrophobicContact CZ2-CZ 3.64Å; W66-F115 HydrophobicContact CH2-CD2 4.3Å; W66-F115 HydrophobicContact CH2-CE2 4.35Å; W66-F115 AromaticContact CZ2-CD2 3.8Å; W66-F115 HydrophobicContact CZ2-CD2 3.8Å; W66-F115 AromaticContact CZ2-CE2 3.87Å; W66-F115 HydrophobicContact CZ2-CE2 3.87Å; W66-I441 HydrophobicContact CZ2-CG2 4.07Å; W66-I441 PolarHBondContact NE1-O 2.89Å; W66-G444 VanDerWaalsContact CD1-C 3.45Å; W66-K445 HydrophobicContact CD2-CB 4.15Å; W66-K445 HydrophobicContact CD2-CD 3.59Å; W66-K445 HydrophobicContact CD2-CG 4.46Å; W66-K445 HydrophobicContact CE3-CD 3.58Å; W66-K445 HydrophobicContact CG-CB 4.07Å; W66-K445 HydrophobicContact CG-CD 4.02Å; W66-K445 HydrophobicContact CH2-CD 4.34Å; W66-K445 HydrophobicContact CZ2-CD 4.36Å; W66-K445 HydrophobicContact CZ3-CD 3.96Å; W66-S448 VanDerWaalsContact C-OG 3.31Å; W66-S448 PolarHBondContact O-OG 3.16Å
67	M	98.3	Very high	97.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57	-50.1	174.2	-76.8	-61.6	-40	0	0	111	V51 T63 F65 R69 S71 F73 V75 S448 I451	V51-M67 HydrophobicContact CG2-CE 3.62Å; V51-M67 HydrophobicContact CG2-SD 4.42Å; T63-M67 HydrophobicContact CG2-CG 4.11Å; T63-M67 VanDerWaalsContact O-CB 3.32Å; T63-M67 WeakPolarHBondContact O-CB 3.48Å; T63-M67 WeakPolarHBondContact O-CG 3.45Å; T63-M67 PolarHBondContact O-N 3.14Å; F65-M67 PolarHBondContact O-N 2.93Å; M67-R69 VanDerWaalsContact C-N 3.34Å; M67-R69 PolarHBondContact O-N 3.01Å; M67-S71 WeakPolarHBondContact O-CB 3.41Å; M67-S71 PolarHBondContact O-N 3.09Å; M67-S71 VanDerWaalsContact O-N 3.07Å; M67-S71 PolarHBondContact O-OG 3.14Å; M67-F73 HydrophobicContact CE-CB 4.18Å; M67-F73 HydrophobicContact CE-CD2 3.48Å; M67-F73 VanDerWaalsContact CE-CD2 3.48Å; M67-F73 HydrophobicContact CE-CE2 4.34Å; M67-F73 HydrophobicContact CE-CG 4.29Å; M67-V75 HydrophobicContact CB-CG2 3.7Å; M67-S448 WeakPolarHBondContact CA-OG 3.33Å; M67-S448 PolarHBondContact N-OG 3.35Å; M67-S448 WeakPolarHBondContact SD-CA 3.32Å; M67-I451 HydrophobicContact CE-CB 4.37Å; M67-I451 HydrophobicContact CE-CG2 3.86Å; M67-I451 HydrophobicContact SD-CB 3.97Å; M67-I451 HydrophobicContact SD-CD1 3.96Å; M67-I451 HydrophobicContact SD-CG2 4.1Å
68	R	97.2	Very high	97.9	Very high	52 Å²	52	27.1 Å²	27.1	20%	0.196	13%	0.125	C	C	.	.	H	α-helix	trans	-71.2	-28.5	-179.9	-75.4	-59.7	-60.7	108.3	12.5	113.6	A64 F65 W66 S71 F73 V75 M216 V218	A64-R68 WeakPolarHBondContact O-CB 3.41Å; A64-R68 PolarHBondContact O-N 2.72Å; F65-R68 PolarHBondContact O-N 3.23Å; W66-R68 PolarHBondContact O-N 3.2Å; R68-S71 PolarHBondContact NH1-O 2.95Å; R68-S71 VanDerWaalsContact O-O 3.09Å; R68-F73 VanDerWaalsContact CD-O 3.27Å; R68-F73 WeakPolarHBondContact CD-O 3.23Å; R68-F73 PolarHBondContact NH1-O 3.45Å; R68-V75 HydrophobicContact CG-CB 4.27Å; R68-V75 HydrophobicContact CG-CG2 3.9Å; R68-M216 VanDerWaalsContact C-CE 3.45Å; R68-M216 HydrophobicContact CB-CB 4.14Å; R68-M216 HydrophobicContact CB-CE 3.69Å; R68-M216 PolarHBondContact NE-O 2.92Å; R68-M216 PolarHBondContact NH2-O 3.27Å; R68-V218 HydrophobicContact CB-CG2 4.4Å; R68-V218 HydrophobicContact CG-CG2 3.35Å
69	R	96.1	Very high	97.9	Very high	100 Å²	100	27.7 Å²	27.7	38%	0.377	13%	0.127	S	C	.	.	H	α-helix	trans	-72.6	-48.5	179.7	-175	-176.2	-176.2	165.7	8.1	111.5	F65 W66 M67 Y122 M216	F65-R69 VanDerWaalsContact O-CB 3.24Å; F65-R69 WeakPolarHBondContact O-CB 3.18Å; F65-R69 PolarHBondContact O-N 3.44Å; W66-R69 VanDerWaalsContact CH2-NH1 3.27Å; W66-R69 PolarHBondContact O-N 3.17Å; M67-R69 VanDerWaalsContact C-N 3.34Å; M67-R69 PolarHBondContact O-N 3.01Å; R69-Y122 VanDerWaalsContact CZ-CE1 3.49Å; R69-M216 VanDerWaalsContact CA-CE 3.44Å; R69-M216 HydrophobicContact CB-CE 3.83Å; R69-M216 VanDerWaalsContact N-CE 3.32Å
70	D	95.6	Very high	97.7	Very high	57 Å²	57	30.8 Å²	30.8	31%	0.305	14%	0.14	S	C	.	.	H	α-helix	trans	-94.4	-10.7	-169.2	-59.8	-27.9	0	0	0	112.7	W66 K445	W66-D70 WeakPolarHBondContact O-CB 3.46Å; W66-D70 PolarHBondContact O-N 3.44Å; D70-K445 IonicContact OD1-NZ 3.97Å; D70-K445 IonicContact OD2-NZ 3.26Å; D70-K445 PolarHBondContact OD2-NZ 3.42Å
71	S	95.9	Very high	97.5	Very high	13 Å²	13	32 Å²	32	9%	0.091	15%	0.147	C	C	.	.			trans	-135.6	172.3	-179.9	86.9	0	0	0	0	112.9	M67 R68 F73	M67-S71 WeakPolarHBondContact O-CB 3.41Å; M67-S71 PolarHBondContact O-N 3.09Å; M67-S71 VanDerWaalsContact O-N 3.07Å; M67-S71 PolarHBondContact O-OG 3.14Å; R68-S71 PolarHBondContact NH1-O 2.95Å; R68-S71 VanDerWaalsContact O-O 3.09Å; S71-F73 WeakPolarHBondContact OG-CB 3.13Å; S71-F73 WeakPolarHBondContact OG-CD2 3.41Å; S71-F73 PolarHBondContact OG-N 2.88Å; S71-F73 VanDerWaalsContact OG-N 3.15Å
72	K	94.8	Very high	97.2	Very high	193 Å²	193	35.1 Å²	35.1	84%	0.839	17%	0.167	S	C	*	.			trans	-100.5	8.4	170.8	-58.8	-55.8	-177.2	-168.5	0	112.9
73	F	97.4	Very high	96.9	Very high	75 Å²	75	39.9 Å²	39.9	33%	0.329	20%	0.196	S	C	.	.			trans	-61.8	140.4	178.8	-64.9	-44	0	0	0	110.9	D50 M67 R68 S71 T452	D50-F73 HydrophobicContact CB-CB 3.77Å; D50-F73 HydrophobicContact CB-CD1 3.94Å; D50-F73 HydrophobicContact CB-CG 4.11Å; D50-F73 WeakPolarHBondContact OD2-CA 3.48Å; M67-F73 HydrophobicContact CE-CB 4.18Å; M67-F73 HydrophobicContact CE-CD2 3.48Å; M67-F73 VanDerWaalsContact CE-CD2 3.48Å; M67-F73 HydrophobicContact CE-CE2 4.34Å; M67-F73 HydrophobicContact CE-CG 4.29Å; R68-F73 VanDerWaalsContact CD-O 3.27Å; R68-F73 WeakPolarHBondContact CD-O 3.23Å; R68-F73 PolarHBondContact NH1-O 3.45Å; S71-F73 WeakPolarHBondContact OG-CB 3.13Å; S71-F73 WeakPolarHBondContact OG-CD2 3.41Å; S71-F73 PolarHBondContact OG-N 2.88Å; S71-F73 VanDerWaalsContact OG-N 3.15Å; F73-T452 HydrophobicContact CE2-CG2 4.47Å
74	S	98	Very high	96.6	Very high	45 Å²	45	40.5 Å²	40.5	32%	0.315	20%	0.199	S	C	.	.			trans	-70.9	132.5	165.9	55.6	0	0	0	0	109.2	T49 D50 V51	T49-S74 PolarHBondContact OG1-O 2.92Å; D50-S74 WeakPolarHBondContact CB-O 3.18Å; D50-S74 VanDerWaalsContact CG-OG 3.3Å; D50-S74 PolarHBondContact N-O 3.41Å; D50-S74 PolarHBondContact N-OG 2.9Å; D50-S74 PolarHBondContact OD2-N 3.24Å; D50-S74 PolarHBondContact OD2-OG 3.08Å; V51-S74 PolarHBondContact N-O 2.77Å
75	V	98.7	Very high	96.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	132.9	-177.9	-173.5	0	0	0	0	108.4	V51 V53 A64 M67 R68 V218 N219	V51-V75 HydrophobicContact CB-CG2 4.44Å; V51-V75 WeakPolarHBondContact O-CA 3.47Å; V53-V75 HydrophobicContact CG2-CG1 4Å; A64-V75 HydrophobicContact CB-CG1 3.94Å; M67-V75 HydrophobicContact CB-CG2 3.7Å; R68-V75 HydrophobicContact CG-CB 4.27Å; R68-V75 HydrophobicContact CG-CG2 3.9Å; V75-V218 HydrophobicContact CB-CG1 4.39Å; V75-V218 HydrophobicContact CB-CG2 4.37Å; V75-V218 HydrophobicContact CG1-CG1 4.31Å; V75-N219 PolarHBondContact O-N 3.47Å
76	T	98.5	Very high	95.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.2	175.1	-56.8	0	0	0	0	108.8	P46 T49 V51 L52 V53 V78 N219 V221 I268	P46-T76 HydrophobicContact CG-CG2 3.93Å; P46-T76 WeakPolarHBondContact CG-OG1 3.41Å; T49-T76 VanDerWaalsContact CB-OG1 3.24Å; T49-T76 WeakPolarHBondContact CB-OG1 3.47Å; T49-T76 PolarHBondContact OG1-N 2.85Å; T49-T76 PolarHBondContact OG1-OG1 2.96Å; V51-T76 PolarHBondContact O-N 2.7Å; L52-T76 CarbonylContact C-O 3.56Å; L52-T76 WeakPolarHBondContact CA-O 3.28Å; L52-T76 HydrophobicContact CD1-CG2 4.15Å; V53-T76 PolarHBondContact N-O 2.88Å; T76-V78 HydrophobicContact CG2-CG2 4.49Å; T76-N219 CarbonylContact C-O 3.55Å; T76-N219 WeakPolarHBondContact CA-O 3.32Å; T76-N219 HydrophobicContact CG2-CB 4.06Å; T76-N219 PolarHBondContact OG1-ND2 3.18Å; T76-V221 HydrophobicContact CG2-CG2 3.8Å; T76-I268 HydrophobicContact CG2-CD1 4.42Å
77	V	98.7	Very high	95.4	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.8	174.7	179.6	0	0	0	0	108.1	V53 W61 A64 V218 N219 V221	V53-V77 HydrophobicContact CB-CG2 4.1Å; V53-V77 HydrophobicContact CG2-CG2 4.47Å; V53-V77 WeakPolarHBondContact O-CA 3.47Å; W61-V77 HydrophobicContact CE3-CG2 4.06Å; W61-V77 HydrophobicContact CH2-CB 4.05Å; W61-V77 HydrophobicContact CH2-CG1 4.2Å; W61-V77 HydrophobicContact CH2-CG2 4.28Å; W61-V77 HydrophobicContact CZ2-CB 4.42Å; W61-V77 HydrophobicContact CZ2-CG1 4.07Å; W61-V77 HydrophobicContact CZ3-CB 4.15Å; W61-V77 HydrophobicContact CZ3-CG1 4.49Å; W61-V77 HydrophobicContact CZ3-CG2 3.86Å; A64-V77 HydrophobicContact CB-CG2 3.63Å; V77-V218 HydrophobicContact CB-CG1 4.46Å; V77-V218 HydrophobicContact CG2-CG1 3.7Å; V77-N219 PolarHBondContact N-O 3.18Å; V77-V221 PolarHBondContact O-N 3.08Å
78	V	98.4	Very high	95.2	Very high	3 Å²	3	50 Å²	50	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.2	174.9	178.8	0	0	0	0	108.6	L52 V53 G55 T76 V221 G223 V225 V258 I268	L52-V78 HydrophobicContact CD1-CG2 3.65Å; V53-V78 PolarHBondContact O-N 3.18Å; G55-V78 PolarHBondContact N-O 2.78Å; T76-V78 HydrophobicContact CG2-CG2 4.49Å; V78-V221 WeakPolarHBondContact CA-O 3.42Å; V78-V221 HydrophobicContact CG2-CB 4.17Å; V78-G223 WeakPolarHBondContact CG1-O 3.14Å; V78-V225 HydrophobicContact CB-CG2 4.4Å; V78-V225 HydrophobicContact CG1-CG2 4.02Å; V78-V258 HydrophobicContact CG1-CG1 3.88Å; V78-V258 HydrophobicContact CG1-CG2 4.41Å; V78-V258 HydrophobicContact CG2-CG2 4.25Å; V78-I268 HydrophobicContact CG2-CD1 4.36Å
79	E	97.5	Very high	95	Very high	18 Å²	18	48 Å²	48	8%	0.084	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128	176.6	176.4	49.2	-104.2	0	0	109.7	G56 D81 Y84 Y220 V221 V222 G223	G56-E79 WeakPolarHBondContact CA-OE2 3.43Å; G56-E79 PolarHBondContact N-OE2 3.25Å; E79-D81 WeakPolarHBondContact CG-O 3.43Å; E79-D81 PolarHBondContact OE1-N 3.36Å; E79-Y84 HydrophobicContact CG-CE1 4.05Å; E79-Y220 HydrophobicContact CB-CE2 3.65Å; E79-Y220 HydrophobicContact CG-CE2 4.49Å; E79-V221 PolarHBondContact N-O 3.4Å; E79-V222 CarbonylContact O-C 3.3Å; E79-V222 VanDerWaalsContact O-CA 3.3Å; E79-V222 WeakPolarHBondContact O-CA 3.26Å; E79-G223 CarbonylContact C-O 3.52Å; E79-G223 VanDerWaalsContact C-O 3.24Å; E79-G223 PolarHBondContact O-N 2.97Å
80	K	95.7	Very high	94.8	Very high	80 Å²	80	45.8 Å²	45.8	35%	0.348	25%	0.247	S	C	.	.	S	Bend	trans	-81.2	-29.2	-177.9	67.5	178.5	-175	176.5	0	113.1	G223 E224	K80-G223 VanDerWaalsContact CA-O 3.23Å; K80-G223 WeakPolarHBondContact CA-O 3.35Å; K80-G223 PolarHBondContact N-O 2.92Å; K80-E224 HydrophobicContact CB-CB 3.94Å; K80-E224 HydrophobicContact CB-CG 4.41Å; K80-E224 HydrophobicContact CD-CG 4.4Å; K80-E224 IonicContact NZ-OE1 2.7Å
81	D	94.3	Very high	94.7	Very high	26 Å²	26	45.1 Å²	45.1	14%	0.139	24%	0.243	C	C	.	.			trans	-120.8	96.9	-179.7	178.7	7.5	0	0	0	110.7	E79 T83 Y84 S85 Q86	E79-D81 WeakPolarHBondContact CG-O 3.43Å; E79-D81 PolarHBondContact OE1-N 3.36Å; D81-T83 PolarHBondContact O-N 2.89Å; D81-T83 WeakPolarHBondContact OD1-CA 3.46Å; D81-T83 WeakPolarHBondContact OD1-CB 3.29Å; D81-T83 PolarHBondContact OD1-N 3.35Å; D81-T83 PolarHBondContact OD1-OG1 3.14Å; D81-Y84 PolarHBondContact O-N 3.47Å; D81-Y84 VanDerWaalsContact O-N 3.14Å; D81-Y84 PolarHBondContact OD1-N 3.02Å; D81-S85 WeakPolarHBondContact OD2-CB 3.29Å; D81-S85 PolarHBondContact OD2-N 2.82Å; D81-S85 PolarHBondContact OD2-OG 2.91Å; D81-Q86 PolarHBondContact OD2-N 3.5Å
82	P	91.5	Very high	94.6	Very high	65 Å²	65	45.3 Å²	45.3	42%	0.422	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.2	179.9	30.4	-35.5	0	0	0	113.4	V222	P82-V222 HydrophobicContact CB-CG1 4.22Å; P82-V222 HydrophobicContact CB-CG2 4.17Å; P82-V222 HydrophobicContact CG-CG1 3.85Å
83	T	92.8	Very high	94.6	Very high	100 Å²	100	37.6 Å²	37.6	61%	0.613	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-12.3	176.3	72.8	0	0	0	0	112.8	D81 S85	D81-T83 PolarHBondContact O-N 2.89Å; D81-T83 WeakPolarHBondContact OD1-CA 3.46Å; D81-T83 WeakPolarHBondContact OD1-CB 3.29Å; D81-T83 PolarHBondContact OD1-N 3.35Å; D81-T83 PolarHBondContact OD1-OG1 3.14Å; T83-S85 PolarHBondContact O-N 2.87Å; T83-S85 WeakPolarHBondContact OG1-CB 3.47Å; T83-S85 PolarHBondContact OG1-N 2.97Å
84	Y	92.7	Very high	94.4	Very high	13 Å²	13	34.1 Å²	34.1	5%	0.051	20%	0.2	C	C	.	.			trans	57	24.5	-175.6	-59.1	-68.9	0	0	0	114.3	G56 W61 E79 D81 Q86 S87 V90 L206	G56-Y84 WeakPolarHBondContact O-CE1 3.36Å; G56-Y84 PolarHBondContact O-OH 3.37Å; W61-Y84 PolarHBondContact NE1-OH 2.87Å; W61-Y84 VanDerWaalsContact NE1-OH 3.09Å; E79-Y84 HydrophobicContact CG-CE1 4.05Å; D81-Y84 PolarHBondContact O-N 3.47Å; D81-Y84 VanDerWaalsContact O-N 3.14Å; D81-Y84 PolarHBondContact OD1-N 3.02Å; Y84-Q86 PolarHBondContact O-N 3.4Å; Y84-S87 VanDerWaalsContact O-CB 3.27Å; Y84-S87 WeakPolarHBondContact O-CB 3.5Å; Y84-S87 PolarHBondContact O-N 3.42Å; Y84-V90 HydrophobicContact CG-CG2 4.23Å; Y84-L206 HydrophobicContact CD1-CD2 4.2Å; Y84-L206 HydrophobicContact CD2-CD2 4.07Å; Y84-L206 HydrophobicContact CE1-CD2 4.14Å; Y84-L206 HydrophobicContact CE2-CD2 3.97Å; Y84-L206 HydrophobicContact CG-CD2 4.16Å
85	S	90.2	Very high	94.2	Very high	69 Å²	69	32.8 Å²	32.8	48%	0.483	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.5	-175.5	66.1	0	0	0	0	113.6	D81 T83	D81-S85 WeakPolarHBondContact OD2-CB 3.29Å; D81-S85 PolarHBondContact OD2-N 2.82Å; D81-S85 PolarHBondContact OD2-OG 2.91Å; T83-S85 PolarHBondContact O-N 2.87Å; T83-S85 WeakPolarHBondContact OG1-CB 3.47Å; T83-S85 PolarHBondContact OG1-N 2.97Å
86	Q	89.5	Confident	94.2	Very high	108 Å²	108	32.8 Å²	32.8	51%	0.505	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-0.2	176.3	-58	-175.6	37.5	0	0	112.8	D81 Y84 A88 W280	D81-Q86 PolarHBondContact OD2-N 3.5Å; Y84-Q86 PolarHBondContact O-N 3.4Å; Q86-A88 PolarHBondContact O-N 3.3Å; Q86-W280 HydrophobicContact CB-CH2 3.63Å; Q86-W280 HydrophobicContact CB-CZ2 3.71Å; Q86-W280 WeakPolarHBondContact O-CH2 3.07Å
87	S	91.6	Very high	94.1	Very high	12 Å²	12	33.1 Å²	33.1	8%	0.084	19%	0.192	C	C	.	.			trans	-66.9	126.5	-170.8	-180	0	0	0	0	111.8	Y84 T89 V90 L91	Y84-S87 VanDerWaalsContact O-CB 3.27Å; Y84-S87 WeakPolarHBondContact O-CB 3.5Å; Y84-S87 PolarHBondContact O-N 3.42Å; S87-T89 PolarHBondContact O-N 2.96Å; S87-T89 VanDerWaalsContact O-N 3.13Å; S87-T89 WeakPolarHBondContact OG-CB 3.41Å; S87-T89 PolarHBondContact OG-N 3.04Å; S87-V90 PolarHBondContact O-N 3.39Å; S87-L91 WeakPolarHBondContact O-CB 3.16Å; S87-L91 WeakPolarHBondContact O-CG 3.29Å; S87-L91 PolarHBondContact O-N 3.09Å
88	A	93.6	Very high	94.1	Very high	22 Å²	22	33.1 Å²	33.1	18%	0.182	19%	0.192	C	C	.	.	H	α-helix	trans	-54.3	-30.3	170.8	0	0	0	0	0	112.6	Q86 G92 P279 V405	Q86-A88 PolarHBondContact O-N 3.3Å; A88-G92 WeakPolarHBondContact O-CA 3.49Å; A88-G92 PolarHBondContact O-N 3.07Å; A88-P279 HydrophobicContact CB-CG 3.96Å; A88-V405 WeakPolarHBondContact CA-O 3.41Å; A88-V405 HydrophobicContact CB-CG1 4.21Å; A88-V405 WeakPolarHBondContact CB-O 3.42Å
89	T	93.7	Very high	94.1	Very high	8 Å²	8	33.2 Å²	33.2	5%	0.049	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-47.7	175.7	-59	0	0	0	0	111.9	I58 S87 P202 L206	I58-T89 HydrophobicContact CB-CG2 3.71Å; I58-T89 WeakPolarHBondContact CB-OG1 3.32Å; I58-T89 HydrophobicContact CG2-CG2 4.2Å; I58-T89 VanDerWaalsContact CG2-OG1 3.31Å; I58-T89 WeakPolarHBondContact CG2-OG1 3.43Å; I58-T89 PolarHBondContact N-OG1 3.11Å; S87-T89 PolarHBondContact O-N 2.96Å; S87-T89 VanDerWaalsContact O-N 3.13Å; S87-T89 WeakPolarHBondContact OG-CB 3.41Å; S87-T89 PolarHBondContact OG-N 3.04Å; T89-P202 HydrophobicContact CG2-CB 3.93Å; T89-P202 VanDerWaalsContact O-CB 3.26Å; T89-P202 WeakPolarHBondContact O-CB 3.31Å; T89-L206 HydrophobicContact CG2-CB 4.1Å; T89-L206 HydrophobicContact CG2-CD1 4.44Å; T89-L206 HydrophobicContact CG2-CD2 4.05Å; T89-L206 HydrophobicContact CG2-CG 4.44Å
90	V	92.4	Very high	94.1	Very high	54 Å²	54	32.4 Å²	32.4	33%	0.327	19%	0.188	S	C	.	.	H	α-helix	trans	-83.4	-34.5	-172.6	178.8	0	0	0	0	111.6	Y84 S87 G92 F203 L206	Y84-V90 HydrophobicContact CG-CG2 4.23Å; S87-V90 PolarHBondContact O-N 3.39Å; V90-G92 VanDerWaalsContact C-N 3.32Å; V90-F203 HydrophobicContact CG2-CB 4.44Å; V90-F203 HydrophobicContact CG2-CD2 3.79Å; V90-L206 HydrophobicContact CG2-CD2 4.07Å
91	L	93	Very high	94.1	Very high	44 Å²	44	29.4 Å²	29.4	23%	0.23	18%	0.177	C	C	.	.	H	α-helix	trans	-79.1	-18.7	175.7	-61.7	176	0	0	0	112.4	S87 W402 S404 V405	S87-L91 WeakPolarHBondContact O-CB 3.16Å; S87-L91 WeakPolarHBondContact O-CG 3.29Å; S87-L91 PolarHBondContact O-N 3.09Å; L91-W402 PolarHBondContact O-NE1 2.94Å; L91-S404 WeakPolarHBondContact O-CB 3.29Å; L91-V405 HydrophobicContact CD1-CG1 4.11Å
92	G	92.6	Very high	94.2	Very high	16 Å²	16	29.1 Å²	29.1	17%	0.165	18%	0.175	C	C	.	.	S	Bend	trans	-82.8	170.9	179.2	0	0	0	0	0	113.8	A88 V90	A88-G92 WeakPolarHBondContact O-CA 3.49Å; A88-G92 PolarHBondContact O-N 3.07Å; V90-G92 VanDerWaalsContact C-N 3.32Å
93	L	94.8	Very high	94.5	Very high	32 Å²	32	28 Å²	28	17%	0.168	17%	0.168	C	C	.	.			trans	-99.3	147.6	171.6	-63.2	167.6	0	0	0	109.8	I308 I352 Y354 W402	L93-I308 HydrophobicContact CD1-CD1 3.86Å; L93-I308 HydrophobicContact CD1-CG1 4.43Å; L93-I308 HydrophobicContact CD1-CG2 4.45Å; L93-I308 HydrophobicContact CD2-CD1 4.44Å; L93-I308 HydrophobicContact CG-CD1 3.83Å; L93-I352 HydrophobicContact CD1-CG2 3.68Å; L93-I352 HydrophobicContact CD2-CD1 4Å; L93-I352 HydrophobicContact CD2-CG2 3.99Å; L93-I352 HydrophobicContact CG-CG2 4.5Å; L93-Y354 HydrophobicContact CD1-CD1 3.6Å; L93-Y354 HydrophobicContact CD1-CE1 3.3Å; L93-W402 HydrophobicContact CD2-CH2 4.21Å; L93-W402 HydrophobicContact CD2-CZ2 3.78Å
94	G	93.6	Very high	94.7	Very high	2 Å²	2	24 Å²	24	2%	0.021	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	81.6	179.3	0	0	0	0	0	111.5	W199 F200	G94-W199 CarbonylContact O-C 3.59Å; G94-W199 WeakPolarHBondContact O-CA 3.27Å; G94-W199 WeakPolarHBondContact O-CB 3.12Å; G94-F200 WeakPolarHBondContact CA-O 3.34Å; G94-F200 VanDerWaalsContact O-CD1 3.29Å; G94-F200 WeakPolarHBondContact O-CD1 3.5Å; G94-F200 PolarHBondContact O-N 3.32Å
95	S	95.3	Very high	95	Very high	16 Å²	16	23.4 Å²	23.4	11%	0.112	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	154.8	169.2	62.5	0	0	0	0	111.2	G198 Q438	S95-G198 CarbonylContact C-O 3.57Å; S95-G198 WeakPolarHBondContact CA-O 3.23Å; S95-Q438 WeakPolarHBondContact O-CB 3.45Å
96	I	97.5	Very high	95.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.5	172.8	-170.9	159.1	0	0	0	109.6	I113 L116 F136 E197 G198 F200 Q438	I96-I113 HydrophobicContact CD1-CB 3.66Å; I96-I113 HydrophobicContact CD1-CD1 4.17Å; I96-I113 HydrophobicContact CD1-CG1 4.46Å; I96-I113 HydrophobicContact CG1-CB 4.46Å; I96-I113 HydrophobicContact CG2-CD1 3.99Å; I96-L116 HydrophobicContact CD1-CD1 3.87Å; I96-F136 HydrophobicContact CG2-CE2 3.73Å; I96-F136 HydrophobicContact CG2-CZ 4.24Å; I96-E197 CarbonylContact O-C 3.51Å; I96-E197 WeakPolarHBondContact O-CA 3.42Å; I96-E197 WeakPolarHBondContact O-CB 3.39Å; I96-G198 PolarHBondContact N-O 2.8Å; I96-G198 PolarHBondContact O-N 2.83Å; I96-F200 HydrophobicContact CB-CE1 4.38Å; I96-Q438 HydrophobicContact CB-CB 4.34Å; I96-Q438 HydrophobicContact CG1-CB 4.31Å
97	R	97.5	Very high	95.8	Very high	8 Å²	8	18.2 Å²	18.2	3%	0.03	11%	0.108	C	C	.	.			trans	-141.6	159	177.3	61.3	178.4	175.7	83.7	-0.9	110.6	Q99 F100 S109 C141 E197 H435 Q438	R97-Q99 PolarHBondContact NH1-O 3.45Å; R97-F100 HydrophobicContact CG-CE2 3.91Å; R97-F100 HydrophobicContact CG-CZ 4.13Å; R97-F100 VanDerWaalsContact CZ-CE1 3.48Å; R97-F100 VanDerWaalsContact NH1-CD1 3.32Å; R97-F100 WeakPolarHBondContact O-CE2 3.24Å; R97-S109 WeakPolarHBondContact O-CB 3.24Å; R97-S109 PolarHBondContact O-OG 3.35Å; R97-C141 HydrophobicContact CB-CB 4.32Å; R97-E197 WeakPolarHBondContact CA-OE1 3.3Å; R97-E197 HydrophobicContact CB-CG 4.35Å; R97-E197 WeakPolarHBondContact CB-OE1 3.17Å; R97-H435 PolarHBondContact NH2-CE1 2.94Å; R97-Q438 VanDerWaalsContact N-OE1 3.09Å; R97-Q438 PolarHBondContact O-OE1 2.88Å; R97-Q438 VanDerWaalsContact O-OE1 3.05Å
98	Q	97.6	Very high	96.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.104	C	C	.	.			trans	-109.2	-4.6	171.8	-63.5	81.1	64.2	0	0	111.8	F100 I106 L110 A165 E195 N196 E197	Q98-F100 VanDerWaalsContact C-N 3.3Å; Q98-F100 PolarHBondContact O-N 3.02Å; Q98-I106 HydrophobicContact CB-CG2 4.44Å; Q98-I106 WeakPolarHBondContact O-CG1 3.5Å; Q98-L110 HydrophobicContact CG-CD2 3.8Å; Q98-L110 HydrophobicContact CG-CG 4Å; Q98-A165 HydrophobicContact CB-CB 3.64Å; Q98-A165 HydrophobicContact CG-CB 4.35Å; Q98-E195 PolarHBondContact OE1-O 2.82Å; Q98-N196 PolarHBondContact NE2-O 2.97Å; Q98-E197 PolarHBondContact N-OE1 2.85Å
99	Q	97.8	Very high	96.4	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.019	10%	0.095	C	C	.	.			trans	-76.3	73	-177.5	-68.2	-179.2	68.2	0	0	113.3	R97 C141 I143 V167 C191 E197	R97-Q99 PolarHBondContact NH1-O 3.45Å; Q99-C141 PolarHBondContact NE2-O 3.46Å; Q99-I143 HydrophobicContact CB-CD1 3.49Å; Q99-I143 VanDerWaalsContact CB-CD1 3.49Å; Q99-I143 HydrophobicContact CB-CG1 4.48Å; Q99-I143 HydrophobicContact CG-CD1 4.25Å; Q99-V167 HydrophobicContact CG-CG1 3.65Å; Q99-C191 PolarHBondContact NE2-O 2.96Å; Q99-C191 VanDerWaalsContact OE1-CB 3.22Å; Q99-C191 PolarHBondContact OE1-O 3.17Å; Q99-C191 PolarHBondContact OE1-SG 3.37Å; Q99-E197 WeakPolarHBondContact CG-OE1 3.49Å; Q99-E197 PolarHBondContact N-OE1 3.03Å; Q99-E197 PolarHBondContact NE2-OE2 2.71Å
100	F	97.5	Very high	96.6	Very high	1 Å²	1	18.1 Å²	18.1	0%	0.004	10%	0.103	C	C	.	.			trans	-116.4	171.3	174.6	-67.2	-87.3	0	0	0	110.9	R97 Q98 N105 I106 S109 Q160 H435 H439 E477	R97-F100 HydrophobicContact CG-CE2 3.91Å; R97-F100 HydrophobicContact CG-CZ 4.13Å; R97-F100 VanDerWaalsContact CZ-CE1 3.48Å; R97-F100 VanDerWaalsContact NH1-CD1 3.32Å; R97-F100 WeakPolarHBondContact O-CE2 3.24Å; Q98-F100 VanDerWaalsContact C-N 3.3Å; Q98-F100 PolarHBondContact O-N 3.02Å; F100-N105 HydrophobicContact CB-CB 3.78Å; F100-N105 HydrophobicContact CD1-CB 3.83Å; F100-N105 HydrophobicContact CD2-CB 4.1Å; F100-N105 HydrophobicContact CE1-CB 4.42Å; F100-N105 HydrophobicContact CG-CB 3.65Å; F100-I106 HydrophobicContact CB-CG1 3.83Å; F100-S109 WeakPolarHBondContact CE2-OG 3.31Å; F100-Q160 PolarHBondContact O-NE2 2.9Å; F100-H435 AromaticContact CE1-CD2 3.68Å; F100-H435 AromaticContact CE1-CE1 3.88Å; F100-H435 AromaticContact CE1-CG 3.9Å; F100-H435 AromaticContact CE1-NE2 3.64Å; F100-H439 AromaticContact CE2-NE2 3.89Å; F100-H439 AromaticContact CZ-CE1 3.9Å; F100-H439 AromaticContact CZ-NE2 3.93Å; F100-E477 WeakPolarHBondContact CA-OE1 3.44Å; F100-E477 WeakPolarHBondContact CB-OE1 3.36Å; F100-E477 HydrophobicContact CD1-CG 4.33Å; F100-E477 VanDerWaalsContact CD1-OE1 3.31Å; F100-E477 WeakPolarHBondContact CD1-OE1 3.38Å
101	S	96.9	Very high	96.9	Very high	17 Å²	17	17.7 Å²	17.7	12%	0.119	10%	0.097	C	C	.	.	S	Bend	trans	-101.6	-18.8	173	72	0	0	0	0	112.9	N156 L159 E477 V478	S101-N156 VanDerWaalsContact CB-OD1 3.24Å; S101-N156 WeakPolarHBondContact CB-OD1 3.43Å; S101-L159 WeakPolarHBondContact O-CD2 3.5Å; S101-E477 PolarHBondContact N-OE1 2.91Å; S101-E477 WeakPolarHBondContact OG-CA 3.34Å; S101-E477 PolarHBondContact OG-OE1 3.4Å; S101-V478 PolarHBondContact OG-N 3.22Å
102	E	96.6	Very high	97.2	Very high	21 Å²	21	15.6 Å²	15.6	10%	0.098	9%	0.086	C	C	.	.	S	Bend	trans	-96.1	126.4	177.3	-67.5	-69.7	178.2	0	0	111.5	E104 N105 I106 R463 V475 N476 E477	E102-E104 PolarHBondContact O-N 2.86Å; E102-E104 VanDerWaalsContact O-N 3.15Å; E102-N105 HydrophobicContact CB-CB 4.35Å; E102-N105 PolarHBondContact O-N 3.44Å; E102-I106 WeakPolarHBondContact O-CG1 3.37Å; E102-I106 PolarHBondContact O-N 3.12Å; E102-R463 VanDerWaalsContact CD-NH2 3.33Å; E102-R463 IonicContact OE1-NH2 3.68Å; E102-R463 PolarHBondContact OE1-NH2 2.9Å; E102-R463 IonicContact OE2-CZ 3.51Å; E102-R463 IonicContact OE2-NH1 3.62Å; E102-R463 PolarHBondContact OE2-NH1 2.85Å; E102-R463 IonicContact OE2-NH2 2.8Å; E102-R463 PolarHBondContact OE2-NH2 2.85Å; E102-V475 HydrophobicContact CG-CG1 3.78Å; E102-N476 PolarHBondContact OE1-N 3.25Å; E102-N476 VanDerWaalsContact OE1-O 3.08Å; E102-E477 WeakPolarHBondContact CB-OE2 3.47Å; E102-E477 WeakPolarHBondContact CG-OE2 3.38Å; E102-E477 PolarHBondContact N-OE2 2.93Å
103	P	97.6	Very high	97.4	Very high	40 Å²	40	15 Å²	15	26%	0.26	8%	0.079	S	C	.	.	H	α-helix	trans	-51.8	-40.1	-177.3	-29.1	34.3	0	0	0	114.4	I106 Q107 L159 L163	P103-I106 WeakPolarHBondContact O-CB 3.3Å; P103-I106 PolarHBondContact O-N 2.9Å; P103-Q107 WeakPolarHBondContact O-CB 3.27Å; P103-Q107 WeakPolarHBondContact O-CG 3.42Å; P103-Q107 PolarHBondContact O-N 2.84Å; P103-L159 HydrophobicContact CG-CD1 4.29Å; P103-L159 HydrophobicContact CG-CD2 4.23Å; P103-L163 HydrophobicContact CB-CD1 3.78Å
104	E	97.7	Very high	97.6	Very high	16 Å²	16	17.2 Å²	17.2	8%	0.075	9%	0.091	C	C	.	.	H	α-helix	trans	-69.2	-36.4	-178.4	-61.6	92.3	148.8	0	0	112.1	E102 I106 Q107 M108 D460 L461 R463 F464	E102-E104 PolarHBondContact O-N 2.86Å; E102-E104 VanDerWaalsContact O-N 3.15Å; E104-I106 VanDerWaalsContact C-N 3.31Å; E104-Q107 PolarHBondContact O-N 2.96Å; E104-M108 WeakPolarHBondContact O-CB 3.34Å; E104-M108 VanDerWaalsContact O-CG 3.25Å; E104-M108 WeakPolarHBondContact O-CG 3.47Å; E104-M108 PolarHBondContact O-N 2.79Å; E104-D460 WeakPolarHBondContact CG-O 3.34Å; E104-L461 HydrophobicContact CB-CD2 3.84Å; E104-L461 HydrophobicContact CG-CD2 4.22Å; E104-R463 VanDerWaalsContact CD-NH1 3.33Å; E104-R463 VanDerWaalsContact OE1-CD 3.24Å; E104-R463 WeakPolarHBondContact OE1-CD 3.37Å; E104-R463 IonicContact OE1-CZ 3.99Å; E104-R463 IonicContact OE1-NE 3.13Å; E104-R463 IonicContact OE1-NH1 3.95Å; E104-R463 PolarHBondContact OE1-NH1 3.32Å; E104-R463 IonicContact OE2-NH1 2.75Å; E104-R463 PolarHBondContact OE2-NH1 2.92Å; E104-F464 HydrophobicContact CB-CD2 4.22Å; E104-F464 HydrophobicContact CB-CE2 3.32Å; E104-F464 HydrophobicContact CB-CZ 4.02Å; E104-F464 HydrophobicContact CG-CD2 4.37Å; E104-F464 HydrophobicContact CG-CE2 3.64Å
105	N	98	Very high	97.8	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.011	9%	0.09	C	C	.	.	H	α-helix	trans	-64.6	-39.7	174.8	-75.7	-26.6	0	0	0	110.3	F100 E102 M108 S109 N414 H439 E477	F100-N105 HydrophobicContact CB-CB 3.78Å; F100-N105 HydrophobicContact CD1-CB 3.83Å; F100-N105 HydrophobicContact CD2-CB 4.1Å; F100-N105 HydrophobicContact CE1-CB 4.42Å; F100-N105 HydrophobicContact CG-CB 3.65Å; E102-N105 HydrophobicContact CB-CB 4.35Å; E102-N105 PolarHBondContact O-N 3.44Å; N105-M108 WeakPolarHBondContact OD1-CE 3.42Å; N105-S109 WeakPolarHBondContact O-CB 3.3Å; N105-S109 PolarHBondContact O-N 3.15Å; N105-S109 VanDerWaalsContact O-N 3.09Å; N105-S109 PolarHBondContact O-OG 3.27Å; N105-N414 PolarHBondContact ND2-OD1 3.05Å; N105-H439 PolarHBondContact O-NE2 2.72Å; N105-H439 VanDerWaalsContact O-NE2 3.14Å; N105-E477 PolarHBondContact ND2-OE2 2.96Å
106	I	98.4	Very high	97.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.9	-47.5	174.3	-56	169.6	0	0	0	110.4	Q98 F100 E102 P103 E104 S109 L110 L159 Q160 L163	Q98-I106 HydrophobicContact CB-CG2 4.44Å; Q98-I106 WeakPolarHBondContact O-CG1 3.5Å; F100-I106 HydrophobicContact CB-CG1 3.83Å; E102-I106 WeakPolarHBondContact O-CG1 3.37Å; E102-I106 PolarHBondContact O-N 3.12Å; P103-I106 WeakPolarHBondContact O-CB 3.3Å; P103-I106 PolarHBondContact O-N 2.9Å; E104-I106 VanDerWaalsContact C-N 3.31Å; I106-S109 PolarHBondContact O-N 3.23Å; I106-L110 HydrophobicContact CG2-CD1 3.98Å; I106-L110 HydrophobicContact CG2-CG 4.47Å; I106-L110 WeakPolarHBondContact O-CG 3.22Å; I106-L110 PolarHBondContact O-N 2.86Å; I106-L159 HydrophobicContact CD1-CD2 4.03Å; I106-L159 HydrophobicContact CD1-CG 3.96Å; I106-Q160 HydrophobicContact CD1-CG 3.88Å; I106-L163 HydrophobicContact CB-CD1 3.96Å; I106-L163 HydrophobicContact CD1-CD1 3.68Å; I106-L163 HydrophobicContact CG1-CD1 4.37Å; I106-L163 HydrophobicContact CG2-CB 3.95Å; I106-L163 HydrophobicContact CG2-CD1 4.1Å
107	Q	98.6	Very high	97.6	Very high	67 Å²	67	22.6 Å²	22.6	31%	0.313	11%	0.109	S	C	.	.	H	α-helix	trans	-64	-41.9	179.6	-72.3	168.9	6.3	0	0	112.5	P103 E104 S109 L110 F111 I459	P103-Q107 WeakPolarHBondContact O-CB 3.27Å; P103-Q107 WeakPolarHBondContact O-CG 3.42Å; P103-Q107 PolarHBondContact O-N 2.84Å; E104-Q107 PolarHBondContact O-N 2.96Å; Q107-S109 VanDerWaalsContact C-N 3.3Å; Q107-S109 PolarHBondContact O-N 3.24Å; Q107-L110 PolarHBondContact O-N 3.43Å; Q107-F111 WeakPolarHBondContact O-CB 3.47Å; Q107-F111 PolarHBondContact O-N 2.92Å; Q107-I459 HydrophobicContact CB-CD1 4.25Å; Q107-I459 HydrophobicContact CB-CG1 4.18Å; Q107-I459 HydrophobicContact CB-CG2 4.15Å
108	M	98.7	Very high	97.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-40.6	175.2	-75.4	-167.8	-67.3	0	0	111.4	E104 N105 S112 L415 H439 A442 I443 I459 L461	E104-M108 WeakPolarHBondContact O-CB 3.34Å; E104-M108 VanDerWaalsContact O-CG 3.25Å; E104-M108 WeakPolarHBondContact O-CG 3.47Å; E104-M108 PolarHBondContact O-N 2.79Å; N105-M108 WeakPolarHBondContact OD1-CE 3.42Å; M108-S112 VanDerWaalsContact O-CB 3.28Å; M108-S112 WeakPolarHBondContact O-CB 3.31Å; M108-S112 PolarHBondContact O-N 3.37Å; M108-S112 PolarHBondContact O-OG 3.49Å; M108-L415 HydrophobicContact CE-CD2 4.29Å; M108-L415 HydrophobicContact SD-CD2 4.05Å; M108-H439 HydrophobicContact CB-CB 4.36Å; M108-H439 HydrophobicContact SD-CB 4.25Å; M108-A442 HydrophobicContact CB-CB 3.66Å; M108-A442 HydrophobicContact CG-CB 3.64Å; M108-A442 HydrophobicContact SD-CB 4.36Å; M108-I443 HydrophobicContact SD-CG1 4.04Å; M108-I459 HydrophobicContact CG-CD1 4.07Å; M108-I459 HydrophobicContact CG-CG2 4.47Å; M108-L461 HydrophobicContact CE-CD2 4.29Å; M108-L461 HydrophobicContact CG-CD2 4.09Å; M108-L461 HydrophobicContact SD-CD1 3.84Å; M108-L461 HydrophobicContact SD-CD2 3.84Å
109	S	98.5	Very high	97.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.8	-44.2	175.3	-71.9	0	0	0	0	112.8	R97 F100 N105 I106 Q107 F111 S112 I113 Q438 H439	R97-S109 WeakPolarHBondContact O-CB 3.24Å; R97-S109 PolarHBondContact O-OG 3.35Å; F100-S109 WeakPolarHBondContact CE2-OG 3.31Å; N105-S109 WeakPolarHBondContact O-CB 3.3Å; N105-S109 PolarHBondContact O-N 3.15Å; N105-S109 VanDerWaalsContact O-N 3.09Å; N105-S109 PolarHBondContact O-OG 3.27Å; I106-S109 PolarHBondContact O-N 3.23Å; Q107-S109 VanDerWaalsContact C-N 3.3Å; Q107-S109 PolarHBondContact O-N 3.24Å; S109-F111 VanDerWaalsContact C-N 3.35Å; S109-F111 PolarHBondContact O-N 2.95Å; S109-S112 PolarHBondContact O-N 3.04Å; S109-I113 WeakPolarHBondContact O-CG2 3.34Å; S109-I113 PolarHBondContact O-N 2.6Å; S109-Q438 PolarHBondContact OG-OE1 3.36Å; S109-H439 PolarHBondContact OG-CD2 3.11Å; S109-H439 PolarHBondContact OG-NE2 2.92Å
110	L	98.6	Very high	97	Very high	41 Å²	41	26.1 Å²	26.1	22%	0.215	13%	0.13	C	C	.	.	H	α-helix	trans	-62.7	-39.5	176.2	-74.6	169.4	0	0	0	112.4	Q98 I106 Q107 I113 D114 L163	Q98-L110 HydrophobicContact CG-CD2 3.8Å; Q98-L110 HydrophobicContact CG-CG 4Å; I106-L110 HydrophobicContact CG2-CD1 3.98Å; I106-L110 HydrophobicContact CG2-CG 4.47Å; I106-L110 WeakPolarHBondContact O-CG 3.22Å; I106-L110 PolarHBondContact O-N 2.86Å; Q107-L110 PolarHBondContact O-N 3.43Å; L110-I113 VanDerWaalsContact O-CG2 3.28Å; L110-I113 WeakPolarHBondContact O-CG2 3.43Å; L110-D114 PolarHBondContact O-N 2.89Å; L110-L163 WeakPolarHBondContact CD1-O 3.34Å
111	F	98.6	Very high	96.7	Very high	44 Å²	44	31.5 Å²	31.5	19%	0.193	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-43.3	173.8	179.1	-95.6	0	0	0	111.8	W66 Q107 S109 F115 I441 A442 K445 T458 I459	W66-F111 AromaticContact CH2-CZ 4Å; W66-F111 HydrophobicContact CH2-CZ 4Å; W66-F111 AromaticContact CZ2-CE1 3.91Å; W66-F111 HydrophobicContact CZ2-CE1 3.91Å; W66-F111 AromaticContact CZ2-CZ 3.64Å; W66-F111 HydrophobicContact CZ2-CZ 3.64Å; Q107-F111 WeakPolarHBondContact O-CB 3.47Å; Q107-F111 PolarHBondContact O-N 2.92Å; S109-F111 VanDerWaalsContact C-N 3.35Å; S109-F111 PolarHBondContact O-N 2.95Å; F111-F115 PolarHBondContact O-N 2.8Å; F111-I441 HydrophobicContact CD1-CG2 4.27Å; F111-I441 HydrophobicContact CE1-CG2 3.84Å; F111-A442 HydrophobicContact CB-CB 4.46Å; F111-A442 HydrophobicContact CD1-CB 3.71Å; F111-A442 HydrophobicContact CE1-CB 4.43Å; F111-A442 HydrophobicContact CG-CB 4.44Å; F111-K445 HydrophobicContact CE1-CB 3.89Å; F111-K445 HydrophobicContact CE1-CG 4.2Å; F111-K445 HydrophobicContact CZ-CB 3.98Å; F111-K445 HydrophobicContact CZ-CD 4.28Å; F111-K445 HydrophobicContact CZ-CG 3.79Å; F111-T458 HydrophobicContact CD2-CG2 3.78Å; F111-T458 HydrophobicContact CE2-CG2 3.68Å; F111-T458 HydrophobicContact CZ-CG2 4.5Å; F111-I459 HydrophobicContact CB-CD1 3.84Å; F111-I459 HydrophobicContact CG-CD1 4.26Å
112	S	98.4	Very high	96.6	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-70.5	-39.9	-176.4	-57.9	0	0	0	0	111.6	M108 S109 D114 F115 L116 Q438 A442	M108-S112 VanDerWaalsContact O-CB 3.28Å; M108-S112 WeakPolarHBondContact O-CB 3.31Å; M108-S112 PolarHBondContact O-N 3.37Å; M108-S112 PolarHBondContact O-OG 3.49Å; S109-S112 PolarHBondContact O-N 3.04Å; S112-D114 PolarHBondContact O-N 3.41Å; S112-F115 WeakPolarHBondContact O-CA 3.49Å; S112-F115 VanDerWaalsContact O-CB 3.32Å; S112-F115 WeakPolarHBondContact O-CB 3.12Å; S112-F115 PolarHBondContact O-N 2.77Å; S112-F115 VanDerWaalsContact O-N 3.16Å; S112-L116 WeakPolarHBondContact O-CG 3.21Å; S112-L116 PolarHBondContact O-N 2.97Å; S112-Q438 WeakPolarHBondContact CB-O 3.05Å; S112-Q438 PolarHBondContact OG-O 3.32Å; S112-Q438 VanDerWaalsContact OG-O 3.08Å; S112-A442 PolarHBondContact OG-N 2.79Å
113	I	97.8	Very high	96.5	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-67	-36.5	177	-172.1	63.8	0	0	0	112.7	I96 S109 L110 F115 L116 R117 F136 N196	I96-I113 HydrophobicContact CD1-CB 3.66Å; I96-I113 HydrophobicContact CD1-CD1 4.17Å; I96-I113 HydrophobicContact CD1-CG1 4.46Å; I96-I113 HydrophobicContact CG1-CB 4.46Å; I96-I113 HydrophobicContact CG2-CD1 3.99Å; S109-I113 WeakPolarHBondContact O-CG2 3.34Å; S109-I113 PolarHBondContact O-N 2.6Å; L110-I113 VanDerWaalsContact O-CG2 3.28Å; L110-I113 WeakPolarHBondContact O-CG2 3.43Å; I113-F115 VanDerWaalsContact C-N 3.25Å; I113-F115 PolarHBondContact O-N 2.79Å; I113-L116 HydrophobicContact CD1-CB 4.42Å; I113-L116 PolarHBondContact O-N 3.34Å; I113-R117 HydrophobicContact CD1-CG 4.39Å; I113-R117 HydrophobicContact CG1-CG 4.37Å; I113-R117 WeakPolarHBondContact O-CB 3.47Å; I113-R117 WeakPolarHBondContact O-CG 3.47Å; I113-R117 PolarHBondContact O-N 3.38Å; I113-F136 HydrophobicContact CD1-CE1 4.38Å; I113-F136 HydrophobicContact CD1-CE2 3.88Å; I113-F136 HydrophobicContact CD1-CZ 3.57Å; I113-N196 HydrophobicContact CB-CB 4.4Å; I113-N196 WeakPolarHBondContact CD1-O 3.32Å; I113-N196 HydrophobicContact CG1-CB 3.84Å; I113-N196 WeakPolarHBondContact CG1-O 3.27Å; I113-N196 HydrophobicContact CG2-CB 3.91Å
114	D	97.5	Very high	96.3	Very high	79 Å²	79	31.4 Å²	31.4	42%	0.422	16%	0.155	S	C	.	.	H	α-helix	trans	-59.8	-41.4	172.2	179.2	71.8	0	0	0	110.8	L110 S112 R117 N118	L110-D114 PolarHBondContact O-N 2.89Å; S112-D114 PolarHBondContact O-N 3.41Å; D114-R117 PolarHBondContact O-N 3.03Å; D114-N118 WeakPolarHBondContact O-CB 3.48Å; D114-N118 PolarHBondContact O-N 3.16Å; D114-N118 PolarHBondContact O-ND2 3.46Å; D114-N118 PolarHBondContact OD1-ND2 3.14Å
115	F	97.8	Very high	95.7	Very high	1 Å²	1	32 Å²	32	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-61.4	-47.5	173.3	-173	-84.2	0	0	0	112.5	F65 W66 F111 S112 I113 R117 N118 L119 Y122 L123 I441	F65-F115 HydrophobicContact CD1-CE2 4.45Å; F65-F115 AromaticContact CE1-CE2 3.63Å; F65-F115 HydrophobicContact CE1-CE2 3.63Å; F65-F115 AromaticContact CE1-CZ 3.97Å; F65-F115 HydrophobicContact CE1-CZ 3.97Å; F65-F115 HydrophobicContact CZ-CE2 4.04Å; F65-F115 HydrophobicContact CZ-CZ 4.24Å; W66-F115 HydrophobicContact CH2-CD2 4.3Å; W66-F115 HydrophobicContact CH2-CE2 4.35Å; W66-F115 AromaticContact CZ2-CD2 3.8Å; W66-F115 HydrophobicContact CZ2-CD2 3.8Å; W66-F115 AromaticContact CZ2-CE2 3.87Å; W66-F115 HydrophobicContact CZ2-CE2 3.87Å; F111-F115 PolarHBondContact O-N 2.8Å; S112-F115 WeakPolarHBondContact O-CA 3.49Å; S112-F115 VanDerWaalsContact O-CB 3.32Å; S112-F115 WeakPolarHBondContact O-CB 3.12Å; S112-F115 PolarHBondContact O-N 2.77Å; S112-F115 VanDerWaalsContact O-N 3.16Å; I113-F115 VanDerWaalsContact C-N 3.25Å; I113-F115 PolarHBondContact O-N 2.79Å; F115-R117 VanDerWaalsContact C-N 3.32Å; F115-R117 PolarHBondContact O-N 2.97Å; F115-N118 CarbonylContact O-C 3.58Å; F115-N118 VanDerWaalsContact O-C 3.3Å; F115-N118 PolarHBondContact O-N 3.42Å; F115-N118 VanDerWaalsContact O-N 3.12Å; F115-L119 HydrophobicContact CD1-CD2 3.99Å; F115-L119 HydrophobicContact CE1-CD2 3.73Å; F115-L119 PolarHBondContact O-N 3.48Å; F115-Y122 HydrophobicContact CB-CD2 4.47Å; F115-Y122 HydrophobicContact CB-CE2 4.28Å; F115-Y122 HydrophobicContact CD1-CD2 4.44Å; F115-Y122 HydrophobicContact CD2-CD1 4.25Å; F115-Y122 AromaticContact CD2-CD2 3.36Å; F115-Y122 HydrophobicContact CD2-CD2 3.36Å; F115-Y122 HydrophobicContact CD2-CE1 4.4Å; F115-Y122 AromaticContact CD2-CE2 3.62Å; F115-Y122 HydrophobicContact CD2-CE2 3.62Å; F115-Y122 AromaticContact CD2-CG 3.69Å; F115-Y122 HydrophobicContact CD2-CG 3.69Å; F115-Y122 VanDerWaalsContact CE2-CB 3.49Å; F115-Y122 AromaticContact CE2-CD1 3.99Å; F115-Y122 HydrophobicContact CE2-CD1 3.99Å; F115-Y122 AromaticContact CE2-CD2 3.58Å; F115-Y122 HydrophobicContact CE2-CD2 3.58Å; F115-Y122 HydrophobicContact CE2-CE2 4.24Å; F115-Y122 AromaticContact CE2-CG 3.41Å; F115-Y122 HydrophobicContact CE2-CG 3.41Å; F115-Y122 VanDerWaalsContact CE2-CG 3.41Å; F115-Y122 AromaticContact CG-CD2 3.84Å; F115-Y122 HydrophobicContact CG-CD2 3.84Å; F115-Y122 HydrophobicContact CG-CE2 4.09Å; F115-Y122 HydrophobicContact CZ-CD2 4.22Å; F115-Y122 HydrophobicContact CZ-CG 4.04Å; F115-L123 HydrophobicContact CE1-CD1 4.06Å; F115-L123 HydrophobicContact CE1-CG 4.26Å; F115-L123 HydrophobicContact CZ-CD1 4.22Å; F115-L123 HydrophobicContact CZ-CD2 3.97Å; F115-L123 HydrophobicContact CZ-CG 3.98Å; F115-I441 HydrophobicContact CB-CG2 3.73Å; F115-I441 HydrophobicContact CD1-CD1 3.94Å; F115-I441 HydrophobicContact CD1-CG1 3.9Å; F115-I441 HydrophobicContact CD1-CG2 3.9Å; F115-I441 HydrophobicContact CD2-CG2 3.67Å; F115-I441 HydrophobicContact CE1-CD1 3.76Å; F115-I441 HydrophobicContact CE1-CG1 4.26Å; F115-I441 HydrophobicContact CE1-CG2 4.41Å; F115-I441 HydrophobicContact CE2-CG2 4.2Å; F115-I441 HydrophobicContact CG-CG1 4.35Å; F115-I441 HydrophobicContact CG-CG2 3.5Å; F115-I441 VanDerWaalsContact CG-CG2 3.5Å; F115-I441 HydrophobicContact CZ-CD1 4.28Å
116	L	96.4	Very high	94.6	Very high	14 Å²	14	36.9 Å²	36.9	7%	0.073	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-35.7	-179.5	-64.8	-175.7	0	0	0	112.4	I96 S112 I113 N118 L119 I134 F200 L205	I96-L116 HydrophobicContact CD1-CD1 3.87Å; S112-L116 WeakPolarHBondContact O-CG 3.21Å; S112-L116 PolarHBondContact O-N 2.97Å; I113-L116 HydrophobicContact CD1-CB 4.42Å; I113-L116 PolarHBondContact O-N 3.34Å; L116-N118 VanDerWaalsContact C-N 3.26Å; L116-N118 PolarHBondContact O-N 2.9Å; L116-L119 HydrophobicContact CD2-CD1 4.4Å; L116-L119 HydrophobicContact CD2-CD2 4.15Å; L116-L119 WeakPolarHBondContact O-CD1 3.13Å; L116-L119 WeakPolarHBondContact O-CG 3.33Å; L116-I134 HydrophobicContact CD2-CD1 3.94Å; L116-F200 HydrophobicContact CD1-CD1 4Å; L116-F200 HydrophobicContact CD1-CE1 3.59Å; L116-F200 HydrophobicContact CD1-CZ 3.95Å; L116-L205 HydrophobicContact CD2-CD1 3.87Å; L116-L205 HydrophobicContact CD2-CD2 3.77Å; L116-L205 HydrophobicContact CD2-CG 4.46Å
117	R	93.3	Very high	92.9	Very high	116 Å²	116	44 Å²	44	44%	0.438	22%	0.22	S	C	.	.	H	α-helix	trans	-70.1	-24.7	175.1	-74.4	176.5	166.1	-161.5	-7.7	113.2	I113 D114 F115 E195 N196	I113-R117 HydrophobicContact CD1-CG 4.39Å; I113-R117 HydrophobicContact CG1-CG 4.37Å; I113-R117 WeakPolarHBondContact O-CB 3.47Å; I113-R117 WeakPolarHBondContact O-CG 3.47Å; I113-R117 PolarHBondContact O-N 3.38Å; D114-R117 PolarHBondContact O-N 3.03Å; F115-R117 VanDerWaalsContact C-N 3.32Å; F115-R117 PolarHBondContact O-N 2.97Å; R117-E195 IonicContact CZ-OE1 3.99Å; R117-E195 IonicContact NH1-OE1 3.33Å; R117-E195 PolarHBondContact NH1-OE1 2.89Å; R117-E195 IonicContact NH2-OE1 3.73Å; R117-N196 PolarHBondContact NE-OD1 3.18Å; R117-N196 PolarHBondContact NH1-OD1 3.36Å; R117-N196 PolarHBondContact NH2-OD1 3.08Å
118	N	93.7	Very high	91.1	Very high	57 Å²	57	46.4 Å²	46.4	31%	0.305	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	25.7	-177.5	-67.9	-77.8	0	0	0	112.4	D114 F115 L116 S120 N121 Y122	D114-N118 WeakPolarHBondContact O-CB 3.48Å; D114-N118 PolarHBondContact O-N 3.16Å; D114-N118 PolarHBondContact O-ND2 3.46Å; D114-N118 PolarHBondContact OD1-ND2 3.14Å; F115-N118 CarbonylContact O-C 3.58Å; F115-N118 VanDerWaalsContact O-C 3.3Å; F115-N118 PolarHBondContact O-N 3.42Å; F115-N118 VanDerWaalsContact O-N 3.12Å; L116-N118 VanDerWaalsContact C-N 3.26Å; L116-N118 PolarHBondContact O-N 2.9Å; N118-S120 VanDerWaalsContact C-N 3.32Å; N118-S120 PolarHBondContact O-N 3.31Å; N118-N121 WeakPolarHBondContact O-CB 3.2Å; N118-N121 PolarHBondContact O-N 2.78Å; N118-N121 PolarHBondContact OD1-ND2 2.68Å; N118-Y122 HydrophobicContact CB-CD2 4.04Å; N118-Y122 HydrophobicContact CB-CE2 3.71Å; N118-Y122 VanDerWaalsContact O-CD2 3.23Å; N118-Y122 WeakPolarHBondContact O-CD2 3.41Å; N118-Y122 PolarHBondContact O-N 2.91Å
119	L	94.1	Very high	89.4	Confident	10 Å²	10	52 Å²	52	5%	0.052	27%	0.271	C	S	.	.	H	α-helix	trans	-49.5	-48.9	-172.5	-82.2	161.1	0	0	0	113.5	F115 L116 N121 Y122 L123 I134 L205	F115-L119 HydrophobicContact CD1-CD2 3.99Å; F115-L119 HydrophobicContact CE1-CD2 3.73Å; F115-L119 PolarHBondContact O-N 3.48Å; L116-L119 HydrophobicContact CD2-CD1 4.4Å; L116-L119 HydrophobicContact CD2-CD2 4.15Å; L116-L119 WeakPolarHBondContact O-CD1 3.13Å; L116-L119 WeakPolarHBondContact O-CG 3.33Å; L119-N121 PolarHBondContact O-N 2.77Å; L119-Y122 CarbonylContact O-C 3.09Å; L119-Y122 WeakPolarHBondContact O-CA 3.39Å; L119-Y122 PolarHBondContact O-N 3.29Å; L119-L123 HydrophobicContact CD2-CD1 3.76Å; L119-L123 PolarHBondContact O-N 2.77Å; L119-I134 HydrophobicContact CD1-CB 4.48Å; L119-I134 HydrophobicContact CD1-CD1 3.56Å; L119-I134 HydrophobicContact CD1-CG1 3.74Å; L119-I134 HydrophobicContact CD1-CG2 3.94Å; L119-L205 HydrophobicContact CD2-CD1 3.57Å
120	S	92.2	Very high	88.2	Confident	20 Å²	20	56.2 Å²	56.2	14%	0.14	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-31	-177.6	-51.8	0	0	0	0	112.6	N118 Y122 S124 E130 I132	N118-S120 VanDerWaalsContact C-N 3.32Å; N118-S120 PolarHBondContact O-N 3.31Å; S120-Y122 PolarHBondContact O-N 3.42Å; S120-S124 WeakPolarHBondContact O-CB 3.21Å; S120-S124 PolarHBondContact O-N 2.83Å; S120-S124 PolarHBondContact O-OG 2.85Å; S120-E130 WeakPolarHBondContact CB-O 3.28Å; S120-E130 PolarHBondContact OG-O 3.28Å; S120-I132 PolarHBondContact OG-N 3.1Å
121	N	92.1	Very high	87.4	Confident	113 Å²	113	60.8 Å²	60.8	60%	0.604	32%	0.315	S	S	*	.	H	α-helix	trans	-68.4	-27.6	174.9	-64.6	-25.5	0	0	0	112.1	N118 L119	N118-N121 WeakPolarHBondContact O-CB 3.2Å; N118-N121 PolarHBondContact O-N 2.78Å; N118-N121 PolarHBondContact OD1-ND2 2.68Å; L119-N121 PolarHBondContact O-N 2.77Å
122	Y	94.2	Very high	87	Confident	47 Å²	47	59.7 Å²	59.7	18%	0.184	31%	0.311	C	S	.	.	H	α-helix	trans	-95.8	-40.7	-175.7	-67.9	-56.2	0	0	0	113.2	F65 R69 F115 N118 L119 S120 K212	F65-Y122 WeakPolarHBondContact CE2-O 3.33Å; R69-Y122 VanDerWaalsContact CZ-CE1 3.49Å; F115-Y122 HydrophobicContact CB-CD2 4.47Å; F115-Y122 HydrophobicContact CB-CE2 4.28Å; F115-Y122 HydrophobicContact CD1-CD2 4.44Å; F115-Y122 HydrophobicContact CD2-CD1 4.25Å; F115-Y122 AromaticContact CD2-CD2 3.36Å; F115-Y122 HydrophobicContact CD2-CD2 3.36Å; F115-Y122 HydrophobicContact CD2-CE1 4.4Å; F115-Y122 AromaticContact CD2-CE2 3.62Å; F115-Y122 HydrophobicContact CD2-CE2 3.62Å; F115-Y122 AromaticContact CD2-CG 3.69Å; F115-Y122 HydrophobicContact CD2-CG 3.69Å; F115-Y122 VanDerWaalsContact CE2-CB 3.49Å; F115-Y122 AromaticContact CE2-CD1 3.99Å; F115-Y122 HydrophobicContact CE2-CD1 3.99Å; F115-Y122 AromaticContact CE2-CD2 3.58Å; F115-Y122 HydrophobicContact CE2-CD2 3.58Å; F115-Y122 HydrophobicContact CE2-CE2 4.24Å; F115-Y122 AromaticContact CE2-CG 3.41Å; F115-Y122 HydrophobicContact CE2-CG 3.41Å; F115-Y122 VanDerWaalsContact CE2-CG 3.41Å; F115-Y122 AromaticContact CG-CD2 3.84Å; F115-Y122 HydrophobicContact CG-CD2 3.84Å; F115-Y122 HydrophobicContact CG-CE2 4.09Å; F115-Y122 HydrophobicContact CZ-CD2 4.22Å; F115-Y122 HydrophobicContact CZ-CG 4.04Å; N118-Y122 HydrophobicContact CB-CD2 4.04Å; N118-Y122 HydrophobicContact CB-CE2 3.71Å; N118-Y122 VanDerWaalsContact O-CD2 3.23Å; N118-Y122 WeakPolarHBondContact O-CD2 3.41Å; N118-Y122 PolarHBondContact O-N 2.91Å; L119-Y122 CarbonylContact O-C 3.09Å; L119-Y122 WeakPolarHBondContact O-CA 3.39Å; L119-Y122 PolarHBondContact O-N 3.29Å; S120-Y122 PolarHBondContact O-N 3.42Å; Y122-K212 VanDerWaalsContact O-CE 3.32Å; Y122-K212 WeakPolarHBondContact O-CE 3.46Å
123	L	95.1	Very high	86.7	Confident	2 Å²	2	65 Å²	65	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-115	-8.3	-164.2	-60.5	-173.9	0	0	0	115	F65 F115 L119 V125 I132 L205 A208 L209 K212	F65-L123 HydrophobicContact CD2-CD2 3.84Å; F65-L123 HydrophobicContact CE2-CD2 3.62Å; F65-L123 HydrophobicContact CG-CD2 4.47Å; F65-L123 HydrophobicContact CZ-CD2 4.09Å; F115-L123 HydrophobicContact CE1-CD1 4.06Å; F115-L123 HydrophobicContact CE1-CG 4.26Å; F115-L123 HydrophobicContact CZ-CD1 4.22Å; F115-L123 HydrophobicContact CZ-CD2 3.97Å; F115-L123 HydrophobicContact CZ-CG 3.98Å; L119-L123 HydrophobicContact CD2-CD1 3.76Å; L119-L123 PolarHBondContact O-N 2.77Å; L123-V125 PolarHBondContact O-N 3.27Å; L123-I132 HydrophobicContact CB-CD1 3.45Å; L123-I132 VanDerWaalsContact CB-CD1 3.45Å; L123-I132 WeakPolarHBondContact O-CD1 3.25Å; L123-L205 HydrophobicContact CD1-CD1 4.33Å; L123-A208 HydrophobicContact CD1-CB 3.8Å; L123-L209 HydrophobicContact CD1-CD2 4.21Å; L123-L209 HydrophobicContact CD1-CG 4.11Å; L123-L209 HydrophobicContact CD2-CD2 3.84Å; L123-L209 HydrophobicContact CD2-CG 4.5Å; L123-K212 HydrophobicContact CB-CB 4.45Å; L123-K212 HydrophobicContact CD2-CB 3.87Å; L123-K212 HydrophobicContact CD2-CG 3.89Å
124	S	91.5	Very high	86.6	Confident	27 Å²	27	65 Å²	65	19%	0.189	34%	0.339	C	S	.	.			trans	-57.2	136.1	175.3	53.1	0	0	0	0	111.6	S120 K212	S120-S124 WeakPolarHBondContact O-CB 3.21Å; S120-S124 PolarHBondContact O-N 2.83Å; S120-S124 PolarHBondContact O-OG 2.85Å; S124-K212 PolarHBondContact O-NZ 3.06Å
125	V	86.7	Confident	86.4	Confident	28 Å²	28	62.9 Å²	62.9	17%	0.17	34%	0.336	C	S	.	.			trans	-105.3	-35.2	-180	170.1	0	0	0	0	112.2	L123 T211 K212 F215	L123-V125 PolarHBondContact O-N 3.27Å; V125-T211 HydrophobicContact CG2-CG2 4.13Å; V125-K212 HydrophobicContact CG2-CB 4.46Å; V125-K212 HydrophobicContact CG2-CD 3.93Å; V125-F215 HydrophobicContact CB-CB 4.49Å; V125-F215 HydrophobicContact CB-CG 4.38Å; V125-F215 HydrophobicContact CG1-CB 3.8Å; V125-F215 HydrophobicContact CG1-CD1 4.26Å; V125-F215 HydrophobicContact CG1-CD2 3.37Å; V125-F215 HydrophobicContact CG1-CE2 3.91Å; V125-F215 HydrophobicContact CG1-CG 3.54Å; V125-F215 HydrophobicContact CG2-CB 3.87Å; V125-F215 HydrophobicContact CG2-CD1 4.48Å; V125-F215 HydrophobicContact CG2-CG 4.16Å
126	E	75	Confident	86.2	Confident	106 Å²	106	65.5 Å²	65.5	50%	0.495	35%	0.347	S	S	.	.	S	Bend	trans	-108.5	162.5	179.6	-57.5	-156	119.3	0	0	113.3	T35	T35-E126 HydrophobicContact CG2-CG 4.43Å; T35-E126 WeakPolarHBondContact CG2-OE1 3.47Å
127	D	62.2	Low	86.2	Confident	149 Å²	149	66.2 Å²	66.2	80%	0.797	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	132.7	172.3	-158.3	17.8	0	0	0	107.8
128	P	60.8	Low	86.2	Confident	118 Å²	118	64.6 Å²	64.6	77%	0.766	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	cis	-68.1	147.5	4.9	28.7	-33.3	0	0	0	113.4	E130	P128-E130 PolarHBondContact O-N 3.06Å
129	I	61.8	Low	86.3	Confident	118 Å²	118	64.8 Å²	64.8	61%	0.605	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-30.2	102.7	180	-58	164.4	0	0	0	111.8	N131	I129-N131 PolarHBondContact O-N 3.24Å
130	E	73.4	Confident	86.4	Confident	87 Å²	87	64.4 Å²	64.4	41%	0.407	35%	0.353	S	S	.	.			trans	-56.8	122.5	171	-175.6	-177.7	-178.6	0	0	109.3	S120 P128 I132	S120-E130 WeakPolarHBondContact CB-O 3.28Å; S120-E130 PolarHBondContact OG-O 3.28Å; P128-E130 PolarHBondContact O-N 3.06Å; E130-I132 HydrophobicContact CG-CG1 4.16Å; E130-I132 PolarHBondContact O-N 2.82Å
131	N	81.7	Confident	86.7	Confident	138 Å²	138	63.4 Å²	63.4	74%	0.738	35%	0.346	S	S	*	.			trans	-80.2	99.6	173.7	-173.2	32.9	0	0	0	109.1	I129 D133	I129-N131 PolarHBondContact O-N 3.24Å; N131-D133 PolarHBondContact O-N 3.33Å
132	I	90.8	Very high	87	Confident	21 Å²	21	58 Å²	58	11%	0.108	32%	0.317	C	S	.	.			trans	-83	112.1	178.7	-64.5	173.2	0	0	0	108.5	S120 L123 E130 I134 A208	S120-I132 PolarHBondContact OG-N 3.1Å; L123-I132 HydrophobicContact CB-CD1 3.45Å; L123-I132 VanDerWaalsContact CB-CD1 3.45Å; L123-I132 WeakPolarHBondContact O-CD1 3.25Å; E130-I132 HydrophobicContact CG-CG1 4.16Å; E130-I132 PolarHBondContact O-N 2.82Å; I132-I134 HydrophobicContact CG2-CG2 4.43Å; I132-A208 HydrophobicContact CG2-CB 3.84Å
133	D	92.3	Very high	87.2	Confident	111 Å²	111	56 Å²	56	59%	0.594	31%	0.31	S	S	*	.			trans	-106	129.6	175	-169.6	2.5	0	0	0	110.3	N131 G135	N131-D133 PolarHBondContact O-N 3.33Å; D133-G135 PolarHBondContact OD1-N 3.12Å
134	I	95.2	Very high	87.4	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	31%	0.309	C	S	.	.			trans	-112	11.5	176.5	61.6	167.2	0	0	0	111.8	L116 L119 I132 F136 F200 D201 L204 L205	L116-I134 HydrophobicContact CD2-CD1 3.94Å; L119-I134 HydrophobicContact CD1-CB 4.48Å; L119-I134 HydrophobicContact CD1-CD1 3.56Å; L119-I134 HydrophobicContact CD1-CG1 3.74Å; L119-I134 HydrophobicContact CD1-CG2 3.94Å; I132-I134 HydrophobicContact CG2-CG2 4.43Å; I134-F136 HydrophobicContact CG1-CB 4.2Å; I134-F200 HydrophobicContact CD1-CB 3.7Å; I134-F200 HydrophobicContact CD1-CD2 3.71Å; I134-F200 HydrophobicContact CD1-CE2 4.45Å; I134-F200 HydrophobicContact CD1-CG 3.75Å; I134-F200 HydrophobicContact CG1-CB 4Å; I134-D201 WeakPolarHBondContact O-CB 3.28Å; I134-D201 PolarHBondContact O-N 2.95Å; I134-L204 HydrophobicContact CB-CB 4.18Å; I134-L204 HydrophobicContact CG2-CB 4.07Å; I134-L205 HydrophobicContact CG2-CB 4.17Å
135	G	93.9	Very high	87.7	Confident	35 Å²	35	54.6 Å²	54.6	36%	0.361	30%	0.3	S	S	.	.			trans	67.7	36.3	-175.5	0	0	0	0	0	112.7	D133 N137	D133-G135 PolarHBondContact OD1-N 3.12Å; G135-N137 PolarHBondContact O-N 2.76Å
136	F	94.9	Very high	88.2	Confident	57 Å²	57	54.6 Å²	54.6	25%	0.25	30%	0.299	C	S	.	.			trans	-66.6	123	-177.6	-173.9	-101.6	0	0	0	111.4	I96 I113 I134 P138 W199 F200	I96-F136 HydrophobicContact CG2-CE2 3.73Å; I96-F136 HydrophobicContact CG2-CZ 4.24Å; I113-F136 HydrophobicContact CD1-CE1 4.38Å; I113-F136 HydrophobicContact CD1-CE2 3.88Å; I113-F136 HydrophobicContact CD1-CZ 3.57Å; I134-F136 HydrophobicContact CG1-CB 4.2Å; F136-P138 HydrophobicContact CD1-CB 4.23Å; F136-P138 HydrophobicContact CE1-CB 3.75Å; F136-W199 CarbonylContact C-O 3.49Å; F136-W199 WeakPolarHBondContact CA-O 3.4Å; F136-F200 HydrophobicContact CB-CB 4.43Å; F136-F200 HydrophobicContact CD2-CB 4.07Å; F136-F200 HydrophobicContact CD2-CD1 4.22Å; F136-F200 HydrophobicContact CE2-CD1 4.5Å
137	N	94.8	Very high	89.3	Confident	29 Å²	29	52.9 Å²	52.9	16%	0.155	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-108.7	107	178.7	-159.7	-45.1	0	0	0	110.3	G135 Q139 G198 W199	G135-N137 PolarHBondContact O-N 2.76Å; N137-Q139 PolarHBondContact O-N 3.03Å; N137-Q139 VanDerWaalsContact O-N 3.11Å; N137-Q139 WeakPolarHBondContact OD1-CG 3.49Å; N137-G198 WeakPolarHBondContact O-CA 3.43Å; N137-W199 HydrophobicContact CB-CD2 3.77Å; N137-W199 VanDerWaalsContact CB-CE2 3.44Å; N137-W199 HydrophobicContact CB-CE3 4.32Å; N137-W199 HydrophobicContact CB-CG 4.16Å; N137-W199 HydrophobicContact CB-CH2 4.33Å; N137-W199 HydrophobicContact CB-CZ2 3.77Å; N137-W199 PolarHBondContact N-O 2.9Å; N137-W199 WeakPolarHBondContact ND2-CZ2 3.22Å; N137-W199 PolarHBondContact O-N 2.82Å
138	P	94.2	Very high	90.9	Very high	81 Å²	81	54.6 Å²	54.6	53%	0.526	30%	0.303	S	S	.	.			trans	-86.7	35.6	-171.2	36.9	-38.9	0	0	0	113.5	F136 G140	F136-P138 HydrophobicContact CD1-CB 4.23Å; F136-P138 HydrophobicContact CE1-CB 3.75Å; P138-G140 PolarHBondContact O-N 2.65Å
139	Q	94.8	Very high	92.6	Very high	62 Å²	62	51.2 Å²	51.2	29%	0.29	28%	0.279	S	S	.	.			trans	-86.1	17.5	-175.6	-66.8	-72.3	1.2	0	0	113.7	N137 Y192 W199 L329 P332	N137-Q139 PolarHBondContact O-N 3.03Å; N137-Q139 VanDerWaalsContact O-N 3.11Å; N137-Q139 WeakPolarHBondContact OD1-CG 3.49Å; Q139-Y192 PolarHBondContact O-OH 3.13Å; Q139-W199 HydrophobicContact CB-CH2 3.92Å; Q139-W199 HydrophobicContact CB-CZ3 3.93Å; Q139-L329 PolarHBondContact NE2-O 2.95Å; Q139-P332 VanDerWaalsContact O-CA 3.24Å; Q139-P332 WeakPolarHBondContact O-CA 3.29Å; Q139-P332 VanDerWaalsContact O-CB 3.32Å; Q139-P332 WeakPolarHBondContact O-CB 3.32Å
140	G	96.9	Very high	94.3	Very high	1 Å²	1	46 Å²	46	1%	0.01	25%	0.253	C	S	.	.			trans	72.5	-178.6	172.6	0	0	0	0	0	114.3	P138 G193 E197 F333	P138-G140 PolarHBondContact O-N 2.65Å; G140-G193 WeakPolarHBondContact CA-O 3.2Å; G140-E197 WeakPolarHBondContact CA-O 3.4Å; G140-E197 PolarHBondContact N-O 3.3Å; G140-F333 PolarHBondContact O-N 3.31Å; G140-F333 VanDerWaalsContact O-N 3.11Å
141	C	98.4	Very high	95.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	134.5	170.1	170.8	0	0	0	0	110.4	R97 Q99 Y192 G193 E197 F333	R97-C141 HydrophobicContact CB-CB 4.32Å; Q99-C141 PolarHBondContact NE2-O 3.46Å; C141-Y192 WeakPolarHBondContact O-CA 3.4Å; C141-G193 PolarHBondContact N-O 2.87Å; C141-G193 PolarHBondContact O-N 2.79Å; C141-E197 HydrophobicContact CB-CB 3.98Å; C141-E197 WeakPolarHBondContact CB-OE2 3.13Å; C141-E197 PolarHBondContact N-OE2 3.45Å; C141-F333 CarbonylContact C-O 3.25Å; C141-F333 WeakPolarHBondContact CA-O 3.07Å; C141-F333 HydrophobicContact CB-CB 4.31Å; C141-F333 HydrophobicContact CB-CD1 3.92Å
142	L	98.7	Very high	96.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	117.3	179.7	175.4	66.3	0	0	0	109.3	L144 L175 W179 M182 C191 Y192 P332 F333 M334 I335	L142-L144 HydrophobicContact CD1-CD2 4.09Å; L142-L144 HydrophobicContact CD2-CD2 3.91Å; L142-L144 HydrophobicContact CG-CD2 3.86Å; L142-L144 HydrophobicContact CG-CG 4.37Å; L142-L175 HydrophobicContact CD1-CD2 3.93Å; L142-L175 HydrophobicContact CD2-CD2 4.25Å; L142-W179 HydrophobicContact CD1-CH2 4.38Å; L142-W179 HydrophobicContact CD1-CZ3 4.06Å; L142-W179 HydrophobicContact CD2-CE3 3.91Å; L142-W179 HydrophobicContact CD2-CH2 4.1Å; L142-W179 HydrophobicContact CD2-CZ3 3.61Å; L142-W179 HydrophobicContact CG-CZ3 4.41Å; L142-M182 HydrophobicContact CD2-CE 3.57Å; L142-M182 HydrophobicContact CD2-SD 4.2Å; L142-C191 WeakPolarHBondContact CA-O 3.28Å; L142-Y192 HydrophobicContact CB-CD2 4.22Å; L142-P332 HydrophobicContact CB-CB 4.08Å; L142-P332 HydrophobicContact CB-CG 3.64Å; L142-P332 HydrophobicContact CD2-CG 4.08Å; L142-F333 PolarHBondContact N-O 3.26Å; L142-M334 HydrophobicContact CD2-CG 4.44Å; L142-M334 CarbonylContact O-C 3.5Å; L142-M334 WeakPolarHBondContact O-CA 3.34Å; L142-I335 PolarHBondContact O-N 3.01Å
143	I	98.6	Very high	96.6	Very high	4 Å²	4	42 Å²	42	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.7	174	-54.1	-173.1	0	0	0	108.8	Q99 L153 G190 C191 I335 C480 F481	Q99-I143 HydrophobicContact CB-CD1 3.49Å; Q99-I143 VanDerWaalsContact CB-CD1 3.49Å; Q99-I143 HydrophobicContact CB-CG1 4.48Å; Q99-I143 HydrophobicContact CG-CD1 4.25Å; I143-L153 HydrophobicContact CG2-CD1 4.38Å; I143-G190 CarbonylContact O-C 3.54Å; I143-G190 VanDerWaalsContact O-CA 3.27Å; I143-G190 WeakPolarHBondContact O-CA 3.3Å; I143-C191 PolarHBondContact N-O 3.28Å; I143-C191 PolarHBondContact O-N 3.22Å; I143-I335 HydrophobicContact CD1-CD1 4.2Å; I143-I335 HydrophobicContact CG1-CB 4.23Å; I143-I335 HydrophobicContact CG1-CD1 4.09Å; I143-I335 HydrophobicContact CG1-CG1 4.43Å; I143-C480 WeakPolarHBondContact CG2-SG 3.39Å; I143-F481 HydrophobicContact CD1-CE1 4.11Å; I143-F481 HydrophobicContact CG2-CD1 3.67Å; I143-F481 HydrophobicContact CG2-CE1 4Å
144	L	98.7	Very high	96.8	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	136.9	-178.5	-59.2	177.7	0	0	0	110.9	L142 L175 M182 I187 M334 I335 H337	L142-L144 HydrophobicContact CD1-CD2 4.09Å; L142-L144 HydrophobicContact CD2-CD2 3.91Å; L142-L144 HydrophobicContact CG-CD2 3.86Å; L142-L144 HydrophobicContact CG-CG 4.37Å; L144-L175 HydrophobicContact CD2-CD1 3.95Å; L144-L175 HydrophobicContact CD2-CD2 4.4Å; L144-M182 HydrophobicContact CD1-SD 3.97Å; L144-M182 HydrophobicContact CD2-SD 4.3Å; L144-I187 HydrophobicContact CB-CD1 3.78Å; L144-I187 HydrophobicContact CB-CG1 4.45Å; L144-I187 HydrophobicContact CD1-CD1 4.28Å; L144-I187 HydrophobicContact CD1-CG1 4.37Å; L144-I187 HydrophobicContact CD2-CG2 4.31Å; L144-M334 HydrophobicContact CD1-CG 4.21Å; L144-M334 HydrophobicContact CD1-SD 3.88Å; L144-I335 PolarHBondContact N-O 3.38Å; L144-H337 WeakPolarHBondContact O-CB 3.23Å; L144-H337 PolarHBondContact O-N 2.9Å
145	A	98.4	Very high	97	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.9	174.6	0	0	0	0	0	111.2	N149 L153 E188 M189 C480	A145-N149 HydrophobicContact CB-CB 4.49Å; A145-L153 HydrophobicContact CB-CB 4.03Å; A145-L153 HydrophobicContact CB-CD2 3.85Å; A145-L153 HydrophobicContact CB-CG 4.36Å; A145-E188 PolarHBondContact O-N 3.14Å; A145-M189 PolarHBondContact N-O 3.32Å; A145-M189 PolarHBondContact O-N 2.59Å; A145-C480 HydrophobicContact CB-CB 4.44Å
146	N	97.6	Very high	97.2	Very high	27 Å²	27	45.8 Å²	45.8	14%	0.144	24%	0.238	C	C	.	.			trans	-84.7	179.2	167.3	67.9	25.5	0	0	0	110.5	K148 N149 V150 H337	N146-K148 PolarHBondContact O-N 2.93Å; N146-K148 VanDerWaalsContact O-N 3.11Å; N146-K148 WeakPolarHBondContact OD1-CA 3.18Å; N146-K148 VanDerWaalsContact OD1-CB 3.3Å; N146-K148 WeakPolarHBondContact OD1-CB 3.48Å; N146-K148 PolarHBondContact OD1-N 3.03Å; N146-N149 PolarHBondContact O-N 3.2Å; N146-N149 VanDerWaalsContact O-N 3.15Å; N146-N149 PolarHBondContact OD1-N 3.27Å; N146-N149 VanDerWaalsContact OD1-N 3.17Å; N146-V150 PolarHBondContact O-N 3.37Å; N146-V150 VanDerWaalsContact O-N 3.14Å; N146-H337 PolarHBondContact ND2-CE1 3.43Å; N146-H337 PolarHBondContact ND2-ND1 2.72Å
147	A	97.1	Very high	97.3	Very high	70 Å²	70	44.1 Å²	44.1	58%	0.579	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.8	179.1	0	0	0	0	0	114.8
148	K	96.8	Very high	97.5	Very high	186 Å²	186	48.8 Å²	48.8	81%	0.809	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-31.2	178.9	-62.1	178.8	177.8	178	0	112.5	N146	N146-K148 PolarHBondContact O-N 2.93Å; N146-K148 VanDerWaalsContact O-N 3.11Å; N146-K148 WeakPolarHBondContact OD1-CA 3.18Å; N146-K148 VanDerWaalsContact OD1-CB 3.3Å; N146-K148 WeakPolarHBondContact OD1-CB 3.48Å; N146-K148 PolarHBondContact OD1-N 3.03Å
149	N	96.1	Very high	97.7	Very high	46 Å²	46	47.3 Å²	47.3	25%	0.246	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	2.8	-168.8	-57.9	-3.9	0	0	0	112.7	A145 N146 D151 L152 L153 C480	A145-N149 HydrophobicContact CB-CB 4.49Å; N146-N149 PolarHBondContact O-N 3.2Å; N146-N149 VanDerWaalsContact O-N 3.15Å; N146-N149 PolarHBondContact OD1-N 3.27Å; N146-N149 VanDerWaalsContact OD1-N 3.17Å; N149-D151 PolarHBondContact O-N 3.47Å; N149-L152 PolarHBondContact O-N 2.92Å; N149-L153 PolarHBondContact O-N 3.39Å; N149-C480 HydrophobicContact CB-CB 4.01Å; N149-C480 VanDerWaalsContact CB-O 3.28Å; N149-C480 WeakPolarHBondContact CB-O 3.2Å; N149-C480 PolarHBondContact ND2-O 2.96Å
150	V	97.5	Very high	97.8	Very high	10 Å²	10	44.7 Å²	44.7	6%	0.061	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-36.9	-176	66.4	0	0	0	0	113.4	N146 L152 L153 K154 E188 M189	N146-V150 PolarHBondContact O-N 3.37Å; N146-V150 VanDerWaalsContact O-N 3.14Å; V150-L152 VanDerWaalsContact C-N 3.35Å; V150-L153 WeakPolarHBondContact O-CB 3.23Å; V150-L153 PolarHBondContact O-N 3.09Å; V150-K154 WeakPolarHBondContact O-CG 2.97Å; V150-K154 PolarHBondContact O-N 3.3Å; V150-E188 HydrophobicContact CB-CB 4.26Å; V150-E188 HydrophobicContact CB-CG 4.02Å; V150-E188 HydrophobicContact CG1-CG 4.16Å; V150-E188 HydrophobicContact CG2-CB 4.31Å; V150-E188 HydrophobicContact CG2-CG 3.84Å; V150-M189 HydrophobicContact CG2-CB 3.79Å; V150-M189 HydrophobicContact CG2-SD 4.18Å
151	D	97.8	Very high	97.9	Very high	114 Å²	114	48.7 Å²	48.7	61%	0.61	25%	0.25	S	S	*	.	H	α-helix	trans	-69.3	-38.2	-179.4	-67.6	-31.3	0	0	0	111.1	N149 K154 E155	N149-D151 PolarHBondContact O-N 3.47Å; D151-K154 PolarHBondContact O-N 3.38Å; D151-K154 IonicContact OD1-NZ 2.95Å; D151-E155 PolarHBondContact O-N 3.22Å
152	L	97.2	Very high	97.9	Very high	42 Å²	42	55 Å²	55	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-40.3	171.9	179	65.5	0	0	0	111.8	N149 V150 K154 E155 N156 V478 N479 C480	N149-L152 PolarHBondContact O-N 2.92Å; V150-L152 VanDerWaalsContact C-N 3.35Å; L152-K154 VanDerWaalsContact C-N 3.3Å; L152-K154 PolarHBondContact O-N 3.33Å; L152-E155 PolarHBondContact O-N 3.42Å; L152-N156 WeakPolarHBondContact O-CB 3.41Å; L152-N156 VanDerWaalsContact O-CG 3.28Å; L152-N156 PolarHBondContact O-N 3.19Å; L152-V478 HydrophobicContact CD1-CB 4.24Å; L152-V478 HydrophobicContact CD1-CG1 3.89Å; L152-V478 HydrophobicContact CD2-CB 4.44Å; L152-V478 HydrophobicContact CD2-CG1 3.57Å; L152-V478 HydrophobicContact CG-CG1 4.39Å; L152-N479 WeakPolarHBondContact CD2-O 3.44Å; L152-C480 HydrophobicContact CD2-CB 4.37Å
153	L	98	Very high	97.9	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-43.9	174.2	-175.1	79.8	0	0	0	111.1	I143 A145 N149 V150 H157 L169 M189 C191 C480	I143-L153 HydrophobicContact CG2-CD1 4.38Å; A145-L153 HydrophobicContact CB-CB 4.03Å; A145-L153 HydrophobicContact CB-CD2 3.85Å; A145-L153 HydrophobicContact CB-CG 4.36Å; N149-L153 PolarHBondContact O-N 3.39Å; V150-L153 WeakPolarHBondContact O-CB 3.23Å; V150-L153 PolarHBondContact O-N 3.09Å; L153-H157 VanDerWaalsContact O-CB 3.27Å; L153-H157 WeakPolarHBondContact O-CB 3.41Å; L153-H157 PolarHBondContact O-N 2.82Å; L153-L169 HydrophobicContact CD2-CD2 3.95Å; L153-L169 HydrophobicContact CG-CD2 4.13Å; L153-M189 HydrophobicContact CD2-CB 4.06Å; L153-M189 HydrophobicContact CD2-CG 4.01Å; L153-C191 HydrophobicContact CD1-CB 3.68Å; L153-C191 HydrophobicContact CD2-CB 4.16Å; L153-C191 HydrophobicContact CG-CB 4.08Å; L153-C480 HydrophobicContact CB-CB 4.22Å; L153-C480 HydrophobicContact CD1-CB 4.34Å; L153-C480 WeakPolarHBondContact CD1-SG 3.49Å
154	K	98.3	Very high	97.9	Very high	80 Å²	80	58.5 Å²	58.5	35%	0.348	31%	0.31	S	S	.	.	H	α-helix	trans	-67.2	-41.9	178.3	-70	169.1	-177.3	163.2	0	112.4	V150 D151 L152 H157 L158 L169 M189	V150-K154 WeakPolarHBondContact O-CG 2.97Å; V150-K154 PolarHBondContact O-N 3.3Å; D151-K154 PolarHBondContact O-N 3.38Å; D151-K154 IonicContact OD1-NZ 2.95Å; L152-K154 VanDerWaalsContact C-N 3.3Å; L152-K154 PolarHBondContact O-N 3.33Å; K154-H157 PolarHBondContact O-N 3.09Å; K154-L158 WeakPolarHBondContact O-CG 2.99Å; K154-L158 PolarHBondContact O-N 2.97Å; K154-L158 VanDerWaalsContact O-N 3.16Å; K154-L169 HydrophobicContact CG-CD1 3.98Å; K154-M189 HydrophobicContact CG-SD 4.18Å
155	E	97.6	Very high	97.8	Very high	133 Å²	133	58.8 Å²	58.8	62%	0.621	31%	0.312	S	S	*	.	H	α-helix	trans	-61.1	-50	176.1	-177.3	177.4	179.4	0	0	111.2	D151 L152 H157 L158 L159	D151-E155 PolarHBondContact O-N 3.22Å; L152-E155 PolarHBondContact O-N 3.42Å; E155-H157 VanDerWaalsContact C-N 3.32Å; E155-H157 PolarHBondContact O-N 3.15Å; E155-L158 PolarHBondContact O-N 3.35Å; E155-L159 PolarHBondContact O-N 3.17Å
156	N	98.2	Very high	97.8	Very high	14 Å²	14	62.4 Å²	62.4	8%	0.075	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-41.9	177	-72.4	-11.6	0	0	0	111.4	S101 L152 L158 L159 Q160 V478	S101-N156 VanDerWaalsContact CB-OD1 3.24Å; S101-N156 WeakPolarHBondContact CB-OD1 3.43Å; L152-N156 WeakPolarHBondContact O-CB 3.41Å; L152-N156 VanDerWaalsContact O-CG 3.28Å; L152-N156 PolarHBondContact O-N 3.19Å; N156-L158 VanDerWaalsContact C-N 3.33Å; N156-L158 PolarHBondContact O-N 3Å; N156-L159 PolarHBondContact O-N 2.72Å; N156-Q160 WeakPolarHBondContact O-CB 3.45Å; N156-Q160 WeakPolarHBondContact O-CG 3.48Å; N156-Q160 PolarHBondContact O-N 3.32Å; N156-Q160 PolarHBondContact O-NE2 2.95Å; N156-V478 PolarHBondContact ND2-O 3.09Å
157	H	98.4	Very high	97.9	Very high	21 Å²	21	61.3 Å²	61.3	10%	0.097	32%	0.322	C	S	.	.	H	α-helix	trans	-57.6	-41.3	177.3	174.2	-102.6	0	0	0	113	L153 K154 E155 Q160 I161 V167 L169	L153-H157 VanDerWaalsContact O-CB 3.27Å; L153-H157 WeakPolarHBondContact O-CB 3.41Å; L153-H157 PolarHBondContact O-N 2.82Å; K154-H157 PolarHBondContact O-N 3.09Å; E155-H157 VanDerWaalsContact C-N 3.32Å; E155-H157 PolarHBondContact O-N 3.15Å; H157-Q160 PolarHBondContact O-N 3.12Å; H157-I161 WeakPolarHBondContact CE1-CD1 3.4Å; H157-I161 VanDerWaalsContact NE2-CD1 3.28Å; H157-I161 WeakPolarHBondContact NE2-CD1 3.27Å; H157-I161 PolarHBondContact O-N 3.36Å; H157-V167 PolarHBondContact NE2-O 3.39Å; H157-V167 VanDerWaalsContact NE2-O 3.15Å; H157-L169 HydrophobicContact CB-CD1 4.29Å; H157-L169 HydrophobicContact CB-CD2 3.98Å; H157-L169 HydrophobicContact CB-CG 4.2Å
158	L	98.2	Very high	97.9	Very high	127 Å²	127	61.1 Å²	61.1	67%	0.665	31%	0.309	S	S	*	.	H	α-helix	trans	-62.5	-46.5	177.4	-69.4	173.1	0	0	0	111.8	K154 E155 N156 Q160 I161 D162	K154-L158 WeakPolarHBondContact O-CG 2.99Å; K154-L158 PolarHBondContact O-N 2.97Å; K154-L158 VanDerWaalsContact O-N 3.16Å; E155-L158 PolarHBondContact O-N 3.35Å; N156-L158 VanDerWaalsContact C-N 3.33Å; N156-L158 PolarHBondContact O-N 3Å; L158-Q160 VanDerWaalsContact C-N 3.34Å; L158-Q160 PolarHBondContact O-N 2.97Å; L158-I161 PolarHBondContact O-N 3.07Å; L158-D162 WeakPolarHBondContact O-CB 3.47Å; L158-D162 PolarHBondContact O-N 3.02Å
159	L	97.9	Very high	98	Very high	50 Å²	50	54.9 Å²	54.9	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-42.9	176.5	176.9	64.6	0	0	0	111.7	S101 P103 I106 E155 N156 I161 D162 L163	S101-L159 WeakPolarHBondContact O-CD2 3.5Å; P103-L159 HydrophobicContact CG-CD1 4.29Å; P103-L159 HydrophobicContact CG-CD2 4.23Å; I106-L159 HydrophobicContact CD1-CD2 4.03Å; I106-L159 HydrophobicContact CD1-CG 3.96Å; E155-L159 PolarHBondContact O-N 3.17Å; N156-L159 PolarHBondContact O-N 2.72Å; L159-I161 PolarHBondContact O-N 3.14Å; L159-D162 PolarHBondContact O-N 3.48Å; L159-L163 HydrophobicContact CD1-CD1 3.95Å; L159-L163 HydrophobicContact CD1-CG 4.33Å; L159-L163 HydrophobicContact CG-CD1 4.13Å; L159-L163 WeakPolarHBondContact O-CG 3.39Å; L159-L163 PolarHBondContact O-N 3.41Å; L159-L163 VanDerWaalsContact O-N 3.08Å
160	Q	98.4	Very high	98.1	Very high	7 Å²	7	53.3 Å²	53.3	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-46.6	179.2	-70.5	158.4	18.4	0	0	111.4	F100 I106 N156 H157 L158 L163 G164 A165 V167	F100-Q160 PolarHBondContact O-NE2 2.9Å; I106-Q160 HydrophobicContact CD1-CG 3.88Å; N156-Q160 WeakPolarHBondContact O-CB 3.45Å; N156-Q160 WeakPolarHBondContact O-CG 3.48Å; N156-Q160 PolarHBondContact O-N 3.32Å; N156-Q160 PolarHBondContact O-NE2 2.95Å; H157-Q160 PolarHBondContact O-N 3.12Å; L158-Q160 VanDerWaalsContact C-N 3.34Å; L158-Q160 PolarHBondContact O-N 2.97Å; Q160-L163 PolarHBondContact O-N 2.94Å; Q160-G164 PolarHBondContact O-N 2.84Å; Q160-A165 HydrophobicContact CB-CB 3.88Å; Q160-A165 WeakPolarHBondContact O-CB 3.12Å; Q160-A165 PolarHBondContact O-N 3.42Å; Q160-V167 HydrophobicContact CB-CG2 3.91Å
161	I	98.4	Very high	98.2	Very high	85 Å²	85	55.7 Å²	55.7	44%	0.436	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-44.2	175.9	-72.7	-173.4	0	0	0	111.5	H157 L158 L159 L163 G164 V167	H157-I161 WeakPolarHBondContact CE1-CD1 3.4Å; H157-I161 VanDerWaalsContact NE2-CD1 3.28Å; H157-I161 WeakPolarHBondContact NE2-CD1 3.27Å; H157-I161 PolarHBondContact O-N 3.36Å; L158-I161 PolarHBondContact O-N 3.07Å; L159-I161 PolarHBondContact O-N 3.14Å; I161-L163 PolarHBondContact O-N 3.13Å; I161-G164 WeakPolarHBondContact O-CA 3.31Å; I161-G164 PolarHBondContact O-N 3.28Å; I161-V167 HydrophobicContact CG1-CG2 3.95Å
162	D	98.5	Very high	98.2	Very high	134 Å²	134	54 Å²	54	72%	0.717	28%	0.278	S	S	*	.	H	α-helix	trans	-58.1	-37.1	-179.6	-171.9	64.2	0	0	0	111.8	L158 L159 G164	L158-D162 WeakPolarHBondContact O-CB 3.47Å; L158-D162 PolarHBondContact O-N 3.02Å; L159-D162 PolarHBondContact O-N 3.48Å; D162-G164 VanDerWaalsContact C-N 3.31Å; D162-G164 PolarHBondContact O-N 2.85Å
163	L	98.1	Very high	98.2	Very high	46 Å²	46	58 Å²	58	24%	0.241	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-1.9	176.1	-65.6	173.9	0	0	0	114.3	P103 I106 L110 L159 Q160 I161	P103-L163 HydrophobicContact CB-CD1 3.78Å; I106-L163 HydrophobicContact CB-CD1 3.96Å; I106-L163 HydrophobicContact CD1-CD1 3.68Å; I106-L163 HydrophobicContact CG1-CD1 4.37Å; I106-L163 HydrophobicContact CG2-CB 3.95Å; I106-L163 HydrophobicContact CG2-CD1 4.1Å; L110-L163 WeakPolarHBondContact CD1-O 3.34Å; L159-L163 HydrophobicContact CD1-CD1 3.95Å; L159-L163 HydrophobicContact CD1-CG 4.33Å; L159-L163 HydrophobicContact CG-CD1 4.13Å; L159-L163 WeakPolarHBondContact O-CG 3.39Å; L159-L163 PolarHBondContact O-N 3.41Å; L159-L163 VanDerWaalsContact O-N 3.08Å; Q160-L163 PolarHBondContact O-N 2.94Å; I161-L163 PolarHBondContact O-N 3.13Å
164	G	98	Very high	98.3	Very high	31 Å²	31	61.3 Å²	61.3	32%	0.32	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	9	172.8	0	0	0	0	0	116	Q160 I161 D162	Q160-G164 PolarHBondContact O-N 2.84Å; I161-G164 WeakPolarHBondContact O-CA 3.31Å; I161-G164 PolarHBondContact O-N 3.28Å; D162-G164 VanDerWaalsContact C-N 3.31Å; D162-G164 PolarHBondContact O-N 2.85Å
165	A	98.3	Very high	98.3	Very high	5 Å²	5	57.5 Å²	57.5	4%	0.041	30%	0.301	C	S	.	.			trans	-60.8	147.5	171	0	0	0	0	0	111.2	Q98 Q160 V167	Q98-A165 HydrophobicContact CB-CB 3.64Å; Q98-A165 HydrophobicContact CG-CB 4.35Å; Q160-A165 HydrophobicContact CB-CB 3.88Å; Q160-A165 WeakPolarHBondContact O-CB 3.12Å; Q160-A165 PolarHBondContact O-N 3.42Å; A165-V167 HydrophobicContact CB-CG1 4.26Å; A165-V167 HydrophobicContact CB-CG2 4.25Å; A165-V167 PolarHBondContact O-N 3.37Å
166	K	98.3	Very high	98.2	Very high	76 Å²	76	53.3 Å²	53.3	33%	0.33	29%	0.286	S	S	.	.			trans	-103.7	72.8	-176.1	-61.7	-54.4	-176.9	-163.4	0	109.9	G193 Y194 E195	K166-G193 CarbonylContact O-C 3.57Å; K166-G193 VanDerWaalsContact O-CA 3.28Å; K166-G193 WeakPolarHBondContact O-CA 3.43Å; K166-Y194 HydrophobicContact CB-CD2 4.23Å; K166-Y194 HydrophobicContact CB-CE1 4.28Å; K166-Y194 HydrophobicContact CB-CE2 3.72Å; K166-Y194 HydrophobicContact CD-CE2 4.48Å; K166-Y194 HydrophobicContact CG-CE2 4.44Å; K166-Y194 WeakPolarHBondContact O-CD1 3.1Å; K166-Y194 WeakPolarHBondContact O-CE1 3.18Å; K166-Y194 PolarHBondContact O-N 2.95Å; K166-E195 HydrophobicContact CB-CB 3.62Å; K166-E195 HydrophobicContact CG-CB 3.93Å; K166-E195 HydrophobicContact CG-CG 4.41Å
167	V	98.5	Very high	98.1	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.024	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.4	-171.3	-66.4	0	0	0	0	111.9	Q99 H157 Q160 I161 A165 Y192	Q99-V167 HydrophobicContact CG-CG1 3.65Å; H157-V167 PolarHBondContact NE2-O 3.39Å; H157-V167 VanDerWaalsContact NE2-O 3.15Å; Q160-V167 HydrophobicContact CB-CG2 3.91Å; I161-V167 HydrophobicContact CG1-CG2 3.95Å; A165-V167 HydrophobicContact CB-CG1 4.26Å; A165-V167 HydrophobicContact CB-CG2 4.25Å; A165-V167 PolarHBondContact O-N 3.37Å; V167-Y192 CarbonylContact C-O 3.34Å; V167-Y192 VanDerWaalsContact CA-O 3.31Å; V167-Y192 WeakPolarHBondContact CA-O 3.32Å
168	E	98.4	Very high	98.1	Very high	67 Å²	67	60.2 Å²	60.2	31%	0.313	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.7	177.1	65.6	-177.5	158.3	0	0	111.2	L170 R178 C191 Y192 Y194	E168-L170 HydrophobicContact CG-CD2 4.04Å; E168-L170 HydrophobicContact CG-CG 4.26Å; E168-R178 IonicContact OE1-CZ 2.9Å; E168-R178 IonicContact OE1-NH1 3.37Å; E168-R178 PolarHBondContact OE1-NH1 3.12Å; E168-C191 CarbonylContact O-C 3.56Å; E168-C191 WeakPolarHBondContact O-CA 3.32Å; E168-Y192 HydrophobicContact CG-CD1 4.26Å; E168-Y192 PolarHBondContact N-O 3.04Å; E168-Y192 PolarHBondContact O-N 3.46Å; E168-Y192 WeakPolarHBondContact OE1-CD1 3.4Å; E168-Y194 HydrophobicContact CB-CD1 4.2Å; E168-Y194 HydrophobicContact CB-CE1 4.27Å; E168-Y194 HydrophobicContact CG-CD1 4.03Å
169	L	98.7	Very high	98	Very high	55 Å²	55	54.2 Å²	54.2	29%	0.288	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.7	170	-66.7	175.6	0	0	0	109.4	L153 K154 H157 M189 G190 C191	L153-L169 HydrophobicContact CD2-CD2 3.95Å; L153-L169 HydrophobicContact CG-CD2 4.13Å; K154-L169 HydrophobicContact CG-CD1 3.98Å; H157-L169 HydrophobicContact CB-CD1 4.29Å; H157-L169 HydrophobicContact CB-CD2 3.98Å; H157-L169 HydrophobicContact CB-CG 4.2Å; L169-M189 HydrophobicContact CB-CG 4.48Å; L169-M189 HydrophobicContact CB-SD 4.07Å; L169-M189 HydrophobicContact CD1-SD 4Å; L169-M189 HydrophobicContact CD2-CG 4.39Å; L169-M189 HydrophobicContact CD2-SD 4.06Å; L169-M189 HydrophobicContact CG-SD 4.27Å; L169-G190 CarbonylContact C-O 3.56Å; L169-G190 WeakPolarHBondContact CA-O 3.49Å; L169-C191 HydrophobicContact CD2-CB 3.92Å
170	L	98.7	Very high	97.8	Very high	12 Å²	12	56 Å²	56	6%	0.063	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128	-179.6	-61.9	178.1	0	0	0	109.3	E168 D174 L175 W179 M189 G190	E168-L170 HydrophobicContact CG-CD2 4.04Å; E168-L170 HydrophobicContact CG-CG 4.26Å; L170-D174 HydrophobicContact CB-CB 4.06Å; L170-D174 HydrophobicContact CD2-CB 4.09Å; L170-L175 HydrophobicContact CB-CD2 3.81Å; L170-L175 HydrophobicContact CB-CG 4.04Å; L170-L175 HydrophobicContact CD1-CD2 3.88Å; L170-W179 HydrophobicContact CD1-CH2 4.06Å; L170-W179 HydrophobicContact CD1-CZ3 3.72Å; L170-M189 WeakPolarHBondContact O-CA 3.18Å; L170-M189 WeakPolarHBondContact O-CG 3.45Å; L170-G190 PolarHBondContact N-O 2.74Å; L170-G190 PolarHBondContact O-N 3.48Å
171	T	98.3	Very high	97.6	Very high	61 Å²	61	56.3 Å²	56.3	37%	0.374	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	165.5	172.4	68	0	0	0	0	110.6	D173 D174 L175	T171-D173 PolarHBondContact O-N 2.98Å; T171-D173 PolarHBondContact OG1-N 3.31Å; T171-D174 WeakPolarHBondContact CB-OD2 3.35Å; T171-D174 WeakPolarHBondContact CG2-OD2 3.42Å; T171-D174 PolarHBondContact N-OD2 3.48Å; T171-D174 PolarHBondContact O-N 3.48Å; T171-D174 VanDerWaalsContact O-N 3.11Å; T171-D174 PolarHBondContact OG1-N 2.88Å; T171-D174 PolarHBondContact OG1-OD2 3.3Å; T171-L175 WeakPolarHBondContact O-CG 3.48Å; T171-L175 PolarHBondContact O-N 3.3Å
172	K	97.7	Very high	97.5	Very high	78 Å²	78	52.7 Å²	52.7	34%	0.339	29%	0.293	S	S	.	.	H	α-helix	trans	-51.7	-38.1	172.1	-174.8	174.8	178.2	157.7	0	113.3	S176 V184 E185	K172-S176 WeakPolarHBondContact O-CB 3.39Å; K172-S176 PolarHBondContact O-N 3.39Å; K172-S176 PolarHBondContact O-OG 3.32Å; K172-V184 HydrophobicContact CD-CG2 4.35Å; K172-V184 WeakPolarHBondContact CE-O 3.43Å; K172-V184 HydrophobicContact CG-CB 4.03Å; K172-V184 HydrophobicContact CG-CG2 3.53Å; K172-V184 PolarHBondContact NZ-O 2.67Å; K172-E185 PolarHBondContact NZ-O 2.91Å
173	D	98.2	Very high	97.4	Very high	126 Å²	126	48.1 Å²	48.1	67%	0.674	27%	0.269	S	S	*	.	H	α-helix	trans	-71.3	-41.7	178.4	-69	-15.8	0	0	0	111.2	T171 L175 S176 A177	T171-D173 PolarHBondContact O-N 2.98Å; T171-D173 PolarHBondContact OG1-N 3.31Å; D173-L175 VanDerWaalsContact C-N 3.34Å; D173-L175 PolarHBondContact O-N 3.45Å; D173-S176 PolarHBondContact O-N 2.9Å; D173-A177 WeakPolarHBondContact O-CB 3.47Å; D173-A177 PolarHBondContact O-N 2.72Å
174	D	98.5	Very high	97.4	Very high	75 Å²	75	46.3 Å²	46.3	40%	0.401	26%	0.26	S	S	.	.	H	α-helix	trans	-61.3	-43.3	175.2	-58.8	-48.7	0	0	0	111.4	L170 T171 A177 R178	L170-D174 HydrophobicContact CB-CB 4.06Å; L170-D174 HydrophobicContact CD2-CB 4.09Å; T171-D174 WeakPolarHBondContact CB-OD2 3.35Å; T171-D174 WeakPolarHBondContact CG2-OD2 3.42Å; T171-D174 PolarHBondContact N-OD2 3.48Å; T171-D174 PolarHBondContact O-N 3.48Å; T171-D174 VanDerWaalsContact O-N 3.11Å; T171-D174 PolarHBondContact OG1-N 2.88Å; T171-D174 PolarHBondContact OG1-OD2 3.3Å; D174-A177 PolarHBondContact O-N 3.1Å; D174-R178 VanDerWaalsContact O-CB 3.28Å; D174-R178 WeakPolarHBondContact O-CB 3.49Å; D174-R178 PolarHBondContact O-N 2.84Å
175	L	98.5	Very high	97.3	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-47.1	176.3	-67.9	175	0	0	0	111.4	L142 L144 L170 T171 D173 A177 R178 W179 V184 I187	L142-L175 HydrophobicContact CD1-CD2 3.93Å; L142-L175 HydrophobicContact CD2-CD2 4.25Å; L144-L175 HydrophobicContact CD2-CD1 3.95Å; L144-L175 HydrophobicContact CD2-CD2 4.4Å; L170-L175 HydrophobicContact CB-CD2 3.81Å; L170-L175 HydrophobicContact CB-CG 4.04Å; L170-L175 HydrophobicContact CD1-CD2 3.88Å; T171-L175 WeakPolarHBondContact O-CG 3.48Å; T171-L175 PolarHBondContact O-N 3.3Å; D173-L175 VanDerWaalsContact C-N 3.34Å; D173-L175 PolarHBondContact O-N 3.45Å; L175-A177 VanDerWaalsContact C-N 3.32Å; L175-A177 PolarHBondContact O-N 2.96Å; L175-R178 PolarHBondContact O-N 3.3Å; L175-W179 HydrophobicContact CD2-CE3 3.97Å; L175-W179 HydrophobicContact CD2-CZ3 3.71Å; L175-W179 PolarHBondContact O-N 2.89Å; L175-V184 HydrophobicContact CB-CG1 3.94Å; L175-V184 HydrophobicContact CD1-CG1 4.25Å; L175-I187 HydrophobicContact CD1-CG2 3.75Å
176	S	96.5	Very high	97.3	Very high	45 Å²	45	53.6 Å²	53.6	32%	0.315	29%	0.286	S	S	.	.	H	α-helix	trans	-64.2	-37.7	179.4	-57.4	0	0	0	0	112.1	K172 D173 P180 V184	K172-S176 WeakPolarHBondContact O-CB 3.39Å; K172-S176 PolarHBondContact O-N 3.39Å; K172-S176 PolarHBondContact O-OG 3.32Å; D173-S176 PolarHBondContact O-N 2.9Å; S176-P180 WeakPolarHBondContact O-CA 3.49Å; S176-P180 WeakPolarHBondContact O-CG 3.2Å; S176-V184 WeakPolarHBondContact OG-CG2 3.42Å
177	A	96.7	Very high	97.3	Very high	81 Å²	81	50.2 Å²	50.2	67%	0.669	27%	0.271	S	S	*	.	H	α-helix	trans	-70.5	-41.2	178.1	0	0	0	0	0	111.8	D173 D174 L175	D173-A177 WeakPolarHBondContact O-CB 3.47Å; D173-A177 PolarHBondContact O-N 2.72Å; D174-A177 PolarHBondContact O-N 3.1Å; L175-A177 VanDerWaalsContact C-N 3.32Å; L175-A177 PolarHBondContact O-N 2.96Å
178	R	96.8	Very high	97.3	Very high	99 Å²	99	55 Å²	55	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-78.5	-40.5	-177.2	-168.8	171.8	-174.3	163.7	3.1	112.8	E168 D174 L175	E168-R178 IonicContact OE1-CZ 2.9Å; E168-R178 IonicContact OE1-NH1 3.37Å; E168-R178 PolarHBondContact OE1-NH1 3.12Å; D174-R178 VanDerWaalsContact O-CB 3.28Å; D174-R178 WeakPolarHBondContact O-CB 3.49Å; D174-R178 PolarHBondContact O-N 2.84Å; L175-R178 PolarHBondContact O-N 3.3Å
179	W	96.3	Very high	97.3	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	29%	0.285	C	S	.	.			trans	-128.9	76	-179.3	-61.4	-63.8	0	0	0	111.3	L142 L170 L175 W181 M182 Y192 D330 P332	L142-W179 HydrophobicContact CD1-CH2 4.38Å; L142-W179 HydrophobicContact CD1-CZ3 4.06Å; L142-W179 HydrophobicContact CD2-CE3 3.91Å; L142-W179 HydrophobicContact CD2-CH2 4.1Å; L142-W179 HydrophobicContact CD2-CZ3 3.61Å; L142-W179 HydrophobicContact CG-CZ3 4.41Å; L170-W179 HydrophobicContact CD1-CH2 4.06Å; L170-W179 HydrophobicContact CD1-CZ3 3.72Å; L175-W179 HydrophobicContact CD2-CE3 3.97Å; L175-W179 HydrophobicContact CD2-CZ3 3.71Å; L175-W179 PolarHBondContact O-N 2.89Å; W179-W181 HydrophobicContact CB-CD2 4.28Å; W179-W181 HydrophobicContact CB-CH2 4.37Å; W179-W181 HydrophobicContact CB-CZ2 3.74Å; W179-W181 AromaticContact CD1-CE2 3.79Å; W179-W181 AromaticContact CD1-CZ2 3.47Å; W179-W181 VanDerWaalsContact CD1-CZ2 3.47Å; W179-W181 AromaticContact CD1-NE1 3.7Å; W179-W181 AromaticContact CG-CE2 4Å; W179-W181 HydrophobicContact CG-CH2 4.43Å; W179-W181 AromaticContact CG-CZ2 3.68Å; W179-W181 HydrophobicContact CG-CZ2 3.68Å; W179-W181 PolarHBondContact O-N 3.38Å; W179-M182 HydrophobicContact CB-CB 4.26Å; W179-M182 HydrophobicContact CB-CE 3.81Å; W179-M182 HydrophobicContact CD2-CE 4.13Å; W179-M182 HydrophobicContact CE3-CE 3.98Å; W179-M182 HydrophobicContact CG-CE 4.1Å; W179-M182 VanDerWaalsContact O-CB 3.28Å; W179-M182 WeakPolarHBondContact O-CB 3.32Å; W179-M182 PolarHBondContact O-N 3.25Å; W179-Y192 HydrophobicContact CH2-CD1 4.43Å; W179-Y192 AromaticContact CH2-CD2 3.88Å; W179-Y192 HydrophobicContact CH2-CD2 3.88Å; W179-Y192 HydrophobicContact CH2-CE2 4.25Å; W179-Y192 AromaticContact CH2-CG 3.98Å; W179-Y192 HydrophobicContact CH2-CG 3.98Å; W179-Y192 HydrophobicContact CZ2-CD2 4.34Å; W179-Y192 HydrophobicContact CZ2-CE2 4.26Å; W179-D330 PolarHBondContact NE1-O 2.83Å; W179-P332 HydrophobicContact CH2-CG 4.28Å; W179-P332 HydrophobicContact CZ2-CB 4.49Å; W179-P332 HydrophobicContact CZ2-CG 3.8Å
180	P	93.9	Very high	97.3	Very high	88 Å²	88	50.6 Å²	50.6	57%	0.571	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.5	-175.8	-23.4	33.7	0	0	0	115.3	S176 M182	S176-P180 WeakPolarHBondContact O-CA 3.49Å; S176-P180 WeakPolarHBondContact O-CG 3.2Å; P180-M182 VanDerWaalsContact C-N 3.28Å
181	W	93.9	Very high	97.3	Very high	13 Å²	13	50 Å²	50	5%	0.049	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.5	174.2	50.6	-102.2	0	0	0	113.4	W179 P325 P327 M331 M334 I390	W179-W181 HydrophobicContact CB-CD2 4.28Å; W179-W181 HydrophobicContact CB-CH2 4.37Å; W179-W181 HydrophobicContact CB-CZ2 3.74Å; W179-W181 AromaticContact CD1-CE2 3.79Å; W179-W181 AromaticContact CD1-CZ2 3.47Å; W179-W181 VanDerWaalsContact CD1-CZ2 3.47Å; W179-W181 AromaticContact CD1-NE1 3.7Å; W179-W181 AromaticContact CG-CE2 4Å; W179-W181 HydrophobicContact CG-CH2 4.43Å; W179-W181 AromaticContact CG-CZ2 3.68Å; W179-W181 HydrophobicContact CG-CZ2 3.68Å; W179-W181 PolarHBondContact O-N 3.38Å; W181-P325 HydrophobicContact CB-CB 4.11Å; W181-P325 HydrophobicContact CB-CG 4.06Å; W181-P325 WeakPolarHBondContact CB-O 3.39Å; W181-P327 HydrophobicContact CD2-CB 3.93Å; W181-P327 HydrophobicContact CD2-CG 3.85Å; W181-P327 HydrophobicContact CE3-CB 4.24Å; W181-P327 HydrophobicContact CE3-CG 3.77Å; W181-P327 HydrophobicContact CG-CB 4.4Å; W181-P327 HydrophobicContact CG-CG 4.34Å; W181-P327 HydrophobicContact CH2-CB 4.34Å; W181-P327 HydrophobicContact CH2-CG 4.47Å; W181-P327 HydrophobicContact CZ2-CB 4.02Å; W181-P327 HydrophobicContact CZ3-CB 4.44Å; W181-P327 HydrophobicContact CZ3-CG 4.1Å; W181-M331 HydrophobicContact CH2-CE 4.34Å; W181-M331 HydrophobicContact CH2-CG 3.89Å; W181-M331 HydrophobicContact CH2-SD 4.25Å; W181-M331 HydrophobicContact CZ2-CB 4.06Å; W181-M331 HydrophobicContact CZ2-CG 3.93Å; W181-M334 HydrophobicContact CZ3-CE 4.42Å; W181-I390 HydrophobicContact CE3-CD1 4.4Å; W181-I390 HydrophobicContact CE3-CG1 4.14Å; W181-I390 HydrophobicContact CE3-CG2 4.29Å; W181-I390 HydrophobicContact CZ3-CD1 3.99Å; W181-I390 HydrophobicContact CZ3-CG1 3.97Å
182	M	96.2	Very high	97.3	Very high	9 Å²	9	47.7 Å²	47.7	4%	0.044	25%	0.253	C	S	.	.	S	Bend	trans	-88.4	126.5	-177.7	-166.2	-176.9	-51.6	0	0	110	L142 L144 W179 P180 V184 M334 R389	L142-M182 HydrophobicContact CD2-CE 3.57Å; L142-M182 HydrophobicContact CD2-SD 4.2Å; L144-M182 HydrophobicContact CD1-SD 3.97Å; L144-M182 HydrophobicContact CD2-SD 4.3Å; W179-M182 HydrophobicContact CB-CB 4.26Å; W179-M182 HydrophobicContact CB-CE 3.81Å; W179-M182 HydrophobicContact CD2-CE 4.13Å; W179-M182 HydrophobicContact CE3-CE 3.98Å; W179-M182 HydrophobicContact CG-CE 4.1Å; W179-M182 VanDerWaalsContact O-CB 3.28Å; W179-M182 WeakPolarHBondContact O-CB 3.32Å; W179-M182 PolarHBondContact O-N 3.25Å; P180-M182 VanDerWaalsContact C-N 3.28Å; M182-V184 HydrophobicContact CB-CG1 4.47Å; M182-V184 HydrophobicContact CG-CG1 4.11Å; M182-V184 HydrophobicContact SD-CG1 4.1Å; M182-M334 HydrophobicContact CE-SD 3.74Å; M182-M334 HydrophobicContact CG-SD 4.5Å; M182-M334 HydrophobicContact SD-SD 3.97Å; M182-R389 HydrophobicContact CG-CG 4.46Å
183	N	97	Very high	97.3	Very high	39 Å²	39	44 Å²	44	21%	0.209	24%	0.237	C	C	.	.			trans	-73.5	129.8	164.7	179.8	14.7	0	0	0	108.4	E185 K388 R389 P391	N183-E185 WeakPolarHBondContact OD1-CB 3.49Å; N183-E185 PolarHBondContact OD1-N 2.94Å; N183-K388 WeakPolarHBondContact CB-O 3.35Å; N183-K388 PolarHBondContact ND2-O 3.38Å; N183-R389 PolarHBondContact N-O 2.93Å; N183-R389 PolarHBondContact O-NH1 3.07Å; N183-P391 HydrophobicContact CB-CG 3.8Å
184	V	97.6	Very high	97.2	Very high	8 Å²	8	43.3 Å²	43.3	5%	0.048	23%	0.225	C	C	.	.			trans	-124.5	15.4	178.1	-62.5	0	0	0	0	112.3	K172 L175 S176 M182 D186 I187	K172-V184 HydrophobicContact CD-CG2 4.35Å; K172-V184 WeakPolarHBondContact CE-O 3.43Å; K172-V184 HydrophobicContact CG-CB 4.03Å; K172-V184 HydrophobicContact CG-CG2 3.53Å; K172-V184 PolarHBondContact NZ-O 2.67Å; L175-V184 HydrophobicContact CB-CG1 3.94Å; L175-V184 HydrophobicContact CD1-CG1 4.25Å; S176-V184 WeakPolarHBondContact OG-CG2 3.42Å; M182-V184 HydrophobicContact CB-CG1 4.47Å; M182-V184 HydrophobicContact CG-CG1 4.11Å; M182-V184 HydrophobicContact SD-CG1 4.1Å; V184-D186 PolarHBondContact O-N 2.98Å; V184-I187 HydrophobicContact CB-CB 4.17Å; V184-I187 HydrophobicContact CB-CG1 4.48Å; V184-I187 PolarHBondContact O-N 3.03Å
185	E	97.1	Very high	97.2	Very high	150 Å²	150	43.2 Å²	43.2	70%	0.701	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-44.1	-177.4	-173.2	-177.1	175.8	0	0	112.2	K172 N183	K172-E185 PolarHBondContact NZ-O 2.91Å; N183-E185 WeakPolarHBondContact OD1-CB 3.49Å; N183-E185 PolarHBondContact OD1-N 2.94Å
186	D	97.5	Very high	97.1	Very high	39 Å²	39	44.1 Å²	44.1	21%	0.209	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	9.9	-178.5	75	-31.3	0	0	0	114.7	V184 H337 K388 R389	V184-D186 PolarHBondContact O-N 2.98Å; D186-H337 IonicContact OD2-CE1 2.67Å; D186-H337 IonicContact OD2-NE2 3.63Å; D186-H337 PolarHBondContact OD2-NE2 3.12Å; D186-K388 WeakPolarHBondContact OD2-CE 3.4Å; D186-K388 IonicContact OD2-NZ 3.77Å; D186-K388 PolarHBondContact OD2-NZ 3.26Å; D186-R389 IonicContact OD1-CZ 3.65Å; D186-R389 IonicContact OD1-NH1 2.82Å; D186-R389 PolarHBondContact OD1-NH1 3.44Å; D186-R389 IonicContact OD1-NH2 3.55Å; D186-R389 PolarHBondContact OD1-NH2 3.08Å; D186-R389 IonicContact OD2-NH2 3.95Å
187	I	98.3	Very high	97.2	Very high	4 Å²	4	42 Å²	42	2%	0.021	21%	0.213	C	C	.	.			trans	-104	133.9	-179.8	-60.6	-54.2	0	0	0	109.9	L144 L175 V184	L144-I187 HydrophobicContact CB-CD1 3.78Å; L144-I187 HydrophobicContact CB-CG1 4.45Å; L144-I187 HydrophobicContact CD1-CD1 4.28Å; L144-I187 HydrophobicContact CD1-CG1 4.37Å; L144-I187 HydrophobicContact CD2-CG2 4.31Å; L175-I187 HydrophobicContact CD1-CG2 3.75Å; V184-I187 HydrophobicContact CB-CB 4.17Å; V184-I187 HydrophobicContact CB-CG1 4.48Å; V184-I187 PolarHBondContact O-N 3.03Å
188	E	97.9	Very high	97.2	Very high	106 Å²	106	38.2 Å²	38.2	50%	0.495	18%	0.181	S	C	.	.	S	Bend	trans	-91.5	-44.3	173	-171.4	66.7	-162.5	0	0	110.3	A145 V150	A145-E188 PolarHBondContact O-N 3.14Å; V150-E188 HydrophobicContact CB-CB 4.26Å; V150-E188 HydrophobicContact CB-CG 4.02Å; V150-E188 HydrophobicContact CG1-CG 4.16Å; V150-E188 HydrophobicContact CG2-CB 4.31Å; V150-E188 HydrophobicContact CG2-CG 3.84Å
189	M	98.4	Very high	97.1	Very high	29 Å²	29	34 Å²	34	14%	0.143	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	153	-174.2	-165.9	163.8	-80.3	0	0	111.3	A145 V150 L153 K154 L169 L170	A145-M189 PolarHBondContact N-O 3.32Å; A145-M189 PolarHBondContact O-N 2.59Å; V150-M189 HydrophobicContact CG2-CB 3.79Å; V150-M189 HydrophobicContact CG2-SD 4.18Å; L153-M189 HydrophobicContact CD2-CB 4.06Å; L153-M189 HydrophobicContact CD2-CG 4.01Å; K154-M189 HydrophobicContact CG-SD 4.18Å; L169-M189 HydrophobicContact CB-CG 4.48Å; L169-M189 HydrophobicContact CB-SD 4.07Å; L169-M189 HydrophobicContact CD1-SD 4Å; L169-M189 HydrophobicContact CD2-CG 4.39Å; L169-M189 HydrophobicContact CD2-SD 4.06Å; L169-M189 HydrophobicContact CG-SD 4.27Å; L170-M189 WeakPolarHBondContact O-CA 3.18Å; L170-M189 WeakPolarHBondContact O-CG 3.45Å
190	G	98.5	Very high	97.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	155.1	167.5	0	0	0	0	0	111.6	I143 L169 L170	I143-G190 CarbonylContact O-C 3.54Å; I143-G190 VanDerWaalsContact O-CA 3.27Å; I143-G190 WeakPolarHBondContact O-CA 3.3Å; L169-G190 CarbonylContact C-O 3.56Å; L169-G190 WeakPolarHBondContact CA-O 3.49Å; L170-G190 PolarHBondContact N-O 2.74Å; L170-G190 PolarHBondContact O-N 3.48Å
191	C	98.7	Very high	97.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.7	166.6	-172.4	0	0	0	0	108.7	Q99 L142 I143 L153 E168 L169	Q99-C191 PolarHBondContact NE2-O 2.96Å; Q99-C191 VanDerWaalsContact OE1-CB 3.22Å; Q99-C191 PolarHBondContact OE1-O 3.17Å; Q99-C191 PolarHBondContact OE1-SG 3.37Å; L142-C191 WeakPolarHBondContact CA-O 3.28Å; I143-C191 PolarHBondContact N-O 3.28Å; I143-C191 PolarHBondContact O-N 3.22Å; L153-C191 HydrophobicContact CD1-CB 3.68Å; L153-C191 HydrophobicContact CD2-CB 4.16Å; L153-C191 HydrophobicContact CG-CB 4.08Å; E168-C191 CarbonylContact O-C 3.56Å; E168-C191 WeakPolarHBondContact O-CA 3.32Å; L169-C191 HydrophobicContact CD2-CB 3.92Å
192	Y	98.7	Very high	97.3	Very high	12 Å²	12	33.4 Å²	33.4	5%	0.047	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.4	-176.2	176.6	-117.1	0	0	0	110.6	Q139 C141 L142 V167 E168 W179 Y194 P332	Q139-Y192 PolarHBondContact O-OH 3.13Å; C141-Y192 WeakPolarHBondContact O-CA 3.4Å; L142-Y192 HydrophobicContact CB-CD2 4.22Å; V167-Y192 CarbonylContact C-O 3.34Å; V167-Y192 VanDerWaalsContact CA-O 3.31Å; V167-Y192 WeakPolarHBondContact CA-O 3.32Å; E168-Y192 HydrophobicContact CG-CD1 4.26Å; E168-Y192 PolarHBondContact N-O 3.04Å; E168-Y192 PolarHBondContact O-N 3.46Å; E168-Y192 WeakPolarHBondContact OE1-CD1 3.4Å; W179-Y192 HydrophobicContact CH2-CD1 4.43Å; W179-Y192 AromaticContact CH2-CD2 3.88Å; W179-Y192 HydrophobicContact CH2-CD2 3.88Å; W179-Y192 HydrophobicContact CH2-CE2 4.25Å; W179-Y192 AromaticContact CH2-CG 3.98Å; W179-Y192 HydrophobicContact CH2-CG 3.98Å; W179-Y192 HydrophobicContact CZ2-CD2 4.34Å; W179-Y192 HydrophobicContact CZ2-CE2 4.26Å; Y192-Y194 VanDerWaalsContact CE1-CA 3.4Å; Y192-Y194 VanDerWaalsContact CE1-CB 3.41Å; Y192-Y194 PolarHBondContact O-N 3.33Å; Y192-P332 HydrophobicContact CD2-CB 4.29Å; Y192-P332 HydrophobicContact CE2-CB 3.81Å
193	G	98.4	Very high	97.3	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	104.5	166.8	0	0	0	0	0	110.7	G140 C141 K166 E195 E197	G140-G193 WeakPolarHBondContact CA-O 3.2Å; C141-G193 PolarHBondContact N-O 2.87Å; C141-G193 PolarHBondContact O-N 2.79Å; K166-G193 CarbonylContact O-C 3.57Å; K166-G193 VanDerWaalsContact O-CA 3.28Å; K166-G193 WeakPolarHBondContact O-CA 3.43Å; G193-E195 VanDerWaalsContact C-N 3.33Å; G193-E197 WeakPolarHBondContact CA-OE2 3.39Å; G193-E197 PolarHBondContact N-OE2 2.74Å
194	Y	96.8	Very high	97.2	Very high	111 Å²	111	38.1 Å²	38.1	44%	0.435	18%	0.18	S	C	.	.			trans	-84.6	-9.2	-175.7	58	-96.7	0	0	0	113.6	K166 E168 Y192	K166-Y194 HydrophobicContact CB-CD2 4.23Å; K166-Y194 HydrophobicContact CB-CE1 4.28Å; K166-Y194 HydrophobicContact CB-CE2 3.72Å; K166-Y194 HydrophobicContact CD-CE2 4.48Å; K166-Y194 HydrophobicContact CG-CE2 4.44Å; K166-Y194 WeakPolarHBondContact O-CD1 3.1Å; K166-Y194 WeakPolarHBondContact O-CE1 3.18Å; K166-Y194 PolarHBondContact O-N 2.95Å; E168-Y194 HydrophobicContact CB-CD1 4.2Å; E168-Y194 HydrophobicContact CB-CE1 4.27Å; E168-Y194 HydrophobicContact CG-CD1 4.03Å; Y192-Y194 VanDerWaalsContact CE1-CA 3.4Å; Y192-Y194 VanDerWaalsContact CE1-CB 3.41Å; Y192-Y194 PolarHBondContact O-N 3.33Å
195	E	97.1	Very high	97.2	Very high	74 Å²	74	37.8 Å²	37.8	35%	0.346	18%	0.178	S	C	.	.	S	Bend	trans	-146.2	154.4	175.4	-172.6	-173.9	170	0	0	108.7	Q98 R117 K166 G193 E197	Q98-E195 PolarHBondContact OE1-O 2.82Å; R117-E195 IonicContact CZ-OE1 3.99Å; R117-E195 IonicContact NH1-OE1 3.33Å; R117-E195 PolarHBondContact NH1-OE1 2.89Å; R117-E195 IonicContact NH2-OE1 3.73Å; K166-E195 HydrophobicContact CB-CB 3.62Å; K166-E195 HydrophobicContact CG-CB 3.93Å; K166-E195 HydrophobicContact CG-CG 4.41Å; G193-E195 VanDerWaalsContact C-N 3.33Å; E195-E197 PolarHBondContact O-N 3.2Å; E195-E197 VanDerWaalsContact O-N 3.11Å
196	N	97	Very high	97.2	Very high	19 Å²	19	30.8 Å²	30.8	10%	0.102	15%	0.145	C	C	.	.	S	Bend	trans	67.5	-0.3	178	-65.5	-46.5	0	0	0	116.1	Q98 I113 R117	Q98-N196 PolarHBondContact NE2-O 2.97Å; I113-N196 HydrophobicContact CB-CB 4.4Å; I113-N196 WeakPolarHBondContact CD1-O 3.32Å; I113-N196 HydrophobicContact CG1-CB 3.84Å; I113-N196 WeakPolarHBondContact CG1-O 3.27Å; I113-N196 HydrophobicContact CG2-CB 3.91Å; R117-N196 PolarHBondContact NE-OD1 3.18Å; R117-N196 PolarHBondContact NH1-OD1 3.36Å; R117-N196 PolarHBondContact NH2-OD1 3.08Å
197	E	97.8	Very high	97.1	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	16%	0.161	C	C	.	.			trans	-111.5	155.6	175.1	-50.9	-163.3	141.8	0	0	111.6	I96 R97 Q98 Q99 G140 C141 G193 E195	I96-E197 CarbonylContact O-C 3.51Å; I96-E197 WeakPolarHBondContact O-CA 3.42Å; I96-E197 WeakPolarHBondContact O-CB 3.39Å; R97-E197 WeakPolarHBondContact CA-OE1 3.3Å; R97-E197 HydrophobicContact CB-CG 4.35Å; R97-E197 WeakPolarHBondContact CB-OE1 3.17Å; Q98-E197 PolarHBondContact N-OE1 2.85Å; Q99-E197 WeakPolarHBondContact CG-OE1 3.49Å; Q99-E197 PolarHBondContact N-OE1 3.03Å; Q99-E197 PolarHBondContact NE2-OE2 2.71Å; G140-E197 WeakPolarHBondContact CA-O 3.4Å; G140-E197 PolarHBondContact N-O 3.3Å; C141-E197 HydrophobicContact CB-CB 3.98Å; C141-E197 WeakPolarHBondContact CB-OE2 3.13Å; C141-E197 PolarHBondContact N-OE2 3.45Å; G193-E197 WeakPolarHBondContact CA-OE2 3.39Å; G193-E197 PolarHBondContact N-OE2 2.74Å; E195-E197 PolarHBondContact O-N 3.2Å; E195-E197 VanDerWaalsContact O-N 3.11Å
198	G	96.3	Very high	97	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.7	-157.9	-178	0	0	0	0	0	113.1	S95 I96 N137	S95-G198 CarbonylContact C-O 3.57Å; S95-G198 WeakPolarHBondContact CA-O 3.23Å; I96-G198 PolarHBondContact N-O 2.8Å; I96-G198 PolarHBondContact O-N 2.83Å; N137-G198 WeakPolarHBondContact O-CA 3.43Å
199	W	96.5	Very high	97	Very high	11 Å²	11	30.3 Å²	30.3	4%	0.042	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	165.4	176.9	64.7	96.6	0	0	0	112.7	G94 F136 N137 Q139 F333 E343 R344	G94-W199 CarbonylContact O-C 3.59Å; G94-W199 WeakPolarHBondContact O-CA 3.27Å; G94-W199 WeakPolarHBondContact O-CB 3.12Å; F136-W199 CarbonylContact C-O 3.49Å; F136-W199 WeakPolarHBondContact CA-O 3.4Å; N137-W199 HydrophobicContact CB-CD2 3.77Å; N137-W199 VanDerWaalsContact CB-CE2 3.44Å; N137-W199 HydrophobicContact CB-CE3 4.32Å; N137-W199 HydrophobicContact CB-CG 4.16Å; N137-W199 HydrophobicContact CB-CH2 4.33Å; N137-W199 HydrophobicContact CB-CZ2 3.77Å; N137-W199 PolarHBondContact N-O 2.9Å; N137-W199 WeakPolarHBondContact ND2-CZ2 3.22Å; N137-W199 PolarHBondContact O-N 2.82Å; Q139-W199 HydrophobicContact CB-CH2 3.92Å; Q139-W199 HydrophobicContact CB-CZ3 3.93Å; W199-F333 HydrophobicContact CE3-CB 3.99Å; W199-F333 HydrophobicContact CZ3-CB 4.16Å; W199-E343 HydrophobicContact CD2-CB 4.42Å; W199-R344 HydrophobicContact CH2-CB 4.48Å; W199-R344 HydrophobicContact CZ2-CB 4.08Å; W199-R344 PolarHBondContact NE1-O 2.89Å
200	F	96.1	Very high	96.9	Very high	11 Å²	11	30.7 Å²	30.7	5%	0.048	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	171.7	-176.6	60.9	-86.4	0	0	0	110.6	G94 I96 L116 I134 F136 P202 L205 T437	G94-F200 WeakPolarHBondContact CA-O 3.34Å; G94-F200 VanDerWaalsContact O-CD1 3.29Å; G94-F200 WeakPolarHBondContact O-CD1 3.5Å; G94-F200 PolarHBondContact O-N 3.32Å; I96-F200 HydrophobicContact CB-CE1 4.38Å; L116-F200 HydrophobicContact CD1-CD1 4Å; L116-F200 HydrophobicContact CD1-CE1 3.59Å; L116-F200 HydrophobicContact CD1-CZ 3.95Å; I134-F200 HydrophobicContact CD1-CB 3.7Å; I134-F200 HydrophobicContact CD1-CD2 3.71Å; I134-F200 HydrophobicContact CD1-CE2 4.45Å; I134-F200 HydrophobicContact CD1-CG 3.75Å; I134-F200 HydrophobicContact CG1-CB 4Å; F136-F200 HydrophobicContact CB-CB 4.43Å; F136-F200 HydrophobicContact CD2-CB 4.07Å; F136-F200 HydrophobicContact CD2-CD1 4.22Å; F136-F200 HydrophobicContact CE2-CD1 4.5Å; F200-P202 VanDerWaalsContact O-CD 3.3Å; F200-P202 WeakPolarHBondContact O-CD 3.33Å; F200-L205 HydrophobicContact CE2-CB 4.25Å; F200-L205 HydrophobicContact CE2-CD2 3.67Å; F200-L205 HydrophobicContact CZ-CD2 4.16Å; F200-T437 HydrophobicContact CE2-CG2 3.94Å; F200-T437 HydrophobicContact CZ-CG2 3.75Å
201	D	95.9	Very high	96.7	Very high	67 Å²	67	32.7 Å²	32.7	36%	0.358	16%	0.155	S	C	.	.			trans	-85.3	111.6	174.5	-173	-32.5	0	0	0	111.1	I134 F203 L204 L205	I134-D201 WeakPolarHBondContact O-CB 3.28Å; I134-D201 PolarHBondContact O-N 2.95Å; D201-F203 VanDerWaalsContact C-N 3.27Å; D201-F203 PolarHBondContact O-N 2.9Å; D201-F203 WeakPolarHBondContact OD1-CA 3.17Å; D201-F203 VanDerWaalsContact OD1-CB 3.26Å; D201-F203 WeakPolarHBondContact OD1-CB 3.41Å; D201-F203 PolarHBondContact OD1-N 2.99Å; D201-L204 HydrophobicContact CB-CB 4.16Å; D201-L204 HydrophobicContact CB-CD1 3.9Å; D201-L204 HydrophobicContact CB-CG 3.88Å; D201-L204 PolarHBondContact O-N 2.99Å; D201-L204 PolarHBondContact OD1-N 3.04Å; D201-L205 PolarHBondContact O-N 3.34Å
202	P	96.1	Very high	96.5	Very high	11 Å²	11	34.3 Å²	34.3	7%	0.071	16%	0.162	C	C	.	.	H	α-helix	trans	-62.4	-32	178.3	-20.9	33	0	0	0	113.8	T89 F200 L205 L206 T437	T89-P202 HydrophobicContact CG2-CB 3.93Å; T89-P202 VanDerWaalsContact O-CB 3.26Å; T89-P202 WeakPolarHBondContact O-CB 3.31Å; F200-P202 VanDerWaalsContact O-CD 3.3Å; F200-P202 WeakPolarHBondContact O-CD 3.33Å; P202-L205 PolarHBondContact O-N 3.4Å; P202-L206 VanDerWaalsContact O-CB 3.29Å; P202-L206 WeakPolarHBondContact O-CB 3.32Å; P202-L206 PolarHBondContact O-N 2.95Å; P202-T437 HydrophobicContact CB-CG2 3.88Å; P202-T437 HydrophobicContact CG-CG2 4.02Å
203	F	95.5	Very high	96.4	Very high	86 Å²	86	33.7 Å²	33.7	38%	0.377	16%	0.16	S	C	.	.	H	α-helix	trans	-69.8	-38.1	-178.9	174.3	-106	0	0	0	111	V90 D201 L206 K207	V90-F203 HydrophobicContact CG2-CB 4.44Å; V90-F203 HydrophobicContact CG2-CD2 3.79Å; D201-F203 VanDerWaalsContact C-N 3.27Å; D201-F203 PolarHBondContact O-N 2.9Å; D201-F203 WeakPolarHBondContact OD1-CA 3.17Å; D201-F203 VanDerWaalsContact OD1-CB 3.26Å; D201-F203 WeakPolarHBondContact OD1-CB 3.41Å; D201-F203 PolarHBondContact OD1-N 2.99Å; F203-L206 HydrophobicContact CD2-CD2 4.43Å; F203-L206 WeakPolarHBondContact O-CB 3.16Å; F203-L206 PolarHBondContact O-N 2.98Å; F203-K207 WeakPolarHBondContact O-CB 3.06Å; F203-K207 PolarHBondContact O-N 2.96Å
204	L	96	Very high	96.2	Very high	62 Å²	62	34.8 Å²	34.8	33%	0.325	17%	0.165	S	C	.	.	H	α-helix	trans	-64.3	-41.9	173.9	-64.7	-176.4	0	0	0	111.6	I134 D201 K207 A208	I134-L204 HydrophobicContact CB-CB 4.18Å; I134-L204 HydrophobicContact CG2-CB 4.07Å; D201-L204 HydrophobicContact CB-CB 4.16Å; D201-L204 HydrophobicContact CB-CD1 3.9Å; D201-L204 HydrophobicContact CB-CG 3.88Å; D201-L204 PolarHBondContact O-N 2.99Å; D201-L204 PolarHBondContact OD1-N 3.04Å; L204-K207 PolarHBondContact O-N 3.04Å; L204-A208 WeakPolarHBondContact O-CB 3.3Å; L204-A208 PolarHBondContact O-N 3.04Å
205	L	97.2	Very high	96	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-63.8	-44.9	174.8	-177.8	62.9	0	0	0	112	I58 L116 L119 L123 I134 F200 D201 P202 K207 A208 L209	I58-L205 HydrophobicContact CD1-CB 4.23Å; I58-L205 HydrophobicContact CD1-CD2 3.86Å; I58-L205 HydrophobicContact CD1-CG 3.8Å; I58-L205 HydrophobicContact CG1-CD2 4.47Å; L116-L205 HydrophobicContact CD2-CD1 3.87Å; L116-L205 HydrophobicContact CD2-CD2 3.77Å; L116-L205 HydrophobicContact CD2-CG 4.46Å; L119-L205 HydrophobicContact CD2-CD1 3.57Å; L123-L205 HydrophobicContact CD1-CD1 4.33Å; I134-L205 HydrophobicContact CG2-CB 4.17Å; F200-L205 HydrophobicContact CE2-CB 4.25Å; F200-L205 HydrophobicContact CE2-CD2 3.67Å; F200-L205 HydrophobicContact CZ-CD2 4.16Å; D201-L205 PolarHBondContact O-N 3.34Å; P202-L205 PolarHBondContact O-N 3.4Å; L205-K207 VanDerWaalsContact C-N 3.34Å; L205-K207 PolarHBondContact O-N 3.21Å; L205-A208 PolarHBondContact O-N 3.43Å; L205-L209 HydrophobicContact CD1-CD1 4.47Å; L205-L209 HydrophobicContact CG-CD1 4.17Å; L205-L209 PolarHBondContact O-N 2.58Å
206	L	97.2	Very high	95.9	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-56	-48.2	175.3	177.6	69.2	0	0	0	111.3	I58 W61 Y84 T89 V90 P202 F203 L209 K210	I58-L206 HydrophobicContact CD1-CB 4.13Å; I58-L206 HydrophobicContact CD1-CD1 4.45Å; W61-L206 HydrophobicContact CG-CD1 4.32Å; Y84-L206 HydrophobicContact CD1-CD2 4.2Å; Y84-L206 HydrophobicContact CD2-CD2 4.07Å; Y84-L206 HydrophobicContact CE1-CD2 4.14Å; Y84-L206 HydrophobicContact CE2-CD2 3.97Å; Y84-L206 HydrophobicContact CG-CD2 4.16Å; T89-L206 HydrophobicContact CG2-CB 4.1Å; T89-L206 HydrophobicContact CG2-CD1 4.44Å; T89-L206 HydrophobicContact CG2-CD2 4.05Å; T89-L206 HydrophobicContact CG2-CG 4.44Å; V90-L206 HydrophobicContact CG2-CD2 4.07Å; P202-L206 VanDerWaalsContact O-CB 3.29Å; P202-L206 WeakPolarHBondContact O-CB 3.32Å; P202-L206 PolarHBondContact O-N 2.95Å; F203-L206 HydrophobicContact CD2-CD2 4.43Å; F203-L206 WeakPolarHBondContact O-CB 3.16Å; F203-L206 PolarHBondContact O-N 2.98Å; L206-L209 PolarHBondContact O-N 2.96Å; L206-K210 WeakPolarHBondContact O-CB 3.43Å; L206-K210 PolarHBondContact O-N 2.68Å
207	K	95.1	Very high	95.8	Very high	126 Å²	126	34.4 Å²	34.4	55%	0.548	18%	0.175	S	C	.	.	H	α-helix	trans	-61.8	-44.9	179	-173.7	-179.3	179.9	-175.6	0	111.3	F203 L204 L205 K210 T211	F203-K207 WeakPolarHBondContact O-CB 3.06Å; F203-K207 PolarHBondContact O-N 2.96Å; L204-K207 PolarHBondContact O-N 3.04Å; L205-K207 VanDerWaalsContact C-N 3.34Å; L205-K207 PolarHBondContact O-N 3.21Å; K207-K210 PolarHBondContact O-N 3.08Å; K207-T211 WeakPolarHBondContact O-CB 3.45Å; K207-T211 PolarHBondContact O-N 2.95Å; K207-T211 PolarHBondContact O-OG1 3.22Å
208	A	96	Very high	95.8	Very high	14 Å²	14	34.7 Å²	34.7	12%	0.116	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-44.9	177.4	0	0	0	0	0	111.9	L123 I132 L204 L205 T211 K212	L123-A208 HydrophobicContact CD1-CB 3.8Å; I132-A208 HydrophobicContact CG2-CB 3.84Å; L204-A208 WeakPolarHBondContact O-CB 3.3Å; L204-A208 PolarHBondContact O-N 3.04Å; L205-A208 PolarHBondContact O-N 3.43Å; A208-T211 PolarHBondContact O-N 2.92Å; A208-K212 WeakPolarHBondContact O-CB 3.48Å; A208-K212 PolarHBondContact O-N 3.39Å
209	L	97.8	Very high	95.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-48.1	175.3	-79.1	164.3	0	0	0	112	I58 W61 A62 F65 L123 L205 L206 T211 K212 C213 I441	I58-L209 HydrophobicContact CD1-CD1 3.54Å; I58-L209 HydrophobicContact CG1-CD1 4.37Å; W61-L209 HydrophobicContact CB-CB 3.94Å; A62-L209 HydrophobicContact CB-CD1 4.43Å; F65-L209 HydrophobicContact CB-CD2 3.96Å; F65-L209 HydrophobicContact CD1-CD2 4.4Å; F65-L209 HydrophobicContact CG-CD2 4.07Å; L123-L209 HydrophobicContact CD1-CD2 4.21Å; L123-L209 HydrophobicContact CD1-CG 4.11Å; L123-L209 HydrophobicContact CD2-CD2 3.84Å; L123-L209 HydrophobicContact CD2-CG 4.5Å; L205-L209 HydrophobicContact CD1-CD1 4.47Å; L205-L209 HydrophobicContact CG-CD1 4.17Å; L205-L209 PolarHBondContact O-N 2.58Å; L206-L209 PolarHBondContact O-N 2.96Å; L209-T211 PolarHBondContact O-N 3.47Å; L209-K212 PolarHBondContact O-N 3.49Å; L209-C213 WeakPolarHBondContact O-CB 3.47Å; L209-C213 PolarHBondContact O-N 2.98Å; L209-C213 PolarHBondContact O-SG 2.92Å; L209-I441 HydrophobicContact CD1-CD1 3.99Å; L209-I441 HydrophobicContact CD2-CD1 4.33Å
210	K	95.9	Very high	95.8	Very high	37 Å²	37	35.3 Å²	35.3	16%	0.161	18%	0.181	C	C	.	.	H	α-helix	trans	-57.6	-50	177.5	176.9	172.2	177.5	-179.6	0	111.1	E42 W61 L206 K207 K212 C213 H214 Y220	E42-K210 IonicContact OE1-NZ 3.19Å; W61-K210 HydrophobicContact CD2-CB 3.97Å; W61-K210 HydrophobicContact CD2-CG 4.29Å; W61-K210 HydrophobicContact CE3-CB 4.38Å; W61-K210 HydrophobicContact CG-CB 4.36Å; W61-K210 HydrophobicContact CH2-CD 4.36Å; W61-K210 HydrophobicContact CH2-CG 3.88Å; W61-K210 HydrophobicContact CZ2-CB 4.2Å; W61-K210 HydrophobicContact CZ2-CD 3.72Å; W61-K210 HydrophobicContact CZ2-CG 3.62Å; W61-K210 HydrophobicContact CZ3-CG 4.32Å; L206-K210 WeakPolarHBondContact O-CB 3.43Å; L206-K210 PolarHBondContact O-N 2.68Å; K207-K210 PolarHBondContact O-N 3.08Å; K210-K212 PolarHBondContact O-N 3.34Å; K210-C213 WeakPolarHBondContact O-CB 3.42Å; K210-C213 PolarHBondContact O-N 3.36Å; K210-H214 WeakPolarHBondContact CE-CE1 3.41Å; K210-H214 PolarHBondContact O-N 3.13Å; K210-Y220 VanDerWaalsContact NZ-CE1 3.28Å
211	T	94.5	Very high	95.8	Very high	42 Å²	42	34.9 Å²	34.9	26%	0.258	18%	0.179	S	C	.	.	H	α-helix	trans	-59	-46.3	179.1	-60.9	0	0	0	0	111.6	V125 K207 A208 L209 C213 H214 F215	V125-T211 HydrophobicContact CG2-CG2 4.13Å; K207-T211 WeakPolarHBondContact O-CB 3.45Å; K207-T211 PolarHBondContact O-N 2.95Å; K207-T211 PolarHBondContact O-OG1 3.22Å; A208-T211 PolarHBondContact O-N 2.92Å; L209-T211 PolarHBondContact O-N 3.47Å; T211-C213 PolarHBondContact O-N 3.5Å; T211-H214 PolarHBondContact O-N 3.36Å; T211-F215 PolarHBondContact O-N 3.46Å
212	K	95.3	Very high	95.8	Very high	33 Å²	33	33.1 Å²	33.1	14%	0.143	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-42.5	176.8	-176	59.8	168.9	-168.1	0	112.2	F65 Y122 L123 S124 V125 A208 L209 K210 F215 M216	F65-K212 HydrophobicContact CD2-CG 3.92Å; F65-K212 HydrophobicContact CE2-CG 3.88Å; Y122-K212 VanDerWaalsContact O-CE 3.32Å; Y122-K212 WeakPolarHBondContact O-CE 3.46Å; L123-K212 HydrophobicContact CB-CB 4.45Å; L123-K212 HydrophobicContact CD2-CB 3.87Å; L123-K212 HydrophobicContact CD2-CG 3.89Å; S124-K212 PolarHBondContact O-NZ 3.06Å; V125-K212 HydrophobicContact CG2-CB 4.46Å; V125-K212 HydrophobicContact CG2-CD 3.93Å; A208-K212 WeakPolarHBondContact O-CB 3.48Å; A208-K212 PolarHBondContact O-N 3.39Å; L209-K212 PolarHBondContact O-N 3.49Å; K210-K212 PolarHBondContact O-N 3.34Å; K212-F215 WeakPolarHBondContact O-CB 3.27Å; K212-F215 PolarHBondContact O-N 3.17Å; K212-M216 HydrophobicContact CD-CG 4.44Å; K212-M216 HydrophobicContact CD-SD 4.19Å; K212-M216 HydrophobicContact CG-SD 3.87Å; K212-M216 VanDerWaalsContact O-CG 3.25Å; K212-M216 WeakPolarHBondContact O-CG 3.47Å; K212-M216 PolarHBondContact O-N 3.01Å
213	C	96.7	Very high	95.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.3	-45.8	177	-75.3	0	0	0	0	111.9	W61 F65 L209 K210 T211 F215 M216 G217 V218	W61-C213 HydrophobicContact CE3-CB 3.62Å; W61-C213 HydrophobicContact CZ3-CB 3.72Å; F65-C213 VanDerWaalsContact CA-SG 3.55Å; F65-C213 PolarHBondContact N-SG 3.26Å; F65-C213 VanDerWaalsContact N-SG 3.39Å; L209-C213 WeakPolarHBondContact O-CB 3.47Å; L209-C213 PolarHBondContact O-N 2.98Å; L209-C213 PolarHBondContact O-SG 2.92Å; K210-C213 WeakPolarHBondContact O-CB 3.42Å; K210-C213 PolarHBondContact O-N 3.36Å; T211-C213 PolarHBondContact O-N 3.5Å; C213-F215 PolarHBondContact O-N 3.34Å; C213-M216 CarbonylContact O-C 3.57Å; C213-M216 PolarHBondContact O-N 3.01Å; C213-M216 VanDerWaalsContact O-N 3.12Å; C213-G217 PolarHBondContact O-N 3.06Å; C213-G217 VanDerWaalsContact O-N 3.17Å; C213-V218 HydrophobicContact CB-CB 3.96Å; C213-V218 HydrophobicContact CB-CG2 3.65Å; C213-V218 WeakPolarHBondContact O-CB 3.48Å; C213-V218 WeakPolarHBondContact O-CG2 3.29Å; C213-V218 PolarHBondContact O-N 3.34Å
214	H	93.5	Very high	95.9	Very high	23 Å²	23	32.3 Å²	32.3	11%	0.106	17%	0.168	C	C	.	.	H	α-helix	trans	-60.2	-44.6	175.4	-75.1	-172.8	0	0	0	111.9	Y40 E42 W61 K210 T211 M216 G217 Y220	Y40-H214 HydrophobicContact CD1-CB 3.44Å; Y40-H214 VanDerWaalsContact CD1-CB 3.44Å; Y40-H214 AromaticContact CD1-CE1 3.98Å; Y40-H214 AromaticContact CD1-CG 3.5Å; Y40-H214 AromaticContact CD1-ND1 2.99Å; Y40-H214 WeakPolarHBondContact CD1-ND1 3.36Å; Y40-H214 HydrophobicContact CE1-CB 3.29Å; Y40-H214 AromaticContact CE1-CG 3.68Å; Y40-H214 AromaticContact CE1-ND1 3.27Å; Y40-H214 VanDerWaalsContact CE1-ND1 3.27Å; Y40-H214 WeakPolarHBondContact CE1-ND1 3.39Å; Y40-H214 AromaticContact CG-ND1 3.46Å; Y40-H214 AromaticContact CZ-ND1 3.95Å; E42-H214 IonicContact OE1-CE1 2.71Å; W61-H214 AromaticContact CH2-CD2 3.99Å; W61-H214 AromaticContact CH2-NE2 3.63Å; K210-H214 WeakPolarHBondContact CE-CE1 3.41Å; K210-H214 PolarHBondContact O-N 3.13Å; T211-H214 PolarHBondContact O-N 3.36Å; H214-M216 PolarHBondContact O-N 2.89Å; H214-G217 PolarHBondContact O-N 2.87Å; H214-Y220 VanDerWaalsContact NE2-CB 3.31Å; H214-Y220 WeakPolarHBondContact NE2-CB 3.25Å; H214-Y220 AromaticContact NE2-CG 3.72Å
215	F	93.3	Very high	96.1	Very high	121 Å²	121	29.6 Å²	29.6	53%	0.531	15%	0.154	S	C	.	.	H	α-helix	trans	-59	-35.9	174.7	176.5	-102.6	0	0	0	112.4	V125 T211 K212 C213 G217	V125-F215 HydrophobicContact CB-CB 4.49Å; V125-F215 HydrophobicContact CB-CG 4.38Å; V125-F215 HydrophobicContact CG1-CB 3.8Å; V125-F215 HydrophobicContact CG1-CD1 4.26Å; V125-F215 HydrophobicContact CG1-CD2 3.37Å; V125-F215 HydrophobicContact CG1-CE2 3.91Å; V125-F215 HydrophobicContact CG1-CG 3.54Å; V125-F215 HydrophobicContact CG2-CB 3.87Å; V125-F215 HydrophobicContact CG2-CD1 4.48Å; V125-F215 HydrophobicContact CG2-CG 4.16Å; T211-F215 PolarHBondContact O-N 3.46Å; K212-F215 WeakPolarHBondContact O-CB 3.27Å; K212-F215 PolarHBondContact O-N 3.17Å; C213-F215 PolarHBondContact O-N 3.34Å; F215-G217 PolarHBondContact O-N 2.93Å
216	M	94.5	Very high	96.1	Very high	36 Å²	36	32.1 Å²	32.1	18%	0.177	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	0.6	176.5	-65.8	171.6	75.6	0	0	113.8	F65 R68 R69 K212 C213 H214	F65-M216 HydrophobicContact CD2-SD 4.08Å; F65-M216 HydrophobicContact CE2-SD 4.27Å; R68-M216 VanDerWaalsContact C-CE 3.45Å; R68-M216 HydrophobicContact CB-CB 4.14Å; R68-M216 HydrophobicContact CB-CE 3.69Å; R68-M216 PolarHBondContact NE-O 2.92Å; R68-M216 PolarHBondContact NH2-O 3.27Å; R69-M216 VanDerWaalsContact CA-CE 3.44Å; R69-M216 HydrophobicContact CB-CE 3.83Å; R69-M216 VanDerWaalsContact N-CE 3.32Å; K212-M216 HydrophobicContact CD-CG 4.44Å; K212-M216 HydrophobicContact CD-SD 4.19Å; K212-M216 HydrophobicContact CG-SD 3.87Å; K212-M216 VanDerWaalsContact O-CG 3.25Å; K212-M216 WeakPolarHBondContact O-CG 3.47Å; K212-M216 PolarHBondContact O-N 3.01Å; C213-M216 CarbonylContact O-C 3.57Å; C213-M216 PolarHBondContact O-N 3.01Å; C213-M216 VanDerWaalsContact O-N 3.12Å; H214-M216 PolarHBondContact O-N 2.89Å
217	G	94.4	Very high	96.2	Very high	39 Å²	39	35.9 Å²	35.9	40%	0.402	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	25.4	177.2	0	0	0	0	0	114.8	C213 H214 F215	C213-G217 PolarHBondContact O-N 3.06Å; C213-G217 VanDerWaalsContact O-N 3.17Å; H214-G217 PolarHBondContact O-N 2.87Å; F215-G217 PolarHBondContact O-N 2.93Å
218	V	97.3	Very high	96.3	Very high	7 Å²	7	30.6 Å²	30.6	4%	0.042	17%	0.167	C	C	.	.			trans	-64.1	130	165.2	178.9	0	0	0	0	108.6	W61 A64 R68 V75 V77 C213	W61-V218 HydrophobicContact CZ3-CG1 3.99Å; A64-V218 HydrophobicContact CB-CG1 4.16Å; A64-V218 HydrophobicContact CB-CG2 4.16Å; R68-V218 HydrophobicContact CB-CG2 4.4Å; R68-V218 HydrophobicContact CG-CG2 3.35Å; V75-V218 HydrophobicContact CB-CG1 4.39Å; V75-V218 HydrophobicContact CB-CG2 4.37Å; V75-V218 HydrophobicContact CG1-CG1 4.31Å; V77-V218 HydrophobicContact CB-CG1 4.46Å; V77-V218 HydrophobicContact CG2-CG1 3.7Å; C213-V218 HydrophobicContact CB-CB 3.96Å; C213-V218 HydrophobicContact CB-CG2 3.65Å; C213-V218 WeakPolarHBondContact O-CB 3.48Å; C213-V218 WeakPolarHBondContact O-CG2 3.29Å; C213-V218 PolarHBondContact O-N 3.34Å
219	N	96.7	Very high	96.4	Very high	19 Å²	19	34.2 Å²	34.2	10%	0.102	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	136.3	171.7	-57.7	-51.8	0	0	0	109.1	P46 V75 T76 V77	P46-N219 HydrophobicContact CG-CB 4.41Å; V75-N219 PolarHBondContact O-N 3.47Å; T76-N219 CarbonylContact C-O 3.55Å; T76-N219 WeakPolarHBondContact CA-O 3.32Å; T76-N219 HydrophobicContact CG2-CB 4.06Å; T76-N219 PolarHBondContact OG1-ND2 3.18Å; V77-N219 PolarHBondContact N-O 3.18Å
220	Y	96.6	Very high	96.2	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.016	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.6	175.9	176.6	-125.6	0	0	0	108.5	E42 W61 E79 K210 H214 V222	E42-Y220 HydrophobicContact CB-CD1 4.29Å; E42-Y220 HydrophobicContact CG-CD1 3.87Å; E42-Y220 WeakPolarHBondContact OE1-CD1 3.32Å; W61-Y220 AromaticContact CH2-CD2 3.63Å; W61-Y220 HydrophobicContact CH2-CD2 3.63Å; W61-Y220 HydrophobicContact CH2-CE2 4.33Å; W61-Y220 HydrophobicContact CH2-CG 4.08Å; W61-Y220 AromaticContact CZ2-CD2 3.6Å; W61-Y220 HydrophobicContact CZ2-CD2 3.6Å; W61-Y220 AromaticContact CZ2-CE2 3.82Å; W61-Y220 HydrophobicContact CZ2-CE2 3.82Å; W61-Y220 HydrophobicContact CZ2-CG 4.34Å; E79-Y220 HydrophobicContact CB-CE2 3.65Å; E79-Y220 HydrophobicContact CG-CE2 4.49Å; K210-Y220 VanDerWaalsContact NZ-CE1 3.28Å; H214-Y220 VanDerWaalsContact NE2-CB 3.31Å; H214-Y220 WeakPolarHBondContact NE2-CB 3.25Å; H214-Y220 AromaticContact NE2-CG 3.72Å; Y220-V222 HydrophobicContact CD1-CG2 4.36Å; Y220-V222 HydrophobicContact CE1-CG2 3.58Å
221	V	96.4	Very high	95.9	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.1	179	176	0	0	0	0	107.8	V45 T76 V77 V78 E79 G223 V258 L260 I268	V45-V221 HydrophobicContact CG1-CG2 4.45Å; V45-V221 HydrophobicContact CG2-CG1 4.1Å; V45-V221 HydrophobicContact CG2-CG2 4.41Å; T76-V221 HydrophobicContact CG2-CG2 3.8Å; V77-V221 PolarHBondContact O-N 3.08Å; V78-V221 WeakPolarHBondContact CA-O 3.42Å; V78-V221 HydrophobicContact CG2-CB 4.17Å; E79-V221 PolarHBondContact N-O 3.4Å; V221-G223 PolarHBondContact O-N 2.7Å; V221-V258 HydrophobicContact CG1-CG1 4.22Å; V221-L260 HydrophobicContact CG1-CD2 3.93Å; V221-I268 HydrophobicContact CG2-CD1 4.46Å
222	V	96.3	Very high	95.5	Very high	30 Å²	30	37.3 Å²	37.3	18%	0.182	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	116.9	169.6	-175.9	0	0	0	0	108.2	E79 P82 Y220 P261	E79-V222 CarbonylContact O-C 3.3Å; E79-V222 VanDerWaalsContact O-CA 3.3Å; E79-V222 WeakPolarHBondContact O-CA 3.26Å; P82-V222 HydrophobicContact CB-CG1 4.22Å; P82-V222 HydrophobicContact CB-CG2 4.17Å; P82-V222 HydrophobicContact CG-CG1 3.85Å; Y220-V222 HydrophobicContact CD1-CG2 4.36Å; Y220-V222 HydrophobicContact CE1-CG2 3.58Å; V222-P261 HydrophobicContact CB-CG 4.43Å; V222-P261 HydrophobicContact CG1-CG 3.85Å; V222-P261 VanDerWaalsContact O-CD 3.29Å; V222-P261 WeakPolarHBondContact O-CD 3.31Å
223	G	95.9	Very high	94.9	Very high	4 Å²	4	40.5 Å²	40.5	4%	0.041	23%	0.225	C	C	.	.	S	Bend	trans	166.7	167.6	-178.5	0	0	0	0	0	112.8	V78 E79 K80 V221 S259	V78-G223 WeakPolarHBondContact CG1-O 3.14Å; E79-G223 CarbonylContact C-O 3.52Å; E79-G223 VanDerWaalsContact C-O 3.24Å; E79-G223 PolarHBondContact O-N 2.97Å; K80-G223 VanDerWaalsContact CA-O 3.23Å; K80-G223 WeakPolarHBondContact CA-O 3.35Å; K80-G223 PolarHBondContact N-O 2.92Å; V221-G223 PolarHBondContact O-N 2.7Å; G223-S259 CarbonylContact C-O 3.08Å; G223-S259 WeakPolarHBondContact CA-O 3.45Å
224	E	97.7	Very high	93.5	Very high	76 Å²	76	47.1 Å²	47.1	36%	0.355	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.1	179.7	-178.1	163	-140.7	0	0	110.4	K80 T226 V258 S259	K80-E224 HydrophobicContact CB-CB 3.94Å; K80-E224 HydrophobicContact CB-CG 4.41Å; K80-E224 HydrophobicContact CD-CG 4.4Å; K80-E224 IonicContact NZ-OE1 2.7Å; E224-T226 HydrophobicContact CG-CG2 4.29Å; E224-T226 PolarHBondContact O-N 2.89Å; E224-V258 CarbonylContact O-C 3.49Å; E224-V258 VanDerWaalsContact O-CA 3.32Å; E224-V258 WeakPolarHBondContact O-CA 3.4Å; E224-S259 PolarHBondContact N-O 3.42Å; E224-S259 PolarHBondContact O-N 3.17Å
225	V	98.7	Very high	92.4	Very high	6 Å²	6	52.2 Å²	52.2	4%	0.036	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	122.7	167.8	175.8	0	0	0	0	108	V54 V78 F228 A256 T257 V258 L287	V54-V225 HydrophobicContact CB-CG2 4.4Å; V54-V225 HydrophobicContact CG1-CB 4.03Å; V54-V225 HydrophobicContact CG1-CG2 3.71Å; V54-V225 HydrophobicContact CG2-CG2 3.83Å; V78-V225 HydrophobicContact CB-CG2 4.4Å; V78-V225 HydrophobicContact CG1-CG2 4.02Å; V225-F228 HydrophobicContact CG1-CD2 4.5Å; V225-F228 HydrophobicContact CG1-CE1 4.26Å; V225-F228 HydrophobicContact CG1-CE2 3.9Å; V225-F228 HydrophobicContact CG1-CZ 3.76Å; V225-A256 HydrophobicContact CG1-CB 4.06Å; V225-A256 HydrophobicContact CG2-CB 4.48Å; V225-T257 WeakPolarHBondContact CA-O 3.18Å; V225-V258 HydrophobicContact CG2-CG2 4.23Å; V225-L287 HydrophobicContact CG1-CD1 4.22Å; V225-L287 WeakPolarHBondContact O-CD1 3.42Å
226	T	98.5	Very high	91.5	Very high	53 Å²	53	52.9 Å²	52.9	33%	0.325	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-16.8	-173.7	48.5	0	0	0	0	113.5	E224 T257 L287	E224-T226 HydrophobicContact CG-CG2 4.29Å; E224-T226 PolarHBondContact O-N 2.89Å; T226-T257 PolarHBondContact N-O 3.39Å; T226-T257 PolarHBondContact OG1-O 2.82Å; T226-L287 WeakPolarHBondContact O-CD2 3.45Å
227	D	98.5	Very high	90.3	Very high	82 Å²	82	53.1 Å²	53.1	44%	0.439	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	159.2	179.6	-169.3	29.8	0	0	0	111.5	A256 T257	D227-A256 WeakPolarHBondContact O-CA 3.35Å; D227-T257 PolarHBondContact O-N 2.83Å
228	F	98.6	Very high	89.1	Confident	15 Å²	15	55 Å²	55	7%	0.066	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.1	170.9	-73.2	-77.4	0	0	0	111.8	V54 V225 L253 S255 A256 F270 V273 V284 L287 A288	V54-F228 HydrophobicContact CG2-CZ 4.43Å; V225-F228 HydrophobicContact CG1-CD2 4.5Å; V225-F228 HydrophobicContact CG1-CE1 4.26Å; V225-F228 HydrophobicContact CG1-CE2 3.9Å; V225-F228 HydrophobicContact CG1-CZ 3.76Å; F228-L253 HydrophobicContact CB-CD1 4.38Å; F228-L253 HydrophobicContact CB-CD2 4.12Å; F228-L253 HydrophobicContact CD1-CD1 3.94Å; F228-L253 HydrophobicContact CE1-CD1 4.31Å; F228-L253 HydrophobicContact CG-CD1 4.06Å; F228-S255 WeakPolarHBondContact CA-O 3.48Å; F228-A256 HydrophobicContact CD1-CB 3.85Å; F228-A256 HydrophobicContact CE1-CB 3.7Å; F228-F270 HydrophobicContact CD1-CE1 4.17Å; F228-F270 AromaticContact CD1-CZ 3.9Å; F228-F270 HydrophobicContact CD1-CZ 3.9Å; F228-F270 HydrophobicContact CE1-CE1 4.05Å; F228-F270 AromaticContact CE1-CZ 3.91Å; F228-F270 HydrophobicContact CE1-CZ 3.91Å; F228-V273 HydrophobicContact CE1-CG1 4.47Å; F228-V273 HydrophobicContact CE1-CG2 4.05Å; F228-V273 HydrophobicContact CZ-CG2 4.24Å; F228-V284 HydrophobicContact CE2-CG1 4.09Å; F228-V284 HydrophobicContact CZ-CG1 4.31Å; F228-L287 HydrophobicContact CD2-CB 3.81Å; F228-L287 HydrophobicContact CE2-CB 4.12Å; F228-A288 HydrophobicContact CD2-CB 3.89Å; F228-A288 HydrophobicContact CE2-CB 4.46Å; F228-A288 HydrophobicContact CG-CB 4.41Å
229	N	97.3	Very high	87.6	Confident	89 Å²	89	55.8 Å²	55.8	48%	0.476	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.9	167.6	-169.3	-78.7	0	0	0	109.7	R254 S255	N229-R254 PolarHBondContact O-N 3.21Å; N229-S255 WeakPolarHBondContact CB-OG 3.35Å; N229-S255 PolarHBondContact N-O 2.91Å; N229-S255 PolarHBondContact O-N 3.19Å
230	A	93.6	Very high	86.1	Confident	24 Å²	24	60.1 Å²	60.1	20%	0.198	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	149.1	177.4	0	0	0	0	0	112.1	R251 L253	A230-R251 HydrophobicContact CB-CG 4.19Å; A230-L253 HydrophobicContact CB-CD2 3.76Å
231	C	90.1	Very high	84.7	Confident	28 Å²	28	63.4 Å²	63.4	19%	0.189	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-65.5	160.6	166.4	-69.3	0	0	0	0	110.9	R251 P252	C231-R251 WeakPolarHBondContact O-CG 3.36Å; C231-P252 HydrophobicContact CB-CG 4.11Å; C231-P252 PolarHBondContact N-O 3.32Å
232	P	86.2	Confident	83.3	Confident	93 Å²	93	65.2 Å²	65.2	60%	0.604	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-58.9	159.8	163	-20.6	33.1	0	0	0	111.2	M234	P232-M234 HydrophobicContact CB-CG 4.32Å; P232-M234 WeakPolarHBondContact O-CG 3.31Å; P232-M234 PolarHBondContact O-N 3.49Å; P232-M234 VanDerWaalsContact O-N 3.17Å
233	F	81.5	Confident	81.6	Confident	99 Å²	99	69.5 Å²	69.5	43%	0.434	40%	0.401	S	S	.	.	S	Bend	trans	-61.6	116.5	167.4	-72.2	-80.8	0	0	0	109.2	S249 R251 F295	F233-S249 WeakPolarHBondContact CD1-O 3.43Å; F233-R251 HydrophobicContact CD1-CB 3.81Å; F233-R251 HydrophobicContact CD1-CG 4.34Å; F233-R251 HydrophobicContact CE1-CB 3.72Å; F233-R251 HydrophobicContact CE1-CG 4.29Å; F233-R251 HydrophobicContact CE2-CG 4.46Å; F233-R251 HydrophobicContact CG-CB 4.38Å; F233-R251 HydrophobicContact CG-CG 4.45Å; F233-R251 HydrophobicContact CZ-CB 4.22Å; F233-R251 HydrophobicContact CZ-CG 4.36Å; F233-F295 HydrophobicContact CE1-CE1 4.18Å; F233-F295 HydrophobicContact CE1-CZ 4.08Å; F233-F295 HydrophobicContact CZ-CE1 4.08Å; F233-F295 AromaticContact CZ-CZ 3.77Å; F233-F295 HydrophobicContact CZ-CZ 3.77Å
234	M	68.3	Low	80.4	Confident	140 Å²	140	77.7 Å²	77.7	69%	0.69	44%	0.439	S	S	*	.			trans	-129.5	-39.1	-168.3	-78	178.1	71.8	0	0	114.5	P232 S250	P232-M234 HydrophobicContact CB-CG 4.32Å; P232-M234 WeakPolarHBondContact O-CG 3.31Å; P232-M234 PolarHBondContact O-N 3.49Å; P232-M234 VanDerWaalsContact O-N 3.17Å; M234-S250 PolarHBondContact N-O 3.1Å
235	M	70.3	Confident	79.4	Confident	129 Å²	129	75.7 Å²	75.7	64%	0.635	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.4	-166.8	-75.6	-83.8	-75.1	0	0	110.8	S237 S249 S250	M235-S237 PolarHBondContact O-N 3.27Å; M235-S249 CarbonylContact O-C 3.3Å; M235-S249 WeakPolarHBondContact O-CA 3.24Å; M235-S250 PolarHBondContact O-N 3.06Å; M235-S250 PolarHBondContact O-OG 2.85Å
236	I	74.7	Confident	78.3	Confident	136 Å²	136	79.3 Å²	79.3	70%	0.697	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	113.3	164.3	-62.7	177.1	0	0	0	106.7	P247 V248	I236-P247 HydrophobicContact CG2-CB 3.34Å; I236-P247 HydrophobicContact CG2-CG 4.47Å; I236-V248 WeakPolarHBondContact CA-O 3.3Å
237	S	68.1	Low	77.4	Confident	40 Å²	40	80.8 Å²	80.8	28%	0.28	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.1	177.1	-171.7	0	0	0	0	109.6	M235 P247 V248	M235-S237 PolarHBondContact O-N 3.27Å; S237-P247 VanDerWaalsContact O-CA 3.29Å; S237-P247 WeakPolarHBondContact O-CA 3.21Å; S237-V248 PolarHBondContact N-O 3.1Å; S237-V248 PolarHBondContact O-N 3.31Å
238	S	70	Confident	76.6	Confident	79 Å²	79	78.4 Å²	78.4	55%	0.552	45%	0.45	S	S	*	.			trans	-92.1	145.5	168.8	53	0	0	0	0	110.2	I240	S238-I240 PolarHBondContact O-N 3.1Å; S238-I240 VanDerWaalsContact O-N 3.09Å
239	S	66.5	Low	75.9	Confident	24 Å²	24	80.1 Å²	80.1	17%	0.168	46%	0.464	C	S	.	.			trans	-70.8	106.3	178.4	-57.6	0	0	0	0	110.9	G241 R242 R245	S239-G241 PolarHBondContact O-N 2.95Å; S239-R242 CarbonylContact O-C 3.29Å; S239-R242 PolarHBondContact O-N 2.63Å; S239-R242 VanDerWaalsContact O-N 3.11Å; S239-R245 WeakPolarHBondContact OG-CB 3.27Å
240	I	65.4	Low	75.4	Confident	110 Å²	110	76.3 Å²	76.3	56%	0.564	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	131.1	173.9	-61.1	172.2	0	0	0	108.7	S238 R242 Q454	S238-I240 PolarHBondContact O-N 3.1Å; S238-I240 VanDerWaalsContact O-N 3.09Å; I240-R242 PolarHBondContact O-N 2.68Å; I240-Q454 HydrophobicContact CD1-CB 4.39Å
241	G	65.3	Low	75.3	Confident	73 Å²	73	77 Å²	77	75%	0.753	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	-4.5	-177.6	0	0	0	0	0	115	S239	S239-G241 PolarHBondContact O-N 2.95Å
242	R	68.6	Low	75.4	Confident	39 Å²	39	77.3 Å²	77.3	15%	0.147	44%	0.444	C	S	.	.			trans	-133.1	74.5	176.8	-63.8	-167.3	-176.9	-160.4	-2.7	112.1	S239 I240 Q244 R245 V462 S465 D467	S239-R242 CarbonylContact O-C 3.29Å; S239-R242 PolarHBondContact O-N 2.63Å; S239-R242 VanDerWaalsContact O-N 3.11Å; I240-R242 PolarHBondContact O-N 2.68Å; R242-Q244 PolarHBondContact O-N 3.42Å; R242-R245 HydrophobicContact CB-CB 4.44Å; R242-R245 HydrophobicContact CB-CG 3.76Å; R242-R245 PolarHBondContact O-N 2.85Å; R242-V462 PolarHBondContact NH2-O 2.66Å; R242-S465 PolarHBondContact NH1-OG 3.19Å; R242-S465 PolarHBondContact NH2-OG 3.09Å; R242-D467 IonicContact CZ-OD1 2.85Å; R242-D467 IonicContact CZ-OD2 2.63Å; R242-D467 IonicContact NE-OD2 2.68Å; R242-D467 IonicContact NH1-OD1 3.72Å; R242-D467 PolarHBondContact NH1-OD1 2.99Å; R242-D467 IonicContact NH1-OD2 3.92Å; R242-D467 PolarHBondContact NH1-OD2 3.45Å; R242-D467 IonicContact NH2-OD1 2.95Å
243	P	60.6	Low	75.9	Confident	120 Å²	120	73.1 Å²	73.1	78%	0.779	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-16.8	-175.7	26	-34.3	0	0	0	113.9	R245	P243-R245 VanDerWaalsContact C-N 3.31Å
244	Q	70.5	Confident	76.7	Confident	176 Å²	176	76.3 Å²	76.3	82%	0.822	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-8	177.7	-59.2	-63.4	5.6	0	0	114.1	R242	R242-Q244 PolarHBondContact O-N 3.42Å
245	R	76.7	Confident	78.1	Confident	35 Å²	35	70.5 Å²	70.5	13%	0.132	40%	0.398	C	S	.	.	S	Bend	trans	-91	130.2	-179.8	-59.2	-65.8	-164.5	-139.7	-3.4	109.4	S239 R242 P243 D467 F471 E473	S239-R245 WeakPolarHBondContact OG-CB 3.27Å; R242-R245 HydrophobicContact CB-CB 4.44Å; R242-R245 HydrophobicContact CB-CG 3.76Å; R242-R245 PolarHBondContact O-N 2.85Å; P243-R245 VanDerWaalsContact C-N 3.31Å; R245-D467 IonicContact CZ-OD2 3.42Å; R245-D467 IonicContact NE-OD2 3.77Å; R245-D467 PolarHBondContact NE-OD2 3.38Å; R245-D467 IonicContact NH2-OD2 3.19Å; R245-F471 VanDerWaalsContact NH1-CE2 3.32Å; R245-E473 IonicContact CZ-OE1 2.69Å; R245-E473 IonicContact CZ-OE2 3.81Å; R245-E473 IonicContact NH1-OE1 3.86Å; R245-E473 PolarHBondContact NH1-OE1 3.04Å; R245-E473 VanDerWaalsContact NH1-OE1 3.12Å; R245-E473 IonicContact NH1-OE2 2.79Å; R245-E473 IonicContact NH2-OE1 3.61Å; R245-E473 PolarHBondContact NH2-OE1 2.93Å; R245-E473 IonicContact NH2-OE2 3.25Å; R245-E473 PolarHBondContact NH2-OE2 2.63Å
246	P	75.5	Confident	79.5	Confident	82 Å²	82	64.3 Å²	64.3	53%	0.532	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-64.1	144.9	-177.7	26.3	-33.7	0	0	0	110.9
247	P	79	Confident	80.6	Confident	83 Å²	83	59.5 Å²	59.5	54%	0.539	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-60.7	139.2	173.4	-20.3	31.6	0	0	0	111.3	I236 S237	I236-P247 HydrophobicContact CG2-CB 3.34Å; I236-P247 HydrophobicContact CG2-CG 4.47Å; S237-P247 VanDerWaalsContact O-CA 3.29Å; S237-P247 WeakPolarHBondContact O-CA 3.21Å
248	V	81.1	Confident	82	Confident	32 Å²	32	57.6 Å²	57.6	19%	0.194	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	152.7	-179.1	-65.9	0	0	0	0	111	I236 S237 S250 P421 F422	I236-V248 WeakPolarHBondContact CA-O 3.3Å; S237-V248 PolarHBondContact N-O 3.1Å; S237-V248 PolarHBondContact O-N 3.31Å; V248-S250 PolarHBondContact O-N 2.9Å; V248-P421 HydrophobicContact CG2-CB 4.41Å; V248-P421 WeakPolarHBondContact CG2-O 3.08Å; V248-F422 HydrophobicContact CB-CD1 4.11Å; V248-F422 HydrophobicContact CB-CE1 3.89Å; V248-F422 HydrophobicContact CG1-CE1 4.05Å; V248-F422 HydrophobicContact CG1-CZ 4.28Å; V248-F422 HydrophobicContact CG2-CD1 4.43Å
249	S	84.1	Confident	83.3	Confident	51 Å²	51	55.4 Å²	55.4	36%	0.357	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	110.6	172.6	-166.5	0	0	0	0	109.1	F233 M235	F233-S249 WeakPolarHBondContact CD1-O 3.43Å; M235-S249 CarbonylContact O-C 3.3Å; M235-S249 WeakPolarHBondContact O-CA 3.24Å
250	S	87.6	Confident	84.7	Confident	9 Å²	9	55.6 Å²	55.6	6%	0.063	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	146.4	-178.7	72	0	0	0	0	111.5	M234 M235 V248 F422	M234-S250 PolarHBondContact N-O 3.1Å; M235-S250 PolarHBondContact O-N 3.06Å; M235-S250 PolarHBondContact O-OG 2.85Å; V248-S250 PolarHBondContact O-N 2.9Å; S250-F422 WeakPolarHBondContact CA-O 3.28Å
251	R	91.5	Very high	86	Confident	38 Å²	38	55.3 Å²	55.3	14%	0.143	32%	0.32	C	S	.	.			trans	-133.4	68.3	177.7	-165	-173.8	174.2	-166.6	-12.8	108.5	A230 C231 F233 E289 F295 F422 H423	A230-R251 HydrophobicContact CB-CG 4.19Å; C231-R251 WeakPolarHBondContact O-CG 3.36Å; F233-R251 HydrophobicContact CD1-CB 3.81Å; F233-R251 HydrophobicContact CD1-CG 4.34Å; F233-R251 HydrophobicContact CE1-CB 3.72Å; F233-R251 HydrophobicContact CE1-CG 4.29Å; F233-R251 HydrophobicContact CE2-CG 4.46Å; F233-R251 HydrophobicContact CG-CB 4.38Å; F233-R251 HydrophobicContact CG-CG 4.45Å; F233-R251 HydrophobicContact CZ-CB 4.22Å; F233-R251 HydrophobicContact CZ-CG 4.36Å; R251-E289 IonicContact CZ-OE1 3.7Å; R251-E289 IonicContact CZ-OE2 3.52Å; R251-E289 IonicContact NH1-OE1 3.94Å; R251-E289 IonicContact NH1-OE2 2.98Å; R251-E289 PolarHBondContact NH1-OE2 2.73Å; R251-E289 IonicContact NH2-OE1 2.94Å; R251-E289 PolarHBondContact NH2-OE1 3.24Å; R251-E289 IonicContact NH2-OE2 3.51Å; R251-F295 HydrophobicContact CB-CZ 4.29Å; R251-F422 PolarHBondContact N-O 2.91Å; R251-H423 PolarHBondContact O-CE1 3.22Å; R251-H423 PolarHBondContact O-ND1 2.53Å
252	P	92.9	Very high	87.2	Confident	35 Å²	35	56.9 Å²	56.9	23%	0.227	31%	0.312	C	S	.	.			trans	-61	148.1	-174.1	26	-34.2	0	0	0	111.7	C231 N425	C231-P252 HydrophobicContact CB-CG 4.11Å; C231-P252 PolarHBondContact N-O 3.32Å; P252-N425 WeakPolarHBondContact CA-OD1 3.26Å
253	L	96.4	Very high	88.2	Confident	5 Å²	5	63.3 Å²	63.3	3%	0.026	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	141.5	173.8	-59.7	179.6	0	0	0	109.9	F228 A230 F270 V273 A288 H423 N425 M426	F228-L253 HydrophobicContact CB-CD1 4.38Å; F228-L253 HydrophobicContact CB-CD2 4.12Å; F228-L253 HydrophobicContact CD1-CD1 3.94Å; F228-L253 HydrophobicContact CE1-CD1 4.31Å; F228-L253 HydrophobicContact CG-CD1 4.06Å; A230-L253 HydrophobicContact CB-CD2 3.76Å; L253-F270 HydrophobicContact CB-CE2 3.74Å; L253-F270 HydrophobicContact CB-CZ 3.76Å; L253-V273 HydrophobicContact CD1-CG1 3.96Å; L253-A288 HydrophobicContact CD1-CB 3.91Å; L253-A288 HydrophobicContact CD2-CB 4.29Å; L253-H423 WeakPolarHBondContact CD2-ND1 3.48Å; L253-H423 HydrophobicContact CG-CB 4.32Å; L253-N425 PolarHBondContact N-OD1 3.26Å; L253-N425 PolarHBondContact O-ND2 3Å; L253-M426 HydrophobicContact CD1-CB 4.16Å; L253-M426 HydrophobicContact CD1-CG 4.41Å; L253-M426 HydrophobicContact CD1-SD 3.83Å
254	R	96.8	Very high	89.7	Confident	167 Å²	167	60.6 Å²	60.6	63%	0.63	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	-40.3	-174.8	-176.7	175.6	179.8	145.5	1.3	112.9	N229 G269 F270	N229-R254 PolarHBondContact O-N 3.21Å; R254-G269 WeakPolarHBondContact O-CA 3.34Å; R254-F270 PolarHBondContact O-N 3.35Å
255	S	98.5	Very high	91	Very high	17 Å²	17	57.2 Å²	57.2	12%	0.119	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	158.6	-179.1	59.9	0	0	0	0	111.8	F228 N229 I268 F270	F228-S255 WeakPolarHBondContact CA-O 3.48Å; N229-S255 WeakPolarHBondContact CB-OG 3.35Å; N229-S255 PolarHBondContact N-O 2.91Å; N229-S255 PolarHBondContact O-N 3.19Å; S255-I268 CarbonylContact C-O 3.58Å; S255-I268 WeakPolarHBondContact CA-O 3.34Å; S255-I268 VanDerWaalsContact CB-O 3.28Å; S255-I268 WeakPolarHBondContact CB-O 3.49Å; S255-F270 VanDerWaalsContact C-CE1 3.43Å
256	A	98.8	Very high	91.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.8	170.9	0	0	0	0	0	109.7	L52 V225 D227 F228 S267 I268 F270	L52-A256 HydrophobicContact CD2-CB 3.6Å; V225-A256 HydrophobicContact CG1-CB 4.06Å; V225-A256 HydrophobicContact CG2-CB 4.48Å; D227-A256 WeakPolarHBondContact O-CA 3.35Å; F228-A256 HydrophobicContact CD1-CB 3.85Å; F228-A256 HydrophobicContact CE1-CB 3.7Å; A256-S267 WeakPolarHBondContact O-CA 2.79Å; A256-I268 PolarHBondContact N-O 2.76Å; A256-I268 PolarHBondContact O-N 2.85Å; A256-F270 HydrophobicContact CB-CE1 3.83Å
257	T	98.6	Very high	93	Very high	34 Å²	34	56.9 Å²	56.9	21%	0.209	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.3	165.6	-56.5	0	0	0	0	108.3	V225 T226 D227 N265 V266	V225-T257 WeakPolarHBondContact CA-O 3.18Å; T226-T257 PolarHBondContact N-O 3.39Å; T226-T257 PolarHBondContact OG1-O 2.82Å; D227-T257 PolarHBondContact O-N 2.83Å; T257-N265 HydrophobicContact CG2-CB 3.97Å; T257-V266 WeakPolarHBondContact CA-O 3.33Å
258	V	98.4	Very high	93.9	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.9	177.5	-174.4	0	0	0	0	108.6	V78 V221 E224 V225 L260 N265 V266 I268	V78-V258 HydrophobicContact CG1-CG1 3.88Å; V78-V258 HydrophobicContact CG1-CG2 4.41Å; V78-V258 HydrophobicContact CG2-CG2 4.25Å; V221-V258 HydrophobicContact CG1-CG1 4.22Å; E224-V258 CarbonylContact O-C 3.49Å; E224-V258 VanDerWaalsContact O-CA 3.32Å; E224-V258 WeakPolarHBondContact O-CA 3.4Å; V225-V258 HydrophobicContact CG2-CG2 4.23Å; V258-L260 HydrophobicContact CG1-CD2 4.17Å; V258-N265 WeakPolarHBondContact O-CA 3.41Å; V258-V266 HydrophobicContact CB-CG2 3.95Å; V258-V266 PolarHBondContact N-O 2.98Å; V258-V266 WeakPolarHBondContact O-CG2 3.32Å; V258-V266 PolarHBondContact O-N 2.91Å; V258-I268 HydrophobicContact CG2-CD1 3.82Å; V258-I268 HydrophobicContact CG2-CG1 4.18Å
259	S	97.4	Very high	94.7	Very high	34 Å²	34	51.8 Å²	51.8	24%	0.238	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	117	170.4	177.3	0	0	0	0	109.1	G223 E224 N265	G223-S259 CarbonylContact C-O 3.08Å; G223-S259 WeakPolarHBondContact CA-O 3.45Å; E224-S259 PolarHBondContact N-O 3.42Å; E224-S259 PolarHBondContact O-N 3.17Å; S259-N265 VanDerWaalsContact CA-OD1 3.32Å; S259-N265 WeakPolarHBondContact CA-OD1 3.24Å; S259-N265 WeakPolarHBondContact CB-OD1 3.47Å
260	L	95.4	Very high	95.4	Very high	28 Å²	28	49.9 Å²	49.9	15%	0.147	27%	0.27	C	S	.	.			trans	-82.6	163.5	179.3	-58.7	-178.2	0	0	0	111.3	V45 V221 V258 N262 Q263 T264 V266	V45-L260 HydrophobicContact CG2-CD1 4.1Å; V45-L260 HydrophobicContact CG2-CD2 4.07Å; V221-L260 HydrophobicContact CG1-CD2 3.93Å; V258-L260 HydrophobicContact CG1-CD2 4.17Å; L260-N262 WeakPolarHBondContact CB-OD1 3.44Å; L260-N262 PolarHBondContact O-N 2.95Å; L260-N262 VanDerWaalsContact O-N 3.07Å; L260-Q263 WeakPolarHBondContact O-CA 3.13Å; L260-Q263 PolarHBondContact O-N 3.47Å; L260-T264 WeakPolarHBondContact CB-O 3.37Å; L260-T264 PolarHBondContact N-O 3.21Å; L260-V266 HydrophobicContact CD1-CG1 3.8Å; L260-V266 HydrophobicContact CD1-CG2 4.08Å; L260-V266 HydrophobicContact CD2-CG2 3.97Å; L260-V266 HydrophobicContact CG-CG1 4.4Å; L260-V266 HydrophobicContact CG-CG2 3.96Å
261	P	92.5	Very high	95.9	Very high	103 Å²	103	54.6 Å²	54.6	67%	0.669	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.6	-179.8	-29.6	36.2	0	0	0	115.1	V222 Q263	V222-P261 HydrophobicContact CB-CG 4.43Å; V222-P261 HydrophobicContact CG1-CG 3.85Å; V222-P261 VanDerWaalsContact O-CD 3.29Å; V222-P261 WeakPolarHBondContact O-CD 3.31Å; P261-Q263 PolarHBondContact O-N 3.25Å
262	N	90.6	Very high	96.2	Very high	107 Å²	107	53.5 Å²	53.5	57%	0.572	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	12.1	175.2	68.9	-5	0	0	0	113.5	L260 T264	L260-N262 WeakPolarHBondContact CB-OD1 3.44Å; L260-N262 PolarHBondContact O-N 2.95Å; L260-N262 VanDerWaalsContact O-N 3.07Å; N262-T264 PolarHBondContact ND2-OG1 3.43Å; N262-T264 PolarHBondContact O-N 3.02Å; N262-T264 WeakPolarHBondContact OD1-CB 3.31Å; N262-T264 PolarHBondContact OD1-N 3.36Å; N262-T264 PolarHBondContact OD1-OG1 3.09Å
263	Q	88.9	Confident	96.5	Very high	173 Å²	173	51.9 Å²	51.9	81%	0.808	28%	0.282	S	S	*	.	S	Bend	trans	63.2	16.2	-178	-53.9	178.2	-6.5	0	0	114.7	L260 P261	L260-Q263 WeakPolarHBondContact O-CA 3.13Å; L260-Q263 PolarHBondContact O-N 3.47Å; P261-Q263 PolarHBondContact O-N 3.25Å
264	T	93.7	Very high	96.6	Very high	64 Å²	64	51.6 Å²	51.6	39%	0.393	28%	0.28	S	S	.	.			trans	-86.6	137.2	170	64.3	0	0	0	0	110.2	L260 N262	L260-T264 WeakPolarHBondContact CB-O 3.37Å; L260-T264 PolarHBondContact N-O 3.21Å; N262-T264 PolarHBondContact ND2-OG1 3.43Å; N262-T264 PolarHBondContact O-N 3.02Å; N262-T264 WeakPolarHBondContact OD1-CB 3.31Å; N262-T264 PolarHBondContact OD1-N 3.36Å; N262-T264 PolarHBondContact OD1-OG1 3.09Å
265	N	96.3	Very high	96.7	Very high	105 Å²	105	43.7 Å²	43.7	56%	0.561	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	132.9	176.3	-71.5	-26	0	0	0	110.2	T257 V258 S259	T257-N265 HydrophobicContact CG2-CB 3.97Å; V258-N265 WeakPolarHBondContact O-CA 3.41Å; S259-N265 VanDerWaalsContact CA-OD1 3.32Å; S259-N265 WeakPolarHBondContact CA-OD1 3.24Å; S259-N265 WeakPolarHBondContact CB-OD1 3.47Å
266	V	96.3	Very high	96.7	Very high	39 Å²	39	43.2 Å²	43.2	24%	0.236	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.3	176.3	-64.8	0	0	0	0	109.6	V45 T257 V258 L260	V45-V266 HydrophobicContact CB-CG2 4.44Å; V45-V266 HydrophobicContact CG1-CB 4.2Å; V45-V266 HydrophobicContact CG1-CG2 3.62Å; V45-V266 HydrophobicContact CG2-CG2 4.32Å; T257-V266 WeakPolarHBondContact CA-O 3.33Å; V258-V266 HydrophobicContact CB-CG2 3.95Å; V258-V266 PolarHBondContact N-O 2.98Å; V258-V266 WeakPolarHBondContact O-CG2 3.32Å; V258-V266 PolarHBondContact O-N 2.91Å; L260-V266 HydrophobicContact CD1-CG1 3.8Å; L260-V266 HydrophobicContact CD1-CG2 4.08Å; L260-V266 HydrophobicContact CD2-CG2 3.97Å; L260-V266 HydrophobicContact CG-CG1 4.4Å; L260-V266 HydrophobicContact CG-CG2 3.96Å
267	S	97.8	Very high	96.7	Very high	71 Å²	71	43.9 Å²	43.9	50%	0.497	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.7	176.9	178.1	0	0	0	0	110.1	A256	A256-S267 WeakPolarHBondContact O-CA 2.79Å
268	I	98.5	Very high	96.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	114	174.7	-53	-178.1	0	0	0	108.4	V45 T49 L52 T76 V78 V221 S255 A256 V258	V45-I268 HydrophobicContact CG1-CD1 3.73Å; V45-I268 HydrophobicContact CG1-CG1 3.82Å; T49-I268 HydrophobicContact CG2-CG2 4.01Å; L52-I268 HydrophobicContact CD1-CG2 4.41Å; T76-I268 HydrophobicContact CG2-CD1 4.42Å; V78-I268 HydrophobicContact CG2-CD1 4.36Å; V221-I268 HydrophobicContact CG2-CD1 4.46Å; S255-I268 CarbonylContact C-O 3.58Å; S255-I268 WeakPolarHBondContact CA-O 3.34Å; S255-I268 VanDerWaalsContact CB-O 3.28Å; S255-I268 WeakPolarHBondContact CB-O 3.49Å; A256-I268 PolarHBondContact N-O 2.76Å; A256-I268 PolarHBondContact O-N 2.85Å; V258-I268 HydrophobicContact CG2-CD1 3.82Å; V258-I268 HydrophobicContact CG2-CG1 4.18Å
269	G	98.6	Very high	96.4	Very high	7 Å²	7	43.1 Å²	43.1	7%	0.072	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	147.3	170.7	0	0	0	0	0	112	R47 N48 T49 R254	R47-G269 PolarHBondContact O-N 2.78Å; N48-G269 CarbonylContact C-O 3.6Å; N48-G269 VanDerWaalsContact CA-O 3.23Å; N48-G269 WeakPolarHBondContact CA-O 3.41Å; T49-G269 PolarHBondContact N-O 3.23Å; R254-G269 WeakPolarHBondContact O-CA 3.34Å
270	F	98.5	Very high	96.4	Very high	12 Å²	12	44.6 Å²	44.6	5%	0.053	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	159.4	177.3	55.7	-102.4	0	0	0	114.5	T49 L52 F228 L253 R254 S255 A256 V273	T49-F270 HydrophobicContact CG2-CB 3.92Å; T49-F270 WeakPolarHBondContact O-CA 3.39Å; L52-F270 HydrophobicContact CB-CB 4Å; L52-F270 HydrophobicContact CB-CD1 3.84Å; L52-F270 HydrophobicContact CB-CG 3.99Å; L52-F270 HydrophobicContact CD2-CD1 3.47Å; L52-F270 VanDerWaalsContact CD2-CD1 3.47Å; L52-F270 HydrophobicContact CD2-CE1 3.61Å; L52-F270 HydrophobicContact CD2-CG 4.43Å; L52-F270 HydrophobicContact CG-CD1 4.29Å; F228-F270 HydrophobicContact CD1-CE1 4.17Å; F228-F270 AromaticContact CD1-CZ 3.9Å; F228-F270 HydrophobicContact CD1-CZ 3.9Å; F228-F270 HydrophobicContact CE1-CE1 4.05Å; F228-F270 AromaticContact CE1-CZ 3.91Å; F228-F270 HydrophobicContact CE1-CZ 3.91Å; L253-F270 HydrophobicContact CB-CE2 3.74Å; L253-F270 HydrophobicContact CB-CZ 3.76Å; R254-F270 PolarHBondContact O-N 3.35Å; S255-F270 VanDerWaalsContact C-CE1 3.43Å; A256-F270 HydrophobicContact CB-CE1 3.83Å; F270-V273 HydrophobicContact CD2-CB 3.93Å; F270-V273 HydrophobicContact CD2-CG1 4.3Å; F270-V273 HydrophobicContact CE1-CB 4.24Å; F270-V273 HydrophobicContact CE2-CB 3.57Å; F270-V273 HydrophobicContact CE2-CG1 3.52Å; F270-V273 HydrophobicContact CG-CB 4.43Å; F270-V273 HydrophobicContact CZ-CB 3.73Å; F270-V273 HydrophobicContact CZ-CG1 3.72Å; F270-V273 HydrophobicContact CZ-CG2 4.38Å
271	N	97.1	Very high	96.6	Very high	107 Å²	107	43.2 Å²	43.2	57%	0.572	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87	-43	170.3	-64.7	-30.6	0	0	0	111.1	D50 N425	D50-N271 WeakPolarHBondContact O-CB 3.45Å; D50-N271 PolarHBondContact O-N 2.89Å; D50-N271 VanDerWaalsContact O-N 3.13Å; D50-N271 PolarHBondContact OD1-ND2 3.31Å; N271-N425 VanDerWaalsContact O-CB 3.29Å; N271-N425 WeakPolarHBondContact O-CB 3.01Å; N271-N425 PolarHBondContact O-ND2 3.39Å
272	S	98.2	Very high	96.8	Very high	16 Å²	16	38.8 Å²	38.8	11%	0.112	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	148.4	175.3	-60.8	0	0	0	0	111.1	D50 V51 L52 N425	D50-S272 PolarHBondContact O-N 2.78Å; V51-S272 WeakPolarHBondContact CA-O 3.42Å; L52-S272 PolarHBondContact N-O 3.35Å; S272-N425 WeakPolarHBondContact CA-O 3.26Å
273	V	98.8	Very high	97.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	137.6	172.1	59.2	0	0	0	0	110.7	L52 V54 F228 L253 F270 N425 M426 Y427	L52-V273 HydrophobicContact CB-CB 4.36Å; L52-V273 HydrophobicContact CB-CG2 4.21Å; L52-V273 HydrophobicContact CD2-CG2 4.17Å; L52-V273 HydrophobicContact CG-CG2 4.3Å; L52-V273 CarbonylContact O-C 3.51Å; L52-V273 VanDerWaalsContact O-CA 3.24Å; L52-V273 WeakPolarHBondContact O-CA 3.18Å; V54-V273 HydrophobicContact CG2-CG2 3.81Å; F228-V273 HydrophobicContact CE1-CG1 4.47Å; F228-V273 HydrophobicContact CE1-CG2 4.05Å; F228-V273 HydrophobicContact CZ-CG2 4.24Å; L253-V273 HydrophobicContact CD1-CG1 3.96Å; F270-V273 HydrophobicContact CD2-CB 3.93Å; F270-V273 HydrophobicContact CD2-CG1 4.3Å; F270-V273 HydrophobicContact CE1-CB 4.24Å; F270-V273 HydrophobicContact CE2-CB 3.57Å; F270-V273 HydrophobicContact CE2-CG1 3.52Å; F270-V273 HydrophobicContact CG-CB 4.43Å; F270-V273 HydrophobicContact CZ-CB 3.73Å; F270-V273 HydrophobicContact CZ-CG1 3.72Å; F270-V273 HydrophobicContact CZ-CG2 4.38Å; V273-N425 PolarHBondContact N-O 3.34Å; V273-M426 HydrophobicContact CG1-CB 3.97Å; V273-M426 HydrophobicContact CG1-CG 4.03Å; V273-M426 CarbonylContact O-C 3.52Å; V273-M426 WeakPolarHBondContact O-CA 3.26Å; V273-Y427 PolarHBondContact O-N 2.88Å
274	V	98.9	Very high	97.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	117.1	176.2	-175.2	0	0	0	0	108	V51 L52 V53 V54 T63 A276 Y427 C429 I447 I451	V51-V274 HydrophobicContact CG1-CG2 4.04Å; L52-V274 PolarHBondContact O-N 2.91Å; V53-V274 HydrophobicContact CG1-CB 4.45Å; V53-V274 HydrophobicContact CG2-CB 4.35Å; V53-V274 HydrophobicContact CG2-CG2 4.48Å; V54-V274 PolarHBondContact N-O 2.94Å; T63-V274 HydrophobicContact CG2-CG1 4.34Å; T63-V274 HydrophobicContact CG2-CG2 4.17Å; V274-A276 HydrophobicContact CG1-CB 4.33Å; V274-A276 PolarHBondContact O-N 2.95Å; V274-Y427 CarbonylContact C-O 3.53Å; V274-Y427 WeakPolarHBondContact CA-O 3.39Å; V274-C429 WeakPolarHBondContact CG1-SG 3.48Å; V274-I447 HydrophobicContact CG1-CG2 4.05Å; V274-I447 HydrophobicContact CG2-CG2 3.74Å; V274-I451 HydrophobicContact CG2-CD1 3.66Å
275	N	98.8	Very high	97.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	95.8	168.9	-179.5	1.6	0	0	0	108.4	A277 A281 V284 M426 Y427 F428 C429 N430	N275-A277 WeakPolarHBondContact OD1-CB 3.46Å; N275-A277 PolarHBondContact OD1-N 3.31Å; N275-A281 PolarHBondContact ND2-O 2.86Å; N275-V284 HydrophobicContact CB-CG1 4.44Å; N275-M426 HydrophobicContact CB-CE 3.86Å; N275-Y427 PolarHBondContact N-O 3.41Å; N275-F428 HydrophobicContact CB-CD1 4.06Å; N275-F428 HydrophobicContact CB-CE1 4.45Å; N275-C429 PolarHBondContact O-N 3.3Å; N275-C429 PolarHBondContact O-SG 2.98Å; N275-N430 VanDerWaalsContact O-CG 3.31Å; N275-N430 PolarHBondContact O-ND2 3.45Å; N275-N430 PolarHBondContact O-OD1 3.39Å
276	A	98.6	Very high	98	Very high	8 Å²	8	24.7 Å²	24.7	7%	0.066	15%	0.151	C	C	.	.			trans	-111.4	29	176.1	0	0	0	0	0	111	V53 V54 I59 V274 G278	V53-A276 HydrophobicContact CG1-CB 4.02Å; V54-A276 CarbonylContact O-C 3.24Å; V54-A276 VanDerWaalsContact O-CA 3.31Å; V54-A276 WeakPolarHBondContact O-CA 3.21Å; V54-A276 PolarHBondContact O-N 3.05Å; I59-A276 HydrophobicContact CG2-CB 4.44Å; V274-A276 HydrophobicContact CG1-CB 4.33Å; V274-A276 PolarHBondContact O-N 2.95Å; A276-G278 PolarHBondContact O-N 3.33Å; A276-G278 VanDerWaalsContact O-N 3.14Å
277	A	98.2	Very high	98.1	Very high	13 Å²	13	24.4 Å²	24.4	11%	0.107	15%	0.147	C	C	.	.			trans	-82.3	16.8	-171.7	0	0	0	0	0	113.7	V54 N275 W280 A281 V284	V54-A277 PolarHBondContact O-N 2.92Å; V54-A277 VanDerWaalsContact O-N 3.12Å; N275-A277 WeakPolarHBondContact OD1-CB 3.46Å; N275-A277 PolarHBondContact OD1-N 3.31Å; A277-W280 PolarHBondContact O-N 2.8Å; A277-A281 PolarHBondContact O-N 2.69Å; A277-V284 HydrophobicContact CB-CB 4.32Å; A277-V284 HydrophobicContact CB-CG2 3.61Å
278	G	96.2	Very high	98	Very high	14 Å²	14	21.2 Å²	21.2	14%	0.144	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	49.1	-125.5	172.6	0	0	0	0	0	112.8	A276 W280 A281	A276-G278 PolarHBondContact O-N 3.33Å; A276-G278 VanDerWaalsContact O-N 3.14Å; G278-W280 PolarHBondContact O-N 3.08Å; G278-A281 WeakPolarHBondContact O-CB 3.41Å; G278-A281 PolarHBondContact O-N 2.92Å
279	P	95.6	Very high	97.9	Very high	4 Å²	4	24.3 Å²	24.3	3%	0.026	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-54	-26.3	179.5	-28.9	36.4	0	0	0	114.9	A88 P303 V405 D407	A88-P279 HydrophobicContact CB-CG 3.96Å; P279-P303 HydrophobicContact CB-CB 3.87Å; P279-P303 HydrophobicContact CB-CG 3.86Å; P279-P303 WeakPolarHBondContact O-CD 3.38Å; P279-P303 WeakPolarHBondContact O-CG 3.49Å; P279-V405 HydrophobicContact CB-CG2 4.05Å; P279-V405 HydrophobicContact CG-CG1 4.22Å; P279-V405 HydrophobicContact CG-CG2 3.81Å; P279-D407 HydrophobicContact CG-CB 4.5Å
280	W	97.7	Very high	97.8	Very high	65 Å²	65	24.1 Å²	24.1	25%	0.246	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-98	9.6	-179.1	-49.5	-80.8	0	0	0	113.2	Q86 A277 G278 A282 H283 V284	Q86-W280 HydrophobicContact CB-CH2 3.63Å; Q86-W280 HydrophobicContact CB-CZ2 3.71Å; Q86-W280 WeakPolarHBondContact O-CH2 3.07Å; A277-W280 PolarHBondContact O-N 2.8Å; G278-W280 PolarHBondContact O-N 3.08Å; W280-A282 VanDerWaalsContact C-N 3.26Å; W280-A282 PolarHBondContact O-N 3.17Å; W280-H283 WeakPolarHBondContact O-CB 3.41Å; W280-H283 PolarHBondContact O-N 3.34Å; W280-V284 PolarHBondContact O-N 3.16Å; W280-V284 VanDerWaalsContact O-N 3.14Å
281	A	98.2	Very high	97.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-55.4	-39.2	-179.3	0	0	0	0	0	113.4	N275 A277 G278 H283 V284 A285 L299 V301 N430	N275-A281 PolarHBondContact ND2-O 2.86Å; A277-A281 PolarHBondContact O-N 2.69Å; G278-A281 WeakPolarHBondContact O-CB 3.41Å; G278-A281 PolarHBondContact O-N 2.92Å; A281-H283 VanDerWaalsContact C-N 3.31Å; A281-H283 PolarHBondContact O-N 3.03Å; A281-V284 PolarHBondContact O-N 3.5Å; A281-A285 WeakPolarHBondContact O-CB 3.42Å; A281-A285 PolarHBondContact O-N 3.22Å; A281-L299 HydrophobicContact CB-CD2 3.75Å; A281-V301 HydrophobicContact CB-CG1 4.34Å; A281-N430 HydrophobicContact CB-CB 3.81Å; A281-N430 VanDerWaalsContact CB-CG 3.41Å; A281-N430 WeakPolarHBondContact CB-ND2 3.26Å
282	A	98	Very high	97.5	Very high	9 Å²	9	22.3 Å²	22.3	7%	0.074	14%	0.14	C	C	.	.	H	α-helix	trans	-67.1	-32.6	177.9	0	0	0	0	0	112.7	W280 A285 G286 L299 V301	W280-A282 VanDerWaalsContact C-N 3.26Å; W280-A282 PolarHBondContact O-N 3.17Å; A282-A285 PolarHBondContact O-N 3.12Å; A282-G286 PolarHBondContact O-N 3.11Å; A282-L299 HydrophobicContact CB-CB 4.45Å; A282-L299 WeakPolarHBondContact CB-O 3.5Å; A282-V301 WeakPolarHBondContact CB-O 3.22Å
283	H	98.1	Very high	97.1	Very high	104 Å²	104	30.8 Å²	30.8	48%	0.481	18%	0.178	S	C	.	.	H	α-helix	trans	-65.4	-48.5	173.3	174.8	68.8	0	0	0	110.7	W280 A281 A285 G286 L287	W280-H283 WeakPolarHBondContact O-CB 3.41Å; W280-H283 PolarHBondContact O-N 3.34Å; A281-H283 VanDerWaalsContact C-N 3.31Å; A281-H283 PolarHBondContact O-N 3.03Å; H283-A285 VanDerWaalsContact C-N 3.29Å; H283-A285 PolarHBondContact O-N 3.08Å; H283-G286 WeakPolarHBondContact O-CA 3.41Å; H283-G286 PolarHBondContact O-N 2.91Å; H283-L287 PolarHBondContact O-N 3.46Å; H283-L287 VanDerWaalsContact O-N 3.15Å
284	V	98.6	Very high	96.4	Very high	10 Å²	10	35.2 Å²	35.2	6%	0.061	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-37.7	176.7	175.3	0	0	0	0	111.9	V54 F228 N275 A277 W280 A281 G286 L287	V54-V284 HydrophobicContact CB-CG1 4.38Å; V54-V284 HydrophobicContact CG1-CG1 3.95Å; V54-V284 HydrophobicContact CG1-CG2 4.11Å; F228-V284 HydrophobicContact CE2-CG1 4.09Å; F228-V284 HydrophobicContact CZ-CG1 4.31Å; N275-V284 HydrophobicContact CB-CG1 4.44Å; A277-V284 HydrophobicContact CB-CB 4.32Å; A277-V284 HydrophobicContact CB-CG2 3.61Å; W280-V284 PolarHBondContact O-N 3.16Å; W280-V284 VanDerWaalsContact O-N 3.14Å; A281-V284 PolarHBondContact O-N 3.5Å; V284-G286 VanDerWaalsContact C-N 3.32Å; V284-L287 WeakPolarHBondContact O-CB 3.24Å; V284-L287 PolarHBondContact O-N 3.18Å
285	A	98.4	Very high	96	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-40.2	172.9	0	0	0	0	0	111.6	A281 A282 H283 L287 A288 I290 L299 F428	A281-A285 WeakPolarHBondContact O-CB 3.42Å; A281-A285 PolarHBondContact O-N 3.22Å; A282-A285 PolarHBondContact O-N 3.12Å; H283-A285 VanDerWaalsContact C-N 3.29Å; H283-A285 PolarHBondContact O-N 3.08Å; A285-L287 VanDerWaalsContact C-N 3.29Å; A285-L287 PolarHBondContact O-N 3.02Å; A285-A288 CarbonylContact O-C 3.57Å; A285-A288 WeakPolarHBondContact O-CA 3.37Å; A285-A288 WeakPolarHBondContact O-CB 3.47Å; A285-A288 PolarHBondContact O-N 3.14Å; A285-I290 HydrophobicContact CB-CB 4.08Å; A285-I290 HydrophobicContact CB-CD1 4.29Å; A285-I290 HydrophobicContact CB-CG2 4.37Å; A285-I290 VanDerWaalsContact O-CB 3.29Å; A285-I290 WeakPolarHBondContact O-CB 3.37Å; A285-I290 PolarHBondContact O-N 3.48Å; A285-I290 VanDerWaalsContact O-N 3.14Å; A285-L299 HydrophobicContact CB-CB 4.08Å; A285-L299 HydrophobicContact CB-CD2 4.23Å; A285-F428 HydrophobicContact CB-CE1 4.21Å
286	G	98.2	Very high	95.6	Very high	40 Å²	40	40.5 Å²	40.5	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-61.3	-32.9	175.9	0	0	0	0	0	114.1	A282 H283 V284 A288 E289 I290	A282-G286 PolarHBondContact O-N 3.11Å; H283-G286 WeakPolarHBondContact O-CA 3.41Å; H283-G286 PolarHBondContact O-N 2.91Å; V284-G286 VanDerWaalsContact C-N 3.32Å; G286-A288 PolarHBondContact O-N 3Å; G286-E289 WeakPolarHBondContact O-CA 3.5Å; G286-E289 PolarHBondContact O-N 3.18Å; G286-I290 WeakPolarHBondContact CA-O 3.03Å
287	L	98.4	Very high	95.3	Very high	33 Å²	33	42.4 Å²	42.4	17%	0.173	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-22.8	173	-57.4	179.9	0	0	0	112.7	V225 T226 F228 H283 V284 A285 E289	V225-L287 HydrophobicContact CG1-CD1 4.22Å; V225-L287 WeakPolarHBondContact O-CD1 3.42Å; T226-L287 WeakPolarHBondContact O-CD2 3.45Å; F228-L287 HydrophobicContact CD2-CB 3.81Å; F228-L287 HydrophobicContact CE2-CB 4.12Å; H283-L287 PolarHBondContact O-N 3.46Å; H283-L287 VanDerWaalsContact O-N 3.15Å; V284-L287 WeakPolarHBondContact O-CB 3.24Å; V284-L287 PolarHBondContact O-N 3.18Å; A285-L287 VanDerWaalsContact C-N 3.29Å; A285-L287 PolarHBondContact O-N 3.02Å; L287-E289 VanDerWaalsContact C-N 3.31Å
288	A	97.1	Very high	95.2	Very high	3 Å²	3	49.8 Å²	49.8	3%	0.025	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	21.9	172.3	0	0	0	0	0	112.2	F228 L253 A285 G286 I290 H423 M426	F228-A288 HydrophobicContact CD2-CB 3.89Å; F228-A288 HydrophobicContact CE2-CB 4.46Å; F228-A288 HydrophobicContact CG-CB 4.41Å; L253-A288 HydrophobicContact CD1-CB 3.91Å; L253-A288 HydrophobicContact CD2-CB 4.29Å; A285-A288 CarbonylContact O-C 3.57Å; A285-A288 WeakPolarHBondContact O-CA 3.37Å; A285-A288 WeakPolarHBondContact O-CB 3.47Å; A285-A288 PolarHBondContact O-N 3.14Å; G286-A288 PolarHBondContact O-N 3Å; A288-I290 HydrophobicContact CB-CD1 4.41Å; A288-I290 HydrophobicContact CB-CG1 4.32Å; A288-I290 PolarHBondContact O-N 2.95Å; A288-I290 VanDerWaalsContact O-N 3.15Å; A288-H423 PolarHBondContact O-NE2 2.77Å; A288-M426 HydrophobicContact CB-CE 4.39Å; A288-M426 HydrophobicContact CB-SD 3.91Å
289	E	96	Very high	95.2	Very high	65 Å²	65	49.1 Å²	49.1	30%	0.304	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	11	-177.5	-53.2	175.1	-164.6	0	0	114.6	R251 G286 L287 G291 S292 N294 F295	R251-E289 IonicContact CZ-OE1 3.7Å; R251-E289 IonicContact CZ-OE2 3.52Å; R251-E289 IonicContact NH1-OE1 3.94Å; R251-E289 IonicContact NH1-OE2 2.98Å; R251-E289 PolarHBondContact NH1-OE2 2.73Å; R251-E289 IonicContact NH2-OE1 2.94Å; R251-E289 PolarHBondContact NH2-OE1 3.24Å; R251-E289 IonicContact NH2-OE2 3.51Å; G286-E289 WeakPolarHBondContact O-CA 3.5Å; G286-E289 PolarHBondContact O-N 3.18Å; L287-E289 VanDerWaalsContact C-N 3.31Å; E289-G291 PolarHBondContact O-N 3.44Å; E289-S292 WeakPolarHBondContact O-CB 3.47Å; E289-S292 PolarHBondContact O-N 3.02Å; E289-S292 VanDerWaalsContact O-N 3.1Å; E289-S292 PolarHBondContact O-OG 3.34Å; E289-N294 PolarHBondContact OE2-ND2 3.23Å; E289-F295 HydrophobicContact CB-CD2 4.15Å
290	I	96	Very high	95.3	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.021	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-76.6	122.5	177.3	-53.9	176.5	0	0	0	109.6	A285 G286 A288 L297 M426 F428 F466	A285-I290 HydrophobicContact CB-CB 4.08Å; A285-I290 HydrophobicContact CB-CD1 4.29Å; A285-I290 HydrophobicContact CB-CG2 4.37Å; A285-I290 VanDerWaalsContact O-CB 3.29Å; A285-I290 WeakPolarHBondContact O-CB 3.37Å; A285-I290 PolarHBondContact O-N 3.48Å; A285-I290 VanDerWaalsContact O-N 3.14Å; G286-I290 WeakPolarHBondContact CA-O 3.03Å; A288-I290 HydrophobicContact CB-CD1 4.41Å; A288-I290 HydrophobicContact CB-CG1 4.32Å; A288-I290 PolarHBondContact O-N 2.95Å; A288-I290 VanDerWaalsContact O-N 3.15Å; I290-L297 VanDerWaalsContact CG2-O 3.3Å; I290-L297 WeakPolarHBondContact CG2-O 3.18Å; I290-M426 HydrophobicContact CD1-CE 4.48Å; I290-M426 HydrophobicContact CD1-SD 3.76Å; I290-F428 HydrophobicContact CD1-CE1 4.41Å; I290-F428 HydrophobicContact CD1-CZ 3.75Å; I290-F466 HydrophobicContact CG2-CZ 4.45Å
291	G	94.9	Very high	95.3	Very high	37 Å²	37	47.3 Å²	47.3	38%	0.381	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	6.2	-166.9	0	0	0	0	0	114.3	E289 F295	E289-G291 PolarHBondContact O-N 3.44Å; G291-F295 VanDerWaalsContact CA-O 3.31Å; G291-F295 WeakPolarHBondContact CA-O 3.25Å; G291-F295 PolarHBondContact N-O 2.84Å
292	S	94.5	Very high	95.2	Very high	44 Å²	44	50.9 Å²	50.9	31%	0.308	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-96.7	179.8	173.2	78.9	0	0	0	0	112.2	E289 N294 F295 P296	E289-S292 WeakPolarHBondContact O-CB 3.47Å; E289-S292 PolarHBondContact O-N 3.02Å; E289-S292 VanDerWaalsContact O-N 3.1Å; E289-S292 PolarHBondContact O-OG 3.34Å; S292-N294 PolarHBondContact O-N 2.82Å; S292-N294 PolarHBondContact OG-N 3.47Å; S292-F295 PolarHBondContact N-O 2.77Å; S292-F295 CarbonylContact O-C 3.55Å; S292-F295 PolarHBondContact O-N 3.05Å; S292-F295 VanDerWaalsContact O-N 3.13Å; S292-P296 WeakPolarHBondContact O-CA 3.39Å
293	E	89.2	Confident	95	Very high	194 Å²	194	52.5 Å²	52.5	91%	0.907	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-32.5	174.6	-64.4	-175.9	175.3	0	0	113.5
294	N	85.3	Confident	94.8	Very high	92 Å²	92	48.7 Å²	48.7	49%	0.492	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-34.5	179.9	-70.2	-31.4	0	0	0	112.5	E289 S292	E289-N294 PolarHBondContact OE2-ND2 3.23Å; S292-N294 PolarHBondContact O-N 2.82Å; S292-N294 PolarHBondContact OG-N 3.47Å
295	F	90.1	Very high	94.6	Very high	6 Å²	6	50.1 Å²	50.1	3%	0.026	27%	0.271	C	S	.	.	B	Isolated β-bridge	trans	-139.9	78.2	-179.6	-56.2	-63.2	0	0	0	109.3	F233 R251 E289 G291 S292 L297 F422 H423	F233-F295 HydrophobicContact CE1-CE1 4.18Å; F233-F295 HydrophobicContact CE1-CZ 4.08Å; F233-F295 HydrophobicContact CZ-CE1 4.08Å; F233-F295 AromaticContact CZ-CZ 3.77Å; F233-F295 HydrophobicContact CZ-CZ 3.77Å; R251-F295 HydrophobicContact CB-CZ 4.29Å; E289-F295 HydrophobicContact CB-CD2 4.15Å; G291-F295 VanDerWaalsContact CA-O 3.31Å; G291-F295 WeakPolarHBondContact CA-O 3.25Å; G291-F295 PolarHBondContact N-O 2.84Å; S292-F295 PolarHBondContact N-O 2.77Å; S292-F295 CarbonylContact O-C 3.55Å; S292-F295 PolarHBondContact O-N 3.05Å; S292-F295 VanDerWaalsContact O-N 3.13Å; F295-L297 PolarHBondContact O-N 2.79Å; F295-L297 VanDerWaalsContact O-N 3.09Å; F295-F422 HydrophobicContact CD1-CB 3.87Å; F295-F422 HydrophobicContact CD1-CD1 4.41Å; F295-F422 AromaticContact CD1-CD2 3.7Å; F295-F422 HydrophobicContact CD1-CD2 3.7Å; F295-F422 HydrophobicContact CD1-CE2 4.33Å; F295-F422 AromaticContact CD1-CG 3.74Å; F295-F422 HydrophobicContact CD1-CG 3.74Å; F295-F422 HydrophobicContact CE1-CB 3.29Å; F295-F422 AromaticContact CE1-CD1 3.91Å; F295-F422 HydrophobicContact CE1-CD1 3.91Å; F295-F422 AromaticContact CE1-CD2 3.94Å; F295-F422 HydrophobicContact CE1-CD2 3.94Å; F295-F422 AromaticContact CE1-CG 3.45Å; F295-F422 HydrophobicContact CE1-CG 3.45Å; F295-F422 VanDerWaalsContact CE1-CG 3.45Å; F295-F422 HydrophobicContact CZ-CB 3.97Å; F295-H423 AromaticContact CD2-NE2 3.5Å; F295-H423 WeakPolarHBondContact CD2-NE2 3.48Å; F295-H423 AromaticContact CE2-CE1 3.57Å; F295-H423 AromaticContact CE2-NE2 3.07Å; F295-H423 WeakPolarHBondContact CE2-NE2 3.46Å; F295-H423 AromaticContact CZ-CE1 4Å; F295-H423 AromaticContact CZ-NE2 3.75Å
296	P	89.8	Confident	94.3	Very high	105 Å²	105	51.1 Å²	51.1	68%	0.682	28%	0.275	S	S	*	.			trans	-67	-18.8	-163.4	23.5	-34.7	0	0	0	115.1	S292 R298	S292-P296 WeakPolarHBondContact O-CA 3.39Å; P296-R298 PolarHBondContact O-N 3.27Å; P296-R298 VanDerWaalsContact O-N 3.13Å
297	L	93.3	Very high	94.2	Very high	49 Å²	49	49.3 Å²	49.3	26%	0.257	26%	0.256	S	S	.	.			trans	-78.1	101	178.9	-173.9	63.1	0	0	0	110.8	I290 F295 F466 L469 F470	I290-L297 VanDerWaalsContact CG2-O 3.3Å; I290-L297 WeakPolarHBondContact CG2-O 3.18Å; F295-L297 PolarHBondContact O-N 2.79Å; F295-L297 VanDerWaalsContact O-N 3.09Å; L297-F466 HydrophobicContact CD2-CE1 4.19Å; L297-F466 HydrophobicContact CD2-CZ 4.14Å; L297-F466 HydrophobicContact CG-CZ 4.25Å; L297-L469 HydrophobicContact CD2-CB 3.7Å; L297-F470 HydrophobicContact CB-CE1 3.86Å; L297-F470 HydrophobicContact CB-CZ 4Å; L297-F470 HydrophobicContact CD2-CD1 3.73Å; L297-F470 HydrophobicContact CD2-CD2 3.65Å; L297-F470 HydrophobicContact CD2-CE1 3.65Å; L297-F470 HydrophobicContact CD2-CE2 3.57Å; L297-F470 HydrophobicContact CD2-CG 3.73Å; L297-F470 HydrophobicContact CD2-CZ 3.57Å; L297-F470 HydrophobicContact CG-CE1 4.44Å; L297-F470 HydrophobicContact CG-CZ 4.43Å
298	R	95.2	Very high	94	Very high	167 Å²	167	47.9 Å²	47.9	63%	0.63	25%	0.248	S	C	*	.			trans	-68.4	143.6	174.5	-174.2	175.4	177.3	172.5	-1.4	110.7	P296 P300	P296-R298 PolarHBondContact O-N 3.27Å; P296-R298 VanDerWaalsContact O-N 3.13Å; R298-P300 VanDerWaalsContact O-CD 3.27Å; R298-P300 WeakPolarHBondContact O-CD 3.35Å
299	L	97.6	Very high	94.1	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	25%	0.247	C	C	.	.			trans	-63.4	115.3	167.7	-178.5	68.4	0	0	0	109.5	A281 A282 A285 V301 I416 F428 F466	A281-L299 HydrophobicContact CB-CD2 3.75Å; A282-L299 HydrophobicContact CB-CB 4.45Å; A282-L299 WeakPolarHBondContact CB-O 3.5Å; A285-L299 HydrophobicContact CB-CB 4.08Å; A285-L299 HydrophobicContact CB-CD2 4.23Å; L299-V301 HydrophobicContact CD1-CG2 4.17Å; L299-V301 HydrophobicContact CD2-CB 4.41Å; L299-V301 HydrophobicContact CD2-CG2 4.31Å; L299-V301 HydrophobicContact CG-CB 4.21Å; L299-V301 HydrophobicContact CG-CG2 3.92Å; L299-V301 PolarHBondContact O-N 2.91Å; L299-I416 HydrophobicContact CD1-CB 4.47Å; L299-I416 HydrophobicContact CD1-CD1 4.01Å; L299-I416 HydrophobicContact CD1-CG2 3.88Å; L299-F428 HydrophobicContact CD1-CD1 4.29Å; L299-F428 HydrophobicContact CD1-CE1 4.47Å; L299-F428 HydrophobicContact CD1-CG 4.48Å; L299-F428 HydrophobicContact CD2-CD1 3.99Å; L299-F428 HydrophobicContact CD2-CE1 4.08Å; L299-F466 HydrophobicContact CB-CE2 4.36Å; L299-F466 HydrophobicContact CD1-CD2 3.82Å; L299-F466 HydrophobicContact CD1-CE2 3.84Å
300	P	97.4	Very high	94.1	Very high	26 Å²	26	44.6 Å²	44.6	17%	0.169	23%	0.232	C	C	.	.			trans	-83	51	-172.4	35.9	-37.2	0	0	0	111.6	R298 N409 T410 W411 I416 L469	R298-P300 VanDerWaalsContact O-CD 3.27Å; R298-P300 WeakPolarHBondContact O-CD 3.35Å; P300-N409 CarbonylContact O-C 3.46Å; P300-N409 VanDerWaalsContact O-CA 3.32Å; P300-N409 WeakPolarHBondContact O-CA 3.48Å; P300-N409 PolarHBondContact O-OD1 2.71Å; P300-T410 WeakPolarHBondContact CB-OG1 3.28Å; P300-T410 PolarHBondContact O-N 3.15Å; P300-T410 PolarHBondContact O-OG1 3.45Å; P300-W411 HydrophobicContact CB-CB 4.32Å; P300-W411 HydrophobicContact CG-CB 3.96Å; P300-I416 HydrophobicContact CG-CD1 3.81Å; P300-L469 HydrophobicContact CG-CD1 3.85Å; P300-L469 HydrophobicContact CG-CD2 4.33Å
301	V	98.1	Very high	94.2	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.03	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.2	179.4	178.3	0	0	0	0	109.3	A281 A282 L299 D407 Y408 I416 N430	A281-V301 HydrophobicContact CB-CG1 4.34Å; A282-V301 WeakPolarHBondContact CB-O 3.22Å; L299-V301 HydrophobicContact CD1-CG2 4.17Å; L299-V301 HydrophobicContact CD2-CB 4.41Å; L299-V301 HydrophobicContact CD2-CG2 4.31Å; L299-V301 HydrophobicContact CG-CB 4.21Å; L299-V301 HydrophobicContact CG-CG2 3.92Å; L299-V301 PolarHBondContact O-N 2.91Å; V301-D407 HydrophobicContact CG1-CB 3.89Å; V301-Y408 WeakPolarHBondContact CA-O 3.49Å; V301-I416 HydrophobicContact CG2-CD1 4.08Å; V301-N430 HydrophobicContact CG1-CB 4.48Å; V301-N430 HydrophobicContact CG2-CB 4.24Å
302	E	95.8	Very high	94.2	Very high	75 Å²	75	47.5 Å²	47.5	35%	0.35	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	159.7	178.7	68.4	-179.3	-158.5	0	0	112.4	R304 Y408 T410	E302-R304 PolarHBondContact O-N 3.29Å; E302-R304 IonicContact OE1-CZ 2.91Å; E302-R304 IonicContact OE1-NE 3.86Å; E302-R304 IonicContact OE1-NH2 3.62Å; E302-R304 PolarHBondContact OE1-NH2 3.21Å; E302-Y408 PolarHBondContact N-O 3.22Å; E302-Y408 PolarHBondContact O-N 3.14Å; E302-T410 VanDerWaalsContact CD-CG2 3.48Å; E302-T410 HydrophobicContact CG-CG2 3.74Å
303	P	94.2	Very high	94	Very high	42 Å²	42	45.7 Å²	45.7	27%	0.273	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	127.8	169	-16.9	30.6	0	0	0	110.7	P279 Y305 V405	P279-P303 HydrophobicContact CB-CB 3.87Å; P279-P303 HydrophobicContact CB-CG 3.86Å; P279-P303 WeakPolarHBondContact O-CD 3.38Å; P279-P303 WeakPolarHBondContact O-CG 3.49Å; P303-Y305 HydrophobicContact CB-CE2 4.04Å; P303-V405 HydrophobicContact CB-CG2 3.78Å
304	R	93.5	Very high	93.8	Very high	24 Å²	24	42.7 Å²	42.7	9%	0.091	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123.4	172.7	-173.5	64.4	59.1	110.5	-1.4	110.2	E302 R306 D361 V405 C406 Y408	E302-R304 PolarHBondContact O-N 3.29Å; E302-R304 IonicContact OE1-CZ 2.91Å; E302-R304 IonicContact OE1-NE 3.86Å; E302-R304 IonicContact OE1-NH2 3.62Å; E302-R304 PolarHBondContact OE1-NH2 3.21Å; R304-R306 VanDerWaalsContact CG-NH1 3.27Å; R304-D361 IonicContact CZ-OD2 2.62Å; R304-D361 IonicContact NH1-OD1 3.31Å; R304-D361 PolarHBondContact NH1-OD1 2.93Å; R304-D361 IonicContact NH1-OD2 3.34Å; R304-D361 PolarHBondContact NH1-OD2 2.86Å; R304-V405 CarbonylContact O-C 3.59Å; R304-V405 WeakPolarHBondContact O-CA 3.43Å; R304-C406 PolarHBondContact N-O 3.25Å; R304-C406 PolarHBondContact O-N 3.42Å; R304-Y408 HydrophobicContact CB-CD2 4.26Å; R304-Y408 HydrophobicContact CB-CG 3.93Å; R304-Y408 HydrophobicContact CG-CD2 4.06Å; R304-Y408 HydrophobicContact CG-CG 4.08Å
305	Y	93.1	Very high	93.1	Very high	41 Å²	41	42.2 Å²	42.2	16%	0.161	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	146.5	-172.6	-62.2	-80.7	0	0	0	112.5	P303 N364 N368 I403 S404 V405	P303-Y305 HydrophobicContact CB-CE2 4.04Å; Y305-N364 VanDerWaalsContact O-CB 3.28Å; Y305-N364 WeakPolarHBondContact O-CB 3.39Å; Y305-N368 HydrophobicContact CD2-CB 4.4Å; Y305-N368 HydrophobicContact CE1-CB 4.46Å; Y305-N368 HydrophobicContact CE2-CB 4.2Å; Y305-N368 VanDerWaalsContact CZ-CG 3.48Å; Y305-N368 PolarHBondContact OH-ND2 3.29Å; Y305-N368 VanDerWaalsContact OH-ND2 3.07Å; Y305-I403 HydrophobicContact CD1-CG2 3.69Å; Y305-I403 HydrophobicContact CG-CG2 4.28Å; Y305-S404 CarbonylContact C-O 3.47Å; Y305-S404 VanDerWaalsContact CA-O 3.26Å; Y305-S404 WeakPolarHBondContact CA-O 3.37Å; Y305-V405 HydrophobicContact CD1-CB 3.88Å; Y305-V405 HydrophobicContact CD1-CG2 4Å; Y305-V405 HydrophobicContact CE1-CB 3.82Å; Y305-V405 HydrophobicContact CE1-CG2 3.72Å
306	R	93.6	Very high	91.7	Very high	20 Å²	20	47.2 Å²	47.2	8%	0.075	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142.5	173.9	-56.2	-72.8	176	-113.4	18	109.7	R304 S355 D356 D361 I403 S404	R304-R306 VanDerWaalsContact CG-NH1 3.27Å; R306-S355 WeakPolarHBondContact CD-O 3.44Å; R306-D356 PolarHBondContact NH2-O 2.67Å; R306-D361 IonicContact CZ-OD1 3.41Å; R306-D361 IonicContact NH1-OD1 3.91Å; R306-D361 PolarHBondContact NH1-OD1 3.35Å; R306-D361 IonicContact NH2-OD1 2.89Å; R306-D361 PolarHBondContact NH2-OD1 3.43Å; R306-I403 WeakPolarHBondContact O-CA 3.19Å; R306-S404 WeakPolarHBondContact CB-OG 3.35Å; R306-S404 PolarHBondContact N-O 2.93Å; R306-S404 PolarHBondContact O-N 3.36Å
307	Q	94.5	Very high	90.2	Very high	3 Å²	3	47.5 Å²	47.5	1%	0.014	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	119.5	174.4	-65.9	-179.2	75.4	0	0	109.4	F309 Y354 N364 V373 F377 I403	Q307-F309 HydrophobicContact CB-CE2 3.6Å; Q307-F309 HydrophobicContact CB-CZ 3.83Å; Q307-Y354 WeakPolarHBondContact O-CB 3.04Å; Q307-N364 WeakPolarHBondContact CG-OD1 3.3Å; Q307-N364 PolarHBondContact NE2-OD1 2.96Å; Q307-V373 HydrophobicContact CB-CG1 4.37Å; Q307-F377 HydrophobicContact CB-CD1 4.49Å; Q307-F377 HydrophobicContact CB-CE1 4.34Å; Q307-I403 HydrophobicContact CB-CD1 4.4Å; Q307-I403 HydrophobicContact CG-CD1 3.58Å
308	I	95.9	Very high	88.5	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	127.3	176.7	-62.8	172.3	0	0	0	108.6	L93 I352 Y354 G401 W402	L93-I308 HydrophobicContact CD1-CD1 3.86Å; L93-I308 HydrophobicContact CD1-CG1 4.43Å; L93-I308 HydrophobicContact CD1-CG2 4.45Å; L93-I308 HydrophobicContact CD2-CD1 4.44Å; L93-I308 HydrophobicContact CG-CD1 3.83Å; I308-I352 HydrophobicContact CG2-CG2 3.45Å; I308-I352 VanDerWaalsContact CG2-CG2 3.45Å; I308-Y354 HydrophobicContact CG1-CG 4.37Å; I308-G401 CarbonylContact O-C 3.51Å; I308-G401 WeakPolarHBondContact O-CA 3.49Å; I308-W402 HydrophobicContact CB-CD2 4.16Å; I308-W402 HydrophobicContact CB-CH2 4.49Å; I308-W402 HydrophobicContact CB-CZ2 4.14Å; I308-W402 HydrophobicContact CD1-CZ2 3.84Å; I308-W402 HydrophobicContact CG2-CD2 4.24Å; I308-W402 HydrophobicContact CG2-CE3 4.22Å; I308-W402 HydrophobicContact CG2-CH2 3.58Å; I308-W402 HydrophobicContact CG2-CZ2 3.59Å; I308-W402 HydrophobicContact CG2-CZ3 3.91Å; I308-W402 PolarHBondContact N-O 3.47Å; I308-W402 PolarHBondContact O-N 3.41Å
309	F	97.6	Very high	86.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	138.8	178.4	-60.2	-84.8	0	0	0	110.1	Q307 V311 I352 V353 V373 F377 F378 I382 V398	Q307-F309 HydrophobicContact CB-CE2 3.6Å; Q307-F309 HydrophobicContact CB-CZ 3.83Å; F309-V311 HydrophobicContact CB-CG1 4.36Å; F309-I352 CarbonylContact O-C 3.56Å; F309-I352 WeakPolarHBondContact O-CA 3.44Å; F309-V353 PolarHBondContact N-O 3.46Å; F309-V353 PolarHBondContact O-N 2.9Å; F309-V373 HydrophobicContact CD1-CB 4.23Å; F309-V373 HydrophobicContact CD1-CG2 4.13Å; F309-V373 HydrophobicContact CE1-CB 3.53Å; F309-V373 HydrophobicContact CE1-CG1 4.17Å; F309-V373 HydrophobicContact CE1-CG2 3.74Å; F309-V373 HydrophobicContact CZ-CB 3.98Å; F309-V373 HydrophobicContact CZ-CG1 4.44Å; F309-F377 AromaticContact CE2-CD1 3.82Å; F309-F377 HydrophobicContact CE2-CD1 3.82Å; F309-F377 HydrophobicContact CE2-CE1 4Å; F309-F377 AromaticContact CZ-CD1 3.87Å; F309-F377 HydrophobicContact CZ-CD1 3.87Å; F309-F377 HydrophobicContact CZ-CE1 4.49Å; F309-F378 HydrophobicContact CB-CD2 3.92Å; F309-F378 HydrophobicContact CB-CE2 4.16Å; F309-F378 HydrophobicContact CD1-CB 3.96Å; F309-F378 AromaticContact CD1-CD2 3.87Å; F309-F378 HydrophobicContact CD1-CD2 3.87Å; F309-F378 HydrophobicContact CD1-CG 4.15Å; F309-F378 HydrophobicContact CD2-CB 4.49Å; F309-F378 AromaticContact CD2-CD2 3.83Å; F309-F378 HydrophobicContact CD2-CD2 3.83Å; F309-F378 HydrophobicContact CE1-CB 3.62Å; F309-F378 HydrophobicContact CE1-CD2 4.36Å; F309-F378 HydrophobicContact CE1-CG 4.32Å; F309-F378 HydrophobicContact CE2-CB 4.2Å; F309-F378 HydrophobicContact CE2-CD2 4.32Å; F309-F378 HydrophobicContact CG-CB 4.38Å; F309-F378 AromaticContact CG-CD2 3.58Å; F309-F378 HydrophobicContact CG-CD2 3.58Å; F309-F378 HydrophobicContact CG-CE2 4.32Å; F309-F378 HydrophobicContact CG-CG 4.31Å; F309-F378 HydrophobicContact CZ-CB 3.76Å; F309-I382 HydrophobicContact CD2-CG1 4.41Å; F309-I382 HydrophobicContact CE2-CG1 4.19Å; F309-V398 HydrophobicContact CD1-CG1 4.01Å
310	V	97.6	Very high	84.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124	166.5	-174.2	0	0	0	0	107.7	E350 F351 I352 V398 T399 S400 W402	V310-E350 HydrophobicContact CG1-CB 3.71Å; V310-E350 HydrophobicContact CG1-CG 4.22Å; V310-F351 CarbonylContact C-O 3.5Å; V310-F351 VanDerWaalsContact CA-O 3.31Å; V310-F351 WeakPolarHBondContact CA-O 3.34Å; V310-I352 HydrophobicContact CG2-CG1 4.39Å; V310-V398 CarbonylContact O-C 3.45Å; V310-V398 WeakPolarHBondContact O-CA 3.21Å; V310-T399 WeakPolarHBondContact CG1-OG1 3.35Å; V310-T399 PolarHBondContact O-N 3.35Å; V310-T399 PolarHBondContact O-OG1 2.92Å; V310-S400 VanDerWaalsContact CB-OG 3.29Å; V310-S400 WeakPolarHBondContact CB-OG 3.37Å; V310-S400 VanDerWaalsContact CG2-OG 3.25Å; V310-S400 WeakPolarHBondContact CG2-OG 3.47Å; V310-S400 PolarHBondContact N-O 3.26Å; V310-W402 HydrophobicContact CG2-CH2 4.37Å; V310-W402 HydrophobicContact CG2-CZ3 3.61Å
311	V	97	Very high	82.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	142.3	-175.4	-57	0	0	0	0	111.3	F309 E350 F351 V353 F378 L386 V396 E397 V398	F309-V311 HydrophobicContact CB-CG1 4.36Å; V311-E350 CarbonylContact O-C 3.5Å; V311-E350 VanDerWaalsContact O-CA 3.28Å; V311-E350 WeakPolarHBondContact O-CA 3.17Å; V311-F351 HydrophobicContact CG2-CB 3.91Å; V311-F351 PolarHBondContact N-O 3.49Å; V311-F351 PolarHBondContact O-N 3.25Å; V311-V353 HydrophobicContact CG2-CG2 3.76Å; V311-F378 HydrophobicContact CG1-CE2 3.55Å; V311-F378 HydrophobicContact CG1-CZ 3.57Å; V311-L386 HydrophobicContact CG2-CD2 4.17Å; V311-V396 HydrophobicContact CB-CB 4.32Å; V311-E397 CarbonylContact C-O 3.59Å; V311-E397 VanDerWaalsContact CA-O 3.25Å; V311-E397 WeakPolarHBondContact CA-O 3.48Å; V311-V398 HydrophobicContact CG1-CG2 4.32Å
312	R	94.7	Very high	80.5	Confident	102 Å²	102	64.3 Å²	64.3	39%	0.385	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.4	172	-171.1	176.3	-74	130.8	-1.1	109.8	K314 E350 V396 E397 T399	R312-K314 PolarHBondContact O-N 2.75Å; R312-E350 HydrophobicContact CB-CG 4.02Å; R312-E350 HydrophobicContact CG-CG 4.33Å; R312-E350 IonicContact CZ-OE1 3.61Å; R312-E350 IonicContact NE-OE1 3.38Å; R312-E350 IonicContact NH1-OE1 2.89Å; R312-E350 IonicContact NH2-OE1 3.51Å; R312-E350 PolarHBondContact NH2-OE1 2.9Å; R312-E350 IonicContact NH2-OE2 2.82Å; R312-E350 PolarHBondContact NH2-OE2 2.86Å; R312-E350 VanDerWaalsContact NH2-OE2 3.13Å; R312-V396 WeakPolarHBondContact O-CA 3.37Å; R312-E397 PolarHBondContact N-O 3.5Å; R312-E397 PolarHBondContact O-N 3.22Å; R312-T399 HydrophobicContact CB-CG2 3.65Å
313	P	91.6	Very high	79.1	Confident	6 Å²	6	64.3 Å²	64.3	4%	0.039	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	130.6	169.2	-20	33.1	0	0	0	110.4	L326 F351 F393 V396	P313-L326 HydrophobicContact CB-CD1 4.02Å; P313-L326 HydrophobicContact CB-CD2 3.96Å; P313-L326 HydrophobicContact CG-CD1 4.45Å; P313-L326 HydrophobicContact CG-CD2 4.23Å; P313-F351 HydrophobicContact CG-CD2 4.25Å; P313-F351 HydrophobicContact CG-CE2 3.88Å; P313-F393 HydrophobicContact CB-CD1 4.26Å; P313-F393 HydrophobicContact CB-CE1 4.35Å; P313-F393 HydrophobicContact CG-CD1 3.66Å; P313-F393 HydrophobicContact CG-CE1 3.37Å; P313-F393 HydrophobicContact CG-CG 4.47Å; P313-F393 HydrophobicContact CG-CZ 3.98Å; P313-V396 HydrophobicContact CB-CG1 4.5Å; P313-V396 HydrophobicContact CG-CG1 4.45Å
314	K	84.3	Confident	78.1	Confident	131 Å²	131	69.1 Å²	69.1	57%	0.57	35%	0.351	S	S	*	.	S	Bend	trans	-73.5	-33.8	-177.7	-71.8	-176.8	176.5	179.2	0	113.2	R312 D395 E397	R312-K314 PolarHBondContact O-N 2.75Å; K314-D395 PolarHBondContact N-O 2.98Å; K314-E397 HydrophobicContact CG-CB 4.38Å
315	N	70.2	Confident	77.6	Confident	82 Å²	82	70.7 Å²	70.7	44%	0.439	36%	0.364	S	S	.	.			trans	-101.5	91.6	-175.8	-70.3	-26.5	0	0	0	110.7	L317 L326	N315-L317 VanDerWaalsContact C-N 3.31Å; N315-L326 WeakPolarHBondContact O-CD1 3.5Å
316	T	62.1	Low	77.4	Confident	110 Å²	110	70.6 Å²	70.6	68%	0.675	37%	0.367	S	S	*	.			trans	-80.1	-8.8	177	39.4	0	0	0	0	114.2	S318 L326	T316-S318 PolarHBondContact O-N 2.8Å; T316-L326 HydrophobicContact CG2-CD1 4.48Å
317	L	58.1	Low	77.4	Confident	111 Å²	111	70.3 Å²	70.3	58%	0.581	37%	0.367	S	S	*	.			trans	-83	93.9	-179.9	-64.8	171.7	0	0	0	110.5	N315 H319 I320	N315-L317 VanDerWaalsContact C-N 3.31Å; L317-H319 PolarHBondContact O-N 2.85Å; L317-I320 HydrophobicContact CB-CD1 4.01Å; L317-I320 HydrophobicContact CB-CG1 4.41Å; L317-I320 HydrophobicContact CD1-CD1 4.01Å
318	S	55.8	Low	77.1	Confident	56 Å²	56	71.6 Å²	71.6	39%	0.392	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.3	175.1	57.2	0	0	0	0	114.1	T316	T316-S318 PolarHBondContact O-N 2.8Å
319	H	52.6	Low	76.9	Confident	176 Å²	176	76.7 Å²	76.7	82%	0.815	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	3.4	-171.2	-58.1	-52.6	0	0	0	115.1	L317	L317-H319 PolarHBondContact O-N 2.85Å
320	I	53.5	Low	76.7	Confident	92 Å²	92	80.2 Å²	80.2	47%	0.472	43%	0.427	S	S	.	.	S	Bend	trans	-92.8	133.1	177.3	-58.8	170.6	0	0	0	108	L317 G322 H323	L317-I320 HydrophobicContact CB-CD1 4.01Å; L317-I320 HydrophobicContact CB-CG1 4.41Å; L317-I320 HydrophobicContact CD1-CD1 4.01Å; I320-G322 PolarHBondContact O-N 3.26Å; I320-H323 WeakPolarHBondContact CB-CD2 3.36Å; I320-H323 WeakPolarHBondContact O-CB 3.44Å; I320-H323 PolarHBondContact O-CD2 3.39Å; I320-H323 VanDerWaalsContact O-CD2 3.25Å; I320-H323 PolarHBondContact O-N 2.97Å; I320-H323 VanDerWaalsContact O-N 3.16Å
321	E	53.7	Low	76.6	Confident	196 Å²	196	80.2 Å²	80.2	92%	0.916	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	130.6	174.8	-111.2	177.4	170.7	0	0	110.9
322	G	60.3	Low	76.6	Confident	81 Å²	81	80.2 Å²	80.2	84%	0.835	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	1.2	-177.7	0	0	0	0	0	115.6	I320	I320-G322 PolarHBondContact O-N 3.26Å
323	H	67.1	Low	76.8	Confident	75 Å²	75	75.4 Å²	75.4	35%	0.347	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-94.6	138.3	174.5	-69.9	-96.9	0	0	0	112.5	I320	I320-H323 WeakPolarHBondContact CB-CD2 3.36Å; I320-H323 WeakPolarHBondContact O-CB 3.44Å; I320-H323 PolarHBondContact O-CD2 3.39Å; I320-H323 VanDerWaalsContact O-CD2 3.25Å; I320-H323 PolarHBondContact O-N 2.97Å; I320-H323 VanDerWaalsContact O-N 3.16Å
324	Y	73	Confident	77.1	Confident	144 Å²	144	75.2 Å²	75.2	57%	0.565	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-78.4	141.4	170.7	-68.6	-86.8	0	0	0	110	P391	Y324-P391 HydrophobicContact CD1-CB 3.56Å; Y324-P391 HydrophobicContact CD1-CG 4.13Å; Y324-P391 HydrophobicContact CD2-CB 3.65Å; Y324-P391 HydrophobicContact CE1-CB 3.68Å; Y324-P391 HydrophobicContact CE1-CG 4.12Å; Y324-P391 HydrophobicContact CE2-CB 3.78Å; Y324-P391 HydrophobicContact CG-CB 3.54Å
325	P	84	Confident	77.7	Confident	56 Å²	56	69 Å²	69	36%	0.364	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-61.5	147.5	174.5	19.6	-21.9	0	0	0	110.2	W181	W181-P325 HydrophobicContact CB-CB 4.11Å; W181-P325 HydrophobicContact CB-CG 4.06Å; W181-P325 WeakPolarHBondContact CB-O 3.39Å
326	L	88.6	Confident	79.1	Confident	40 Å²	40	65.2 Å²	65.2	21%	0.209	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-95.1	154.5	175	-65.8	179.8	0	0	0	110.5	P313 N315 T316 G328 F393	P313-L326 HydrophobicContact CB-CD1 4.02Å; P313-L326 HydrophobicContact CB-CD2 3.96Å; P313-L326 HydrophobicContact CG-CD1 4.45Å; P313-L326 HydrophobicContact CG-CD2 4.23Å; N315-L326 WeakPolarHBondContact O-CD1 3.5Å; T316-L326 HydrophobicContact CG2-CD1 4.48Å; L326-G328 PolarHBondContact O-N 2.65Å; L326-F393 HydrophobicContact CD2-CD1 3.98Å; L326-F393 HydrophobicContact CD2-CE1 3.97Å
327	P	93	Very high	80.7	Confident	14 Å²	14	60.7 Å²	60.7	9%	0.091	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-60.7	134.6	176.2	-18.7	30.3	0	0	0	112.6	W181 M331 F351 I390 F393	W181-P327 HydrophobicContact CD2-CB 3.93Å; W181-P327 HydrophobicContact CD2-CG 3.85Å; W181-P327 HydrophobicContact CE3-CB 4.24Å; W181-P327 HydrophobicContact CE3-CG 3.77Å; W181-P327 HydrophobicContact CG-CB 4.4Å; W181-P327 HydrophobicContact CG-CG 4.34Å; W181-P327 HydrophobicContact CH2-CB 4.34Å; W181-P327 HydrophobicContact CH2-CG 4.47Å; W181-P327 HydrophobicContact CZ2-CB 4.02Å; W181-P327 HydrophobicContact CZ3-CB 4.44Å; W181-P327 HydrophobicContact CZ3-CG 4.1Å; P327-M331 HydrophobicContact CB-CB 3.88Å; P327-M331 HydrophobicContact CB-CG 4.03Å; P327-M331 HydrophobicContact CB-SD 3.35Å; P327-M331 WeakPolarHBondContact CB-SD 3.41Å; P327-M331 HydrophobicContact CG-SD 3.8Å; P327-F351 HydrophobicContact CB-CE1 3.89Å; P327-F351 HydrophobicContact CB-CZ 4.11Å; P327-F351 HydrophobicContact CG-CE1 4.05Å; P327-F351 HydrophobicContact CG-CZ 4.14Å; P327-I390 HydrophobicContact CG-CD1 4.07Å; P327-I390 HydrophobicContact CG-CG2 4.02Å; P327-F393 HydrophobicContact CG-CE1 3.97Å; P327-F393 HydrophobicContact CG-CZ 3.86Å
328	G	89.1	Confident	82.5	Confident	30 Å²	30	57.8 Å²	57.8	31%	0.309	32%	0.317	S	S	.	.			trans	-89.9	-168.8	177.7	0	0	0	0	0	113.7	L326 D330 M331 R344	L326-G328 PolarHBondContact O-N 2.65Å; G328-D330 PolarHBondContact O-N 3.2Å; G328-M331 WeakPolarHBondContact O-CB 3.44Å; G328-M331 PolarHBondContact O-N 3.35Å; G328-M331 VanDerWaalsContact O-N 3.15Å; G328-R344 VanDerWaalsContact O-CD 3.26Å; G328-R344 WeakPolarHBondContact O-CD 3.24Å; G328-R344 PolarHBondContact O-NE 3.21Å; G328-R344 VanDerWaalsContact O-NE 3.1Å
329	L	91.7	Very high	84.4	Confident	108 Å²	108	57.1 Å²	57.1	57%	0.565	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.5	177	-66	-178.9	0	0	0	113.6	Q139 M331 R344 L347	Q139-L329 PolarHBondContact NE2-O 2.95Å; L329-M331 VanDerWaalsContact C-N 3.31Å; L329-R344 VanDerWaalsContact O-CZ 3.27Å; L329-R344 PolarHBondContact O-NH2 3.16Å; L329-L347 HydrophobicContact CD1-CD2 4.45Å; L329-L347 HydrophobicContact CD2-CD2 3.43Å; L329-L347 VanDerWaalsContact CD2-CD2 3.43Å
330	D	92.7	Very high	86.6	Confident	75 Å²	75	48.7 Å²	48.7	40%	0.401	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	6.1	175.6	66.9	-31.7	0	0	0	113	W179 G328 P332	W179-D330 PolarHBondContact NE1-O 2.83Å; G328-D330 PolarHBondContact O-N 3.2Å; D330-P332 WeakPolarHBondContact O-CD 3.43Å
331	M	95.8	Very high	88.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-63.7	124.9	172.8	176.5	175.8	178.8	0	0	110	W181 P327 G328 L329 M334 I342 R344 F351 I390	W181-M331 HydrophobicContact CH2-CE 4.34Å; W181-M331 HydrophobicContact CH2-CG 3.89Å; W181-M331 HydrophobicContact CH2-SD 4.25Å; W181-M331 HydrophobicContact CZ2-CB 4.06Å; W181-M331 HydrophobicContact CZ2-CG 3.93Å; P327-M331 HydrophobicContact CB-CB 3.88Å; P327-M331 HydrophobicContact CB-CG 4.03Å; P327-M331 HydrophobicContact CB-SD 3.35Å; P327-M331 WeakPolarHBondContact CB-SD 3.41Å; P327-M331 HydrophobicContact CG-SD 3.8Å; G328-M331 WeakPolarHBondContact O-CB 3.44Å; G328-M331 PolarHBondContact O-N 3.35Å; G328-M331 VanDerWaalsContact O-N 3.15Å; L329-M331 VanDerWaalsContact C-N 3.31Å; M331-M334 HydrophobicContact CE-CE 4.24Å; M331-I342 HydrophobicContact CE-CB 3.97Å; M331-I342 HydrophobicContact CE-CG2 3.42Å; M331-I342 VanDerWaalsContact CE-CG2 3.42Å; M331-R344 HydrophobicContact CB-CG 4.38Å; M331-R344 PolarHBondContact O-NH2 3.41Å; M331-R344 HydrophobicContact SD-CG 4.26Å; M331-F351 HydrophobicContact CE-CD1 4.39Å; M331-F351 HydrophobicContact SD-CD1 3.71Å; M331-F351 HydrophobicContact SD-CE1 3.46Å; M331-F351 WeakPolarHBondContact SD-CE1 3.35Å; M331-I390 HydrophobicContact CE-CD1 4.2Å
332	P	97.2	Very high	90.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-78	166.1	174.9	34.7	-37.3	0	0	0	111.7	Q139 L142 W179 Y192 D330 M334	Q139-P332 VanDerWaalsContact O-CA 3.24Å; Q139-P332 WeakPolarHBondContact O-CA 3.29Å; Q139-P332 VanDerWaalsContact O-CB 3.32Å; Q139-P332 WeakPolarHBondContact O-CB 3.32Å; L142-P332 HydrophobicContact CB-CB 4.08Å; L142-P332 HydrophobicContact CB-CG 3.64Å; L142-P332 HydrophobicContact CD2-CG 4.08Å; W179-P332 HydrophobicContact CH2-CG 4.28Å; W179-P332 HydrophobicContact CZ2-CB 4.49Å; W179-P332 HydrophobicContact CZ2-CG 3.8Å; Y192-P332 HydrophobicContact CD2-CB 4.29Å; Y192-P332 HydrophobicContact CE2-CB 3.81Å; D330-P332 WeakPolarHBondContact O-CD 3.43Å; P332-M334 PolarHBondContact O-N 3.19Å
333	F	97.9	Very high	92.6	Very high	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	117.5	160.1	171.5	-137.2	0	0	0	108.1	G140 C141 L142 W199 I335 F341 I342 E343	G140-F333 PolarHBondContact O-N 3.31Å; G140-F333 VanDerWaalsContact O-N 3.11Å; C141-F333 CarbonylContact C-O 3.25Å; C141-F333 WeakPolarHBondContact CA-O 3.07Å; C141-F333 HydrophobicContact CB-CB 4.31Å; C141-F333 HydrophobicContact CB-CD1 3.92Å; L142-F333 PolarHBondContact N-O 3.26Å; W199-F333 HydrophobicContact CE3-CB 3.99Å; W199-F333 HydrophobicContact CZ3-CB 4.16Å; F333-I335 HydrophobicContact CE1-CD1 4.05Å; F333-I335 HydrophobicContact CE1-CG1 4.19Å; F333-I335 HydrophobicContact CZ-CD1 4.35Å; F333-I335 HydrophobicContact CZ-CG1 4.19Å; F333-F341 HydrophobicContact CE2-CB 4.1Å; F333-F341 HydrophobicContact CE2-CD1 4.1Å; F333-F341 HydrophobicContact CZ-CB 4.48Å; F333-F341 AromaticContact CZ-CD1 3.68Å; F333-F341 HydrophobicContact CZ-CD1 3.68Å; F333-F341 HydrophobicContact CZ-CE1 4.49Å; F333-I342 WeakPolarHBondContact CD2-O 3.33Å; F333-E343 HydrophobicContact CD2-CB 3.9Å
334	M	98.1	Very high	93.9	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	132.8	-171	-175.2	174.9	55.9	0	0	111.2	L142 L144 W181 M182 M331 P332 F341 I342 R389 I390	L142-M334 HydrophobicContact CD2-CG 4.44Å; L142-M334 CarbonylContact O-C 3.5Å; L142-M334 WeakPolarHBondContact O-CA 3.34Å; L144-M334 HydrophobicContact CD1-CG 4.21Å; L144-M334 HydrophobicContact CD1-SD 3.88Å; W181-M334 HydrophobicContact CZ3-CE 4.42Å; M182-M334 HydrophobicContact CE-SD 3.74Å; M182-M334 HydrophobicContact CG-SD 4.5Å; M182-M334 HydrophobicContact SD-SD 3.97Å; M331-M334 HydrophobicContact CE-CE 4.24Å; P332-M334 PolarHBondContact O-N 3.19Å; M334-F341 WeakPolarHBondContact O-CA 3.27Å; M334-I342 HydrophobicContact CE-CB 4.4Å; M334-I342 HydrophobicContact CE-CD1 3.57Å; M334-I342 HydrophobicContact CE-CG1 4.48Å; M334-I342 PolarHBondContact N-O 2.84Å; M334-I342 PolarHBondContact O-N 3.16Å; M334-R389 HydrophobicContact CE-CG 3.54Å; M334-R389 HydrophobicContact SD-CG 3.9Å; M334-I390 HydrophobicContact CE-CD1 3.99Å; M334-I390 HydrophobicContact CE-CG1 4.22Å
335	I	98.3	Very high	94.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	112.4	174.1	-50	179.7	0	0	0	108.3	L142 I143 L144 F333 L340 F341 F481	L142-I335 PolarHBondContact O-N 3.01Å; I143-I335 HydrophobicContact CD1-CD1 4.2Å; I143-I335 HydrophobicContact CG1-CB 4.23Å; I143-I335 HydrophobicContact CG1-CD1 4.09Å; I143-I335 HydrophobicContact CG1-CG1 4.43Å; L144-I335 PolarHBondContact N-O 3.38Å; F333-I335 HydrophobicContact CE1-CD1 4.05Å; F333-I335 HydrophobicContact CE1-CG1 4.19Å; F333-I335 HydrophobicContact CZ-CD1 4.35Å; F333-I335 HydrophobicContact CZ-CG1 4.19Å; I335-L340 WeakPolarHBondContact CA-O 3.43Å; I335-F341 HydrophobicContact CB-CD1 4.38Å; I335-F341 HydrophobicContact CB-CE1 4.33Å; I335-F341 HydrophobicContact CD1-CD1 4.05Å; I335-F341 HydrophobicContact CD1-CE1 3.71Å; I335-F341 HydrophobicContact CG1-CD1 3.71Å; I335-F341 HydrophobicContact CG1-CE1 3.8Å; I335-F341 HydrophobicContact CG2-CD1 4.07Å; I335-F341 HydrophobicContact CG2-CE1 3.67Å; I335-F341 HydrophobicContact CG2-CZ 3.94Å; I335-F481 HydrophobicContact CD1-CE1 4.48Å; I335-F481 HydrophobicContact CD1-CZ 4.4Å; I335-F481 HydrophobicContact CG2-CB 4.48Å; I335-F481 HydrophobicContact CG2-CD1 3.71Å; I335-F481 HydrophobicContact CG2-CD2 3.84Å; I335-F481 HydrophobicContact CG2-CE1 3.8Å; I335-F481 HydrophobicContact CG2-CE2 3.92Å; I335-F481 HydrophobicContact CG2-CG 3.74Å; I335-F481 HydrophobicContact CG2-CZ 3.9Å
336	D	98.2	Very high	94.9	Very high	3 Å²	3	28 Å²	28	2%	0.016	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	149.5	176.2	-171.4	63.8	0	0	0	112.1	N338 R339 L340 R389 F481	D336-N338 PolarHBondContact O-N 3.07Å; D336-N338 VanDerWaalsContact OD2-CB 3.27Å; D336-N338 WeakPolarHBondContact OD2-CB 3.16Å; D336-N338 PolarHBondContact OD2-N 3.13Å; D336-N338 PolarHBondContact OD2-ND2 3.02Å; D336-R339 WeakPolarHBondContact O-CA 3.34Å; D336-R339 PolarHBondContact O-N 2.86Å; D336-L340 HydrophobicContact CB-CB 3.86Å; D336-L340 PolarHBondContact N-O 2.9Å; D336-R389 IonicContact OD1-CZ 2.9Å; D336-R389 IonicContact OD1-NE 3.12Å; D336-R389 PolarHBondContact OD1-NE 3.41Å; D336-R389 IonicContact OD1-NH2 3.96Å; D336-R389 PolarHBondContact OD1-NH2 2.87Å; D336-F481 WeakPolarHBondContact O-CB 3.15Å
337	H	96.5	Very high	94.8	Very high	16 Å²	16	32.9 Å²	32.9	7%	0.074	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.9	174.9	73.5	98.2	0	0	0	114.7	L144 N146 D186 R339	L144-H337 WeakPolarHBondContact O-CB 3.23Å; L144-H337 PolarHBondContact O-N 2.9Å; N146-H337 PolarHBondContact ND2-CE1 3.43Å; N146-H337 PolarHBondContact ND2-ND1 2.72Å; D186-H337 IonicContact OD2-CE1 2.67Å; D186-H337 IonicContact OD2-NE2 3.63Å; D186-H337 PolarHBondContact OD2-NE2 3.12Å; H337-R339 VanDerWaalsContact C-N 3.33Å
338	N	95.8	Very high	94.6	Very high	50 Å²	50	34.6 Å²	34.6	27%	0.267	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	13.1	172.2	-59.9	-74.6	0	0	0	113.9	D336 N357 L385	D336-N338 PolarHBondContact O-N 3.07Å; D336-N338 VanDerWaalsContact OD2-CB 3.27Å; D336-N338 WeakPolarHBondContact OD2-CB 3.16Å; D336-N338 PolarHBondContact OD2-N 3.13Å; D336-N338 PolarHBondContact OD2-ND2 3.02Å; N338-N357 PolarHBondContact O-ND2 3.44Å; N338-L385 HydrophobicContact CB-CD1 4.49Å; N338-L385 HydrophobicContact CB-CD2 4.13Å
339	R	96.4	Very high	94.6	Very high	41 Å²	41	35.2 Å²	35.2	16%	0.155	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	40.5	-177.3	-50.5	-167.7	149.7	-120.4	0	113.8	D336 H337 F341 S355 D356 N357 F481	D336-R339 WeakPolarHBondContact O-CA 3.34Å; D336-R339 PolarHBondContact O-N 2.86Å; H337-R339 VanDerWaalsContact C-N 3.33Å; R339-F341 HydrophobicContact CB-CE2 4.41Å; R339-S355 VanDerWaalsContact O-CA 3.24Å; R339-S355 WeakPolarHBondContact O-CA 3.43Å; R339-S355 VanDerWaalsContact O-CB 3.27Å; R339-S355 WeakPolarHBondContact O-CB 3.41Å; R339-S355 PolarHBondContact O-OG 2.79Å; R339-D356 WeakPolarHBondContact CB-OD1 2.96Å; R339-D356 WeakPolarHBondContact CD-OD1 3.34Å; R339-D356 IonicContact CZ-OD1 3.07Å; R339-D356 IonicContact NE-OD1 2.65Å; R339-D356 IonicContact NH1-OD1 2.72Å; R339-D356 PolarHBondContact NH1-OD1 2.89Å; R339-D356 IonicContact NH1-OD2 2.92Å; R339-N357 HydrophobicContact CB-CB 3.96Å; R339-N357 HydrophobicContact CG-CB 4.49Å; R339-F481 HydrophobicContact CG-CD2 4.14Å; R339-F481 WeakPolarHBondContact CG-OXT 3.34Å; R339-F481 VanDerWaalsContact CZ-O 3.26Å; R339-F481 PolarHBondContact NE-O 3.37Å; R339-F481 PolarHBondContact NE-OXT 3.5Å; R339-F481 VanDerWaalsContact NE-OXT 3.08Å; R339-F481 PolarHBondContact NH2-O 3.49Å
340	L	97.9	Very high	94.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	129.7	171.2	-174	74.9	0	0	0	108.8	I335 D336 I342 V353 I382 L385 L386	I335-L340 WeakPolarHBondContact CA-O 3.43Å; D336-L340 HydrophobicContact CB-CB 3.86Å; D336-L340 PolarHBondContact N-O 2.9Å; L340-I342 HydrophobicContact CD2-CD1 3.65Å; L340-I342 HydrophobicContact CD2-CG1 4.15Å; L340-I342 HydrophobicContact CG-CD1 4.15Å; L340-I342 HydrophobicContact CG-CG1 4.11Å; L340-V353 HydrophobicContact CD1-CG1 3.68Å; L340-V353 HydrophobicContact CG-CG1 4.33Å; L340-I382 HydrophobicContact CD1-CG2 4.06Å; L340-L385 HydrophobicContact CD1-CB 4.38Å; L340-L385 HydrophobicContact CD2-CB 3.88Å; L340-L386 HydrophobicContact CD2-CB 4.23Å; L340-L386 HydrophobicContact CD2-CD1 4.36Å
341	F	98.2	Very high	95	Very high	9 Å²	9	27.2 Å²	27.2	4%	0.039	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.1	-177.5	-64.5	-100.2	0	0	0	108.9	F333 M334 I335 R339 V353 Y354 D356 F481	F333-F341 HydrophobicContact CE2-CB 4.1Å; F333-F341 HydrophobicContact CE2-CD1 4.1Å; F333-F341 HydrophobicContact CZ-CB 4.48Å; F333-F341 AromaticContact CZ-CD1 3.68Å; F333-F341 HydrophobicContact CZ-CD1 3.68Å; F333-F341 HydrophobicContact CZ-CE1 4.49Å; M334-F341 WeakPolarHBondContact O-CA 3.27Å; I335-F341 HydrophobicContact CB-CD1 4.38Å; I335-F341 HydrophobicContact CB-CE1 4.33Å; I335-F341 HydrophobicContact CD1-CD1 4.05Å; I335-F341 HydrophobicContact CD1-CE1 3.71Å; I335-F341 HydrophobicContact CG1-CD1 3.71Å; I335-F341 HydrophobicContact CG1-CE1 3.8Å; I335-F341 HydrophobicContact CG2-CD1 4.07Å; I335-F341 HydrophobicContact CG2-CE1 3.67Å; I335-F341 HydrophobicContact CG2-CZ 3.94Å; R339-F341 HydrophobicContact CB-CE2 4.41Å; F341-V353 WeakPolarHBondContact O-CA 3.5Å; F341-Y354 HydrophobicContact CB-CD1 3.77Å; F341-Y354 HydrophobicContact CB-CD2 4.17Å; F341-Y354 HydrophobicContact CB-CE1 3.35Å; F341-Y354 HydrophobicContact CB-CE2 3.8Å; F341-Y354 HydrophobicContact CB-CG 4.15Å; F341-Y354 HydrophobicContact CD1-CE2 4.24Å; F341-Y354 AromaticContact CD1-CZ 3.92Å; F341-Y354 HydrophobicContact CD2-CD2 4.14Å; F341-Y354 AromaticContact CD2-CE2 3.77Å; F341-Y354 HydrophobicContact CD2-CE2 3.77Å; F341-Y354 HydrophobicContact CE2-CE2 4.43Å; F341-Y354 HydrophobicContact CG-CD2 4.29Å; F341-Y354 HydrophobicContact CG-CE1 4.09Å; F341-Y354 AromaticContact CG-CE2 3.67Å; F341-Y354 HydrophobicContact CG-CE2 3.67Å; F341-Y354 AromaticContact CG-CZ 3.56Å; F341-Y354 PolarHBondContact N-O 3.08Å; F341-Y354 PolarHBondContact O-N 2.89Å; F341-Y354 VanDerWaalsContact O-N 3.16Å; F341-D356 HydrophobicContact CE2-CB 3.88Å; F341-D356 VanDerWaalsContact CE2-CG 3.4Å; F341-D356 WeakPolarHBondContact CE2-OD1 3.49Å; F341-D356 HydrophobicContact CZ-CB 4.37Å; F341-D356 WeakPolarHBondContact CZ-OD2 3.28Å; F341-F481 HydrophobicContact CE1-CE2 4.45Å; F341-F481 HydrophobicContact CZ-CD2 4.4Å; F341-F481 AromaticContact CZ-CE2 3.85Å; F341-F481 HydrophobicContact CZ-CE2 3.85Å
342	I	98	Very high	95.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	125.7	-176.4	-51.4	162.8	0	0	0	110.1	M331 F333 M334 L340 F351 I352 V353 L386 I390	M331-I342 HydrophobicContact CE-CB 3.97Å; M331-I342 HydrophobicContact CE-CG2 3.42Å; M331-I342 VanDerWaalsContact CE-CG2 3.42Å; F333-I342 WeakPolarHBondContact CD2-O 3.33Å; M334-I342 HydrophobicContact CE-CB 4.4Å; M334-I342 HydrophobicContact CE-CD1 3.57Å; M334-I342 HydrophobicContact CE-CG1 4.48Å; M334-I342 PolarHBondContact N-O 2.84Å; M334-I342 PolarHBondContact O-N 3.16Å; L340-I342 HydrophobicContact CD2-CD1 3.65Å; L340-I342 HydrophobicContact CD2-CG1 4.15Å; L340-I342 HydrophobicContact CG-CD1 4.15Å; L340-I342 HydrophobicContact CG-CG1 4.11Å; I342-F351 HydrophobicContact CG2-CB 4.31Å; I342-I352 WeakPolarHBondContact CA-O 3.45Å; I342-V353 HydrophobicContact CG1-CG1 4.22Å; I342-V353 HydrophobicContact CG1-CG2 4.28Å; I342-V353 HydrophobicContact CG2-CG2 4.15Å; I342-L386 HydrophobicContact CD1-CD1 3.39Å; I342-L386 HydrophobicContact CG1-CD1 3.97Å; I342-I390 HydrophobicContact CD1-CD1 4.12Å
343	E	96.3	Very high	95.2	Very high	7 Å²	7	27.9 Å²	27.9	3%	0.033	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	157.6	170.3	60.8	-173.5	-150.1	0	0	110.9	W199 F333 F351 I352	W199-E343 HydrophobicContact CD2-CB 4.42Å; F333-E343 HydrophobicContact CD2-CB 3.9Å; E343-F351 CarbonylContact O-C 3.58Å; E343-F351 VanDerWaalsContact O-CA 3.27Å; E343-F351 WeakPolarHBondContact O-CA 3.49Å; E343-I352 HydrophobicContact CG-CB 3.8Å; E343-I352 HydrophobicContact CG-CD1 4.38Å; E343-I352 HydrophobicContact CG-CG1 4.46Å; E343-I352 HydrophobicContact CG-CG2 4.46Å; E343-I352 PolarHBondContact N-O 3.09Å; E343-I352 PolarHBondContact O-N 3.26Å
344	R	95.3	Very high	95.1	Very high	13 Å²	13	29.4 Å²	29.4	5%	0.049	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	140.6	171.7	-90.2	-173.4	-59.5	91.5	14.1	110.6	W199 G328 L329 M331 D346 F351	W199-R344 HydrophobicContact CH2-CB 4.48Å; W199-R344 HydrophobicContact CZ2-CB 4.08Å; W199-R344 PolarHBondContact NE1-O 2.89Å; G328-R344 VanDerWaalsContact O-CD 3.26Å; G328-R344 WeakPolarHBondContact O-CD 3.24Å; G328-R344 PolarHBondContact O-NE 3.21Å; G328-R344 VanDerWaalsContact O-NE 3.1Å; L329-R344 VanDerWaalsContact O-CZ 3.27Å; L329-R344 PolarHBondContact O-NH2 3.16Å; M331-R344 HydrophobicContact CB-CG 4.38Å; M331-R344 PolarHBondContact O-NH2 3.41Å; M331-R344 HydrophobicContact SD-CG 4.26Å; R344-D346 PolarHBondContact NH1-O 2.85Å; R344-D346 VanDerWaalsContact NH1-O 3.14Å; R344-D346 PolarHBondContact O-N 2.89Å; R344-F351 HydrophobicContact CG-CD1 3.74Å; R344-F351 HydrophobicContact CG-CE1 3.4Å; R344-F351 HydrophobicContact CG-CZ 4.26Å
345	R	92.2	Very high	95	Very high	80 Å²	80	29.6 Å²	29.6	30%	0.302	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	90.2	166.1	-164.2	170.4	85.5	162.3	8.6	109.9	L347 S348 E350 I352	R345-L347 PolarHBondContact O-N 3.22Å; R345-S348 WeakPolarHBondContact O-CB 3.35Å; R345-S348 PolarHBondContact O-N 2.67Å; R345-S348 VanDerWaalsContact O-N 3.13Å; R345-S348 PolarHBondContact O-OG 3.24Å; R345-E350 HydrophobicContact CB-CB 4.19Å; R345-E350 WeakPolarHBondContact CB-O 3.1Å; R345-E350 IonicContact CZ-OE1 3.4Å; R345-E350 IonicContact CZ-OE2 3.69Å; R345-E350 VanDerWaalsContact CZ-OE2 3.26Å; R345-E350 PolarHBondContact N-O 3.2Å; R345-E350 IonicContact NE-OE2 3.88Å; R345-E350 PolarHBondContact NE-OE2 3.19Å; R345-E350 IonicContact NH2-OE1 2.68Å; R345-E350 PolarHBondContact NH2-OE1 3.49Å; R345-E350 IonicContact NH2-OE2 3.91Å; R345-E350 PolarHBondContact NH2-OE2 3.3Å; R345-I352 HydrophobicContact CB-CD1 4.46Å; R345-I352 HydrophobicContact CB-CG1 4.23Å; R345-I352 HydrophobicContact CG-CD1 4.39Å
346	D	85.3	Confident	94.8	Very high	101 Å²	101	31.4 Å²	31.4	54%	0.54	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	-124.4	177.1	-54.7	-47.3	0	0	0	112.5	R344	R344-D346 PolarHBondContact NH1-O 2.85Å; R344-D346 VanDerWaalsContact NH1-O 3.14Å; R344-D346 PolarHBondContact O-N 2.89Å
347	L	88	Confident	94.6	Very high	142 Å²	142	32.6 Å²	32.6	74%	0.743	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.3	14.2	178.9	-54	-179.6	0	0	0	112.2	L329 R345 G349	L329-L347 HydrophobicContact CD1-CD2 4.45Å; L329-L347 HydrophobicContact CD2-CD2 3.43Å; L329-L347 VanDerWaalsContact CD2-CD2 3.43Å; R345-L347 PolarHBondContact O-N 3.22Å; L347-G349 VanDerWaalsContact C-N 3.26Å; L347-G349 PolarHBondContact O-N 2.71Å
348	S	88.6	Confident	94.4	Very high	49 Å²	49	34.6 Å²	34.6	34%	0.343	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-10.7	-173	65.4	0	0	0	0	114.3	R345 E350	R345-S348 WeakPolarHBondContact O-CB 3.35Å; R345-S348 PolarHBondContact O-N 2.67Å; R345-S348 VanDerWaalsContact O-N 3.13Å; R345-S348 PolarHBondContact O-OG 3.24Å; S348-E350 WeakPolarHBondContact CB-OE2 3.32Å; S348-E350 PolarHBondContact O-N 3.01Å; S348-E350 WeakPolarHBondContact OG-CB 3.28Å; S348-E350 PolarHBondContact OG-N 3.05Å; S348-E350 PolarHBondContact OG-OE2 3.35Å
349	G	89.1	Confident	94.3	Very high	44 Å²	44	38.3 Å²	38.3	45%	0.454	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	10.6	-169.2	0	0	0	0	0	113.4	L347 F351	L347-G349 VanDerWaalsContact C-N 3.26Å; L347-G349 PolarHBondContact O-N 2.71Å; G349-F351 WeakPolarHBondContact O-CE2 3.35Å
350	E	95.1	Very high	94.1	Very high	7 Å²	7	36.7 Å²	36.7	3%	0.033	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	159.3	173.5	-66.4	163.5	120.9	0	0	111.3	V310 V311 R312 R345 S348 T399	V310-E350 HydrophobicContact CG1-CB 3.71Å; V310-E350 HydrophobicContact CG1-CG 4.22Å; V311-E350 CarbonylContact O-C 3.5Å; V311-E350 VanDerWaalsContact O-CA 3.28Å; V311-E350 WeakPolarHBondContact O-CA 3.17Å; R312-E350 HydrophobicContact CB-CG 4.02Å; R312-E350 HydrophobicContact CG-CG 4.33Å; R312-E350 IonicContact CZ-OE1 3.61Å; R312-E350 IonicContact NE-OE1 3.38Å; R312-E350 IonicContact NH1-OE1 2.89Å; R312-E350 IonicContact NH2-OE1 3.51Å; R312-E350 PolarHBondContact NH2-OE1 2.9Å; R312-E350 IonicContact NH2-OE2 2.82Å; R312-E350 PolarHBondContact NH2-OE2 2.86Å; R312-E350 VanDerWaalsContact NH2-OE2 3.13Å; R345-E350 HydrophobicContact CB-CB 4.19Å; R345-E350 WeakPolarHBondContact CB-O 3.1Å; R345-E350 IonicContact CZ-OE1 3.4Å; R345-E350 IonicContact CZ-OE2 3.69Å; R345-E350 VanDerWaalsContact CZ-OE2 3.26Å; R345-E350 PolarHBondContact N-O 3.2Å; R345-E350 IonicContact NE-OE2 3.88Å; R345-E350 PolarHBondContact NE-OE2 3.19Å; R345-E350 IonicContact NH2-OE1 2.68Å; R345-E350 PolarHBondContact NH2-OE1 3.49Å; R345-E350 IonicContact NH2-OE2 3.91Å; R345-E350 PolarHBondContact NH2-OE2 3.3Å; S348-E350 WeakPolarHBondContact CB-OE2 3.32Å; S348-E350 PolarHBondContact O-N 3.01Å; S348-E350 WeakPolarHBondContact OG-CB 3.28Å; S348-E350 PolarHBondContact OG-N 3.05Å; S348-E350 PolarHBondContact OG-OE2 3.35Å; E350-T399 VanDerWaalsContact OE1-CB 3.27Å; E350-T399 WeakPolarHBondContact OE1-CB 3.47Å; E350-T399 WeakPolarHBondContact OE1-CG2 3.5Å; E350-T399 PolarHBondContact OE1-OG1 3.06Å
351	F	97.1	Very high	93.7	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.035	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.3	-177.6	-56.7	-94.6	0	0	0	109.3	V310 V311 P313 P327 M331 I342 E343 R344 G349 V353 F393	V310-F351 CarbonylContact C-O 3.5Å; V310-F351 VanDerWaalsContact CA-O 3.31Å; V310-F351 WeakPolarHBondContact CA-O 3.34Å; V311-F351 HydrophobicContact CG2-CB 3.91Å; V311-F351 PolarHBondContact N-O 3.49Å; V311-F351 PolarHBondContact O-N 3.25Å; P313-F351 HydrophobicContact CG-CD2 4.25Å; P313-F351 HydrophobicContact CG-CE2 3.88Å; P327-F351 HydrophobicContact CB-CE1 3.89Å; P327-F351 HydrophobicContact CB-CZ 4.11Å; P327-F351 HydrophobicContact CG-CE1 4.05Å; P327-F351 HydrophobicContact CG-CZ 4.14Å; M331-F351 HydrophobicContact CE-CD1 4.39Å; M331-F351 HydrophobicContact SD-CD1 3.71Å; M331-F351 HydrophobicContact SD-CE1 3.46Å; M331-F351 WeakPolarHBondContact SD-CE1 3.35Å; I342-F351 HydrophobicContact CG2-CB 4.31Å; E343-F351 CarbonylContact O-C 3.58Å; E343-F351 VanDerWaalsContact O-CA 3.27Å; E343-F351 WeakPolarHBondContact O-CA 3.49Å; R344-F351 HydrophobicContact CG-CD1 3.74Å; R344-F351 HydrophobicContact CG-CE1 3.4Å; R344-F351 HydrophobicContact CG-CZ 4.26Å; G349-F351 WeakPolarHBondContact O-CE2 3.35Å; F351-V353 HydrophobicContact CB-CG2 4.48Å; F351-F393 HydrophobicContact CB-CE2 4.28Å; F351-F393 HydrophobicContact CD1-CE2 4.32Å; F351-F393 AromaticContact CD1-CZ 3.94Å; F351-F393 HydrophobicContact CD1-CZ 3.94Å; F351-F393 HydrophobicContact CD2-CE1 4.3Å; F351-F393 AromaticContact CD2-CE2 3.87Å; F351-F393 HydrophobicContact CD2-CE2 3.87Å; F351-F393 AromaticContact CD2-CZ 3.41Å; F351-F393 HydrophobicContact CD2-CZ 3.41Å; F351-F393 VanDerWaalsContact CD2-CZ 3.41Å; F351-F393 AromaticContact CE1-CZ 3.92Å; F351-F393 HydrophobicContact CE1-CZ 3.92Å; F351-F393 AromaticContact CE2-CE1 3.98Å; F351-F393 HydrophobicContact CE2-CE1 3.98Å; F351-F393 HydrophobicContact CE2-CE2 4.33Å; F351-F393 AromaticContact CE2-CZ 3.42Å; F351-F393 HydrophobicContact CE2-CZ 3.42Å; F351-F393 VanDerWaalsContact CE2-CZ 3.42Å; F351-F393 AromaticContact CG-CE2 3.88Å; F351-F393 HydrophobicContact CG-CE2 3.88Å; F351-F393 AromaticContact CG-CZ 3.69Å; F351-F393 HydrophobicContact CG-CZ 3.69Å; F351-F393 HydrophobicContact CZ-CE1 4.28Å; F351-F393 AromaticContact CZ-CZ 3.68Å; F351-F393 HydrophobicContact CZ-CZ 3.68Å
352	I	97.7	Very high	93.1	Very high	14 Å²	14	40.9 Å²	40.9	7%	0.072	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	128.6	172.9	-60	175.6	0	0	0	107.1	L93 I308 F309 V310 I342 E343 R345 W402	L93-I352 HydrophobicContact CD1-CG2 3.68Å; L93-I352 HydrophobicContact CD2-CD1 4Å; L93-I352 HydrophobicContact CD2-CG2 3.99Å; L93-I352 HydrophobicContact CG-CG2 4.5Å; I308-I352 HydrophobicContact CG2-CG2 3.45Å; I308-I352 VanDerWaalsContact CG2-CG2 3.45Å; F309-I352 CarbonylContact O-C 3.56Å; F309-I352 WeakPolarHBondContact O-CA 3.44Å; V310-I352 HydrophobicContact CG2-CG1 4.39Å; I342-I352 WeakPolarHBondContact CA-O 3.45Å; E343-I352 HydrophobicContact CG-CB 3.8Å; E343-I352 HydrophobicContact CG-CD1 4.38Å; E343-I352 HydrophobicContact CG-CG1 4.46Å; E343-I352 HydrophobicContact CG-CG2 4.46Å; E343-I352 PolarHBondContact N-O 3.09Å; E343-I352 PolarHBondContact O-N 3.26Å; R345-I352 HydrophobicContact CB-CD1 4.46Å; R345-I352 HydrophobicContact CB-CG1 4.23Å; R345-I352 HydrophobicContact CG-CD1 4.39Å; I352-W402 HydrophobicContact CD1-CH2 4.37Å
353	V	98.3	Very high	92.3	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	132.1	-175.5	-172.5	0	0	0	0	110.1	F309 V311 L340 F341 I342 F351 I382 L386	F309-V353 PolarHBondContact N-O 3.46Å; F309-V353 PolarHBondContact O-N 2.9Å; V311-V353 HydrophobicContact CG2-CG2 3.76Å; L340-V353 HydrophobicContact CD1-CG1 3.68Å; L340-V353 HydrophobicContact CG-CG1 4.33Å; F341-V353 WeakPolarHBondContact O-CA 3.5Å; I342-V353 HydrophobicContact CG1-CG1 4.22Å; I342-V353 HydrophobicContact CG1-CG2 4.28Å; I342-V353 HydrophobicContact CG2-CG2 4.15Å; F351-V353 HydrophobicContact CB-CG2 4.48Å; V353-I382 HydrophobicContact CB-CG2 4.44Å; V353-I382 HydrophobicContact CG1-CG2 3.51Å; V353-L386 HydrophobicContact CG1-CD1 4.28Å; V353-L386 HydrophobicContact CG2-CD1 4.02Å; V353-L386 HydrophobicContact CG2-CD2 4.15Å
354	Y	97.2	Very high	91.7	Very high	33 Å²	33	43.9 Å²	43.9	13%	0.129	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	172.2	173	67.5	-80.1	0	0	0	111	L93 Q307 I308 F341	L93-Y354 HydrophobicContact CD1-CD1 3.6Å; L93-Y354 HydrophobicContact CD1-CE1 3.3Å; Q307-Y354 WeakPolarHBondContact O-CB 3.04Å; I308-Y354 HydrophobicContact CG1-CG 4.37Å; F341-Y354 HydrophobicContact CB-CD1 3.77Å; F341-Y354 HydrophobicContact CB-CD2 4.17Å; F341-Y354 HydrophobicContact CB-CE1 3.35Å; F341-Y354 HydrophobicContact CB-CE2 3.8Å; F341-Y354 HydrophobicContact CB-CG 4.15Å; F341-Y354 HydrophobicContact CD1-CE2 4.24Å; F341-Y354 AromaticContact CD1-CZ 3.92Å; F341-Y354 HydrophobicContact CD2-CD2 4.14Å; F341-Y354 AromaticContact CD2-CE2 3.77Å; F341-Y354 HydrophobicContact CD2-CE2 3.77Å; F341-Y354 HydrophobicContact CE2-CE2 4.43Å; F341-Y354 HydrophobicContact CG-CD2 4.29Å; F341-Y354 HydrophobicContact CG-CE1 4.09Å; F341-Y354 AromaticContact CG-CE2 3.67Å; F341-Y354 HydrophobicContact CG-CE2 3.67Å; F341-Y354 AromaticContact CG-CZ 3.56Å; F341-Y354 PolarHBondContact N-O 3.08Å; F341-Y354 PolarHBondContact O-N 2.89Å; F341-Y354 VanDerWaalsContact O-N 3.16Å
355	S	96.4	Very high	90.8	Very high	4 Å²	4	46.5 Å²	46.5	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.5	173.3	-176.9	0	0	0	0	110.7	R306 R339 N357	R306-S355 WeakPolarHBondContact CD-O 3.44Å; R339-S355 VanDerWaalsContact O-CA 3.24Å; R339-S355 WeakPolarHBondContact O-CA 3.43Å; R339-S355 VanDerWaalsContact O-CB 3.27Å; R339-S355 WeakPolarHBondContact O-CB 3.41Å; R339-S355 PolarHBondContact O-OG 2.79Å; S355-N357 WeakPolarHBondContact OG-CB 3.01Å; S355-N357 PolarHBondContact OG-N 3.07Å
356	D	93.6	Very high	89.7	Confident	38 Å²	38	48.4 Å²	48.4	20%	0.203	27%	0.272	C	S	.	.			trans	-96.3	8.4	171.3	83.1	-4	0	0	0	113.2	R306 R339 F341 P358	R306-D356 PolarHBondContact NH2-O 2.67Å; R339-D356 WeakPolarHBondContact CB-OD1 2.96Å; R339-D356 WeakPolarHBondContact CD-OD1 3.34Å; R339-D356 IonicContact CZ-OD1 3.07Å; R339-D356 IonicContact NE-OD1 2.65Å; R339-D356 IonicContact NH1-OD1 2.72Å; R339-D356 PolarHBondContact NH1-OD1 2.89Å; R339-D356 IonicContact NH1-OD2 2.92Å; F341-D356 HydrophobicContact CE2-CB 3.88Å; F341-D356 VanDerWaalsContact CE2-CG 3.4Å; F341-D356 WeakPolarHBondContact CE2-OD1 3.49Å; F341-D356 HydrophobicContact CZ-CB 4.37Å; F341-D356 WeakPolarHBondContact CZ-OD2 3.28Å; D356-P358 WeakPolarHBondContact O-CD 3.34Å
357	N	94.4	Very high	88.5	Confident	28 Å²	28	43.9 Å²	43.9	15%	0.15	25%	0.249	C	C	.	.			trans	-57.6	122.1	-173.7	-163.1	-47.2	0	0	0	111.1	N338 R339 S355 K359 F360	N338-N357 PolarHBondContact O-ND2 3.44Å; R339-N357 HydrophobicContact CB-CB 3.96Å; R339-N357 HydrophobicContact CG-CB 4.49Å; S355-N357 WeakPolarHBondContact OG-CB 3.01Å; S355-N357 PolarHBondContact OG-N 3.07Å; N357-K359 HydrophobicContact CB-CG 4.31Å; N357-K359 PolarHBondContact O-N 2.89Å; N357-K359 VanDerWaalsContact OD1-CG 3.24Å; N357-K359 WeakPolarHBondContact OD1-CG 3.45Å; N357-K359 PolarHBondContact OD1-N 3.32Å; N357-F360 HydrophobicContact CB-CD2 3.64Å; N357-F360 HydrophobicContact CB-CE2 3.83Å; N357-F360 WeakPolarHBondContact O-CB 3.31Å; N357-F360 PolarHBondContact O-N 3.23Å
358	P	91.3	Very high	87.2	Confident	59 Å²	59	40.2 Å²	40.2	38%	0.383	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-56.3	-25.7	-177.1	-28.8	35.6	0	0	0	114.3	D356 F360 D361	D356-P358 WeakPolarHBondContact O-CD 3.34Å; P358-F360 PolarHBondContact O-N 2.96Å; P358-F360 VanDerWaalsContact O-N 3.11Å; P358-D361 WeakPolarHBondContact CA-OD2 3.16Å; P358-D361 WeakPolarHBondContact O-CB 3.22Å; P358-D361 VanDerWaalsContact O-CG 3.31Å; P358-D361 PolarHBondContact O-N 2.73Å; P358-D361 VanDerWaalsContact O-N 3.1Å
359	K	93.1	Very high	85.7	Confident	127 Å²	127	46.7 Å²	46.7	55%	0.552	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-61.9	-19.2	176.3	81	-169.1	179.6	177	0	113.6	N357	N357-K359 HydrophobicContact CB-CG 4.31Å; N357-K359 PolarHBondContact O-N 2.89Å; N357-K359 VanDerWaalsContact OD1-CG 3.24Å; N357-K359 WeakPolarHBondContact OD1-CG 3.45Å; N357-K359 PolarHBondContact OD1-N 3.32Å
360	F	92.7	Very high	84.3	Confident	7 Å²	7	51.3 Å²	51.3	3%	0.031	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-96.5	-1.1	179.4	-57.7	-43.7	0	0	0	113.5	N357 P358 S362 L363 N364 F377 H381	N357-F360 HydrophobicContact CB-CD2 3.64Å; N357-F360 HydrophobicContact CB-CE2 3.83Å; N357-F360 WeakPolarHBondContact O-CB 3.31Å; N357-F360 PolarHBondContact O-N 3.23Å; P358-F360 PolarHBondContact O-N 2.96Å; P358-F360 VanDerWaalsContact O-N 3.11Å; F360-S362 VanDerWaalsContact C-N 3.33Å; F360-S362 PolarHBondContact O-N 3.44Å; F360-L363 HydrophobicContact CD1-CD1 4.19Å; F360-L363 PolarHBondContact O-N 2.64Å; F360-N364 VanDerWaalsContact O-CG 3.32Å; F360-N364 PolarHBondContact O-N 2.62Å; F360-N364 PolarHBondContact O-ND2 3.31Å; F360-N364 VanDerWaalsContact O-ND2 3.17Å; F360-F377 HydrophobicContact CB-CE2 3.97Å; F360-F377 HydrophobicContact CB-CZ 4.07Å; F360-F377 AromaticContact CD1-CE2 3.8Å; F360-F377 HydrophobicContact CD1-CE2 3.8Å; F360-F377 HydrophobicContact CD1-CZ 4.25Å; F360-F377 HydrophobicContact CD2-CE2 4.47Å; F360-F377 HydrophobicContact CD2-CZ 4.12Å; F360-F377 HydrophobicContact CE1-CE2 4.35Å; F360-F377 AromaticContact CG-CE2 3.85Å; F360-F377 HydrophobicContact CG-CE2 3.85Å; F360-F377 AromaticContact CG-CZ 3.92Å; F360-F377 HydrophobicContact CG-CZ 3.92Å; F360-H381 HydrophobicContact CE1-CB 3.72Å; F360-H381 AromaticContact CE1-CD2 3.87Å; F360-H381 AromaticContact CE1-CG 3.66Å; F360-H381 HydrophobicContact CZ-CB 3.72Å
361	D	89.9	Confident	83.1	Confident	19 Å²	19	57.3 Å²	57.3	10%	0.102	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-42.3	-175.5	-74.5	-35.1	0	0	0	112.8	R304 R306 P358 N364 N365	R304-D361 IonicContact CZ-OD2 2.62Å; R304-D361 IonicContact NH1-OD1 3.31Å; R304-D361 PolarHBondContact NH1-OD1 2.93Å; R304-D361 IonicContact NH1-OD2 3.34Å; R304-D361 PolarHBondContact NH1-OD2 2.86Å; R306-D361 IonicContact CZ-OD1 3.41Å; R306-D361 IonicContact NH1-OD1 3.91Å; R306-D361 PolarHBondContact NH1-OD1 3.35Å; R306-D361 IonicContact NH2-OD1 2.89Å; R306-D361 PolarHBondContact NH2-OD1 3.43Å; P358-D361 WeakPolarHBondContact CA-OD2 3.16Å; P358-D361 WeakPolarHBondContact O-CB 3.22Å; P358-D361 VanDerWaalsContact O-CG 3.31Å; P358-D361 PolarHBondContact O-N 2.73Å; P358-D361 VanDerWaalsContact O-N 3.1Å; D361-N364 PolarHBondContact O-N 3.34Å; D361-N365 VanDerWaalsContact O-CG 3.28Å; D361-N365 PolarHBondContact O-N 3.41Å; D361-N365 VanDerWaalsContact O-N 3.08Å; D361-N365 PolarHBondContact O-ND2 2.82Å
362	S	85.6	Confident	82.3	Confident	78 Å²	78	59.5 Å²	59.5	55%	0.545	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-40.2	177.3	54.1	0	0	0	0	112.6	F360	F360-S362 VanDerWaalsContact C-N 3.33Å; F360-S362 PolarHBondContact O-N 3.44Å
363	L	82.1	Confident	81.9	Confident	67 Å²	67	59.6 Å²	59.6	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-68.4	-37.7	178.8	-62.6	173.8	0	0	0	111.6	F360 C367 F377	F360-L363 HydrophobicContact CD1-CD1 4.19Å; F360-L363 PolarHBondContact O-N 2.64Å; L363-C367 PolarHBondContact O-SG 3.41Å; L363-F377 HydrophobicContact CB-CD2 4.2Å; L363-F377 HydrophobicContact CB-CE2 4.26Å; L363-F377 HydrophobicContact CD1-CD2 3.98Å; L363-F377 HydrophobicContact CD1-CE2 4.02Å
364	N	82.9	Confident	81.5	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-70.9	-36.7	179	-70.3	-34.2	0	0	0	112.5	Y305 Q307 F360 D361 N366 C367	Y305-N364 VanDerWaalsContact O-CB 3.28Å; Y305-N364 WeakPolarHBondContact O-CB 3.39Å; Q307-N364 WeakPolarHBondContact CG-OD1 3.3Å; Q307-N364 PolarHBondContact NE2-OD1 2.96Å; F360-N364 VanDerWaalsContact O-CG 3.32Å; F360-N364 PolarHBondContact O-N 2.62Å; F360-N364 PolarHBondContact O-ND2 3.31Å; F360-N364 VanDerWaalsContact O-ND2 3.17Å; D361-N364 PolarHBondContact O-N 3.34Å; N364-N366 VanDerWaalsContact C-N 3.26Å; N364-N366 PolarHBondContact O-N 2.98Å; N364-C367 PolarHBondContact O-N 2.83Å
365	N	75.4	Confident	81.2	Confident	69 Å²	69	65.7 Å²	65.7	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-64.4	-30.4	179.9	-75.5	-15.5	0	0	0	113	D361 C367	D361-N365 VanDerWaalsContact O-CG 3.28Å; D361-N365 PolarHBondContact O-N 3.41Å; D361-N365 VanDerWaalsContact O-N 3.08Å; D361-N365 PolarHBondContact O-ND2 2.82Å; N365-C367 VanDerWaalsContact C-N 3.26Å; N365-C367 PolarHBondContact O-N 3.27Å
366	N	69.4	Low	81.1	Confident	120 Å²	120	71.3 Å²	71.3	64%	0.642	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-69.6	-20.2	177.4	-67.1	-16.8	0	0	0	113.4	N364	N364-N366 VanDerWaalsContact C-N 3.26Å; N364-N366 PolarHBondContact O-N 2.98Å
367	C	60.7	Low	81.1	Confident	6 Å²	6	70 Å²	70	4%	0.041	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-82.2	-15.7	-175.1	-61	0	0	0	0	113.6	L363 N364 N365 E369 Q370 N371 I403	L363-C367 PolarHBondContact O-SG 3.41Å; N364-C367 PolarHBondContact O-N 2.83Å; N365-C367 VanDerWaalsContact C-N 3.26Å; N365-C367 PolarHBondContact O-N 3.27Å; C367-E369 PolarHBondContact O-N 2.81Å; C367-Q370 PolarHBondContact O-N 3.48Å; C367-Q370 VanDerWaalsContact O-N 3.09Å; C367-N371 PolarHBondContact O-N 3.07Å; C367-I403 HydrophobicContact CB-CD1 3.98Å
368	N	61.7	Low	81.1	Confident	64 Å²	64	68.7 Å²	68.7	34%	0.342	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-59.5	-31.7	-178	-173	29.3	0	0	0	112.5	Y305 Q370 N371	Y305-N368 HydrophobicContact CD2-CB 4.4Å; Y305-N368 HydrophobicContact CE1-CB 4.46Å; Y305-N368 HydrophobicContact CE2-CB 4.2Å; Y305-N368 VanDerWaalsContact CZ-CG 3.48Å; Y305-N368 PolarHBondContact OH-ND2 3.29Å; Y305-N368 VanDerWaalsContact OH-ND2 3.07Å; N368-Q370 VanDerWaalsContact C-N 3.29Å; N368-Q370 PolarHBondContact O-N 2.82Å; N368-N371 PolarHBondContact O-OD1 2.8Å
369	E	56.6	Low	81.3	Confident	186 Å²	186	70.6 Å²	70.6	87%	0.869	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-69.8	-25.3	179.1	-64	-173.7	176.6	0	0	113.4	C367	C367-E369 PolarHBondContact O-N 2.81Å
370	Q	58.6	Low	81.5	Confident	140 Å²	140	69.9 Å²	69.9	65%	0.654	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-14.5	-174.6	-66.2	177.7	4.1	0	0	113.3	C367 N368 S372	C367-Q370 PolarHBondContact O-N 3.48Å; C367-Q370 VanDerWaalsContact O-N 3.09Å; N368-Q370 VanDerWaalsContact C-N 3.29Å; N368-Q370 PolarHBondContact O-N 2.82Å; Q370-S372 PolarHBondContact O-N 3.01Å
371	N	69.7	Low	81.6	Confident	133 Å²	133	72.4 Å²	72.4	71%	0.711	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	25.8	-173	-74.4	-28.6	0	0	0	113.9	C367 N368	C367-N371 PolarHBondContact O-N 3.07Å; N368-N371 PolarHBondContact O-OD1 2.8Å
372	S	80.4	Confident	82	Confident	54 Å²	54	71.5 Å²	71.5	38%	0.378	37%	0.366	S	S	.	.	S	Bend	trans	-136.4	147.2	-178.6	61.4	0	0	0	0	110.5	Q370	Q370-S372 PolarHBondContact O-N 3.01Å
373	V	89.1	Confident	82.5	Confident	16 Å²	16	69.5 Å²	69.5	10%	0.097	35%	0.348	C	S	.	.			trans	-69.9	148	173.9	-65.9	0	0	0	0	111.4	Q307 F309 W402 I403	Q307-V373 HydrophobicContact CB-CG1 4.37Å; F309-V373 HydrophobicContact CD1-CB 4.23Å; F309-V373 HydrophobicContact CD1-CG2 4.13Å; F309-V373 HydrophobicContact CE1-CB 3.53Å; F309-V373 HydrophobicContact CE1-CG1 4.17Å; F309-V373 HydrophobicContact CE1-CG2 3.74Å; F309-V373 HydrophobicContact CZ-CB 3.98Å; F309-V373 HydrophobicContact CZ-CG1 4.44Å; V373-W402 WeakPolarHBondContact CG1-O 3.48Å; V373-I403 HydrophobicContact CG1-CD1 4.05Å
374	N	91.4	Very high	83.2	Confident	62 Å²	62	69.6 Å²	69.6	33%	0.332	35%	0.353	S	S	.	.			trans	-89.7	112.4	175.3	-177.7	-20.5	0	0	0	109.8	E376 F377 F378	N374-E376 WeakPolarHBondContact OD1-CA 3.34Å; N374-E376 VanDerWaalsContact OD1-CB 3.26Å; N374-E376 WeakPolarHBondContact OD1-CB 3.24Å; N374-E376 PolarHBondContact OD1-N 3.23Å; N374-F377 HydrophobicContact CB-CB 3.84Å; N374-F377 WeakPolarHBondContact O-CB 3.25Å; N374-F377 PolarHBondContact O-N 3.42Å; N374-F377 PolarHBondContact OD1-N 2.83Å; N374-F377 VanDerWaalsContact OD1-N 3.08Å; N374-F378 PolarHBondContact O-N 3.43Å
375	H	91.2	Very high	83.9	Confident	100 Å²	100	70.9 Å²	70.9	46%	0.463	36%	0.359	S	S	.	.	H	α-helix	trans	-67.8	-33	178.3	-71.8	-78.5	0	0	0	113.2	F378 H379	H375-F378 WeakPolarHBondContact O-CB 3.43Å; H375-F378 PolarHBondContact O-N 2.96Å; H375-H379 PolarHBondContact O-CD2 3.31Å; H375-H379 PolarHBondContact O-N 2.76Å
376	E	92.8	Very high	84.9	Confident	122 Å²	122	67.6 Å²	67.6	57%	0.57	34%	0.342	S	S	*	.	H	α-helix	trans	-63.9	-44	174.7	-171.2	173.4	-153.8	0	0	110.2	N374 F378 H379 E380	N374-E376 WeakPolarHBondContact OD1-CA 3.34Å; N374-E376 VanDerWaalsContact OD1-CB 3.26Å; N374-E376 WeakPolarHBondContact OD1-CB 3.24Å; N374-E376 PolarHBondContact OD1-N 3.23Å; E376-F378 VanDerWaalsContact C-N 3.29Å; E376-F378 PolarHBondContact O-N 3.2Å; E376-H379 PolarHBondContact O-N 2.88Å; E376-H379 VanDerWaalsContact O-N 3.13Å; E376-E380 HydrophobicContact CG-CG 4.24Å; E376-E380 WeakPolarHBondContact O-CB 3.09Å; E376-E380 WeakPolarHBondContact O-CG 3.49Å; E376-E380 PolarHBondContact O-N 3.47Å
377	F	93.9	Very high	86.2	Confident	10 Å²	10	63.2 Å²	63.2	4%	0.044	32%	0.32	C	S	.	.	H	α-helix	trans	-55.5	-43.9	172.6	173.1	-90.3	0	0	0	112.1	Q307 F309 F360 L363 N374 H381 I382	Q307-F377 HydrophobicContact CB-CD1 4.49Å; Q307-F377 HydrophobicContact CB-CE1 4.34Å; F309-F377 AromaticContact CE2-CD1 3.82Å; F309-F377 HydrophobicContact CE2-CD1 3.82Å; F309-F377 HydrophobicContact CE2-CE1 4Å; F309-F377 AromaticContact CZ-CD1 3.87Å; F309-F377 HydrophobicContact CZ-CD1 3.87Å; F309-F377 HydrophobicContact CZ-CE1 4.49Å; F360-F377 HydrophobicContact CB-CE2 3.97Å; F360-F377 HydrophobicContact CB-CZ 4.07Å; F360-F377 AromaticContact CD1-CE2 3.8Å; F360-F377 HydrophobicContact CD1-CE2 3.8Å; F360-F377 HydrophobicContact CD1-CZ 4.25Å; F360-F377 HydrophobicContact CD2-CE2 4.47Å; F360-F377 HydrophobicContact CD2-CZ 4.12Å; F360-F377 HydrophobicContact CE1-CE2 4.35Å; F360-F377 AromaticContact CG-CE2 3.85Å; F360-F377 HydrophobicContact CG-CE2 3.85Å; F360-F377 AromaticContact CG-CZ 3.92Å; F360-F377 HydrophobicContact CG-CZ 3.92Å; L363-F377 HydrophobicContact CB-CD2 4.2Å; L363-F377 HydrophobicContact CB-CE2 4.26Å; L363-F377 HydrophobicContact CD1-CD2 3.98Å; L363-F377 HydrophobicContact CD1-CE2 4.02Å; N374-F377 HydrophobicContact CB-CB 3.84Å; N374-F377 WeakPolarHBondContact O-CB 3.25Å; N374-F377 PolarHBondContact O-N 3.42Å; N374-F377 PolarHBondContact OD1-N 2.83Å; N374-F377 VanDerWaalsContact OD1-N 3.08Å; F377-H381 AromaticContact CD2-CD2 3.56Å; F377-H381 HydrophobicContact CE2-CB 4.33Å; F377-H381 AromaticContact CE2-CD2 3.77Å; F377-H381 WeakPolarHBondContact O-CB 3.29Å; F377-H381 PolarHBondContact O-N 3.19Å; F377-I382 HydrophobicContact CD1-CG1 4.08Å; F377-I382 HydrophobicContact CE1-CD1 3.77Å; F377-I382 HydrophobicContact CE1-CG1 3.58Å; F377-I382 HydrophobicContact CZ-CD1 4.1Å; F377-I382 HydrophobicContact CZ-CG1 4.32Å
378	F	95.6	Very high	87.8	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.338	C	S	.	.	I	π-helix	trans	-59.2	-51.7	175.4	174.7	-95.4	0	0	0	111.6	F309 V311 N374 H375 E376 E380 I382 Q383 L386 V396 V398	F309-F378 HydrophobicContact CB-CD2 3.92Å; F309-F378 HydrophobicContact CB-CE2 4.16Å; F309-F378 HydrophobicContact CD1-CB 3.96Å; F309-F378 AromaticContact CD1-CD2 3.87Å; F309-F378 HydrophobicContact CD1-CD2 3.87Å; F309-F378 HydrophobicContact CD1-CG 4.15Å; F309-F378 HydrophobicContact CD2-CB 4.49Å; F309-F378 AromaticContact CD2-CD2 3.83Å; F309-F378 HydrophobicContact CD2-CD2 3.83Å; F309-F378 HydrophobicContact CE1-CB 3.62Å; F309-F378 HydrophobicContact CE1-CD2 4.36Å; F309-F378 HydrophobicContact CE1-CG 4.32Å; F309-F378 HydrophobicContact CE2-CB 4.2Å; F309-F378 HydrophobicContact CE2-CD2 4.32Å; F309-F378 HydrophobicContact CG-CB 4.38Å; F309-F378 AromaticContact CG-CD2 3.58Å; F309-F378 HydrophobicContact CG-CD2 3.58Å; F309-F378 HydrophobicContact CG-CE2 4.32Å; F309-F378 HydrophobicContact CG-CG 4.31Å; F309-F378 HydrophobicContact CZ-CB 3.76Å; V311-F378 HydrophobicContact CG1-CE2 3.55Å; V311-F378 HydrophobicContact CG1-CZ 3.57Å; N374-F378 PolarHBondContact O-N 3.43Å; H375-F378 WeakPolarHBondContact O-CB 3.43Å; H375-F378 PolarHBondContact O-N 2.96Å; E376-F378 VanDerWaalsContact C-N 3.29Å; E376-F378 PolarHBondContact O-N 3.2Å; F378-E380 PolarHBondContact O-N 2.86Å; F378-I382 HydrophobicContact CD2-CB 3.77Å; F378-I382 HydrophobicContact CD2-CG1 4.48Å; F378-I382 HydrophobicContact CD2-CG2 3.77Å; F378-I382 HydrophobicContact CE2-CB 4.2Å; F378-I382 HydrophobicContact CE2-CG2 3.78Å; F378-I382 HydrophobicContact CG-CB 4.46Å; F378-I382 PolarHBondContact O-N 2.92Å; F378-Q383 HydrophobicContact CD1-CB 4.27Å; F378-Q383 HydrophobicContact CE1-CB 3.82Å; F378-Q383 HydrophobicContact CE1-CG 4.21Å; F378-Q383 HydrophobicContact CZ-CB 4.06Å; F378-Q383 HydrophobicContact CZ-CG 4.46Å; F378-Q383 PolarHBondContact O-N 3Å; F378-L386 HydrophobicContact CZ-CD2 4.47Å; F378-V396 HydrophobicContact CE1-CG2 4.24Å; F378-V396 HydrophobicContact CZ-CG2 3.96Å; F378-V398 HydrophobicContact CD1-CG2 3.47Å; F378-V398 VanDerWaalsContact CD1-CG2 3.47Å; F378-V398 HydrophobicContact CD2-CG2 4.12Å; F378-V398 HydrophobicContact CE1-CG2 3.45Å; F378-V398 VanDerWaalsContact CE1-CG2 3.45Å; F378-V398 HydrophobicContact CE2-CG2 4.1Å; F378-V398 HydrophobicContact CG-CG2 3.82Å; F378-V398 HydrophobicContact CZ-CG2 3.79Å
379	H	95.6	Very high	89.5	Confident	99 Å²	99	64.4 Å²	64.4	46%	0.458	32%	0.322	S	S	.	.	I	π-helix	trans	-65.4	-38.3	-176.3	-70.2	-54.5	0	0	0	113.1	H375 E376 Q383 P384	H375-H379 PolarHBondContact O-CD2 3.31Å; H375-H379 PolarHBondContact O-N 2.76Å; E376-H379 PolarHBondContact O-N 2.88Å; E376-H379 VanDerWaalsContact O-N 3.13Å; H379-Q383 PolarHBondContact ND1-OE1 3.34Å; H379-P384 WeakPolarHBondContact O-CD 3.27Å
380	E	95.8	Very high	91.4	Very high	113 Å²	113	55.6 Å²	55.6	53%	0.528	28%	0.28	S	S	.	.	I	π-helix	trans	-82.3	-30.3	-176.7	-67.7	-168.4	158.1	0	0	113.7	E376 F378	E376-E380 HydrophobicContact CG-CG 4.24Å; E376-E380 WeakPolarHBondContact O-CB 3.09Å; E376-E380 WeakPolarHBondContact O-CG 3.49Å; E376-E380 PolarHBondContact O-N 3.47Å; F378-E380 PolarHBondContact O-N 2.86Å
381	H	95.9	Very high	93	Very high	60 Å²	60	50 Å²	50	28%	0.278	26%	0.256	S	S	.	.	I	π-helix	trans	-124.2	-37.5	-167.5	-61.4	-32.3	0	0	0	114.8	F360 F377 L385	F360-H381 HydrophobicContact CE1-CB 3.72Å; F360-H381 AromaticContact CE1-CD2 3.87Å; F360-H381 AromaticContact CE1-CG 3.66Å; F360-H381 HydrophobicContact CZ-CB 3.72Å; F377-H381 AromaticContact CD2-CD2 3.56Å; F377-H381 HydrophobicContact CE2-CB 4.33Å; F377-H381 AromaticContact CE2-CD2 3.77Å; F377-H381 WeakPolarHBondContact O-CB 3.29Å; F377-H381 PolarHBondContact O-N 3.19Å; H381-L385 WeakPolarHBondContact O-CD1 3.31Å; H381-L385 WeakPolarHBondContact O-CG 3.39Å
382	I	97.3	Very high	94	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-90.3	-50.7	-175.8	-57.8	-57.7	0	0	0	111	F309 L340 V353 F377 F378 L385 L386	F309-I382 HydrophobicContact CD2-CG1 4.41Å; F309-I382 HydrophobicContact CE2-CG1 4.19Å; L340-I382 HydrophobicContact CD1-CG2 4.06Å; V353-I382 HydrophobicContact CB-CG2 4.44Å; V353-I382 HydrophobicContact CG1-CG2 3.51Å; F377-I382 HydrophobicContact CD1-CG1 4.08Å; F377-I382 HydrophobicContact CE1-CD1 3.77Å; F377-I382 HydrophobicContact CE1-CG1 3.58Å; F377-I382 HydrophobicContact CZ-CD1 4.1Å; F377-I382 HydrophobicContact CZ-CG1 4.32Å; F378-I382 HydrophobicContact CD2-CB 3.77Å; F378-I382 HydrophobicContact CD2-CG1 4.48Å; F378-I382 HydrophobicContact CD2-CG2 3.77Å; F378-I382 HydrophobicContact CE2-CB 4.2Å; F378-I382 HydrophobicContact CE2-CG2 3.78Å; F378-I382 HydrophobicContact CG-CB 4.46Å; F378-I382 PolarHBondContact O-N 2.92Å; I382-L385 PolarHBondContact O-N 2.86Å; I382-L386 WeakPolarHBondContact O-CB 3.43Å; I382-L386 PolarHBondContact O-N 2.69Å
383	Q	96.9	Very high	94.6	Very high	36 Å²	36	42 Å²	42	17%	0.168	21%	0.214	C	C	.	.	H	α-helix	trans	-57	-43.4	-177.2	-172.4	175	3.7	0	0	112.7	F378 H379 L385 L386 C387 K394 V396	F378-Q383 HydrophobicContact CD1-CB 4.27Å; F378-Q383 HydrophobicContact CE1-CB 3.82Å; F378-Q383 HydrophobicContact CE1-CG 4.21Å; F378-Q383 HydrophobicContact CZ-CB 4.06Å; F378-Q383 HydrophobicContact CZ-CG 4.46Å; F378-Q383 PolarHBondContact O-N 3Å; H379-Q383 PolarHBondContact ND1-OE1 3.34Å; Q383-L385 VanDerWaalsContact C-N 3.34Å; Q383-L385 PolarHBondContact O-N 3.43Å; Q383-L386 WeakPolarHBondContact O-CB 3.48Å; Q383-L386 PolarHBondContact O-N 3.3Å; Q383-C387 WeakPolarHBondContact O-CB 3.34Å; Q383-C387 PolarHBondContact O-N 2.77Å; Q383-C387 PolarHBondContact O-SG 3.43Å; Q383-K394 PolarHBondContact NE2-O 3.42Å; Q383-V396 HydrophobicContact CG-CG2 4.29Å
384	P	96.8	Very high	94.5	Very high	69 Å²	69	48.4 Å²	48.4	45%	0.448	24%	0.24	S	C	.	.	H	α-helix	trans	-62	-39.5	179	-24.9	36.6	0	0	0	113.3	H379 K388	H379-P384 WeakPolarHBondContact O-CD 3.27Å; P384-K388 WeakPolarHBondContact O-CB 3.39Å; P384-K388 PolarHBondContact O-N 3Å
385	L	97.5	Very high	94.3	Very high	30 Å²	30	49.5 Å²	49.5	16%	0.157	25%	0.246	C	C	.	.	H	α-helix	trans	-67.6	-43.1	176.4	-61.5	176.7	0	0	0	110.9	N338 L340 H381 I382 Q383 K388 R389	N338-L385 HydrophobicContact CB-CD1 4.49Å; N338-L385 HydrophobicContact CB-CD2 4.13Å; L340-L385 HydrophobicContact CD1-CB 4.38Å; L340-L385 HydrophobicContact CD2-CB 3.88Å; H381-L385 WeakPolarHBondContact O-CD1 3.31Å; H381-L385 WeakPolarHBondContact O-CG 3.39Å; I382-L385 PolarHBondContact O-N 2.86Å; Q383-L385 VanDerWaalsContact C-N 3.34Å; Q383-L385 PolarHBondContact O-N 3.43Å; L385-K388 PolarHBondContact O-N 3.4Å; L385-R389 PolarHBondContact O-N 3.34Å; L385-R389 VanDerWaalsContact O-N 3.09Å
386	L	96.9	Very high	94.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-50.4	178.7	-176.6	63.6	0	0	0	111.8	V311 L340 I342 V353 F378 I382 Q383 K388 R389 I390 F393	V311-L386 HydrophobicContact CG2-CD2 4.17Å; L340-L386 HydrophobicContact CD2-CB 4.23Å; L340-L386 HydrophobicContact CD2-CD1 4.36Å; I342-L386 HydrophobicContact CD1-CD1 3.39Å; I342-L386 HydrophobicContact CG1-CD1 3.97Å; V353-L386 HydrophobicContact CG1-CD1 4.28Å; V353-L386 HydrophobicContact CG2-CD1 4.02Å; V353-L386 HydrophobicContact CG2-CD2 4.15Å; F378-L386 HydrophobicContact CZ-CD2 4.47Å; I382-L386 WeakPolarHBondContact O-CB 3.43Å; I382-L386 PolarHBondContact O-N 2.69Å; Q383-L386 WeakPolarHBondContact O-CB 3.48Å; Q383-L386 PolarHBondContact O-N 3.3Å; L386-K388 VanDerWaalsContact C-N 3.28Å; L386-K388 PolarHBondContact O-N 2.94Å; L386-R389 PolarHBondContact O-N 2.87Å; L386-I390 PolarHBondContact O-N 2.78Å; L386-F393 HydrophobicContact CD1-CD2 3.58Å; L386-F393 HydrophobicContact CD1-CE2 4.06Å; L386-F393 HydrophobicContact CD2-CB 4.45Å; L386-F393 HydrophobicContact CD2-CD2 3.83Å; L386-F393 HydrophobicContact CG-CB 4.14Å; L386-F393 HydrophobicContact CG-CD2 3.63Å; L386-F393 HydrophobicContact CG-CG 4.4Å
387	C	94.8	Very high	94.5	Very high	27 Å²	27	44.1 Å²	44.1	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-34.1	177	-61.8	0	0	0	0	112.2	Q383 I390 P391 F393 K394	Q383-C387 WeakPolarHBondContact O-CB 3.34Å; Q383-C387 PolarHBondContact O-N 2.77Å; Q383-C387 PolarHBondContact O-SG 3.43Å; C387-I390 CarbonylContact O-C 3.57Å; C387-P391 VanDerWaalsContact O-CA 3.27Å; C387-P391 WeakPolarHBondContact O-CA 3.43Å; C387-F393 PolarHBondContact SG-O 3.39Å; C387-K394 VanDerWaalsContact SG-CA 3.52Å
388	K	96.1	Very high	94.6	Very high	94 Å²	94	44.8 Å²	44.8	41%	0.409	23%	0.227	S	C	.	.	H	α-helix	trans	-64.6	-45.3	176.8	-172.8	-173.6	-176.1	-162.3	0	111.1	N183 D186 P384 L385 L386	N183-K388 WeakPolarHBondContact CB-O 3.35Å; N183-K388 PolarHBondContact ND2-O 3.38Å; D186-K388 WeakPolarHBondContact OD2-CE 3.4Å; D186-K388 IonicContact OD2-NZ 3.77Å; D186-K388 PolarHBondContact OD2-NZ 3.26Å; P384-K388 WeakPolarHBondContact O-CB 3.39Å; P384-K388 PolarHBondContact O-N 3Å; L385-K388 PolarHBondContact O-N 3.4Å; L386-K388 VanDerWaalsContact C-N 3.28Å; L386-K388 PolarHBondContact O-N 2.94Å
389	R	96.9	Very high	94.5	Very high	2 Å²	2	47 Å²	47	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-77.4	-37.3	-178.7	-175.3	56.8	60.2	-138.6	-7.5	112.5	M182 N183 D186 M334 D336 L385 L386	M182-R389 HydrophobicContact CG-CG 4.46Å; N183-R389 PolarHBondContact N-O 2.93Å; N183-R389 PolarHBondContact O-NH1 3.07Å; D186-R389 IonicContact OD1-CZ 3.65Å; D186-R389 IonicContact OD1-NH1 2.82Å; D186-R389 PolarHBondContact OD1-NH1 3.44Å; D186-R389 IonicContact OD1-NH2 3.55Å; D186-R389 PolarHBondContact OD1-NH2 3.08Å; D186-R389 IonicContact OD2-NH2 3.95Å; M334-R389 HydrophobicContact CE-CG 3.54Å; M334-R389 HydrophobicContact SD-CG 3.9Å; D336-R389 IonicContact OD1-CZ 2.9Å; D336-R389 IonicContact OD1-NE 3.12Å; D336-R389 PolarHBondContact OD1-NE 3.41Å; D336-R389 IonicContact OD1-NH2 3.96Å; D336-R389 PolarHBondContact OD1-NH2 2.87Å; L385-R389 PolarHBondContact O-N 3.34Å; L385-R389 VanDerWaalsContact O-N 3.09Å; L386-R389 PolarHBondContact O-N 2.87Å
390	I	95.7	Very high	94.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.234	C	C	.	.			trans	-125.7	89.4	179.5	-50.4	177.7	0	0	0	108	W181 P327 M331 M334 I342 L386 C387 G392 F393	W181-I390 HydrophobicContact CE3-CD1 4.4Å; W181-I390 HydrophobicContact CE3-CG1 4.14Å; W181-I390 HydrophobicContact CE3-CG2 4.29Å; W181-I390 HydrophobicContact CZ3-CD1 3.99Å; W181-I390 HydrophobicContact CZ3-CG1 3.97Å; P327-I390 HydrophobicContact CG-CD1 4.07Å; P327-I390 HydrophobicContact CG-CG2 4.02Å; M331-I390 HydrophobicContact CE-CD1 4.2Å; M334-I390 HydrophobicContact CE-CD1 3.99Å; M334-I390 HydrophobicContact CE-CG1 4.22Å; I342-I390 HydrophobicContact CD1-CD1 4.12Å; L386-I390 PolarHBondContact O-N 2.78Å; C387-I390 CarbonylContact O-C 3.57Å; I390-G392 PolarHBondContact O-N 3.28Å; I390-G392 VanDerWaalsContact O-N 3.09Å; I390-F393 HydrophobicContact CB-CB 4.36Å; I390-F393 HydrophobicContact CB-CD1 4.3Å; I390-F393 HydrophobicContact CB-CD2 4.22Å; I390-F393 HydrophobicContact CB-CG 4.04Å; I390-F393 HydrophobicContact CD1-CD2 4.14Å; I390-F393 HydrophobicContact CD1-CE2 3.78Å; I390-F393 HydrophobicContact CD1-CZ 4.04Å; I390-F393 HydrophobicContact CG2-CB 4.42Å; I390-F393 HydrophobicContact CG2-CD1 3.55Å; I390-F393 HydrophobicContact CG2-CD2 4.27Å; I390-F393 HydrophobicContact CG2-CE1 3.75Å; I390-F393 HydrophobicContact CG2-CE2 4.45Å; I390-F393 HydrophobicContact CG2-CG 3.82Å; I390-F393 HydrophobicContact CG2-CZ 4.18Å; I390-F393 WeakPolarHBondContact O-CB 3.47Å; I390-F393 PolarHBondContact O-N 3.29Å
391	P	93.4	Very high	94.4	Very high	24 Å²	24	40.5 Å²	40.5	16%	0.156	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-56.8	-28.5	-176.7	-29.6	37.6	0	0	0	114.6	N183 Y324 C387 F393 K394	N183-P391 HydrophobicContact CB-CG 3.8Å; Y324-P391 HydrophobicContact CD1-CB 3.56Å; Y324-P391 HydrophobicContact CD1-CG 4.13Å; Y324-P391 HydrophobicContact CD2-CB 3.65Å; Y324-P391 HydrophobicContact CE1-CB 3.68Å; Y324-P391 HydrophobicContact CE1-CG 4.12Å; Y324-P391 HydrophobicContact CE2-CB 3.78Å; Y324-P391 HydrophobicContact CG-CB 3.54Å; C387-P391 VanDerWaalsContact O-CA 3.27Å; C387-P391 WeakPolarHBondContact O-CA 3.43Å; P391-F393 PolarHBondContact O-N 3.03Å; P391-F393 VanDerWaalsContact O-N 3.13Å; P391-K394 PolarHBondContact O-N 3.5Å
392	G	90.1	Very high	94.4	Very high	19 Å²	19	41.2 Å²	41.2	20%	0.196	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-62.4	-14.1	173.2	0	0	0	0	0	114.3	I390 K394	I390-G392 PolarHBondContact O-N 3.28Å; I390-G392 VanDerWaalsContact O-N 3.09Å; G392-K394 VanDerWaalsContact C-N 3.33Å
393	F	92.3	Very high	94.2	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-93.1	12.1	179	-72.3	16.7	0	0	0	113.1	P313 L326 P327 F351 L386 C387 I390 P391 D395 V396	P313-F393 HydrophobicContact CB-CD1 4.26Å; P313-F393 HydrophobicContact CB-CE1 4.35Å; P313-F393 HydrophobicContact CG-CD1 3.66Å; P313-F393 HydrophobicContact CG-CE1 3.37Å; P313-F393 HydrophobicContact CG-CG 4.47Å; P313-F393 HydrophobicContact CG-CZ 3.98Å; L326-F393 HydrophobicContact CD2-CD1 3.98Å; L326-F393 HydrophobicContact CD2-CE1 3.97Å; P327-F393 HydrophobicContact CG-CE1 3.97Å; P327-F393 HydrophobicContact CG-CZ 3.86Å; F351-F393 HydrophobicContact CB-CE2 4.28Å; F351-F393 HydrophobicContact CD1-CE2 4.32Å; F351-F393 AromaticContact CD1-CZ 3.94Å; F351-F393 HydrophobicContact CD1-CZ 3.94Å; F351-F393 HydrophobicContact CD2-CE1 4.3Å; F351-F393 AromaticContact CD2-CE2 3.87Å; F351-F393 HydrophobicContact CD2-CE2 3.87Å; F351-F393 AromaticContact CD2-CZ 3.41Å; F351-F393 HydrophobicContact CD2-CZ 3.41Å; F351-F393 VanDerWaalsContact CD2-CZ 3.41Å; F351-F393 AromaticContact CE1-CZ 3.92Å; F351-F393 HydrophobicContact CE1-CZ 3.92Å; F351-F393 AromaticContact CE2-CE1 3.98Å; F351-F393 HydrophobicContact CE2-CE1 3.98Å; F351-F393 HydrophobicContact CE2-CE2 4.33Å; F351-F393 AromaticContact CE2-CZ 3.42Å; F351-F393 HydrophobicContact CE2-CZ 3.42Å; F351-F393 VanDerWaalsContact CE2-CZ 3.42Å; F351-F393 AromaticContact CG-CE2 3.88Å; F351-F393 HydrophobicContact CG-CE2 3.88Å; F351-F393 AromaticContact CG-CZ 3.69Å; F351-F393 HydrophobicContact CG-CZ 3.69Å; F351-F393 HydrophobicContact CZ-CE1 4.28Å; F351-F393 AromaticContact CZ-CZ 3.68Å; F351-F393 HydrophobicContact CZ-CZ 3.68Å; L386-F393 HydrophobicContact CD1-CD2 3.58Å; L386-F393 HydrophobicContact CD1-CE2 4.06Å; L386-F393 HydrophobicContact CD2-CB 4.45Å; L386-F393 HydrophobicContact CD2-CD2 3.83Å; L386-F393 HydrophobicContact CG-CB 4.14Å; L386-F393 HydrophobicContact CG-CD2 3.63Å; L386-F393 HydrophobicContact CG-CG 4.4Å; C387-F393 PolarHBondContact SG-O 3.39Å; I390-F393 HydrophobicContact CB-CB 4.36Å; I390-F393 HydrophobicContact CB-CD1 4.3Å; I390-F393 HydrophobicContact CB-CD2 4.22Å; I390-F393 HydrophobicContact CB-CG 4.04Å; I390-F393 HydrophobicContact CD1-CD2 4.14Å; I390-F393 HydrophobicContact CD1-CE2 3.78Å; I390-F393 HydrophobicContact CD1-CZ 4.04Å; I390-F393 HydrophobicContact CG2-CB 4.42Å; I390-F393 HydrophobicContact CG2-CD1 3.55Å; I390-F393 HydrophobicContact CG2-CD2 4.27Å; I390-F393 HydrophobicContact CG2-CE1 3.75Å; I390-F393 HydrophobicContact CG2-CE2 4.45Å; I390-F393 HydrophobicContact CG2-CG 3.82Å; I390-F393 HydrophobicContact CG2-CZ 4.18Å; I390-F393 WeakPolarHBondContact O-CB 3.47Å; I390-F393 PolarHBondContact O-N 3.29Å; P391-F393 PolarHBondContact O-N 3.03Å; P391-F393 VanDerWaalsContact O-N 3.13Å; F393-D395 PolarHBondContact O-N 3.44Å; F393-V396 HydrophobicContact CB-CG1 3.65Å; F393-V396 HydrophobicContact CD1-CG1 4.48Å; F393-V396 HydrophobicContact CD2-CG1 4.25Å; F393-V396 HydrophobicContact CG-CG1 3.9Å; F393-V396 WeakPolarHBondContact O-CG1 3.41Å
394	K	88.1	Confident	94	Very high	149 Å²	149	41 Å²	41	65%	0.648	22%	0.224	S	C	*	.	S	Bend	trans	-48.6	-45.2	172.6	-173.9	178.1	176.3	-176.3	0	112.2	Q383 C387 P391 G392	Q383-K394 PolarHBondContact NE2-O 3.42Å; C387-K394 VanDerWaalsContact SG-CA 3.52Å; P391-K394 PolarHBondContact O-N 3.5Å; G392-K394 VanDerWaalsContact C-N 3.33Å
395	D	87.7	Confident	93.8	Very high	85 Å²	85	38 Å²	38	46%	0.455	21%	0.205	S	C	.	.	S	Bend	trans	-110.8	85	178.9	-60.8	-42.6	0	0	0	110.7	K314 F393	K314-D395 PolarHBondContact N-O 2.98Å; F393-D395 PolarHBondContact O-N 3.44Å
396	V	92.4	Very high	93.6	Very high	12 Å²	12	37.6 Å²	37.6	7%	0.073	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	148.2	175	-72	0	0	0	0	111.9	V311 R312 P313 F378 Q383 F393	V311-V396 HydrophobicContact CB-CB 4.32Å; R312-V396 WeakPolarHBondContact O-CA 3.37Å; P313-V396 HydrophobicContact CB-CG1 4.5Å; P313-V396 HydrophobicContact CG-CG1 4.45Å; F378-V396 HydrophobicContact CE1-CG2 4.24Å; F378-V396 HydrophobicContact CZ-CG2 3.96Å; Q383-V396 HydrophobicContact CG-CG2 4.29Å; F393-V396 HydrophobicContact CB-CG1 3.65Å; F393-V396 HydrophobicContact CD1-CG1 4.48Å; F393-V396 HydrophobicContact CD2-CG1 4.25Å; F393-V396 HydrophobicContact CG-CG1 3.9Å; F393-V396 WeakPolarHBondContact O-CG1 3.41Å
397	E	94.3	Very high	93.5	Very high	98 Å²	98	38 Å²	38	46%	0.458	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	134.6	167.5	-177.1	179.2	174.3	0	0	109.4	V311 R312 K314 T399	V311-E397 CarbonylContact C-O 3.59Å; V311-E397 VanDerWaalsContact CA-O 3.25Å; V311-E397 WeakPolarHBondContact CA-O 3.48Å; R312-E397 PolarHBondContact N-O 3.5Å; R312-E397 PolarHBondContact O-N 3.22Å; K314-E397 HydrophobicContact CG-CB 4.38Å; E397-T399 HydrophobicContact CG-CG2 4.49Å; E397-T399 PolarHBondContact O-N 3.48Å
398	V	96.1	Very high	93.6	Very high	24 Å²	24	37.8 Å²	37.8	15%	0.145	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	110.2	167.7	-180	0	0	0	0	107.8	F309 V310 V311 F378	F309-V398 HydrophobicContact CD1-CG1 4.01Å; V310-V398 CarbonylContact O-C 3.45Å; V310-V398 WeakPolarHBondContact O-CA 3.21Å; V311-V398 HydrophobicContact CG1-CG2 4.32Å; F378-V398 HydrophobicContact CD1-CG2 3.47Å; F378-V398 VanDerWaalsContact CD1-CG2 3.47Å; F378-V398 HydrophobicContact CD2-CG2 4.12Å; F378-V398 HydrophobicContact CE1-CG2 3.45Å; F378-V398 VanDerWaalsContact CE1-CG2 3.45Å; F378-V398 HydrophobicContact CE2-CG2 4.1Å; F378-V398 HydrophobicContact CG-CG2 3.82Å; F378-V398 HydrophobicContact CZ-CG2 3.79Å
399	T	95	Very high	93.6	Very high	46 Å²	46	33.3 Å²	33.3	28%	0.282	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	-28.4	-176.1	59.4	0	0	0	0	112.7	V310 R312 E350 E397	V310-T399 WeakPolarHBondContact CG1-OG1 3.35Å; V310-T399 PolarHBondContact O-N 3.35Å; V310-T399 PolarHBondContact O-OG1 2.92Å; R312-T399 HydrophobicContact CB-CG2 3.65Å; E350-T399 VanDerWaalsContact OE1-CB 3.27Å; E350-T399 WeakPolarHBondContact OE1-CB 3.47Å; E350-T399 WeakPolarHBondContact OE1-CG2 3.5Å; E350-T399 PolarHBondContact OE1-OG1 3.06Å; E397-T399 HydrophobicContact CG-CG2 4.49Å; E397-T399 PolarHBondContact O-N 3.48Å
400	S	94.8	Very high	93.6	Very high	47 Å²	47	36.6 Å²	36.6	33%	0.329	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	171.5	174.2	57.4	0	0	0	0	110	V310	V310-S400 VanDerWaalsContact CB-OG 3.29Å; V310-S400 WeakPolarHBondContact CB-OG 3.37Å; V310-S400 VanDerWaalsContact CG2-OG 3.25Å; V310-S400 WeakPolarHBondContact CG2-OG 3.47Å; V310-S400 PolarHBondContact N-O 3.26Å
401	G	94.4	Very high	93.5	Very high	29 Å²	29	41.5 Å²	41.5	30%	0.299	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.5	160.1	173.3	0	0	0	0	0	110.8	I308	I308-G401 CarbonylContact O-C 3.51Å; I308-G401 WeakPolarHBondContact O-CA 3.49Å
402	W	94.1	Very high	93.6	Very high	74 Å²	74	41.1 Å²	41.1	28%	0.28	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	167.8	177.5	67.5	98.5	0	0	0	111	L91 L93 I308 V310 I352 V373	L91-W402 PolarHBondContact O-NE1 2.94Å; L93-W402 HydrophobicContact CD2-CH2 4.21Å; L93-W402 HydrophobicContact CD2-CZ2 3.78Å; I308-W402 HydrophobicContact CB-CD2 4.16Å; I308-W402 HydrophobicContact CB-CH2 4.49Å; I308-W402 HydrophobicContact CB-CZ2 4.14Å; I308-W402 HydrophobicContact CD1-CZ2 3.84Å; I308-W402 HydrophobicContact CG2-CD2 4.24Å; I308-W402 HydrophobicContact CG2-CE3 4.22Å; I308-W402 HydrophobicContact CG2-CH2 3.58Å; I308-W402 HydrophobicContact CG2-CZ2 3.59Å; I308-W402 HydrophobicContact CG2-CZ3 3.91Å; I308-W402 PolarHBondContact N-O 3.47Å; I308-W402 PolarHBondContact O-N 3.41Å; V310-W402 HydrophobicContact CG2-CH2 4.37Å; V310-W402 HydrophobicContact CG2-CZ3 3.61Å; I352-W402 HydrophobicContact CD1-CH2 4.37Å; V373-W402 WeakPolarHBondContact CG1-O 3.48Å
403	I	93.3	Very high	93.9	Very high	17 Å²	17	44.4 Å²	44.4	9%	0.087	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123.4	174.7	-53.8	-58.3	0	0	0	108.4	Y305 R306 Q307 C367 V373	Y305-I403 HydrophobicContact CD1-CG2 3.69Å; Y305-I403 HydrophobicContact CG-CG2 4.28Å; R306-I403 WeakPolarHBondContact O-CA 3.19Å; Q307-I403 HydrophobicContact CB-CD1 4.4Å; Q307-I403 HydrophobicContact CG-CD1 3.58Å; C367-I403 HydrophobicContact CB-CD1 3.98Å; V373-I403 HydrophobicContact CG1-CD1 4.05Å
404	S	93.2	Very high	94	Very high	14 Å²	14	44.6 Å²	44.6	10%	0.098	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	159.6	167.6	72.7	0	0	0	0	111.3	L91 Y305 R306	L91-S404 WeakPolarHBondContact O-CB 3.29Å; Y305-S404 CarbonylContact C-O 3.47Å; Y305-S404 VanDerWaalsContact CA-O 3.26Å; Y305-S404 WeakPolarHBondContact CA-O 3.37Å; R306-S404 WeakPolarHBondContact CB-OG 3.35Å; R306-S404 PolarHBondContact N-O 2.93Å; R306-S404 PolarHBondContact O-N 3.36Å
405	V	93.1	Very high	94.5	Very high	8 Å²	8	37.6 Å²	37.6	5%	0.048	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	138	177.5	63.8	0	0	0	0	109.1	A88 L91 P279 P303 R304 Y305	A88-V405 WeakPolarHBondContact CA-O 3.41Å; A88-V405 HydrophobicContact CB-CG1 4.21Å; A88-V405 WeakPolarHBondContact CB-O 3.42Å; L91-V405 HydrophobicContact CD1-CG1 4.11Å; P279-V405 HydrophobicContact CB-CG2 4.05Å; P279-V405 HydrophobicContact CG-CG1 4.22Å; P279-V405 HydrophobicContact CG-CG2 3.81Å; P303-V405 HydrophobicContact CB-CG2 3.78Å; R304-V405 CarbonylContact O-C 3.59Å; R304-V405 WeakPolarHBondContact O-CA 3.43Å; Y305-V405 HydrophobicContact CD1-CB 3.88Å; Y305-V405 HydrophobicContact CD1-CG2 4Å; Y305-V405 HydrophobicContact CE1-CB 3.82Å; Y305-V405 HydrophobicContact CE1-CG2 3.72Å
406	C	93.8	Very high	95	Very high	20 Å²	20	33.6 Å²	33.6	14%	0.135	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	162	169.8	70.7	0	0	0	0	111.7	R304 Y408	R304-C406 PolarHBondContact N-O 3.25Å; R304-C406 PolarHBondContact O-N 3.42Å; C406-Y408 PolarHBondContact O-N 3.35Å
407	D	94.7	Very high	95.1	Very high	9 Å²	9	33 Å²	33	5%	0.048	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	87.9	172.4	61	-41	0	0	0	109.6	P279 V301 G431 S432 S433	P279-D407 HydrophobicContact CG-CB 4.5Å; V301-D407 HydrophobicContact CG1-CB 3.89Å; D407-G431 CarbonylContact O-C 3.54Å; D407-G431 VanDerWaalsContact O-C 3.25Å; D407-G431 WeakPolarHBondContact O-CA 2.99Å; D407-G431 PolarHBondContact OD2-N 3.13Å; D407-S432 PolarHBondContact O-N 3.24Å; D407-S432 PolarHBondContact OD2-N 3.23Å; D407-S433 PolarHBondContact O-N 2.89Å
408	Y	96.4	Very high	95.1	Very high	23 Å²	23	28.5 Å²	28.5	9%	0.09	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	122.1	-173.1	-172.9	-93.5	0	0	0	111.1	V301 E302 R304 C406 T410 Q413	V301-Y408 WeakPolarHBondContact CA-O 3.49Å; E302-Y408 PolarHBondContact N-O 3.22Å; E302-Y408 PolarHBondContact O-N 3.14Å; R304-Y408 HydrophobicContact CB-CD2 4.26Å; R304-Y408 HydrophobicContact CB-CG 3.93Å; R304-Y408 HydrophobicContact CG-CD2 4.06Å; R304-Y408 HydrophobicContact CG-CG 4.08Å; C406-Y408 PolarHBondContact O-N 3.35Å; Y408-T410 HydrophobicContact CD1-CG2 3.98Å; Y408-T410 HydrophobicContact CE1-CG2 4.31Å; Y408-T410 PolarHBondContact O-N 2.64Å; Y408-Q413 HydrophobicContact CE1-CG 4.44Å; Y408-Q413 HydrophobicContact CE2-CG 3.97Å; Y408-Q413 WeakPolarHBondContact OH-CG 3.38Å; Y408-Q413 PolarHBondContact OH-NE2 3.13Å
409	N	96.8	Very high	94.8	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	109.8	171.9	176.9	1.5	0	0	0	109.7	P300 W411 D412 Q413 N414 G431 S433	P300-N409 CarbonylContact O-C 3.46Å; P300-N409 VanDerWaalsContact O-CA 3.32Å; P300-N409 WeakPolarHBondContact O-CA 3.48Å; P300-N409 PolarHBondContact O-OD1 2.71Å; N409-W411 PolarHBondContact O-N 2.89Å; N409-W411 WeakPolarHBondContact OD1-CA 3.14Å; N409-W411 WeakPolarHBondContact OD1-CB 3.17Å; N409-W411 PolarHBondContact OD1-N 2.84Å; N409-D412 PolarHBondContact ND2-OD1 2.87Å; N409-Q413 VanDerWaalsContact O-CA 3.3Å; N409-Q413 WeakPolarHBondContact O-CA 3.49Å; N409-Q413 PolarHBondContact O-N 2.82Å; N409-N414 PolarHBondContact ND2-O 3.19Å; N409-G431 WeakPolarHBondContact CB-O 3.21Å; N409-S433 PolarHBondContact N-OG 3.28Å
410	T	95.3	Very high	94.7	Very high	71 Å²	71	27.8 Å²	27.8	44%	0.436	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-12	-178.9	62.4	0	0	0	0	113.6	P300 E302 Y408	P300-T410 WeakPolarHBondContact CB-OG1 3.28Å; P300-T410 PolarHBondContact O-N 3.15Å; P300-T410 PolarHBondContact O-OG1 3.45Å; E302-T410 VanDerWaalsContact CD-CG2 3.48Å; E302-T410 HydrophobicContact CG-CG2 3.74Å; Y408-T410 HydrophobicContact CD1-CG2 3.98Å; Y408-T410 HydrophobicContact CE1-CG2 4.31Å; Y408-T410 PolarHBondContact O-N 2.64Å
411	W	95.1	Very high	94.4	Very high	103 Å²	103	26.4 Å²	26.4	39%	0.39	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-57.5	-179.8	-176.2	-108.4	0	0	0	112.1	P300 N409 L469 N472 T474	P300-W411 HydrophobicContact CB-CB 4.32Å; P300-W411 HydrophobicContact CG-CB 3.96Å; N409-W411 PolarHBondContact O-N 2.89Å; N409-W411 WeakPolarHBondContact OD1-CA 3.14Å; N409-W411 WeakPolarHBondContact OD1-CB 3.17Å; N409-W411 PolarHBondContact OD1-N 2.84Å; W411-L469 HydrophobicContact CB-CD2 4.04Å; W411-L469 HydrophobicContact CD2-CD2 3.99Å; W411-L469 HydrophobicContact CG-CD2 3.5Å; W411-L469 VanDerWaalsContact CG-CD2 3.5Å; W411-N472 HydrophobicContact CZ2-CB 4.36Å; W411-T474 HydrophobicContact CZ2-CG2 4.25Å
412	D	95.2	Very high	94.1	Very high	15 Å²	15	27.5 Å²	27.5	8%	0.08	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-147.7	12.7	-172.3	66.8	2	0	0	0	113.5	N409 N414 R468 T474 V475	N409-D412 PolarHBondContact ND2-OD1 2.87Å; D412-N414 PolarHBondContact O-N 3.39Å; D412-N414 PolarHBondContact O-ND2 3.11Å; D412-N414 VanDerWaalsContact O-ND2 3.17Å; D412-N414 PolarHBondContact OD1-N 3.06Å; D412-R468 VanDerWaalsContact CG-NH2 3.35Å; D412-R468 IonicContact OD1-CZ 3.52Å; D412-R468 IonicContact OD1-NH2 2.78Å; D412-R468 PolarHBondContact OD1-NH2 3.26Å; D412-R468 IonicContact OD2-CZ 3.99Å; D412-R468 IonicContact OD2-NE 3.01Å; D412-R468 PolarHBondContact OD2-NE 3.14Å; D412-R468 IonicContact OD2-NH2 2.85Å; D412-R468 PolarHBondContact OD2-NH2 3.22Å; D412-T474 HydrophobicContact CB-CG2 4.32Å; D412-V475 WeakPolarHBondContact CB-O 3.04Å; D412-V475 PolarHBondContact OD2-N 3.31Å
413	Q	95	Very high	94.1	Very high	89 Å²	89	24 Å²	24	42%	0.416	12%	0.118	S	C	.	.	S	Bend	trans	59.6	11.6	178.6	-54.3	175.7	41.8	0	0	114.8	Y408 N409 S433	Y408-Q413 HydrophobicContact CE1-CG 4.44Å; Y408-Q413 HydrophobicContact CE2-CG 3.97Å; Y408-Q413 WeakPolarHBondContact OH-CG 3.38Å; Y408-Q413 PolarHBondContact OH-NE2 3.13Å; N409-Q413 VanDerWaalsContact O-CA 3.3Å; N409-Q413 WeakPolarHBondContact O-CA 3.49Å; N409-Q413 PolarHBondContact O-N 2.82Å; Q413-S433 WeakPolarHBondContact CA-OG 3.32Å; Q413-S433 WeakPolarHBondContact O-CB 3.39Å; Q413-S433 PolarHBondContact O-OG 2.96Å; Q413-S433 VanDerWaalsContact O-OG 3.1Å
414	N	96	Very high	93.9	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.016	12%	0.124	C	C	.	.	S	Bend	trans	-109.5	161.5	-176.1	-90.4	-67.8	0	0	0	112	N105 N409 D412 I416 G431 F464 V475 E477	N105-N414 PolarHBondContact ND2-OD1 3.05Å; N409-N414 PolarHBondContact ND2-O 3.19Å; D412-N414 PolarHBondContact O-N 3.39Å; D412-N414 PolarHBondContact O-ND2 3.11Å; D412-N414 VanDerWaalsContact O-ND2 3.17Å; D412-N414 PolarHBondContact OD1-N 3.06Å; N414-I416 PolarHBondContact O-N 3.23Å; N414-G431 CarbonylContact C-O 3.56Å; N414-G431 VanDerWaalsContact C-O 3.3Å; N414-F464 HydrophobicContact CB-CD1 4.03Å; N414-F464 HydrophobicContact CB-CE1 3.76Å; N414-V475 HydrophobicContact CB-CB 4.18Å; N414-V475 HydrophobicContact CB-CG1 4.43Å; N414-V475 PolarHBondContact ND2-O 2.9Å; N414-E477 PolarHBondContact ND2-N 3.37Å
415	L	97.8	Very high	94	Very high	3 Å²	3	24.9 Å²	24.9	2%	0.016	12%	0.124	C	C	.	.			trans	-50	140.2	177.4	173.9	65.3	0	0	0	112.2	M108 T417 I443 L461 F464 R468	M108-L415 HydrophobicContact CE-CD2 4.29Å; M108-L415 HydrophobicContact SD-CD2 4.05Å; L415-T417 HydrophobicContact CD2-CG2 3.96Å; L415-T417 HydrophobicContact CG-CG2 4.18Å; L415-I443 HydrophobicContact CD1-CD1 3.79Å; L415-I443 HydrophobicContact CD1-CG1 4.24Å; L415-I443 HydrophobicContact CD1-CG2 4.49Å; L415-I443 HydrophobicContact CD2-CD1 4.01Å; L415-I443 HydrophobicContact CD2-CG1 3.75Å; L415-L461 HydrophobicContact CD2-CD1 4.1Å; L415-F464 HydrophobicContact CB-CB 4.27Å; L415-F464 HydrophobicContact CB-CD1 3.79Å; L415-F464 HydrophobicContact CB-CE1 4.49Å; L415-F464 HydrophobicContact CB-CG 4.15Å; L415-F464 HydrophobicContact CD2-CB 4.38Å; L415-F464 HydrophobicContact CG-CB 4.26Å; L415-F464 WeakPolarHBondContact O-CB 3.26Å; L415-F464 WeakPolarHBondContact O-CD1 3.41Å; L415-R468 PolarHBondContact O-NH1 2.84Å; L415-R468 PolarHBondContact O-NH2 3.23Å
416	I	97.7	Very high	94.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	108.2	164.8	-63.1	171.1	0	0	0	107.1	L299 P300 V301 N414 F428 C429 N430 F464 F466 L469	L299-I416 HydrophobicContact CD1-CB 4.47Å; L299-I416 HydrophobicContact CD1-CD1 4.01Å; L299-I416 HydrophobicContact CD1-CG2 3.88Å; P300-I416 HydrophobicContact CG-CD1 3.81Å; V301-I416 HydrophobicContact CG2-CD1 4.08Å; N414-I416 PolarHBondContact O-N 3.23Å; I416-F428 HydrophobicContact CG2-CB 4.26Å; I416-F428 CarbonylContact O-C 3.55Å; I416-C429 WeakPolarHBondContact O-CA 3.28Å; I416-N430 WeakPolarHBondContact CA-O 3.37Å; I416-N430 PolarHBondContact N-O 3.09Å; I416-N430 PolarHBondContact O-N 3.21Å; I416-F464 WeakPolarHBondContact CA-O 3.27Å; I416-F466 HydrophobicContact CG2-CB 3.93Å; I416-F466 HydrophobicContact CG2-CD2 3.92Å; I416-F466 HydrophobicContact CG2-CG 4.44Å; I416-L469 HydrophobicContact CD1-CD1 4.2Å
417	T	95.9	Very high	94.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	179	178.7	-170.8	0	0	0	0	111.4	L415 F428 I447 Y456 L461 F464 S465 F466	L415-T417 HydrophobicContact CD2-CG2 3.96Å; L415-T417 HydrophobicContact CG-CG2 4.18Å; T417-F428 WeakPolarHBondContact CA-O 3.33Å; T417-F428 PolarHBondContact OG1-O 2.8Å; T417-I447 WeakPolarHBondContact OG1-CD1 3.36Å; T417-Y456 WeakPolarHBondContact CG2-OH 3.4Å; T417-L461 HydrophobicContact CG2-CB 3.87Å; T417-L461 HydrophobicContact CG2-CD1 4.28Å; T417-F464 HydrophobicContact CG2-CB 3.73Å; T417-F464 PolarHBondContact N-O 2.9Å; T417-S465 CarbonylContact O-C 3.57Å; T417-S465 WeakPolarHBondContact O-CA 3.36Å; T417-F466 PolarHBondContact O-N 2.93Å
418	G	92.5	Very high	94.6	Very high	4 Å²	4	23.3 Å²	23.3	4%	0.041	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.1	-173.7	-178.3	0	0	0	0	0	113.9	Y427 F428	G418-Y427 CarbonylContact O-C 3.51Å; G418-Y427 VanDerWaalsContact O-CA 3.28Å; G418-Y427 WeakPolarHBondContact O-CA 3.25Å; G418-F428 PolarHBondContact N-O 2.86Å; G418-F428 PolarHBondContact O-N 3.31Å
419	F	91.5	Very high	94.6	Very high	54 Å²	54	22.2 Å²	22.2	24%	0.237	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	153.7	-177	60.3	-87.7	0	0	0	112.6	M426 Y427	F419-M426 CarbonylContact C-O 3.55Å; F419-M426 WeakPolarHBondContact CA-O 3.48Å; F419-Y427 HydrophobicContact CB-CD1 3.89Å; F419-Y427 HydrophobicContact CB-CE1 3.84Å; F419-Y427 HydrophobicContact CB-CG 4.37Å; F419-Y427 HydrophobicContact CD1-CE1 4.24Å; F419-Y427 HydrophobicContact CG-CE1 4.49Å
420	H	92.2	Very high	94.6	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.109	C	C	.	.			trans	-71.1	136.1	171.4	-173.9	-94.1	0	0	0	110.7	F422 H423 T424 M426 F428 F466	H420-F422 VanDerWaalsContact C-N 3.29Å; H420-F422 AromaticContact CE1-CD2 3.55Å; H420-F422 PolarHBondContact ND1-N 3.39Å; H420-F422 VanDerWaalsContact ND1-N 3.2Å; H420-F422 PolarHBondContact O-N 2.85Å; H420-H423 HydrophobicContact CB-CB 4.18Å; H420-H423 AromaticContact ND1-CD2 3.9Å; H420-H423 PolarHBondContact ND1-N 3.3Å; H420-H423 CarbonylContact O-C 3.33Å; H420-H423 VanDerWaalsContact O-C 3.29Å; H420-T424 WeakPolarHBondContact O-CA 3.36Å; H420-T424 PolarHBondContact O-N 3.11Å; H420-M426 PolarHBondContact N-O 3.27Å; H420-F428 HydrophobicContact CB-CE2 3.72Å; H420-F428 HydrophobicContact CB-CZ 4.14Å; H420-F466 AromaticContact CD2-CD1 3.9Å; H420-F466 AromaticContact CD2-CE1 3.34Å; H420-F466 WeakPolarHBondContact CD2-CE1 3.28Å; H420-F466 AromaticContact CD2-CZ 3.81Å; H420-F466 AromaticContact NE2-CE1 3.79Å
421	P	87.9	Confident	94.6	Very high	17 Å²	17	18.9 Å²	18.9	11%	0.11	9%	0.088	C	C	.	.	S	Bend	trans	-57.4	-35.3	-175.5	-29.8	36.8	0	0	0	115.1	V248 T424 D467 F470	V248-P421 HydrophobicContact CG2-CB 4.41Å; V248-P421 WeakPolarHBondContact CG2-O 3.08Å; P421-T424 VanDerWaalsContact O-CG2 3.32Å; P421-T424 WeakPolarHBondContact O-CG2 3.38Å; P421-D467 HydrophobicContact CG-CB 3.95Å; P421-F470 HydrophobicContact CG-CD2 4.27Å; P421-F470 HydrophobicContact CG-CE2 3.7Å; P421-F470 HydrophobicContact CG-CZ 4.47Å
422	F	89.1	Confident	94.4	Very high	52 Å²	52	14.1 Å²	14.1	23%	0.228	7%	0.071	C	C	.	.	S	Bend	trans	-94.4	-56.3	-177.5	-56.8	-88.1	0	0	0	112.8	V248 S250 R251 F295 H420 T424 F470	V248-F422 HydrophobicContact CB-CD1 4.11Å; V248-F422 HydrophobicContact CB-CE1 3.89Å; V248-F422 HydrophobicContact CG1-CE1 4.05Å; V248-F422 HydrophobicContact CG1-CZ 4.28Å; V248-F422 HydrophobicContact CG2-CD1 4.43Å; S250-F422 WeakPolarHBondContact CA-O 3.28Å; R251-F422 PolarHBondContact N-O 2.91Å; F295-F422 HydrophobicContact CD1-CB 3.87Å; F295-F422 HydrophobicContact CD1-CD1 4.41Å; F295-F422 AromaticContact CD1-CD2 3.7Å; F295-F422 HydrophobicContact CD1-CD2 3.7Å; F295-F422 HydrophobicContact CD1-CE2 4.33Å; F295-F422 AromaticContact CD1-CG 3.74Å; F295-F422 HydrophobicContact CD1-CG 3.74Å; F295-F422 HydrophobicContact CE1-CB 3.29Å; F295-F422 AromaticContact CE1-CD1 3.91Å; F295-F422 HydrophobicContact CE1-CD1 3.91Å; F295-F422 AromaticContact CE1-CD2 3.94Å; F295-F422 HydrophobicContact CE1-CD2 3.94Å; F295-F422 AromaticContact CE1-CG 3.45Å; F295-F422 HydrophobicContact CE1-CG 3.45Å; F295-F422 VanDerWaalsContact CE1-CG 3.45Å; F295-F422 HydrophobicContact CZ-CB 3.97Å; H420-F422 VanDerWaalsContact C-N 3.29Å; H420-F422 AromaticContact CE1-CD2 3.55Å; H420-F422 PolarHBondContact ND1-N 3.39Å; H420-F422 VanDerWaalsContact ND1-N 3.2Å; H420-F422 PolarHBondContact O-N 2.85Å; F422-T424 PolarHBondContact O-N 3.26Å; F422-F470 HydrophobicContact CE2-CE1 4.47Å; F422-F470 HydrophobicContact CE2-CZ 4.2Å
423	H	93.1	Very high	94.3	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.005	7%	0.073	C	C	.	.	S	Bend	trans	-70.9	70.1	162.8	-58.5	-58.4	0	0	0	111.6	R251 L253 A288 F295 H420 N425 M426	R251-H423 PolarHBondContact O-CE1 3.22Å; R251-H423 PolarHBondContact O-ND1 2.53Å; L253-H423 WeakPolarHBondContact CD2-ND1 3.48Å; L253-H423 HydrophobicContact CG-CB 4.32Å; A288-H423 PolarHBondContact O-NE2 2.77Å; F295-H423 AromaticContact CD2-NE2 3.5Å; F295-H423 WeakPolarHBondContact CD2-NE2 3.48Å; F295-H423 AromaticContact CE2-CE1 3.57Å; F295-H423 AromaticContact CE2-NE2 3.07Å; F295-H423 WeakPolarHBondContact CE2-NE2 3.46Å; F295-H423 AromaticContact CZ-CE1 4Å; F295-H423 AromaticContact CZ-NE2 3.75Å; H420-H423 HydrophobicContact CB-CB 4.18Å; H420-H423 AromaticContact ND1-CD2 3.9Å; H420-H423 PolarHBondContact ND1-N 3.3Å; H420-H423 CarbonylContact O-C 3.33Å; H420-H423 VanDerWaalsContact O-C 3.29Å; H423-N425 PolarHBondContact O-N 3.29Å; H423-M426 HydrophobicContact CB-CB 3.85Å; H423-M426 WeakPolarHBondContact O-CB 3.42Å; H423-M426 PolarHBondContact O-N 2.83Å
424	T	90.1	Very high	94	Very high	34 Å²	34	12.4 Å²	12.4	21%	0.209	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-12.9	-171.8	55.1	0	0	0	0	115.2	H420 P421 F422	H420-T424 WeakPolarHBondContact O-CA 3.36Å; H420-T424 PolarHBondContact O-N 3.11Å; P421-T424 VanDerWaalsContact O-CG2 3.32Å; P421-T424 WeakPolarHBondContact O-CG2 3.38Å; F422-T424 PolarHBondContact O-N 3.26Å
425	N	94.6	Very high	93.8	Very high	16 Å²	16	13.9 Å²	13.9	9%	0.086	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	7.2	176.2	70.6	-32.7	0	0	0	113.9	P252 L253 N271 S272 V273 H423	P252-N425 WeakPolarHBondContact CA-OD1 3.26Å; L253-N425 PolarHBondContact N-OD1 3.26Å; L253-N425 PolarHBondContact O-ND2 3Å; N271-N425 VanDerWaalsContact O-CB 3.29Å; N271-N425 WeakPolarHBondContact O-CB 3.01Å; N271-N425 PolarHBondContact O-ND2 3.39Å; S272-N425 WeakPolarHBondContact CA-O 3.26Å; V273-N425 PolarHBondContact N-O 3.34Å; H423-N425 PolarHBondContact O-N 3.29Å
426	M	96.9	Very high	93.5	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.5	170.3	-176	171.2	-167.8	0	0	109.5	L253 V273 N275 A288 I290 F419 H420 H423 F428	L253-M426 HydrophobicContact CD1-CB 4.16Å; L253-M426 HydrophobicContact CD1-CG 4.41Å; L253-M426 HydrophobicContact CD1-SD 3.83Å; V273-M426 HydrophobicContact CG1-CB 3.97Å; V273-M426 HydrophobicContact CG1-CG 4.03Å; V273-M426 CarbonylContact O-C 3.52Å; V273-M426 WeakPolarHBondContact O-CA 3.26Å; N275-M426 HydrophobicContact CB-CE 3.86Å; A288-M426 HydrophobicContact CB-CE 4.39Å; A288-M426 HydrophobicContact CB-SD 3.91Å; I290-M426 HydrophobicContact CD1-CE 4.48Å; I290-M426 HydrophobicContact CD1-SD 3.76Å; F419-M426 CarbonylContact C-O 3.55Å; F419-M426 WeakPolarHBondContact CA-O 3.48Å; H420-M426 PolarHBondContact N-O 3.27Å; H423-M426 HydrophobicContact CB-CB 3.85Å; H423-M426 WeakPolarHBondContact O-CB 3.42Å; H423-M426 PolarHBondContact O-N 2.83Å; M426-F428 HydrophobicContact CE-CE1 4.13Å
427	Y	98.1	Very high	93.4	Very high	3 Å²	3	15 Å²	15	1%	0.012	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	141	-179.5	-62.7	-99.1	0	0	0	110.5	V273 V274 N275 G418 F419 L450 I451 Q454	V273-Y427 PolarHBondContact O-N 2.88Å; V274-Y427 CarbonylContact C-O 3.53Å; V274-Y427 WeakPolarHBondContact CA-O 3.39Å; N275-Y427 PolarHBondContact N-O 3.41Å; G418-Y427 CarbonylContact O-C 3.51Å; G418-Y427 VanDerWaalsContact O-CA 3.28Å; G418-Y427 WeakPolarHBondContact O-CA 3.25Å; F419-Y427 HydrophobicContact CB-CD1 3.89Å; F419-Y427 HydrophobicContact CB-CE1 3.84Å; F419-Y427 HydrophobicContact CB-CG 4.37Å; F419-Y427 HydrophobicContact CD1-CE1 4.24Å; F419-Y427 HydrophobicContact CG-CE1 4.49Å; Y427-L450 HydrophobicContact CD1-CB 4.27Å; Y427-L450 HydrophobicContact CD1-CD1 4.31Å; Y427-L450 HydrophobicContact CE1-CB 3.88Å; Y427-L450 HydrophobicContact CE1-CD1 4.49Å; Y427-I451 HydrophobicContact CD1-CG1 4.29Å; Y427-I451 HydrophobicContact CD2-CD1 4.17Å; Y427-I451 HydrophobicContact CD2-CG1 3.88Å; Y427-I451 HydrophobicContact CE1-CG1 4.07Å; Y427-I451 HydrophobicContact CE2-CD1 4.35Å; Y427-I451 HydrophobicContact CE2-CG1 3.65Å; Y427-I451 HydrophobicContact CG-CD1 4.49Å; Y427-I451 HydrophobicContact CG-CG1 4.2Å; Y427-Q454 PolarHBondContact OH-OE1 3.42Å
428	F	98.2	Very high	93.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	151.2	173.7	-58.7	-68	0	0	0	110.3	N275 A285 I290 L299 I416 T417 G418 H420 M426 I447 F466	N275-F428 HydrophobicContact CB-CD1 4.06Å; N275-F428 HydrophobicContact CB-CE1 4.45Å; A285-F428 HydrophobicContact CB-CE1 4.21Å; I290-F428 HydrophobicContact CD1-CE1 4.41Å; I290-F428 HydrophobicContact CD1-CZ 3.75Å; L299-F428 HydrophobicContact CD1-CD1 4.29Å; L299-F428 HydrophobicContact CD1-CE1 4.47Å; L299-F428 HydrophobicContact CD1-CG 4.48Å; L299-F428 HydrophobicContact CD2-CD1 3.99Å; L299-F428 HydrophobicContact CD2-CE1 4.08Å; I416-F428 HydrophobicContact CG2-CB 4.26Å; I416-F428 CarbonylContact O-C 3.55Å; T417-F428 WeakPolarHBondContact CA-O 3.33Å; T417-F428 PolarHBondContact OG1-O 2.8Å; G418-F428 PolarHBondContact N-O 2.86Å; G418-F428 PolarHBondContact O-N 3.31Å; H420-F428 HydrophobicContact CB-CE2 3.72Å; H420-F428 HydrophobicContact CB-CZ 4.14Å; M426-F428 HydrophobicContact CE-CE1 4.13Å; F428-I447 VanDerWaalsContact O-CD1 3.25Å; F428-I447 WeakPolarHBondContact O-CD1 3.45Å; F428-F466 HydrophobicContact CD2-CB 3.78Å; F428-F466 AromaticContact CD2-CD2 3.83Å; F428-F466 HydrophobicContact CD2-CD2 3.83Å; F428-F466 AromaticContact CD2-CG 3.88Å; F428-F466 HydrophobicContact CD2-CG 3.88Å; F428-F466 HydrophobicContact CE2-CB 4.06Å; F428-F466 HydrophobicContact CE2-CD1 4.16Å; F428-F466 AromaticContact CE2-CD2 3.6Å; F428-F466 HydrophobicContact CE2-CD2 3.6Å; F428-F466 HydrophobicContact CE2-CE2 4.04Å; F428-F466 AromaticContact CE2-CG 3.67Å; F428-F466 HydrophobicContact CE2-CG 3.67Å; F428-F466 HydrophobicContact CE2-CZ 4.49Å; F428-F466 HydrophobicContact CZ-CD2 4.29Å; F428-F466 HydrophobicContact CZ-CE2 4.34Å
429	C	97.6	Very high	93.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	55.3	170.5	47.2	0	0	0	0	110.4	I59 V274 N275 I416 I443 I447	I59-C429 WeakPolarHBondContact CD1-O 3.27Å; I59-C429 HydrophobicContact CG2-CB 3.81Å; I59-C429 VanDerWaalsContact CG2-SG 3.54Å; V274-C429 WeakPolarHBondContact CG1-SG 3.48Å; N275-C429 PolarHBondContact O-N 3.3Å; N275-C429 PolarHBondContact O-SG 2.98Å; I416-C429 WeakPolarHBondContact O-CA 3.28Å; C429-I443 HydrophobicContact CB-CG2 3.48Å; C429-I443 VanDerWaalsContact CB-CG2 3.48Å; C429-I447 HydrophobicContact CB-CD1 4.05Å; C429-I447 HydrophobicContact CB-CG1 3.86Å
430	N	96.8	Very high	94.1	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.005	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	170.4	-163.2	-49.7	-39.8	0	0	0	111.1	N275 A281 V301 I416	N275-N430 VanDerWaalsContact O-CG 3.31Å; N275-N430 PolarHBondContact O-ND2 3.45Å; N275-N430 PolarHBondContact O-OD1 3.39Å; A281-N430 HydrophobicContact CB-CB 3.81Å; A281-N430 VanDerWaalsContact CB-CG 3.41Å; A281-N430 WeakPolarHBondContact CB-ND2 3.26Å; V301-N430 HydrophobicContact CG1-CB 4.48Å; V301-N430 HydrophobicContact CG2-CB 4.24Å; I416-N430 WeakPolarHBondContact CA-O 3.37Å; I416-N430 PolarHBondContact N-O 3.09Å; I416-N430 PolarHBondContact O-N 3.21Å
431	G	94.4	Very high	94.4	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.082	C	C	.	.			trans	83.1	18.1	171.3	0	0	0	0	0	114	D407 N409 N414 S433	D407-G431 CarbonylContact O-C 3.54Å; D407-G431 VanDerWaalsContact O-C 3.25Å; D407-G431 WeakPolarHBondContact O-CA 2.99Å; D407-G431 PolarHBondContact OD2-N 3.13Å; N409-G431 WeakPolarHBondContact CB-O 3.21Å; N414-G431 CarbonylContact C-O 3.56Å; N414-G431 VanDerWaalsContact C-O 3.3Å; G431-S433 PolarHBondContact O-N 2.75Å; G431-S433 PolarHBondContact O-OG 2.8Å
432	S	92.1	Very high	94.9	Very high	4 Å²	4	11.9 Å²	11.9	3%	0.028	8%	0.077	C	C	.	.	B	Isolated β-bridge	trans	-68.4	-2.6	-179.4	-67.2	0	0	0	0	113.9	D407 G434 H435 I443	D407-S432 PolarHBondContact O-N 3.24Å; D407-S432 PolarHBondContact OD2-N 3.23Å; S432-G434 VanDerWaalsContact C-N 3.27Å; S432-G434 PolarHBondContact O-N 2.65Å; S432-H435 PolarHBondContact O-N 3.09Å; S432-I443 WeakPolarHBondContact OG-CD1 3.4Å
433	S	93.1	Very high	95.3	Very high	18 Å²	18	9.4 Å²	9.4	13%	0.126	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	38.6	165.8	-49.2	0	0	0	0	115.4	D407 N409 Q413 G431	D407-S433 PolarHBondContact O-N 2.89Å; N409-S433 PolarHBondContact N-OG 3.28Å; Q413-S433 WeakPolarHBondContact CA-OG 3.32Å; Q413-S433 WeakPolarHBondContact O-CB 3.39Å; Q413-S433 PolarHBondContact O-OG 2.96Å; Q413-S433 VanDerWaalsContact O-OG 3.1Å; G431-S433 PolarHBondContact O-N 2.75Å; G431-S433 PolarHBondContact O-OG 2.8Å
434	G	88.9	Confident	95.6	Very high	50 Å²	50	9.4 Å²	9.4	52%	0.515	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.9	-8.3	-179.5	0	0	0	0	0	114.8	S432	S432-G434 VanDerWaalsContact C-N 3.27Å; S432-G434 PolarHBondContact O-N 2.65Å
435	H	91.8	Very high	96	Very high	33 Å²	33	9 Å²	9	15%	0.153	6%	0.061	C	C	.	.			trans	-100	0.1	176.1	-51.9	-36.7	0	0	0	113.5	R97 F100 S432 T437 Q438 H439	R97-H435 PolarHBondContact NH2-CE1 2.94Å; F100-H435 AromaticContact CE1-CD2 3.68Å; F100-H435 AromaticContact CE1-CE1 3.88Å; F100-H435 AromaticContact CE1-CG 3.9Å; F100-H435 AromaticContact CE1-NE2 3.64Å; S432-H435 PolarHBondContact O-N 3.09Å; H435-T437 VanDerWaalsContact C-N 3.35Å; H435-T437 PolarHBondContact O-N 2.94Å; H435-Q438 HydrophobicContact CB-CG 4.41Å; H435-Q438 WeakPolarHBondContact O-CG 3.48Å; H435-Q438 PolarHBondContact O-N 3.35Å; H435-Q438 VanDerWaalsContact O-N 3.16Å; H435-H439 PolarHBondContact O-N 2.97Å
436	G	91.7	Very high	96.1	Very high	7 Å²	7	8.4 Å²	8.4	7%	0.072	6%	0.058	C	C	.	.	H	α-helix	trans	-53.2	-46	-172.4	0	0	0	0	0	113.7	A440	G436-A440 WeakPolarHBondContact O-CA 3.19Å; G436-A440 VanDerWaalsContact O-CB 3.26Å; G436-A440 WeakPolarHBondContact O-CB 3.24Å; G436-A440 PolarHBondContact O-N 2.82Å
437	T	95.3	Very high	96.2	Very high	19 Å²	19	8.4 Å²	8.4	12%	0.117	6%	0.058	C	C	.	.	H	α-helix	trans	-63.5	-45.1	-179.9	-58.7	0	0	0	0	112.7	F200 P202 H435 A440	F200-T437 HydrophobicContact CE2-CG2 3.94Å; F200-T437 HydrophobicContact CZ-CG2 3.75Å; P202-T437 HydrophobicContact CB-CG2 3.88Å; P202-T437 HydrophobicContact CG-CG2 4.02Å; H435-T437 VanDerWaalsContact C-N 3.35Å; H435-T437 PolarHBondContact O-N 2.94Å; T437-A440 WeakPolarHBondContact O-CB 3.32Å; T437-A440 PolarHBondContact O-N 2.88Å
438	Q	96.9	Very high	96.2	Very high	5 Å²	5	8.2 Å²	8.2	2%	0.023	6%	0.058	C	C	.	.	H	α-helix	trans	-73.2	-32.4	-176	92.8	-176.4	-92	0	0	112.3	S95 I96 R97 S109 S112 H435	S95-Q438 WeakPolarHBondContact O-CB 3.45Å; I96-Q438 HydrophobicContact CB-CB 4.34Å; I96-Q438 HydrophobicContact CG1-CB 4.31Å; R97-Q438 VanDerWaalsContact N-OE1 3.09Å; R97-Q438 PolarHBondContact O-OE1 2.88Å; R97-Q438 VanDerWaalsContact O-OE1 3.05Å; S109-Q438 PolarHBondContact OG-OE1 3.36Å; S112-Q438 WeakPolarHBondContact CB-O 3.05Å; S112-Q438 PolarHBondContact OG-O 3.32Å; S112-Q438 VanDerWaalsContact OG-O 3.08Å; H435-Q438 HydrophobicContact CB-CG 4.41Å; H435-Q438 WeakPolarHBondContact O-CG 3.48Å; H435-Q438 PolarHBondContact O-N 3.35Å; H435-Q438 VanDerWaalsContact O-N 3.16Å
439	H	98.1	Very high	96.2	Very high	2 Å²	2	8.4 Å²	8.4	1%	0.009	6%	0.059	C	C	.	.	H	α-helix	trans	-92.9	-6.4	179.3	-65.2	159.4	0	0	0	113.3	F100 N105 M108 S109 H435 I441 A442 I443	F100-H439 AromaticContact CE2-NE2 3.89Å; F100-H439 AromaticContact CZ-CE1 3.9Å; F100-H439 AromaticContact CZ-NE2 3.93Å; N105-H439 PolarHBondContact O-NE2 2.72Å; N105-H439 VanDerWaalsContact O-NE2 3.14Å; M108-H439 HydrophobicContact CB-CB 4.36Å; M108-H439 HydrophobicContact SD-CB 4.25Å; S109-H439 PolarHBondContact OG-CD2 3.11Å; S109-H439 PolarHBondContact OG-NE2 2.92Å; H435-H439 PolarHBondContact O-N 2.97Å; H439-I441 PolarHBondContact O-N 2.93Å; H439-I441 VanDerWaalsContact O-N 3.12Å; H439-A442 PolarHBondContact O-N 3.48Å; H439-I443 HydrophobicContact CB-CD1 3.7Å; H439-I443 HydrophobicContact CB-CG1 4.1Å; H439-I443 VanDerWaalsContact O-CG1 3.31Å; H439-I443 WeakPolarHBondContact O-CG1 3.37Å; H439-I443 PolarHBondContact O-N 2.88Å
440	A	98.3	Very high	96.1	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-52.5	-41.9	-172.3	0	0	0	0	0	113.5	I58 I59 A62 G436 T437 I443 G444	I58-A440 HydrophobicContact CB-CB 4.19Å; I58-A440 HydrophobicContact CG1-CB 3.6Å; I58-A440 HydrophobicContact CG2-CB 3.73Å; I59-A440 HydrophobicContact CG1-CB 3.98Å; A62-A440 VanDerWaalsContact CB-O 3.27Å; A62-A440 WeakPolarHBondContact CB-O 3.44Å; G436-A440 WeakPolarHBondContact O-CA 3.19Å; G436-A440 VanDerWaalsContact O-CB 3.26Å; G436-A440 WeakPolarHBondContact O-CB 3.24Å; G436-A440 PolarHBondContact O-N 2.82Å; T437-A440 WeakPolarHBondContact O-CB 3.32Å; T437-A440 PolarHBondContact O-N 2.88Å; A440-I443 PolarHBondContact O-N 3.48Å; A440-G444 PolarHBondContact O-N 2.84Å
441	I	98.6	Very high	96	Very high	3 Å²	3	9.5 Å²	9.5	2%	0.015	6%	0.064	C	C	.	.	H	α-helix	trans	-66.7	-43.4	-178.9	-58.1	-57.6	0	0	0	111.1	A62 W66 F111 F115 L209 H439 K445	A62-I441 HydrophobicContact CB-CD1 4.25Å; W66-I441 HydrophobicContact CZ2-CG2 4.07Å; W66-I441 PolarHBondContact NE1-O 2.89Å; F111-I441 HydrophobicContact CD1-CG2 4.27Å; F111-I441 HydrophobicContact CE1-CG2 3.84Å; F115-I441 HydrophobicContact CB-CG2 3.73Å; F115-I441 HydrophobicContact CD1-CD1 3.94Å; F115-I441 HydrophobicContact CD1-CG1 3.9Å; F115-I441 HydrophobicContact CD1-CG2 3.9Å; F115-I441 HydrophobicContact CD2-CG2 3.67Å; F115-I441 HydrophobicContact CE1-CD1 3.76Å; F115-I441 HydrophobicContact CE1-CG1 4.26Å; F115-I441 HydrophobicContact CE1-CG2 4.41Å; F115-I441 HydrophobicContact CE2-CG2 4.2Å; F115-I441 HydrophobicContact CG-CG1 4.35Å; F115-I441 HydrophobicContact CG-CG2 3.5Å; F115-I441 VanDerWaalsContact CG-CG2 3.5Å; F115-I441 HydrophobicContact CZ-CD1 4.28Å; L209-I441 HydrophobicContact CD1-CD1 3.99Å; L209-I441 HydrophobicContact CD2-CD1 4.33Å; H439-I441 PolarHBondContact O-N 2.93Å; H439-I441 VanDerWaalsContact O-N 3.12Å; I441-K445 WeakPolarHBondContact O-CB 3.27Å; I441-K445 PolarHBondContact O-N 2.87Å; I441-K445 VanDerWaalsContact O-N 3.1Å
442	A	98.7	Very high	96.1	Very high	2 Å²	2	11.3 Å²	11.3	2%	0.017	8%	0.076	C	C	.	.	H	α-helix	trans	-68.9	-41	176.4	0	0	0	0	0	112.4	M108 F111 S112 H439 K445 S446 I459	M108-A442 HydrophobicContact CB-CB 3.66Å; M108-A442 HydrophobicContact CG-CB 3.64Å; M108-A442 HydrophobicContact SD-CB 4.36Å; F111-A442 HydrophobicContact CB-CB 4.46Å; F111-A442 HydrophobicContact CD1-CB 3.71Å; F111-A442 HydrophobicContact CE1-CB 4.43Å; F111-A442 HydrophobicContact CG-CB 4.44Å; S112-A442 PolarHBondContact OG-N 2.79Å; H439-A442 PolarHBondContact O-N 3.48Å; A442-K445 WeakPolarHBondContact O-CB 3.41Å; A442-K445 PolarHBondContact O-N 3.18Å; A442-S446 PolarHBondContact O-N 2.86Å; A442-I459 HydrophobicContact CB-CD1 4.15Å
443	I	98.7	Very high	96.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.2	-46.7	176.1	-65.9	168.7	0	0	0	110.2	I59 M108 L415 C429 S432 H439 A440 K445 S446 I447	I59-I443 HydrophobicContact CD1-CD1 4.2Å; I59-I443 HydrophobicContact CG2-CG2 3.82Å; M108-I443 HydrophobicContact SD-CG1 4.04Å; L415-I443 HydrophobicContact CD1-CD1 3.79Å; L415-I443 HydrophobicContact CD1-CG1 4.24Å; L415-I443 HydrophobicContact CD1-CG2 4.49Å; L415-I443 HydrophobicContact CD2-CD1 4.01Å; L415-I443 HydrophobicContact CD2-CG1 3.75Å; C429-I443 HydrophobicContact CB-CG2 3.48Å; C429-I443 VanDerWaalsContact CB-CG2 3.48Å; S432-I443 WeakPolarHBondContact OG-CD1 3.4Å; H439-I443 HydrophobicContact CB-CD1 3.7Å; H439-I443 HydrophobicContact CB-CG1 4.1Å; H439-I443 VanDerWaalsContact O-CG1 3.31Å; H439-I443 WeakPolarHBondContact O-CG1 3.37Å; H439-I443 PolarHBondContact O-N 2.88Å; A440-I443 PolarHBondContact O-N 3.48Å; I443-K445 VanDerWaalsContact C-N 3.25Å; I443-K445 PolarHBondContact O-N 3.44Å; I443-S446 PolarHBondContact O-N 2.83Å; I443-S446 PolarHBondContact O-OG 3.15Å; I443-I447 WeakPolarHBondContact O-CG1 3.27Å; I443-I447 PolarHBondContact O-N 3.14Å
444	G	98.6	Very high	96.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-58.2	-40.2	176	0	0	0	0	0	112.4	T63 W66 A440 S448	T63-G444 WeakPolarHBondContact OG1-CA 3.38Å; W66-G444 VanDerWaalsContact CD1-C 3.45Å; A440-G444 PolarHBondContact O-N 2.84Å; G444-S448 PolarHBondContact O-N 3.27Å; G444-S448 VanDerWaalsContact O-N 3.12Å
445	K	98.5	Very high	96.2	Very high	26 Å²	26	24 Å²	24	11%	0.113	11%	0.11	C	C	.	.	H	α-helix	trans	-64.2	-46.7	176.2	-179.7	66.9	-179.1	-172.8	0	111.6	W66 D70 F111 I441 A442 I443 I447 S448 E449	W66-K445 HydrophobicContact CD2-CB 4.15Å; W66-K445 HydrophobicContact CD2-CD 3.59Å; W66-K445 HydrophobicContact CD2-CG 4.46Å; W66-K445 HydrophobicContact CE3-CD 3.58Å; W66-K445 HydrophobicContact CG-CB 4.07Å; W66-K445 HydrophobicContact CG-CD 4.02Å; W66-K445 HydrophobicContact CH2-CD 4.34Å; W66-K445 HydrophobicContact CZ2-CD 4.36Å; W66-K445 HydrophobicContact CZ3-CD 3.96Å; D70-K445 IonicContact OD1-NZ 3.97Å; D70-K445 IonicContact OD2-NZ 3.26Å; D70-K445 PolarHBondContact OD2-NZ 3.42Å; F111-K445 HydrophobicContact CE1-CB 3.89Å; F111-K445 HydrophobicContact CE1-CG 4.2Å; F111-K445 HydrophobicContact CZ-CB 3.98Å; F111-K445 HydrophobicContact CZ-CD 4.28Å; F111-K445 HydrophobicContact CZ-CG 3.79Å; I441-K445 WeakPolarHBondContact O-CB 3.27Å; I441-K445 PolarHBondContact O-N 2.87Å; I441-K445 VanDerWaalsContact O-N 3.1Å; A442-K445 WeakPolarHBondContact O-CB 3.41Å; A442-K445 PolarHBondContact O-N 3.18Å; I443-K445 VanDerWaalsContact C-N 3.25Å; I443-K445 PolarHBondContact O-N 3.44Å; K445-I447 PolarHBondContact O-N 2.94Å; K445-S448 WeakPolarHBondContact O-CB 3.31Å; K445-S448 PolarHBondContact O-N 3.04Å; K445-S448 VanDerWaalsContact O-N 3.17Å; K445-E449 WeakPolarHBondContact CE-OE1 3.42Å; K445-E449 WeakPolarHBondContact O-CG 3.15Å; K445-E449 PolarHBondContact O-N 3.44Å
446	S	97.8	Very high	96.4	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.021	11%	0.109	C	C	.	.	H	α-helix	trans	-64.4	-39.5	-177.1	74	0	0	0	0	112.1	A442 I443 E449 L450 L461	A442-S446 PolarHBondContact O-N 2.86Å; I443-S446 PolarHBondContact O-N 2.83Å; I443-S446 PolarHBondContact O-OG 3.15Å; S446-E449 PolarHBondContact O-N 3.17Å; S446-L450 WeakPolarHBondContact O-CG 3.28Å; S446-L450 PolarHBondContact O-N 3.11Å; S446-L461 WeakPolarHBondContact OG-CD1 3.42Å
447	I	98	Very high	96.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-43.3	172.7	-62.9	-58.2	0	0	0	111.4	T63 V274 T417 F428 C429 I443 K445 E449 L450 I451	T63-I447 HydrophobicContact CG2-CB 4.12Å; T63-I447 HydrophobicContact CG2-CG2 3.63Å; V274-I447 HydrophobicContact CG1-CG2 4.05Å; V274-I447 HydrophobicContact CG2-CG2 3.74Å; T417-I447 WeakPolarHBondContact OG1-CD1 3.36Å; F428-I447 VanDerWaalsContact O-CD1 3.25Å; F428-I447 WeakPolarHBondContact O-CD1 3.45Å; C429-I447 HydrophobicContact CB-CD1 4.05Å; C429-I447 HydrophobicContact CB-CG1 3.86Å; I443-I447 WeakPolarHBondContact O-CG1 3.27Å; I443-I447 PolarHBondContact O-N 3.14Å; K445-I447 PolarHBondContact O-N 2.94Å; I447-E449 VanDerWaalsContact C-N 3.28Å; I447-E449 PolarHBondContact O-N 3.31Å; I447-L450 PolarHBondContact O-N 3.15Å; I447-I451 HydrophobicContact CG2-CD1 3.76Å; I447-I451 HydrophobicContact CG2-CG1 4.39Å; I447-I451 WeakPolarHBondContact O-CG1 3.41Å; I447-I451 PolarHBondContact O-N 2.97Å
448	S	98.4	Very high	96.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59	-41.9	176.9	179.3	0	0	0	0	112.3	W66 M67 G444 K445 T452	W66-S448 VanDerWaalsContact C-OG 3.31Å; W66-S448 PolarHBondContact O-OG 3.16Å; M67-S448 WeakPolarHBondContact CA-OG 3.33Å; M67-S448 PolarHBondContact N-OG 3.35Å; M67-S448 WeakPolarHBondContact SD-CA 3.32Å; G444-S448 PolarHBondContact O-N 3.27Å; G444-S448 VanDerWaalsContact O-N 3.12Å; K445-S448 WeakPolarHBondContact O-CB 3.31Å; K445-S448 PolarHBondContact O-N 3.04Å; K445-S448 VanDerWaalsContact O-N 3.17Å; S448-T452 WeakPolarHBondContact O-CB 3.27Å; S448-T452 PolarHBondContact O-N 3.22Å; S448-T452 PolarHBondContact O-OG1 2.86Å
449	E	97.7	Very high	96.7	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.019	15%	0.147	C	C	.	.	H	α-helix	trans	-67.5	-42.2	177.4	-70.3	179.1	163.6	0	0	112.8	K445 S446 I447 T452 F453 R455 K457 T458	K445-E449 WeakPolarHBondContact CE-OE1 3.42Å; K445-E449 WeakPolarHBondContact O-CG 3.15Å; K445-E449 PolarHBondContact O-N 3.44Å; S446-E449 PolarHBondContact O-N 3.17Å; I447-E449 VanDerWaalsContact C-N 3.28Å; I447-E449 PolarHBondContact O-N 3.31Å; E449-T452 PolarHBondContact O-N 3.2Å; E449-F453 HydrophobicContact CB-CD2 4.17Å; E449-F453 HydrophobicContact CG-CD2 4.28Å; E449-F453 HydrophobicContact CG-CE2 4.43Å; E449-F453 WeakPolarHBondContact O-CA 3.28Å; E449-F453 WeakPolarHBondContact O-CB 3.21Å; E449-F453 PolarHBondContact O-N 3.23Å; E449-R455 CarbonylContact C-O 3.54Å; E449-K457 HydrophobicContact CG-CB 4.44Å; E449-K457 PolarHBondContact OE2-N 3.27Å; E449-T458 VanDerWaalsContact OE1-CB 3.31Å; E449-T458 WeakPolarHBondContact OE1-CB 3.3Å; E449-T458 PolarHBondContact OE1-N 3.37Å; E449-T458 PolarHBondContact OE1-OG1 3.45Å; E449-T458 PolarHBondContact OE2-N 3.18Å
450	L	95.1	Very high	96.6	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-62	-46.4	175.8	-75.8	178.8	0	0	0	112.1	Y427 S446 I447 T452 Q454 Y456	Y427-L450 HydrophobicContact CD1-CB 4.27Å; Y427-L450 HydrophobicContact CD1-CD1 4.31Å; Y427-L450 HydrophobicContact CE1-CB 3.88Å; Y427-L450 HydrophobicContact CE1-CD1 4.49Å; S446-L450 WeakPolarHBondContact O-CG 3.28Å; S446-L450 PolarHBondContact O-N 3.11Å; I447-L450 PolarHBondContact O-N 3.15Å; L450-T452 VanDerWaalsContact C-N 3.34Å; L450-T452 PolarHBondContact O-N 3.13Å; L450-Q454 WeakPolarHBondContact O-CA 3.15Å; L450-Q454 PolarHBondContact O-N 2.85Å; L450-Q454 PolarHBondContact O-OE1 3.1Å; L450-Y456 HydrophobicContact CD1-CD1 4.34Å; L450-Y456 HydrophobicContact CD1-CE1 3.43Å; L450-Y456 VanDerWaalsContact CD1-CE1 3.43Å; L450-Y456 HydrophobicContact CD2-CD1 3.99Å; L450-Y456 HydrophobicContact CD2-CD2 4.36Å; L450-Y456 HydrophobicContact CD2-CE1 3.75Å; L450-Y456 HydrophobicContact CD2-CE2 4.13Å; L450-Y456 HydrophobicContact CD2-CG 4.3Å; L450-Y456 HydrophobicContact CG-CD1 3.84Å; L450-Y456 HydrophobicContact CG-CE1 3.42Å; L450-Y456 VanDerWaalsContact CG-CE1 3.42Å
451	I	96	Very high	96.5	Very high	15 Å²	15	36.6 Å²	36.6	8%	0.077	17%	0.172	C	C	.	.	H	α-helix	trans	-65.5	-41	179.3	-67.7	172.1	0	0	0	110.8	V51 M67 V274 Y427 I447	V51-I451 HydrophobicContact CG1-CD1 3.98Å; V51-I451 HydrophobicContact CG2-CD1 4.43Å; V51-I451 HydrophobicContact CG2-CG2 3.94Å; M67-I451 HydrophobicContact CE-CB 4.37Å; M67-I451 HydrophobicContact CE-CG2 3.86Å; M67-I451 HydrophobicContact SD-CB 3.97Å; M67-I451 HydrophobicContact SD-CD1 3.96Å; M67-I451 HydrophobicContact SD-CG2 4.1Å; V274-I451 HydrophobicContact CG2-CD1 3.66Å; Y427-I451 HydrophobicContact CD1-CG1 4.29Å; Y427-I451 HydrophobicContact CD2-CD1 4.17Å; Y427-I451 HydrophobicContact CD2-CG1 3.88Å; Y427-I451 HydrophobicContact CE1-CG1 4.07Å; Y427-I451 HydrophobicContact CE2-CD1 4.35Å; Y427-I451 HydrophobicContact CE2-CG1 3.65Å; Y427-I451 HydrophobicContact CG-CD1 4.49Å; Y427-I451 HydrophobicContact CG-CG1 4.2Å; I447-I451 HydrophobicContact CG2-CD1 3.76Å; I447-I451 HydrophobicContact CG2-CG1 4.39Å; I447-I451 WeakPolarHBondContact O-CG1 3.41Å; I447-I451 PolarHBondContact O-N 2.97Å
452	T	96.1	Very high	96.3	Very high	39 Å²	39	39 Å²	39	24%	0.239	19%	0.187	C	C	.	.	H	α-helix	trans	-82.1	-37.9	-173.4	-54.1	0	0	0	0	113.1	F73 S448 E449 L450	F73-T452 HydrophobicContact CE2-CG2 4.47Å; S448-T452 WeakPolarHBondContact O-CB 3.27Å; S448-T452 PolarHBondContact O-N 3.22Å; S448-T452 PolarHBondContact O-OG1 2.86Å; E449-T452 PolarHBondContact O-N 3.2Å; L450-T452 VanDerWaalsContact C-N 3.34Å; L450-T452 PolarHBondContact O-N 3.13Å
453	F	93.9	Very high	96	Very high	85 Å²	85	44 Å²	44	37%	0.373	21%	0.205	S	C	.	.	H	α-helix	trans	-120	-5.8	-170	-52.7	-64	0	0	0	114	E449 R455 K457	E449-F453 HydrophobicContact CB-CD2 4.17Å; E449-F453 HydrophobicContact CG-CD2 4.28Å; E449-F453 HydrophobicContact CG-CE2 4.43Å; E449-F453 WeakPolarHBondContact O-CA 3.28Å; E449-F453 WeakPolarHBondContact O-CB 3.21Å; E449-F453 PolarHBondContact O-N 3.23Å; F453-R455 HydrophobicContact CB-CG 4.26Å; F453-R455 PolarHBondContact O-N 3.15Å; F453-K457 HydrophobicContact CB-CD 4.43Å; F453-K457 HydrophobicContact CD1-CD 4.4Å; F453-K457 HydrophobicContact CD2-CD 3.45Å; F453-K457 VanDerWaalsContact CD2-CD 3.45Å; F453-K457 HydrophobicContact CD2-CG 4.17Å; F453-K457 HydrophobicContact CE2-CD 3.72Å; F453-K457 HydrophobicContact CG-CD 3.84Å; F453-K457 HydrophobicContact CZ-CD 4.3Å
454	Q	90.4	Very high	95.9	Very high	87 Å²	87	44 Å²	44	41%	0.407	21%	0.205	S	C	.	.	S	Bend	trans	57.3	23.6	-174.6	-58.2	-69.8	13.3	0	0	114.1	I240 Y427 L450	I240-Q454 HydrophobicContact CD1-CB 4.39Å; Y427-Q454 PolarHBondContact OH-OE1 3.42Å; L450-Q454 WeakPolarHBondContact O-CA 3.15Å; L450-Q454 PolarHBondContact O-N 2.85Å; L450-Q454 PolarHBondContact O-OE1 3.1Å
455	R	92.5	Very high	95.7	Very high	165 Å²	165	44.2 Å²	44.2	62%	0.623	21%	0.207	S	C	*	.	S	Bend	trans	-161.8	154	174.9	62.7	-176.4	174.5	132	-5	110.3	E449 F453	E449-R455 CarbonylContact C-O 3.54Å; F453-R455 HydrophobicContact CB-CG 4.26Å; F453-R455 PolarHBondContact O-N 3.15Å
456	Y	94.8	Very high	95.4	Very high	29 Å²	29	43 Å²	43	11%	0.114	20%	0.201	C	C	.	.			trans	-68	144.1	167.2	-54.7	-66.3	0	0	0	110.7	T417 L450 I459 D460 L461 V462	T417-Y456 WeakPolarHBondContact CG2-OH 3.4Å; L450-Y456 HydrophobicContact CD1-CD1 4.34Å; L450-Y456 HydrophobicContact CD1-CE1 3.43Å; L450-Y456 VanDerWaalsContact CD1-CE1 3.43Å; L450-Y456 HydrophobicContact CD2-CD1 3.99Å; L450-Y456 HydrophobicContact CD2-CD2 4.36Å; L450-Y456 HydrophobicContact CD2-CE1 3.75Å; L450-Y456 HydrophobicContact CD2-CE2 4.13Å; L450-Y456 HydrophobicContact CD2-CG 4.3Å; L450-Y456 HydrophobicContact CG-CD1 3.84Å; L450-Y456 HydrophobicContact CG-CE1 3.42Å; L450-Y456 VanDerWaalsContact CG-CE1 3.42Å; Y456-I459 VanDerWaalsContact CB-O 3.28Å; Y456-I459 WeakPolarHBondContact CB-O 3.44Å; Y456-D460 WeakPolarHBondContact CD2-OD1 3.44Å; Y456-L461 HydrophobicContact CD1-CB 4.49Å; Y456-L461 HydrophobicContact CE1-CB 3.97Å; Y456-L461 HydrophobicContact CE2-CB 4.13Å; Y456-L461 PolarHBondContact OH-O 3.29Å; Y456-V462 HydrophobicContact CD2-CG2 3.94Å; Y456-V462 HydrophobicContact CE2-CB 4.45Å; Y456-V462 HydrophobicContact CE2-CG2 3.81Å; Y456-V462 VanDerWaalsContact CE2-N 3.3Å
457	K	95.8	Very high	94.9	Very high	124 Å²	124	43.8 Å²	43.8	54%	0.539	21%	0.205	S	C	.	.	S	Bend	trans	-122.8	-33.1	175.6	-67.1	-175.3	67.7	-171	0	112.9	E449 F453	E449-K457 HydrophobicContact CG-CB 4.44Å; E449-K457 PolarHBondContact OE2-N 3.27Å; F453-K457 HydrophobicContact CB-CD 4.43Å; F453-K457 HydrophobicContact CD1-CD 4.4Å; F453-K457 HydrophobicContact CD2-CD 3.45Å; F453-K457 VanDerWaalsContact CD2-CD 3.45Å; F453-K457 HydrophobicContact CD2-CG 4.17Å; F453-K457 HydrophobicContact CE2-CD 3.72Å; F453-K457 HydrophobicContact CG-CD 3.84Å; F453-K457 HydrophobicContact CZ-CD 4.3Å
458	T	97.4	Very high	94.7	Very high	68 Å²	68	43.9 Å²	43.9	42%	0.417	21%	0.205	S	C	.	.	S	Bend	trans	-93.5	-54.4	-175.6	-60.1	0	0	0	0	111.6	F111 E449	F111-T458 HydrophobicContact CD2-CG2 3.78Å; F111-T458 HydrophobicContact CE2-CG2 3.68Å; F111-T458 HydrophobicContact CZ-CG2 4.5Å; E449-T458 VanDerWaalsContact OE1-CB 3.31Å; E449-T458 WeakPolarHBondContact OE1-CB 3.3Å; E449-T458 PolarHBondContact OE1-N 3.37Å; E449-T458 PolarHBondContact OE1-OG1 3.45Å; E449-T458 PolarHBondContact OE2-N 3.18Å
459	I	97.1	Very high	94.4	Very high	14 Å²	14	44.2 Å²	44.2	7%	0.072	21%	0.207	C	C	.	.	S	Bend	trans	-131.5	126	177.4	-63.5	161.5	0	0	0	107.4	Q107 M108 F111 A442 Y456 L461	Q107-I459 HydrophobicContact CB-CD1 4.25Å; Q107-I459 HydrophobicContact CB-CG1 4.18Å; Q107-I459 HydrophobicContact CB-CG2 4.15Å; M108-I459 HydrophobicContact CG-CD1 4.07Å; M108-I459 HydrophobicContact CG-CG2 4.47Å; F111-I459 HydrophobicContact CB-CD1 3.84Å; F111-I459 HydrophobicContact CG-CD1 4.26Å; A442-I459 HydrophobicContact CB-CD1 4.15Å; Y456-I459 VanDerWaalsContact CB-O 3.28Å; Y456-I459 WeakPolarHBondContact CB-O 3.44Å; I459-L461 HydrophobicContact CG2-CD2 3.57Å; I459-L461 HydrophobicContact CG2-CG 4.03Å; I459-L461 PolarHBondContact O-N 2.91Å
460	D	96	Very high	93.9	Very high	97 Å²	97	48 Å²	48	52%	0.519	22%	0.224	S	C	.	.			trans	-76.9	103.2	177	-170.9	-4.5	0	0	0	110.5	E104 Y456 V462	E104-D460 WeakPolarHBondContact CG-O 3.34Å; Y456-D460 WeakPolarHBondContact CD2-OD1 3.44Å; D460-V462 WeakPolarHBondContact OD1-CB 3.46Å; D460-V462 WeakPolarHBondContact OD1-CG2 3.35Å; D460-V462 PolarHBondContact OD1-N 2.88Å
461	L	96.2	Very high	93.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.24	C	C	.	.			trans	-101	25.7	177.2	-58.2	-179.6	0	0	0	112.3	E104 M108 L415 T417 S446 Y456 I459 R463 F464	E104-L461 HydrophobicContact CB-CD2 3.84Å; E104-L461 HydrophobicContact CG-CD2 4.22Å; M108-L461 HydrophobicContact CE-CD2 4.29Å; M108-L461 HydrophobicContact CG-CD2 4.09Å; M108-L461 HydrophobicContact SD-CD1 3.84Å; M108-L461 HydrophobicContact SD-CD2 3.84Å; L415-L461 HydrophobicContact CD2-CD1 4.1Å; T417-L461 HydrophobicContact CG2-CB 3.87Å; T417-L461 HydrophobicContact CG2-CD1 4.28Å; S446-L461 WeakPolarHBondContact OG-CD1 3.42Å; Y456-L461 HydrophobicContact CD1-CB 4.49Å; Y456-L461 HydrophobicContact CE1-CB 3.97Å; Y456-L461 HydrophobicContact CE2-CB 4.13Å; Y456-L461 PolarHBondContact OH-O 3.29Å; I459-L461 HydrophobicContact CG2-CD2 3.57Å; I459-L461 HydrophobicContact CG2-CG 4.03Å; I459-L461 PolarHBondContact O-N 2.91Å; L461-R463 VanDerWaalsContact C-N 3.27Å; L461-R463 PolarHBondContact O-N 3.25Å; L461-F464 HydrophobicContact CB-CD2 4.26Å; L461-F464 HydrophobicContact CD2-CD2 3.91Å; L461-F464 HydrophobicContact CD2-CE2 4.29Å; L461-F464 PolarHBondContact O-N 3.2Å
462	V	93.7	Very high	93.2	Very high	54 Å²	54	56.7 Å²	56.7	33%	0.327	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-53.6	-45.3	175.5	157.8	0	0	0	0	109.8	R242 Y456 D460 F464 S465	R242-V462 PolarHBondContact NH2-O 2.66Å; Y456-V462 HydrophobicContact CD2-CG2 3.94Å; Y456-V462 HydrophobicContact CE2-CB 4.45Å; Y456-V462 HydrophobicContact CE2-CG2 3.81Å; Y456-V462 VanDerWaalsContact CE2-N 3.3Å; D460-V462 WeakPolarHBondContact OD1-CB 3.46Å; D460-V462 WeakPolarHBondContact OD1-CG2 3.35Å; D460-V462 PolarHBondContact OD1-N 2.88Å; V462-F464 PolarHBondContact O-N 3.05Å; V462-S465 VanDerWaalsContact O-CB 3.23Å; V462-S465 WeakPolarHBondContact O-CB 3.41Å; V462-S465 PolarHBondContact O-N 2.88Å; V462-S465 PolarHBondContact O-OG 3.45Å
463	R	94.2	Very high	93.1	Very high	105 Å²	105	59 Å²	59	40%	0.396	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-59.1	-22.1	179.7	-72.6	178.1	55.9	-136.1	6.9	114.1	E102 E104 L461 R468 V475	E102-R463 VanDerWaalsContact CD-NH2 3.33Å; E102-R463 IonicContact OE1-NH2 3.68Å; E102-R463 PolarHBondContact OE1-NH2 2.9Å; E102-R463 IonicContact OE2-CZ 3.51Å; E102-R463 IonicContact OE2-NH1 3.62Å; E102-R463 PolarHBondContact OE2-NH1 2.85Å; E102-R463 IonicContact OE2-NH2 2.8Å; E102-R463 PolarHBondContact OE2-NH2 2.85Å; E104-R463 VanDerWaalsContact CD-NH1 3.33Å; E104-R463 VanDerWaalsContact OE1-CD 3.24Å; E104-R463 WeakPolarHBondContact OE1-CD 3.37Å; E104-R463 IonicContact OE1-CZ 3.99Å; E104-R463 IonicContact OE1-NE 3.13Å; E104-R463 IonicContact OE1-NH1 3.95Å; E104-R463 PolarHBondContact OE1-NH1 3.32Å; E104-R463 IonicContact OE2-NH1 2.75Å; E104-R463 PolarHBondContact OE2-NH1 2.92Å; L461-R463 VanDerWaalsContact C-N 3.27Å; L461-R463 PolarHBondContact O-N 3.25Å; R463-R468 WeakPolarHBondContact O-CD 3.44Å; R463-V475 HydrophobicContact CB-CG2 4.16Å; R463-V475 VanDerWaalsContact O-CG2 3.32Å; R463-V475 WeakPolarHBondContact O-CG2 3.34Å
464	F	96.1	Very high	93.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-92.3	10.5	177.4	-62.3	-80.8	0	0	0	114.6	E104 N414 L415 I416 T417 L461 V462 R468 V475	E104-F464 HydrophobicContact CB-CD2 4.22Å; E104-F464 HydrophobicContact CB-CE2 3.32Å; E104-F464 HydrophobicContact CB-CZ 4.02Å; E104-F464 HydrophobicContact CG-CD2 4.37Å; E104-F464 HydrophobicContact CG-CE2 3.64Å; N414-F464 HydrophobicContact CB-CD1 4.03Å; N414-F464 HydrophobicContact CB-CE1 3.76Å; L415-F464 HydrophobicContact CB-CB 4.27Å; L415-F464 HydrophobicContact CB-CD1 3.79Å; L415-F464 HydrophobicContact CB-CE1 4.49Å; L415-F464 HydrophobicContact CB-CG 4.15Å; L415-F464 HydrophobicContact CD2-CB 4.38Å; L415-F464 HydrophobicContact CG-CB 4.26Å; L415-F464 WeakPolarHBondContact O-CB 3.26Å; L415-F464 WeakPolarHBondContact O-CD1 3.41Å; I416-F464 WeakPolarHBondContact CA-O 3.27Å; T417-F464 HydrophobicContact CG2-CB 3.73Å; T417-F464 PolarHBondContact N-O 2.9Å; L461-F464 HydrophobicContact CB-CD2 4.26Å; L461-F464 HydrophobicContact CD2-CD2 3.91Å; L461-F464 HydrophobicContact CD2-CE2 4.29Å; L461-F464 PolarHBondContact O-N 3.2Å; V462-F464 PolarHBondContact O-N 3.05Å; F464-R468 PolarHBondContact O-NH1 2.8Å; F464-V475 HydrophobicContact CE1-CB 4.28Å; F464-V475 HydrophobicContact CE1-CG1 3.76Å; F464-V475 HydrophobicContact CE1-CG2 4.43Å; F464-V475 HydrophobicContact CZ-CG1 3.88Å
465	S	93.9	Very high	93.3	Very high	6 Å²	6	54.2 Å²	54.2	4%	0.042	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-64.7	145.8	-179.7	57.1	0	0	0	0	114.2	R242 T417 V462 D467 R468	R242-S465 PolarHBondContact NH1-OG 3.19Å; R242-S465 PolarHBondContact NH2-OG 3.09Å; T417-S465 CarbonylContact O-C 3.57Å; T417-S465 WeakPolarHBondContact O-CA 3.36Å; V462-S465 VanDerWaalsContact O-CB 3.23Å; V462-S465 WeakPolarHBondContact O-CB 3.41Å; V462-S465 PolarHBondContact O-N 2.88Å; V462-S465 PolarHBondContact O-OG 3.45Å; S465-D467 VanDerWaalsContact C-N 3.28Å; S465-D467 WeakPolarHBondContact CB-OD1 3.39Å; S465-D467 PolarHBondContact O-N 3Å; S465-D467 PolarHBondContact OG-OD1 2.83Å; S465-R468 WeakPolarHBondContact O-CB 3.32Å; S465-R468 WeakPolarHBondContact O-CG 3.17Å; S465-R468 PolarHBondContact O-N 2.82Å; S465-R468 PolarHBondContact O-NH1 2.84Å
466	F	92.7	Very high	93.2	Very high	1 Å²	1	50.7 Å²	50.7	0%	0.004	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-55.9	-37	171.9	179.4	-92.8	0	0	0	113.9	I290 L297 L299 I416 T417 H420 F428 R468 L469 F470	I290-F466 HydrophobicContact CG2-CZ 4.45Å; L297-F466 HydrophobicContact CD2-CE1 4.19Å; L297-F466 HydrophobicContact CD2-CZ 4.14Å; L297-F466 HydrophobicContact CG-CZ 4.25Å; L299-F466 HydrophobicContact CB-CE2 4.36Å; L299-F466 HydrophobicContact CD1-CD2 3.82Å; L299-F466 HydrophobicContact CD1-CE2 3.84Å; I416-F466 HydrophobicContact CG2-CB 3.93Å; I416-F466 HydrophobicContact CG2-CD2 3.92Å; I416-F466 HydrophobicContact CG2-CG 4.44Å; T417-F466 PolarHBondContact O-N 2.93Å; H420-F466 AromaticContact CD2-CD1 3.9Å; H420-F466 AromaticContact CD2-CE1 3.34Å; H420-F466 WeakPolarHBondContact CD2-CE1 3.28Å; H420-F466 AromaticContact CD2-CZ 3.81Å; H420-F466 AromaticContact NE2-CE1 3.79Å; F428-F466 HydrophobicContact CD2-CB 3.78Å; F428-F466 AromaticContact CD2-CD2 3.83Å; F428-F466 HydrophobicContact CD2-CD2 3.83Å; F428-F466 AromaticContact CD2-CG 3.88Å; F428-F466 HydrophobicContact CD2-CG 3.88Å; F428-F466 HydrophobicContact CE2-CB 4.06Å; F428-F466 HydrophobicContact CE2-CD1 4.16Å; F428-F466 AromaticContact CE2-CD2 3.6Å; F428-F466 HydrophobicContact CE2-CD2 3.6Å; F428-F466 HydrophobicContact CE2-CE2 4.04Å; F428-F466 AromaticContact CE2-CG 3.67Å; F428-F466 HydrophobicContact CE2-CG 3.67Å; F428-F466 HydrophobicContact CE2-CZ 4.49Å; F428-F466 HydrophobicContact CZ-CD2 4.29Å; F428-F466 HydrophobicContact CZ-CE2 4.34Å; F466-R468 PolarHBondContact O-N 3.35Å; F466-R468 VanDerWaalsContact O-N 3.14Å; F466-L469 HydrophobicContact CD2-CD1 3.86Å; F466-L469 HydrophobicContact CE2-CD1 3.89Å; F466-L469 HydrophobicContact CG-CD1 4.48Å; F466-L469 VanDerWaalsContact O-CB 3.3Å; F466-L469 WeakPolarHBondContact O-CB 3.34Å; F466-L469 VanDerWaalsContact O-CG 3.28Å; F466-L469 WeakPolarHBondContact O-CG 3.28Å; F466-L469 PolarHBondContact O-N 2.81Å; F466-L469 VanDerWaalsContact O-N 3.16Å; F466-F470 AromaticContact CD1-CE2 3.98Å; F466-F470 HydrophobicContact CD1-CE2 3.98Å; F466-F470 AromaticContact CE1-CE2 3.56Å; F466-F470 HydrophobicContact CE1-CE2 3.56Å; F466-F470 HydrophobicContact CE1-CZ 4.05Å
467	D	87.5	Confident	93	Very high	18 Å²	18	50.9 Å²	50.9	10%	0.096	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-65.3	-20.3	-175.6	66.9	-41.4	0	0	0	113.4	R242 R245 P421 S465 L469 F470 F471	R242-D467 IonicContact CZ-OD1 2.85Å; R242-D467 IonicContact CZ-OD2 2.63Å; R242-D467 IonicContact NE-OD2 2.68Å; R242-D467 IonicContact NH1-OD1 3.72Å; R242-D467 PolarHBondContact NH1-OD1 2.99Å; R242-D467 IonicContact NH1-OD2 3.92Å; R242-D467 PolarHBondContact NH1-OD2 3.45Å; R242-D467 IonicContact NH2-OD1 2.95Å; R245-D467 IonicContact CZ-OD2 3.42Å; R245-D467 IonicContact NE-OD2 3.77Å; R245-D467 PolarHBondContact NE-OD2 3.38Å; R245-D467 IonicContact NH2-OD2 3.19Å; P421-D467 HydrophobicContact CG-CB 3.95Å; S465-D467 VanDerWaalsContact C-N 3.28Å; S465-D467 WeakPolarHBondContact CB-OD1 3.39Å; S465-D467 PolarHBondContact O-N 3Å; S465-D467 PolarHBondContact OG-OD1 2.83Å; D467-L469 PolarHBondContact O-N 3.02Å; D467-L469 VanDerWaalsContact O-N 3.08Å; D467-F470 HydrophobicContact CB-CD2 4.37Å; D467-F470 WeakPolarHBondContact O-CB 3.41Å; D467-F470 PolarHBondContact O-N 2.92Å; D467-F471 WeakPolarHBondContact O-CD2 3.33Å
468	R	92.4	Very high	92.8	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.008	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-52.6	-31.9	174.1	87.8	178.5	179.7	-104.2	14.9	112.4	D412 L415 R463 F464 S465 F466 F470 F471 N472 E473	D412-R468 VanDerWaalsContact CG-NH2 3.35Å; D412-R468 IonicContact OD1-CZ 3.52Å; D412-R468 IonicContact OD1-NH2 2.78Å; D412-R468 PolarHBondContact OD1-NH2 3.26Å; D412-R468 IonicContact OD2-CZ 3.99Å; D412-R468 IonicContact OD2-NE 3.01Å; D412-R468 PolarHBondContact OD2-NE 3.14Å; D412-R468 IonicContact OD2-NH2 2.85Å; D412-R468 PolarHBondContact OD2-NH2 3.22Å; L415-R468 PolarHBondContact O-NH1 2.84Å; L415-R468 PolarHBondContact O-NH2 3.23Å; R463-R468 WeakPolarHBondContact O-CD 3.44Å; F464-R468 PolarHBondContact O-NH1 2.8Å; S465-R468 WeakPolarHBondContact O-CB 3.32Å; S465-R468 WeakPolarHBondContact O-CG 3.17Å; S465-R468 PolarHBondContact O-N 2.82Å; S465-R468 PolarHBondContact O-NH1 2.84Å; F466-R468 PolarHBondContact O-N 3.35Å; F466-R468 VanDerWaalsContact O-N 3.14Å; R468-F470 VanDerWaalsContact C-N 3.32Å; R468-F470 PolarHBondContact O-N 3.46Å; R468-F471 CarbonylContact O-C 3.58Å; R468-F471 PolarHBondContact O-N 3.11Å; R468-F471 VanDerWaalsContact O-N 3.1Å; R468-N472 PolarHBondContact O-N 3.24Å; R468-E473 HydrophobicContact CB-CB 3.99Å; R468-E473 WeakPolarHBondContact CD-O 3.06Å; R468-E473 VanDerWaalsContact CG-O 3.3Å; R468-E473 WeakPolarHBondContact CG-O 3.5Å; R468-E473 PolarHBondContact O-N 3.22Å
469	L	92.7	Very high	92.3	Very high	8 Å²	8	46.7 Å²	46.7	4%	0.042	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-64.6	-32.6	178.9	-58.6	179.1	0	0	0	112.4	L297 P300 W411 I416 F466 D467 F471	L297-L469 HydrophobicContact CD2-CB 3.7Å; P300-L469 HydrophobicContact CG-CD1 3.85Å; P300-L469 HydrophobicContact CG-CD2 4.33Å; W411-L469 HydrophobicContact CB-CD2 4.04Å; W411-L469 HydrophobicContact CD2-CD2 3.99Å; W411-L469 HydrophobicContact CG-CD2 3.5Å; W411-L469 VanDerWaalsContact CG-CD2 3.5Å; I416-L469 HydrophobicContact CD1-CD1 4.2Å; F466-L469 HydrophobicContact CD2-CD1 3.86Å; F466-L469 HydrophobicContact CE2-CD1 3.89Å; F466-L469 HydrophobicContact CG-CD1 4.48Å; F466-L469 VanDerWaalsContact O-CB 3.3Å; F466-L469 WeakPolarHBondContact O-CB 3.34Å; F466-L469 VanDerWaalsContact O-CG 3.28Å; F466-L469 WeakPolarHBondContact O-CG 3.28Å; F466-L469 PolarHBondContact O-N 2.81Å; F466-L469 VanDerWaalsContact O-N 3.16Å; D467-L469 PolarHBondContact O-N 3.02Å; D467-L469 VanDerWaalsContact O-N 3.08Å; L469-F471 PolarHBondContact O-N 3.31Å
470	F	87.5	Confident	91.8	Very high	83 Å²	83	46.2 Å²	46.2	36%	0.364	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-69.2	-22.6	175.2	-69.7	-84.7	0	0	0	112.8	L297 P421 F422 F466 D467 R468	L297-F470 HydrophobicContact CB-CE1 3.86Å; L297-F470 HydrophobicContact CB-CZ 4Å; L297-F470 HydrophobicContact CD2-CD1 3.73Å; L297-F470 HydrophobicContact CD2-CD2 3.65Å; L297-F470 HydrophobicContact CD2-CE1 3.65Å; L297-F470 HydrophobicContact CD2-CE2 3.57Å; L297-F470 HydrophobicContact CD2-CG 3.73Å; L297-F470 HydrophobicContact CD2-CZ 3.57Å; L297-F470 HydrophobicContact CG-CE1 4.44Å; L297-F470 HydrophobicContact CG-CZ 4.43Å; P421-F470 HydrophobicContact CG-CD2 4.27Å; P421-F470 HydrophobicContact CG-CE2 3.7Å; P421-F470 HydrophobicContact CG-CZ 4.47Å; F422-F470 HydrophobicContact CE2-CE1 4.47Å; F422-F470 HydrophobicContact CE2-CZ 4.2Å; F466-F470 AromaticContact CD1-CE2 3.98Å; F466-F470 HydrophobicContact CD1-CE2 3.98Å; F466-F470 AromaticContact CE1-CE2 3.56Å; F466-F470 HydrophobicContact CE1-CE2 3.56Å; F466-F470 HydrophobicContact CE1-CZ 4.05Å; D467-F470 HydrophobicContact CB-CD2 4.37Å; D467-F470 WeakPolarHBondContact O-CB 3.41Å; D467-F470 PolarHBondContact O-N 2.92Å; R468-F470 VanDerWaalsContact C-N 3.32Å; R468-F470 PolarHBondContact O-N 3.46Å
471	F	87.6	Confident	91.5	Very high	86 Å²	86	42.8 Å²	42.8	38%	0.377	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-106.7	7.6	-174.6	-59.9	-85.4	0	0	0	112.7	R245 D467 R468 L469 E473	R245-F471 VanDerWaalsContact NH1-CE2 3.32Å; D467-F471 WeakPolarHBondContact O-CD2 3.33Å; R468-F471 CarbonylContact O-C 3.58Å; R468-F471 PolarHBondContact O-N 3.11Å; R468-F471 VanDerWaalsContact O-N 3.1Å; L469-F471 PolarHBondContact O-N 3.31Å; F471-E473 HydrophobicContact CB-CG 3.94Å; F471-E473 WeakPolarHBondContact CB-OE1 3.08Å; F471-E473 PolarHBondContact O-N 3.49Å
472	N	89.6	Confident	91.2	Very high	120 Å²	120	45 Å²	45	64%	0.642	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	35.5	-175.3	-61.9	-34.9	0	0	0	113.2	W411 R468	W411-N472 HydrophobicContact CZ2-CB 4.36Å; R468-N472 PolarHBondContact O-N 3.24Å
473	E	92.5	Very high	91.1	Very high	86 Å²	86	44.5 Å²	44.5	40%	0.402	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-90.2	116.9	177.1	-68.7	163.7	-168.1	0	0	108.7	R245 R468 F471	R245-E473 IonicContact CZ-OE1 2.69Å; R245-E473 IonicContact CZ-OE2 3.81Å; R245-E473 IonicContact NH1-OE1 3.86Å; R245-E473 PolarHBondContact NH1-OE1 3.04Å; R245-E473 VanDerWaalsContact NH1-OE1 3.12Å; R245-E473 IonicContact NH1-OE2 2.79Å; R245-E473 IonicContact NH2-OE1 3.61Å; R245-E473 PolarHBondContact NH2-OE1 2.93Å; R245-E473 IonicContact NH2-OE2 3.25Å; R245-E473 PolarHBondContact NH2-OE2 2.63Å; R468-E473 HydrophobicContact CB-CB 3.99Å; R468-E473 WeakPolarHBondContact CD-O 3.06Å; R468-E473 VanDerWaalsContact CG-O 3.3Å; R468-E473 WeakPolarHBondContact CG-O 3.5Å; R468-E473 PolarHBondContact O-N 3.22Å; F471-E473 HydrophobicContact CB-CG 3.94Å; F471-E473 WeakPolarHBondContact CB-OE1 3.08Å; F471-E473 PolarHBondContact O-N 3.49Å
474	T	94.4	Very high	90.9	Very high	69 Å²	69	41.1 Å²	41.1	42%	0.423	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-101.4	144	177.5	55.4	0	0	0	0	111.2	W411 D412 N476	W411-T474 HydrophobicContact CZ2-CG2 4.25Å; D412-T474 HydrophobicContact CB-CG2 4.32Å; T474-N476 PolarHBondContact OG1-ND2 3.4Å
475	V	94.1	Very high	90.6	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.024	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-100.8	127.5	163.2	-178.6	0	0	0	0	107.9	E102 D412 N414 R463 F464	E102-V475 HydrophobicContact CG-CG1 3.78Å; D412-V475 WeakPolarHBondContact CB-O 3.04Å; D412-V475 PolarHBondContact OD2-N 3.31Å; N414-V475 HydrophobicContact CB-CB 4.18Å; N414-V475 HydrophobicContact CB-CG1 4.43Å; N414-V475 PolarHBondContact ND2-O 2.9Å; R463-V475 HydrophobicContact CB-CG2 4.16Å; R463-V475 VanDerWaalsContact O-CG2 3.32Å; R463-V475 WeakPolarHBondContact O-CG2 3.34Å; F464-V475 HydrophobicContact CE1-CB 4.28Å; F464-V475 HydrophobicContact CE1-CG1 3.76Å; F464-V475 HydrophobicContact CE1-CG2 4.43Å; F464-V475 HydrophobicContact CZ-CG1 3.88Å
476	N	90.3	Very high	90.4	Very high	91 Å²	91	45.9 Å²	45.9	49%	0.487	24%	0.236	S	C	.	.			trans	-114.9	101	-170	-68.3	-42.4	0	0	0	110	E102 T474 V478	E102-N476 PolarHBondContact OE1-N 3.25Å; E102-N476 VanDerWaalsContact OE1-O 3.08Å; T474-N476 PolarHBondContact OG1-ND2 3.4Å; N476-V478 HydrophobicContact CB-CG2 4.31Å; N476-V478 WeakPolarHBondContact O-CG2 3.47Å; N476-V478 PolarHBondContact O-N 3.21Å
477	E	92.1	Very high	90.3	Very high	32 Å²	32	48.9 Å²	48.9	15%	0.15	25%	0.251	C	S	.	.			trans	-79.2	102.8	172	-175.9	64.4	-146.4	0	0	109.2	F100 S101 E102 N105 N414 N479	F100-E477 WeakPolarHBondContact CA-OE1 3.44Å; F100-E477 WeakPolarHBondContact CB-OE1 3.36Å; F100-E477 HydrophobicContact CD1-CG 4.33Å; F100-E477 VanDerWaalsContact CD1-OE1 3.31Å; F100-E477 WeakPolarHBondContact CD1-OE1 3.38Å; S101-E477 PolarHBondContact N-OE1 2.91Å; S101-E477 WeakPolarHBondContact OG-CA 3.34Å; S101-E477 PolarHBondContact OG-OE1 3.4Å; E102-E477 WeakPolarHBondContact CB-OE2 3.47Å; E102-E477 WeakPolarHBondContact CG-OE2 3.38Å; E102-E477 PolarHBondContact N-OE2 2.93Å; N105-E477 PolarHBondContact ND2-OE2 2.96Å; N414-E477 PolarHBondContact ND2-N 3.37Å; E477-N479 PolarHBondContact O-N 3.16Å
478	V	91.1	Very high	90.5	Very high	72 Å²	72	51.1 Å²	51.1	44%	0.436	26%	0.262	S	S	.	.			trans	-98	92.1	-174.8	-162.1	0	0	0	0	109.5	S101 L152 N156 N476	S101-V478 PolarHBondContact OG-N 3.22Å; L152-V478 HydrophobicContact CD1-CB 4.24Å; L152-V478 HydrophobicContact CD1-CG1 3.89Å; L152-V478 HydrophobicContact CD2-CB 4.44Å; L152-V478 HydrophobicContact CD2-CG1 3.57Å; L152-V478 HydrophobicContact CG-CG1 4.39Å; N156-V478 PolarHBondContact ND2-O 3.09Å; N476-V478 HydrophobicContact CB-CG2 4.31Å; N476-V478 WeakPolarHBondContact O-CG2 3.47Å; N476-V478 PolarHBondContact O-N 3.21Å
479	N	86.4	Confident	90.3	Very high	33 Å²	33	54.8 Å²	54.8	18%	0.176	28%	0.282	C	S	.	.			trans	-82.4	153.5	175.9	-64.6	-82.2	0	0	0	111.2	L152 E477 F481	L152-N479 WeakPolarHBondContact CD2-O 3.44Å; E477-N479 PolarHBondContact O-N 3.16Å; N479-F481 HydrophobicContact CB-CD1 3.97Å; N479-F481 HydrophobicContact CB-CD2 4.34Å; N479-F481 HydrophobicContact CB-CE1 3.69Å; N479-F481 HydrophobicContact CB-CE2 4.1Å; N479-F481 HydrophobicContact CB-CG 4.29Å; N479-F481 HydrophobicContact CB-CZ 3.76Å; N479-F481 PolarHBondContact O-N 3.35Å; N479-F481 WeakPolarHBondContact OD1-CZ 3.36Å
480	C	87.8	Confident	90.1	Very high	4 Å²	4	58.8 Å²	58.8	3%	0.027	30%	0.302	C	S	.	.			trans	-83.2	12	175.1	62.2	0	0	0	0	114.1	I143 A145 N149 L152 L153	I143-C480 WeakPolarHBondContact CG2-SG 3.39Å; A145-C480 HydrophobicContact CB-CB 4.44Å; N149-C480 HydrophobicContact CB-CB 4.01Å; N149-C480 VanDerWaalsContact CB-O 3.28Å; N149-C480 WeakPolarHBondContact CB-O 3.2Å; N149-C480 PolarHBondContact ND2-O 2.96Å; L152-C480 HydrophobicContact CD2-CB 4.37Å; L153-C480 HydrophobicContact CB-CB 4.22Å; L153-C480 HydrophobicContact CD1-CB 4.34Å; L153-C480 WeakPolarHBondContact CD1-SG 3.49Å
481	F	88.1	Confident	90.4	Very high	25 Å²	25	56.5 Å²	56.5	11%	0.11	30%	0.296	C	S	.	.			trans	-132.1	0	179.2	55.9	-93.6	0	0	0	112.4	I143 I335 D336 R339 F341 N479	I143-F481 HydrophobicContact CD1-CE1 4.11Å; I143-F481 HydrophobicContact CG2-CD1 3.67Å; I143-F481 HydrophobicContact CG2-CE1 4Å; I335-F481 HydrophobicContact CD1-CE1 4.48Å; I335-F481 HydrophobicContact CD1-CZ 4.4Å; I335-F481 HydrophobicContact CG2-CB 4.48Å; I335-F481 HydrophobicContact CG2-CD1 3.71Å; I335-F481 HydrophobicContact CG2-CD2 3.84Å; I335-F481 HydrophobicContact CG2-CE1 3.8Å; I335-F481 HydrophobicContact CG2-CE2 3.92Å; I335-F481 HydrophobicContact CG2-CG 3.74Å; I335-F481 HydrophobicContact CG2-CZ 3.9Å; D336-F481 WeakPolarHBondContact O-CB 3.15Å; R339-F481 HydrophobicContact CG-CD2 4.14Å; R339-F481 WeakPolarHBondContact CG-OXT 3.34Å; R339-F481 VanDerWaalsContact CZ-O 3.26Å; R339-F481 PolarHBondContact NE-O 3.37Å; R339-F481 PolarHBondContact NE-OXT 3.5Å; R339-F481 VanDerWaalsContact NE-OXT 3.08Å; R339-F481 PolarHBondContact NH2-O 3.49Å; F341-F481 HydrophobicContact CE1-CE2 4.45Å; F341-F481 HydrophobicContact CZ-CD2 4.4Å; F341-F481 AromaticContact CZ-CE2 3.85Å; F341-F481 HydrophobicContact CZ-CE2 3.85Å; N479-F481 HydrophobicContact CB-CD1 3.97Å; N479-F481 HydrophobicContact CB-CD2 4.34Å; N479-F481 HydrophobicContact CB-CE1 3.69Å; N479-F481 HydrophobicContact CB-CE2 4.1Å; N479-F481 HydrophobicContact CB-CG 4.29Å; N479-F481 HydrophobicContact CB-CZ 3.76Å; N479-F481 PolarHBondContact O-N 3.35Å; N479-F481 WeakPolarHBondContact OD1-CZ 3.36Å

Retrieved 481 of 481 residues in 125 ms (Link to these results)

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