A0A087XW98_POEFO Loading...

Acetyl-CoA acyltransferase 1

AlphaFold DB , UniProt , Accession A0A087XW98, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 425 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	54	Low	47.1	Very low	246 Å²	246	156.7 Å²	156.7	100%	1.212	81%	0.806	S	S	*	*				0	62.2	0	-69.8	173.8	170	0	0	111.1
2	N	50.7	Low	46.7	Very low	150 Å²	150	152.3 Å²	152.3	80%	0.802	80%	0.8	S	S	*	*			trans	-144.5	28.5	-179.8	-117.7	-0.5	0	0	0	112.3
3	R	46.8	Very low	46.3	Very low	223 Å²	223	151.3 Å²	151.3	84%	0.842	81%	0.807	S	S	*	*	S	Bend	trans	-122.2	-8.5	179.8	-121.4	-177.8	-176.8	-170.8	0.6	114.6
4	L	48.9	Very low	45.9	Very low	158 Å²	158	146.2 Å²	146.2	83%	0.827	81%	0.809	S	S	*	*	S	Bend	trans	-93.5	-10.2	179.3	-88.9	155.8	0	0	0	114.2
5	K	47	Very low	45.3	Very low	191 Å²	191	141.3 Å²	141.3	83%	0.83	80%	0.804	S	S	*	*	S	Bend	trans	-84.3	-13.5	175.9	-88.2	-175.7	174.3	-179.3	0	114.5
6	L	46.9	Very low	45.5	Very low	143 Å²	143	140.3 Å²	140.3	75%	0.749	81%	0.809	S	S	*	*	S	Bend	trans	-86.8	-7.5	-179.9	-95.5	150.9	0	0	0	114.1
7	I	47.5	Very low	45.2	Very low	126 Å²	126	137.4 Å²	137.4	65%	0.646	81%	0.805	S	S	*	*	S	Bend	trans	-103.9	-13.5	-175.9	-59.1	179.1	0	0	0	112.7
8	S	45.4	Very low	45.6	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	80%	0.795	S	S	*	*	G	3₁₀ helix	trans	-83.4	-11.1	-179.4	-163.7	0	0	0	0	114.3	H10	S8-H10 PolarHBondContact O-N 3.15Å
9	G	42.9	Very low	45.4	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	80%	0.797	S	S	*	*	G	3₁₀ helix	trans	-79.9	-7.6	-175.4	0	0	0	0	0	116
10	H	43.2	Very low	45.4	Very low	172 Å²	172	134.4 Å²	134.4	80%	0.796	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-104.5	3.6	-175.4	-72.2	-60.5	0	0	0	114.8	S8	S8-H10 PolarHBondContact O-N 3.15Å
11	L	44.3	Very low	45.3	Very low	153 Å²	153	133.3 Å²	133.3	80%	0.801	79%	0.793	S	S	*	*	S	Bend	trans	-125.9	25.5	-173	-69.8	174.8	0	0	0	114.7
12	S	42.5	Very low	44.8	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	77%	0.773	S	S	*	*			trans	-120.4	116.1	169.9	-65.7	0	0	0	0	110.5	G14	S12-G14 PolarHBondContact O-N 3.43Å
13	P	42.4	Very low	44.4	Very low	139 Å²	139	129.7 Å²	129.7	90%	0.903	78%	0.778	S	S	*	*			trans	-77.6	104.2	174.9	30.4	-28.5	0	0	0	108.4
14	G	40.3	Very low	44.2	Very low	80 Å²	80	129.4 Å²	129.4	83%	0.825	78%	0.777	S	S	*	*			trans	-137.2	100.7	173.3	0	0	0	0	0	109.6	S12	S12-G14 PolarHBondContact O-N 3.43Å
15	G	36.7	Very low	43.9	Very low	72 Å²	72	126.7 Å²	126.7	74%	0.742	77%	0.771	S	S	*	*	S	Bend	trans	165.8	100.1	173.1	0	0	0	0	0	113.2	A17	G15-A17 PolarHBondContact O-N 2.98Å; G15-A17 VanDerWaalsContact O-N 3.14Å
16	S	48.6	Very low	43.7	Very low	125 Å²	125	122.5 Å²	122.5	87%	0.874	77%	0.766	S	S	*	*			trans	-9.1	99.3	157.1	166.2	0	0	0	0	115.3
17	A	40.9	Very low	43.4	Very low	91 Å²	91	122.6 Å²	122.6	75%	0.752	77%	0.767	S	S	*	*			trans	-81.1	117.9	166.2	0	0	0	0	0	108.9	G15	G15-A17 PolarHBondContact O-N 2.98Å; G15-A17 VanDerWaalsContact O-N 3.14Å
18	A	51.4	Low	43.1	Very low	76 Å²	76	122.1 Å²	122.1	63%	0.628	77%	0.774	S	S	*	*			trans	-53.1	148	160.3	0	0	0	0	0	109.2	L20	A18-L20 PolarHBondContact O-N 3.24Å
19	P	41.5	Very low	42.8	Very low	128 Å²	128	120.4 Å²	120.4	83%	0.831	77%	0.771	S	S	*	*			trans	-59.1	113.4	177	24.7	-31.4	0	0	0	108.2
20	L	45.9	Very low	42.8	Very low	149 Å²	149	123 Å²	123	78%	0.78	78%	0.777	S	S	*	*			trans	-53.7	137.8	170.2	-74.1	158.8	0	0	0	107.3	A18 D22	A18-L20 PolarHBondContact O-N 3.24Å; L20-D22 PolarHBondContact O-N 3.36Å
21	P	44.6	Very low	43.1	Very low	112 Å²	112	118.9 Å²	118.9	73%	0.727	77%	0.772	S	S	*	*			trans	-54	132.6	170.1	-11.7	23.2	0	0	0	107.3	L23	P21-L23 PolarHBondContact O-N 3.03Å
22	D	41.5	Very low	43.8	Very low	146 Å²	146	115.8 Å²	115.8	78%	0.781	77%	0.769	S	S	*	*			trans	-40.5	112.1	172.9	-92.2	-32.6	0	0	0	108.6	L20 R24	L20-D22 PolarHBondContact O-N 3.36Å; D22-R24 HydrophobicContact CB-CG 4.46Å; D22-R24 PolarHBondContact O-N 3.3Å
23	L	42.3	Very low	44.8	Very low	174 Å²	174	115.6 Å²	115.6	91%	0.911	77%	0.765	S	S	*	*			trans	-65.7	81.9	164.1	-79	167.1	0	0	0	105.5	P21 S25	P21-L23 PolarHBondContact O-N 3.03Å; L23-S25 PolarHBondContact O-N 3.45Å
24	R	44.3	Very low	46.6	Very low	217 Å²	217	111.1 Å²	111.1	82%	0.819	74%	0.737	S	S	*	*			trans	-56.9	125.5	165.7	-68.8	-174.8	178.2	-174.1	-0.7	105.4	D22 S26	D22-R24 HydrophobicContact CB-CG 4.46Å; D22-R24 PolarHBondContact O-N 3.3Å; R24-S26 VanDerWaalsContact C-N 3.27Å; R24-S26 PolarHBondContact O-N 2.74Å
25	S	41.1	Very low	48.6	Very low	101 Å²	101	111.6 Å²	111.6	71%	0.706	73%	0.725	S	S	*	*			trans	-51.8	104.3	158.9	51.6	0	0	0	0	106.2	L23 D27	L23-S25 PolarHBondContact O-N 3.45Å; S25-D27 VanDerWaalsContact C-N 3.27Å; S25-D27 PolarHBondContact O-N 3.35Å
26	S	44.5	Very low	51	Low	103 Å²	103	113.8 Å²	113.8	72%	0.72	72%	0.716	S	S	*	*			trans	-60.4	106.5	155.6	170.3	0	0	0	0	103.5	R24 C28	R24-S26 VanDerWaalsContact C-N 3.27Å; R24-S26 PolarHBondContact O-N 2.74Å; S26-C28 PolarHBondContact O-N 2.93Å
27	D	39	Very low	53.1	Low	144 Å²	144	110.7 Å²	110.7	77%	0.77	69%	0.69	S	S	*	*			trans	-55.3	98	156.7	-75.7	-33	0	0	0	104.3	S25 G29	S25-D27 VanDerWaalsContact C-N 3.27Å; S25-D27 PolarHBondContact O-N 3.35Å; D27-G29 PolarHBondContact O-N 2.89Å
28	C	42.1	Very low	55.7	Low	117 Å²	117	108 Å²	108	79%	0.791	66%	0.662	S	S	*	*			trans	-70	62.4	163.3	-158.7	0	0	0	0	105.8	S26 C30	S26-C28 PolarHBondContact O-N 2.93Å; C28-C30 VanDerWaalsContact C-N 3.34Å; C28-C30 PolarHBondContact O-N 3.28Å; C28-C30 VanDerWaalsContact O-N 3.07Å
29	G	38.6	Very low	57.9	Low	57 Å²	57	104.5 Å²	104.5	59%	0.588	63%	0.632	S	S	*	*			trans	-66.1	104.9	163.7	0	0	0	0	0	103.9	D27 A31	D27-G29 PolarHBondContact O-N 2.89Å; G29-A31 PolarHBondContact O-N 2.69Å
30	C	43.3	Very low	60.7	Low	124 Å²	124	98.4 Å²	98.4	84%	0.838	59%	0.593	S	S	*	*			trans	-55	89.4	151.1	-65.2	0	0	0	0	105.3	C28 A32	C28-C30 VanDerWaalsContact C-N 3.34Å; C28-C30 PolarHBondContact O-N 3.28Å; C28-C30 VanDerWaalsContact O-N 3.07Å; C30-A32 PolarHBondContact O-N 3.16Å
31	A	49.7	Very low	63.2	Low	85 Å²	85	91.3 Å²	91.3	70%	0.702	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-52.2	135.9	172.8	0	0	0	0	0	106.2	G29	G29-A31 PolarHBondContact O-N 2.69Å
32	A	59.6	Low	65.8	Low	88 Å²	88	86 Å²	86	73%	0.727	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-50.7	132.2	169.8	0	0	0	0	0	107.3	C30 S34	C30-A32 PolarHBondContact O-N 3.16Å; A32-S34 PolarHBondContact O-N 3.25Å
33	P	62.1	Low	68.5	Low	100 Å²	100	80.2 Å²	80.2	65%	0.649	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-53	135.3	-177.2	19.2	-29.7	0	0	0	108.8	D37	P33-D37 HydrophobicContact CB-CB 4.24Å
34	S	79.9	Confident	71.2	Confident	44 Å²	44	72 Å²	72	31%	0.308	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-59	151.8	177.3	76.1	0	0	0	0	108.9	A32 E36 D37	A32-S34 PolarHBondContact O-N 3.25Å; S34-E36 PolarHBondContact O-N 3.23Å; S34-D37 PolarHBondContact O-N 3.19Å; S34-D37 PolarHBondContact OG-N 3.43Å; S34-D37 PolarHBondContact OG-OD2 3.32Å
35	P	82.5	Confident	73.8	Confident	90 Å²	90	63 Å²	63	58%	0.584	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-50.9	-34.8	176.7	-29	36.1	0	0	0	112.8	D37 E38 R291	P35-D37 VanDerWaalsContact C-N 3.26Å; P35-D37 PolarHBondContact O-N 2.93Å; P35-E38 VanDerWaalsContact O-CB 3.3Å; P35-E38 WeakPolarHBondContact O-CB 3.29Å; P35-E38 VanDerWaalsContact O-CG 3.22Å; P35-E38 WeakPolarHBondContact O-CG 3.31Å; P35-E38 PolarHBondContact O-N 3.42Å; P35-R291 WeakPolarHBondContact O-CD 3.42Å; P35-R291 PolarHBondContact O-NE 3.06Å
36	E	88.1	Confident	76.5	Confident	118 Å²	118	58.2 Å²	58.2	55%	0.551	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-64.9	-22.8	177.1	-66.6	-178.3	-172.8	0	0	114.3	S34 R290 A292	S34-E36 PolarHBondContact O-N 3.23Å; E36-R290 VanDerWaalsContact O-CG 3.31Å; E36-R290 WeakPolarHBondContact O-CG 3.41Å; E36-A292 HydrophobicContact CB-CB 4.18Å; E36-A292 PolarHBondContact O-N 3.4Å; E36-A292 VanDerWaalsContact O-N 3.1Å
37	D	91.9	Very high	79.1	Confident	60 Å²	60	53.3 Å²	53.3	32%	0.321	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-93.4	0.4	178.8	-59.5	-42.4	0	0	0	113.3	P33 S34 P35 R290	P33-D37 HydrophobicContact CB-CB 4.24Å; S34-D37 PolarHBondContact O-N 3.19Å; S34-D37 PolarHBondContact OG-N 3.43Å; S34-D37 PolarHBondContact OG-OD2 3.32Å; P35-D37 VanDerWaalsContact C-N 3.26Å; P35-D37 PolarHBondContact O-N 2.93Å; D37-R290 IonicContact OD1-CZ 3.57Å; D37-R290 IonicContact OD1-NE 2.79Å; D37-R290 PolarHBondContact OD1-NE 3.28Å; D37-R290 IonicContact OD1-NH2 3.09Å; D37-R290 PolarHBondContact OD1-NH2 2.86Å
38	E	95.8	Very high	82	Confident	35 Å²	35	46.5 Å²	46.5	16%	0.164	31%	0.309	C	S	.	.			trans	-60.4	139.8	177.3	-71.5	177.6	166.3	0	0	111.3	P35 V40 R291 V304 R306	P35-E38 VanDerWaalsContact O-CB 3.3Å; P35-E38 WeakPolarHBondContact O-CB 3.29Å; P35-E38 VanDerWaalsContact O-CG 3.22Å; P35-E38 WeakPolarHBondContact O-CG 3.31Å; P35-E38 PolarHBondContact O-N 3.42Å; E38-V40 HydrophobicContact CB-CG1 4.44Å; E38-V40 PolarHBondContact O-N 3.02Å; E38-R291 HydrophobicContact CB-CB 4.31Å; E38-R291 PolarHBondContact O-N 3.01Å; E38-R291 IonicContact OE2-CZ 2.84Å; E38-R291 VanDerWaalsContact OE2-CZ 3.29Å; E38-R291 IonicContact OE2-NE 3.3Å; E38-R291 PolarHBondContact OE2-NE 2.89Å; E38-R291 IonicContact OE2-NH2 2.71Å; E38-R291 PolarHBondContact OE2-NH2 3.13Å; E38-V304 HydrophobicContact CB-CG1 4.04Å; E38-V304 HydrophobicContact CG-CG1 4.33Å; E38-R306 IonicContact OE1-CZ 2.68Å; E38-R306 IonicContact OE1-NH1 3.83Å; E38-R306 PolarHBondContact OE1-NH1 3.02Å; E38-R306 IonicContact OE1-NH2 3.79Å; E38-R306 PolarHBondContact OE1-NH2 2.99Å; E38-R306 IonicContact OE2-NH1 3.05Å; E38-R306 IonicContact OE2-NH2 3.52Å
39	V	98.4	Very high	84.7	Confident	2 Å²	2	41 Å²	41	1%	0.012	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.4	169	-178.6	0	0	0	0	108.2	A135 I138 R139 L288 L305	V39-A135 HydrophobicContact CB-CB 4.45Å; V39-A135 HydrophobicContact CG1-CB 3.82Å; V39-A135 HydrophobicContact CG2-CB 4.28Å; V39-I138 HydrophobicContact CG1-CD1 4.16Å; V39-I138 HydrophobicContact CG2-CB 4.18Å; V39-I138 HydrophobicContact CG2-CG2 3.93Å; V39-R139 HydrophobicContact CG2-CG 3.63Å; V39-L288 HydrophobicContact CG1-CB 4.48Å; V39-L288 HydrophobicContact CG1-CD2 3.86Å; V39-L305 HydrophobicContact CB-CB 4.47Å; V39-L305 PolarHBondContact O-N 2.93Å
40	V	98.7	Very high	87.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	148.7	179.5	-59.1	0	0	0	0	110.9	E38 L288 G289 R291 V294 V301 G303 V304	E38-V40 HydrophobicContact CB-CG1 4.44Å; E38-V40 PolarHBondContact O-N 3.02Å; V40-L288 CarbonylContact O-C 3.53Å; V40-L288 VanDerWaalsContact O-CA 3.27Å; V40-L288 WeakPolarHBondContact O-CA 3.27Å; V40-G289 WeakPolarHBondContact CG2-O 3.48Å; V40-G289 PolarHBondContact N-O 3.32Å; V40-G289 PolarHBondContact O-N 3.32Å; V40-R291 HydrophobicContact CG1-CB 3.97Å; V40-V294 HydrophobicContact CG2-CB 3.95Å; V40-V294 HydrophobicContact CG2-CG1 4.05Å; V40-V294 HydrophobicContact CG2-CG2 3.65Å; V40-V301 HydrophobicContact CB-CG1 4.03Å; V40-V301 HydrophobicContact CB-CG2 4.42Å; V40-V301 HydrophobicContact CG1-CG1 4.01Å; V40-V301 HydrophobicContact CG1-CG2 4.46Å; V40-V301 HydrophobicContact CG2-CG2 4.35Å; V40-G303 CarbonylContact C-O 3.39Å; V40-G303 WeakPolarHBondContact CA-O 3.45Å; V40-V304 HydrophobicContact CG1-CG1 4.47Å; V40-V304 HydrophobicContact CG1-CG2 4.26Å
41	V	98.8	Very high	90.1	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.6	167.4	177.3	0	0	0	0	107.2	V286 L288 L302 G303 L392 F420	V41-V286 HydrophobicContact CB-CG1 4.45Å; V41-V286 HydrophobicContact CG1-CG1 3.47Å; V41-V286 VanDerWaalsContact CG1-CG1 3.47Å; V41-V286 HydrophobicContact CG2-CG1 4.19Å; V41-L288 HydrophobicContact CG2-CD2 4.12Å; V41-L288 HydrophobicContact CG2-CG 4.43Å; V41-L302 HydrophobicContact CG1-CD2 4.5Å; V41-L302 WeakPolarHBondContact O-CA 3.45Å; V41-L302 WeakPolarHBondContact O-CB 3.46Å; V41-L302 PolarHBondContact O-N 2.79Å; V41-G303 PolarHBondContact N-O 2.93Å; V41-G303 PolarHBondContact O-N 3.37Å; V41-G303 VanDerWaalsContact O-N 3.16Å; V41-L392 HydrophobicContact CB-CD1 3.79Å; V41-L392 HydrophobicContact CG1-CD1 3.55Å; V41-L392 HydrophobicContact CG2-CD1 4.02Å; V41-F420 HydrophobicContact CG2-CD1 4.34Å; V41-F420 HydrophobicContact CG2-CE1 4.03Å
42	V	98.7	Very high	92.4	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-52.1	179.8	178.4	0	0	0	0	109.9	V77 L287 V294 L299 P300 L302	V42-V77 HydrophobicContact CG1-CG1 4.25Å; V42-L287 HydrophobicContact CB-CB 4.28Å; V42-L287 HydrophobicContact CB-CD2 3.85Å; V42-L287 HydrophobicContact CB-CG 3.91Å; V42-L287 HydrophobicContact CG1-CD2 3.84Å; V42-L287 HydrophobicContact CG1-CG 4.47Å; V42-L287 HydrophobicContact CG2-CD2 4.3Å; V42-L287 HydrophobicContact CG2-CG 4.17Å; V42-L287 PolarHBondContact N-O 2.67Å; V42-V294 HydrophobicContact CG2-CB 4.38Å; V42-V294 HydrophobicContact CG2-CG1 3.86Å; V42-V294 HydrophobicContact CG2-CG2 3.55Å; V42-L299 HydrophobicContact CG1-CB 3.91Å; V42-L299 HydrophobicContact CG1-CD1 4.35Å; V42-P300 WeakPolarHBondContact CA-O 3.41Å; V42-P300 HydrophobicContact CG1-CG 4.11Å; V42-P300 WeakPolarHBondContact CG1-O 3.4Å; V42-L302 WeakPolarHBondContact O-CB 3.21Å
43	H	98.7	Very high	94.1	Very high	23 Å²	23	33.6 Å²	33.6	11%	0.106	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	165.9	-174.5	-169.1	37.3	0	0	0	111.4	D76 V77 L287	H43-D76 IonicContact CD2-OD2 3.45Å; H43-D76 IonicContact CE1-OD2 2.67Å; H43-D76 WeakPolarHBondContact NE2-CB 3.32Å; H43-D76 IonicContact NE2-OD2 3.61Å; H43-D76 PolarHBondContact NE2-OD2 3.36Å; H43-V77 HydrophobicContact CB-CG1 3.69Å; H43-L287 PolarHBondContact O-N 3.29Å
44	G	98.8	Very high	95.6	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162	147.2	172.2	0	0	0	0	0	113.2	A285	G44-A285 CarbonylContact C-O 3.5Å; G44-A285 WeakPolarHBondContact CA-O 3.43Å
45	R	98.9	Very high	96.4	Very high	29 Å²	29	36 Å²	36	11%	0.109	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.9	178.2	-60.4	-65.5	-68.4	-82.3	9.1	109.8	A72 V73 D76 I224 A284 A285	R45-A72 HydrophobicContact CB-CB 4.42Å; R45-A72 HydrophobicContact CG-CB 4.17Å; R45-V73 HydrophobicContact CB-CG2 3.76Å; R45-V73 HydrophobicContact CG-CG2 3.77Å; R45-D76 VanDerWaalsContact CD-OD2 3.28Å; R45-D76 WeakPolarHBondContact CD-OD2 3.42Å; R45-D76 IonicContact CZ-OD2 2.99Å; R45-D76 IonicContact NE-OD2 3.17Å; R45-D76 IonicContact NH1-OD1 2.66Å; R45-D76 PolarHBondContact NH1-OD1 3.42Å; R45-D76 IonicContact NH1-OD2 3.36Å; R45-D76 PolarHBondContact NH1-OD2 2.65Å; R45-I224 PolarHBondContact NH2-O 3.47Å; R45-A284 CarbonylContact O-C 3.53Å; R45-A284 WeakPolarHBondContact O-CA 3.3Å; R45-A285 PolarHBondContact N-O 3.44Å; R45-A285 PolarHBondContact O-N 3.19Å
46	R	98.9	Very high	97.1	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	156.1	172.5	62.7	172.1	-171.9	95.8	-13	110.5	F220 E223 I224 V225 D246 A283 A284 R386	R46-F220 VanDerWaalsContact NH2-CD1 3.31Å; R46-E223 HydrophobicContact CG-CB 4.33Å; R46-E223 WeakPolarHBondContact CG-O 3.07Å; R46-E223 IonicContact CZ-OE1 3.51Å; R46-E223 PolarHBondContact N-O 2.84Å; R46-E223 IonicContact NE-OE1 2.76Å; R46-E223 PolarHBondContact NE-OE1 3.27Å; R46-E223 IonicContact NH2-OE1 3.47Å; R46-E223 PolarHBondContact NH2-OE1 3.3Å; R46-E223 VanDerWaalsContact NH2-OE1 3.15Å; R46-I224 HydrophobicContact CG-CG1 4.35Å; R46-I224 VanDerWaalsContact CZ-CG1 3.46Å; R46-I224 CarbonylContact O-C 3.58Å; R46-I224 VanDerWaalsContact O-CA 3.25Å; R46-I224 WeakPolarHBondContact O-CA 3.49Å; R46-V225 PolarHBondContact O-N 3.36Å; R46-D246 IonicContact CZ-OD1 2.94Å; R46-D246 IonicContact CZ-OD2 3.36Å; R46-D246 IonicContact NH1-OD1 2.84Å; R46-D246 PolarHBondContact NH1-OD1 2.9Å; R46-D246 IonicContact NH1-OD2 2.71Å; R46-D246 PolarHBondContact NH1-OD2 3.2Å; R46-D246 IonicContact NH2-OD1 3.33Å; R46-D246 IonicContact NH2-OD2 3.15Å; R46-D246 PolarHBondContact NH2-OD2 2.83Å; R46-A283 CarbonylContact C-O 3.49Å; R46-A283 WeakPolarHBondContact CA-O 3.24Å; R46-A284 HydrophobicContact CB-CB 3.86Å; R46-R386 HydrophobicContact CB-CG 4.43Å; R46-R386 VanDerWaalsContact CD-CG 3.5Å
47	T	98.9	Very high	97.5	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	167.6	161.5	63.9	0	0	0	0	109.1	V69 V225 V227 G282 A283	T47-V69 HydrophobicContact CG2-CG1 3.68Å; T47-V225 HydrophobicContact CG2-CG1 4.47Å; T47-V227 HydrophobicContact CG2-CG2 3.66Å; T47-G282 WeakPolarHBondContact OG1-CA 3.35Å; T47-A283 HydrophobicContact CG2-CB 4.12Å; T47-A283 PolarHBondContact N-O 2.8Å; T47-A283 PolarHBondContact OG1-N 2.74Å; T47-A283 PolarHBondContact OG1-O 3.32Å
48	A	98.8	Very high	97.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.126	C	C	.	.			trans	-55.9	164.9	151.5	0	0	0	0	0	109.8	F57 I224 V243 R245 D246	A48-F57 VanDerWaalsContact O-CE2 3.31Å; A48-F57 WeakPolarHBondContact O-CE2 3.49Å; A48-I224 HydrophobicContact CB-CD1 4.48Å; A48-I224 HydrophobicContact CB-CG2 4.38Å; A48-V243 HydrophobicContact CB-CG1 3.87Å; A48-R245 WeakPolarHBondContact CB-O 3.13Å; A48-D246 WeakPolarHBondContact CA-OD1 2.93Å
49	I	98.9	Very high	97.8	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	14%	0.135	C	C	.	.			trans	-104.9	118.8	172.2	-60.5	176.6	0	0	0	108.6	D246 E247 S280 L376 P379 R386	I49-D246 PolarHBondContact N-OD1 3.12Å; I49-E247 PolarHBondContact O-N 3.11Å; I49-S280 VanDerWaalsContact CG2-CB 3.43Å; I49-L376 VanDerWaalsContact CB-O 3.3Å; I49-L376 WeakPolarHBondContact CB-O 3.46Å; I49-L376 HydrophobicContact CD1-CB 4.26Å; I49-L376 WeakPolarHBondContact CG2-O 3.22Å; I49-P379 HydrophobicContact CD1-CG 4.33Å; I49-P379 HydrophobicContact CG1-CG 4.41Å; I49-P379 HydrophobicContact CG2-CG 4.25Å; I49-R386 HydrophobicContact CD1-CG 4.28Å
50	G	98.4	Very high	97.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	149.3	176.8	0	0	0	0	0	111.5	E247 S280 D281	G50-E247 VanDerWaalsContact CA-OE2 3.29Å; G50-E247 WeakPolarHBondContact CA-OE2 3.4Å; G50-S280 CarbonylContact O-C 3.56Å; G50-S280 WeakPolarHBondContact O-CA 3.35Å; G50-S280 VanDerWaalsContact O-CB 3.26Å; G50-S280 WeakPolarHBondContact O-CB 3.47Å; G50-S280 PolarHBondContact O-OG 3.46Å; G50-D281 PolarHBondContact N-O 3.23Å; G50-D281 PolarHBondContact O-N 3.47Å
51	K	98	Very high	97.8	Very high	60 Å²	60	30.9 Å²	30.9	26%	0.261	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	128.9	172.6	-71.2	173.1	67.5	-175.5	0	110	K53 G55 E247	K51-K53 PolarHBondContact O-N 2.84Å; K51-G55 WeakPolarHBondContact O-CA 3.42Å; K51-G55 PolarHBondContact O-N 3.41Å; K51-E247 HydrophobicContact CD-CB 4.26Å; K51-E247 WeakPolarHBondContact CD-O 3.01Å; K51-E247 HydrophobicContact CG-CB 4.07Å; K51-E247 PolarHBondContact N-OE2 2.96Å
52	A	97.4	Very high	97.8	Very high	16 Å²	16	31 Å²	31	13%	0.132	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	143.8	-178.7	0	0	0	0	0	111.8	K54 M154 S155 V279	A52-K54 PolarHBondContact O-N 2.91Å; A52-M154 HydrophobicContact CB-CB 4.01Å; A52-S155 WeakPolarHBondContact CA-OG 3.48Å; A52-V279 HydrophobicContact CB-CB 3.97Å; A52-V279 WeakPolarHBondContact CB-O 3.45Å; A52-V279 PolarHBondContact N-O 3.23Å
53	K	95.3	Very high	97.8	Very high	124 Å²	124	32.6 Å²	32.6	54%	0.539	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	-23.5	178.5	-51.2	-68.6	180	171.4	0	116.2	K51 K58 M154 S155	K51-K53 PolarHBondContact O-N 2.84Å; K53-K58 WeakPolarHBondContact O-CD 3.47Å; K53-M154 WeakPolarHBondContact CE-O 3.39Å; K53-S155 WeakPolarHBondContact CD-O 3.34Å; K53-S155 WeakPolarHBondContact CE-O 3.26Å; K53-S155 PolarHBondContact N-OG 2.92Å; K53-S155 PolarHBondContact NZ-O 2.95Å
54	K	94.3	Very high	97.8	Very high	187 Å²	187	36 Å²	36	81%	0.813	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.7	-12.4	-173.1	-63.2	-174.1	177.8	-174.2	0	113.9	A52	A52-K54 PolarHBondContact O-N 2.91Å
55	G	95.8	Very high	97.8	Very high	8 Å²	8	36 Å²	36	8%	0.082	18%	0.176	C	C	.	.	S	Bend	trans	-87.4	179.9	-178.6	0	0	0	0	0	113.2	K51 F57 K58 E247	K51-G55 WeakPolarHBondContact O-CA 3.42Å; K51-G55 PolarHBondContact O-N 3.41Å; G55-F57 PolarHBondContact O-N 3.16Å; G55-K58 WeakPolarHBondContact O-CB 3.39Å; G55-K58 WeakPolarHBondContact O-CG 3.3Å; G55-K58 PolarHBondContact O-N 3.07Å; G55-E247 WeakPolarHBondContact CA-OE2 3.19Å
56	S	96.9	Very high	97.8	Very high	27 Å²	27	34.6 Å²	34.6	19%	0.189	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18.5	-175.9	-62.2	0	0	0	0	114.1	V231 E247	S56-V231 WeakPolarHBondContact O-CG2 3.29Å; S56-E247 WeakPolarHBondContact CB-OE1 3.32Å; S56-E247 PolarHBondContact N-OE1 2.91Å; S56-E247 PolarHBondContact N-OE2 2.9Å; S56-E247 PolarHBondContact OG-OE1 2.85Å
57	F	98.1	Very high	97.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	8.1	177.8	-62.7	-34.8	0	0	0	114.1	A48 G55 D59 T60 L65 V227 V229 V243 D281	A48-F57 VanDerWaalsContact O-CE2 3.31Å; A48-F57 WeakPolarHBondContact O-CE2 3.49Å; G55-F57 PolarHBondContact O-N 3.16Å; F57-D59 PolarHBondContact O-N 3Å; F57-D59 VanDerWaalsContact O-N 3.12Å; F57-T60 PolarHBondContact O-N 3.33Å; F57-L65 HydrophobicContact CD1-CD2 3.75Å; F57-L65 HydrophobicContact CD2-CD2 4.07Å; F57-L65 HydrophobicContact CE1-CD2 3.82Å; F57-L65 HydrophobicContact CE2-CD2 4.14Å; F57-L65 HydrophobicContact CG-CD2 3.88Å; F57-L65 HydrophobicContact CZ-CD2 4.02Å; F57-V227 HydrophobicContact CE1-CB 3.99Å; F57-V227 HydrophobicContact CE1-CG1 4.26Å; F57-V227 HydrophobicContact CE1-CG2 4.49Å; F57-V227 HydrophobicContact CZ-CB 4.19Å; F57-V227 HydrophobicContact CZ-CG2 4.23Å; F57-V229 HydrophobicContact CD1-CG1 3.86Å; F57-V229 HydrophobicContact CE1-CG1 3.81Å; F57-V243 HydrophobicContact CD1-CG2 4.12Å; F57-V243 HydrophobicContact CE1-CB 3.64Å; F57-V243 HydrophobicContact CE1-CG1 3.95Å; F57-V243 HydrophobicContact CE1-CG2 3.54Å; F57-V243 HydrophobicContact CE2-CG1 4.27Å; F57-V243 HydrophobicContact CZ-CB 3.73Å; F57-V243 HydrophobicContact CZ-CG1 3.66Å; F57-V243 HydrophobicContact CZ-CG2 4.13Å; F57-D281 HydrophobicContact CB-CB 3.82Å; F57-D281 HydrophobicContact CD2-CB 4.27Å
58	K	96.9	Very high	97.8	Very high	49 Å²	49	36.4 Å²	36.4	21%	0.213	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-28.7	-174.4	71	178.2	-176.1	63.8	0	114.5	K53 G55 S155 V231 R232	K53-K58 WeakPolarHBondContact O-CD 3.47Å; G55-K58 WeakPolarHBondContact O-CB 3.39Å; G55-K58 WeakPolarHBondContact O-CG 3.3Å; G55-K58 PolarHBondContact O-N 3.07Å; K58-S155 WeakPolarHBondContact CA-OG 3.47Å; K58-V231 HydrophobicContact CG-CG1 4.42Å; K58-R232 WeakPolarHBondContact CE-O 3.37Å; K58-R232 PolarHBondContact NZ-O 3.28Å
59	D	96.8	Very high	97.8	Very high	65 Å²	65	36.4 Å²	36.4	35%	0.348	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	3.4	179.3	-53.3	-46.4	0	0	0	112.1	F57 V231 R232	F57-D59 PolarHBondContact O-N 3Å; F57-D59 VanDerWaalsContact O-N 3.12Å; D59-V231 WeakPolarHBondContact OD2-CA 3.48Å; D59-R232 PolarHBondContact OD2-N 2.9Å
60	T	98	Very high	97.8	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.012	19%	0.185	C	C	.	.			trans	-93.6	128.5	-177.4	-51.2	0	0	0	0	110	F57 E64 L65 L156 V229	F57-T60 PolarHBondContact O-N 3.33Å; T60-E64 HydrophobicContact CG2-CB 4.04Å; T60-L65 HydrophobicContact CG2-CD2 3.71Å; T60-L65 HydrophobicContact CG2-CG 3.93Å; T60-L156 WeakPolarHBondContact O-CD1 3.5Å; T60-V229 HydrophobicContact CG2-CG1 3.95Å; T60-V229 WeakPolarHBondContact OG1-CG1 3.36Å
61	T	98.5	Very high	97.8	Very high	53 Å²	53	38 Å²	38	33%	0.325	20%	0.195	S	C	.	.			trans	-75.9	149.4	178.7	51.6	0	0	0	0	111.1	D63 E64 L65 L156	T61-D63 VanDerWaalsContact C-N 3.25Å; T61-D63 WeakPolarHBondContact CB-OD1 3.49Å; T61-D63 PolarHBondContact O-N 3.13Å; T61-D63 PolarHBondContact OG1-OD1 3.08Å; T61-E64 PolarHBondContact O-N 2.97Å; T61-L65 PolarHBondContact O-N 3.43Å; T61-L156 HydrophobicContact CG2-CD1 4.06Å
62	P	98.6	Very high	97.8	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.032	18%	0.184	C	C	.	.	H	α-helix	trans	-66.4	-23.8	-176.8	24.6	-34.6	0	0	0	113.9	L65 L66 M101 V151	P62-L65 PolarHBondContact O-N 3.17Å; P62-L66 WeakPolarHBondContact O-CB 3.3Å; P62-L66 PolarHBondContact O-N 2.6Å; P62-M101 HydrophobicContact CB-CE 4.28Å; P62-M101 HydrophobicContact CB-CG 4.39Å; P62-M101 HydrophobicContact CB-SD 4.03Å; P62-M101 HydrophobicContact CG-CE 4.5Å; P62-M101 HydrophobicContact CG-CG 3.85Å; P62-M101 HydrophobicContact CG-SD 4.16Å; P62-V151 HydrophobicContact CB-CG2 3.8Å; P62-V151 WeakPolarHBondContact O-CG2 3.43Å
63	D	98.7	Very high	97.9	Very high	33 Å²	33	34.7 Å²	34.7	18%	0.176	18%	0.178	C	C	.	.	H	α-helix	trans	-66.5	-38.7	173.3	46.9	4.5	0	0	0	112.2	T61 S67 M101 V104 A105 L108	T61-D63 VanDerWaalsContact C-N 3.25Å; T61-D63 WeakPolarHBondContact CB-OD1 3.49Å; T61-D63 PolarHBondContact O-N 3.13Å; T61-D63 PolarHBondContact OG1-OD1 3.08Å; D63-S67 WeakPolarHBondContact O-CB 3.31Å; D63-S67 PolarHBondContact O-N 3.05Å; D63-M101 HydrophobicContact CB-CG 3.96Å; D63-M101 HydrophobicContact CB-SD 4.05Å; D63-V104 HydrophobicContact CB-CG1 4.24Å; D63-A105 HydrophobicContact CB-CB 3.97Å; D63-A105 WeakPolarHBondContact O-CB 3.32Å; D63-L108 HydrophobicContact CB-CD1 4.49Å
64	E	98.6	Very high	98.1	Very high	96 Å²	96	29.1 Å²	29.1	45%	0.449	15%	0.154	S	C	.	.	H	α-helix	trans	-64.3	-44.9	172.4	-68.7	-175.4	-179.8	0	0	111.8	T60 T61 L66 S67 A68	T60-E64 HydrophobicContact CG2-CB 4.04Å; T61-E64 PolarHBondContact O-N 2.97Å; E64-L66 PolarHBondContact O-N 2.68Å; E64-S67 PolarHBondContact O-N 3.39Å; E64-A68 PolarHBondContact O-N 3.03Å
65	L	98.9	Very high	98.3	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-44.6	177.3	-63.6	179.2	0	0	0	111.6	F57 T60 T61 P62 V151 V227 D281 A283	F57-L65 HydrophobicContact CD1-CD2 3.75Å; F57-L65 HydrophobicContact CD2-CD2 4.07Å; F57-L65 HydrophobicContact CE1-CD2 3.82Å; F57-L65 HydrophobicContact CE2-CD2 4.14Å; F57-L65 HydrophobicContact CG-CD2 3.88Å; F57-L65 HydrophobicContact CZ-CD2 4.02Å; T60-L65 HydrophobicContact CG2-CD2 3.71Å; T60-L65 HydrophobicContact CG2-CG 3.93Å; T61-L65 PolarHBondContact O-N 3.43Å; P62-L65 PolarHBondContact O-N 3.17Å; L65-V151 HydrophobicContact CB-CG2 4.3Å; L65-V227 HydrophobicContact CD2-CG1 4.4Å; L65-D281 HydrophobicContact CD1-CB 4.36Å; L65-A283 HydrophobicContact CB-CB 4.02Å; L65-A283 WeakPolarHBondContact O-CB 3.23Å
66	L	98.9	Very high	98.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.3	-42.2	178.2	-178.4	59.8	0	0	0	111.3	P62 E64 A68 V69 M70 V89 M101 A102 A105 C149 V151	P62-L66 WeakPolarHBondContact O-CB 3.3Å; P62-L66 PolarHBondContact O-N 2.6Å; E64-L66 PolarHBondContact O-N 2.68Å; L66-A68 VanDerWaalsContact C-N 3.33Å; L66-A68 PolarHBondContact O-N 3.03Å; L66-V69 HydrophobicContact CD1-CG2 4.32Å; L66-V69 WeakPolarHBondContact O-CG2 3.47Å; L66-V69 PolarHBondContact O-N 3.14Å; L66-M70 HydrophobicContact CD1-CE 3.79Å; L66-M70 HydrophobicContact CD1-CG 4.28Å; L66-M70 HydrophobicContact CD1-SD 4.38Å; L66-M70 HydrophobicContact CD2-CE 3.81Å; L66-M70 HydrophobicContact CD2-SD 4.49Å; L66-M70 HydrophobicContact CG-CE 3.69Å; L66-M70 HydrophobicContact CG-CG 4.35Å; L66-M70 HydrophobicContact CG-SD 3.96Å; L66-M70 WeakPolarHBondContact O-CG 3.28Å; L66-M70 PolarHBondContact O-N 2.77Å; L66-V89 HydrophobicContact CD1-CG1 4.23Å; L66-V89 HydrophobicContact CD2-CG1 3.73Å; L66-V89 HydrophobicContact CD2-CG2 4.09Å; L66-M101 HydrophobicContact CD2-SD 4.2Å; L66-A102 HydrophobicContact CD2-CB 4.38Å; L66-A105 HydrophobicContact CB-CB 3.87Å; L66-A105 HydrophobicContact CD2-CB 3.63Å; L66-A105 HydrophobicContact CG-CB 3.82Å; L66-C149 HydrophobicContact CD1-CB 3.57Å; L66-V151 HydrophobicContact CB-CB 4.24Å; L66-V151 HydrophobicContact CB-CG1 4.26Å; L66-V151 HydrophobicContact CB-CG2 4.28Å; L66-V151 HydrophobicContact CD1-CB 4.28Å; L66-V151 HydrophobicContact CD1-CG1 4.33Å; L66-V151 HydrophobicContact CD2-CG1 4.05Å; L66-V151 HydrophobicContact CG-CG1 4.47Å
67	S	98.9	Very high	98.5	Very high	15 Å²	15	30.6 Å²	30.6	11%	0.105	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-42.8	178.8	177.6	0	0	0	0	111.7	D63 E64 V69 M70 T71 S109	D63-S67 WeakPolarHBondContact O-CB 3.31Å; D63-S67 PolarHBondContact O-N 3.05Å; E64-S67 PolarHBondContact O-N 3.39Å; S67-V69 VanDerWaalsContact C-N 3.3Å; S67-V69 PolarHBondContact O-N 3.48Å; S67-M70 PolarHBondContact O-N 2.96Å; S67-T71 WeakPolarHBondContact O-CB 3.42Å; S67-T71 PolarHBondContact O-N 3.19Å; S67-T71 PolarHBondContact O-OG1 3.04Å; S67-T71 VanDerWaalsContact O-OG1 3.06Å; S67-S109 WeakPolarHBondContact CA-OG 3.27Å; S67-S109 VanDerWaalsContact CB-OG 3.3Å; S67-S109 WeakPolarHBondContact CB-OG 3.47Å; S67-S109 PolarHBondContact O-OG 3.31Å; S67-S109 PolarHBondContact OG-OG 3.2Å
68	A	98.9	Very high	98.5	Very high	24 Å²	24	34 Å²	34	20%	0.198	20%	0.198	C	C	.	.	H	α-helix	trans	-56.3	-41.2	178.6	0	0	0	0	0	113.3	E64 L66 A72 V227	E64-A68 PolarHBondContact O-N 3.03Å; L66-A68 VanDerWaalsContact C-N 3.33Å; L66-A68 PolarHBondContact O-N 3.03Å; A68-A72 VanDerWaalsContact O-CB 3.25Å; A68-A72 WeakPolarHBondContact O-CB 3.4Å; A68-A72 PolarHBondContact O-N 2.81Å; A68-V227 HydrophobicContact CB-CG1 4.37Å; A68-V227 HydrophobicContact CB-CG2 4.03Å
69	V	98.9	Very high	98.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-80.3	-33.7	179.6	-66.4	0	0	0	0	112.9	T47 L66 S67 V73 V225 A283 A285	T47-V69 HydrophobicContact CG2-CG1 3.68Å; L66-V69 HydrophobicContact CD1-CG2 4.32Å; L66-V69 WeakPolarHBondContact O-CG2 3.47Å; L66-V69 PolarHBondContact O-N 3.14Å; S67-V69 VanDerWaalsContact C-N 3.3Å; S67-V69 PolarHBondContact O-N 3.48Å; V69-V73 WeakPolarHBondContact O-CG2 3.44Å; V69-V73 PolarHBondContact O-N 3.4Å; V69-V73 VanDerWaalsContact O-N 3.13Å; V69-V225 HydrophobicContact CG1-CG1 3.73Å; V69-A283 HydrophobicContact CG1-CB 4.35Å; V69-A283 HydrophobicContact CG2-CB 3.77Å; V69-A285 HydrophobicContact CB-CB 4Å; V69-A285 HydrophobicContact CG2-CB 3.92Å
70	M	98.9	Very high	98.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-50.6	175.1	-74.4	-179.5	165.1	0	0	110.8	L66 S67 L74 V87 V89 F111 L147 C149	L66-M70 HydrophobicContact CD1-CE 3.79Å; L66-M70 HydrophobicContact CD1-CG 4.28Å; L66-M70 HydrophobicContact CD1-SD 4.38Å; L66-M70 HydrophobicContact CD2-CE 3.81Å; L66-M70 HydrophobicContact CD2-SD 4.49Å; L66-M70 HydrophobicContact CG-CE 3.69Å; L66-M70 HydrophobicContact CG-CG 4.35Å; L66-M70 HydrophobicContact CG-SD 3.96Å; L66-M70 WeakPolarHBondContact O-CG 3.28Å; L66-M70 PolarHBondContact O-N 2.77Å; S67-M70 PolarHBondContact O-N 2.96Å; M70-L74 PolarHBondContact O-N 2.83Å; M70-V87 HydrophobicContact CE-CG1 3.56Å; M70-V89 HydrophobicContact CE-CG2 3.82Å; M70-F111 HydrophobicContact CB-CE2 4.06Å; M70-F111 HydrophobicContact CB-CZ 4.45Å; M70-F111 HydrophobicContact SD-CE2 4.38Å; M70-L147 HydrophobicContact CB-CD2 4.19Å; M70-L147 HydrophobicContact CG-CD2 3.81Å; M70-C149 HydrophobicContact CE-CB 4.37Å
71	T	98.9	Very high	98.6	Very high	35 Å²	35	32.6 Å²	32.6	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-59.4	-50.1	177.2	-57.5	0	0	0	0	111	S67 V73 L74 E75 S109	S67-T71 WeakPolarHBondContact O-CB 3.42Å; S67-T71 PolarHBondContact O-N 3.19Å; S67-T71 PolarHBondContact O-OG1 3.04Å; S67-T71 VanDerWaalsContact O-OG1 3.06Å; T71-V73 PolarHBondContact O-N 2.89Å; T71-L74 PolarHBondContact O-N 2.79Å; T71-E75 VanDerWaalsContact CG2-CD 3.49Å; T71-E75 HydrophobicContact CG2-CG 4.04Å; T71-E75 WeakPolarHBondContact CG2-OE1 3.49Å; T71-E75 WeakPolarHBondContact O-CB 3.46Å; T71-E75 WeakPolarHBondContact O-CG 3.27Å; T71-E75 PolarHBondContact O-N 2.67Å; T71-S109 WeakPolarHBondContact OG1-CB 3.33Å
72	A	98.8	Very high	98.5	Very high	5 Å²	5	33.2 Å²	33.2	4%	0.041	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-39.5	-176	0	0	0	0	0	113.7	R45 A68 L74 D76 V225	R45-A72 HydrophobicContact CB-CB 4.42Å; R45-A72 HydrophobicContact CG-CB 4.17Å; A68-A72 VanDerWaalsContact O-CB 3.25Å; A68-A72 WeakPolarHBondContact O-CB 3.4Å; A68-A72 PolarHBondContact O-N 2.81Å; A72-L74 VanDerWaalsContact C-N 3.34Å; A72-L74 PolarHBondContact O-N 2.93Å; A72-D76 VanDerWaalsContact O-CB 3.31Å; A72-D76 WeakPolarHBondContact O-CB 3.26Å; A72-D76 PolarHBondContact O-N 2.87Å; A72-V225 HydrophobicContact CB-CB 4.04Å; A72-V225 HydrophobicContact CB-CG1 4.47Å; A72-V225 HydrophobicContact CB-CG2 3.77Å
73	V	98.8	Very high	98.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-42.8	178.1	168.5	0	0	0	0	111.3	R45 V69 T71 V77 L147 A285 L287	R45-V73 HydrophobicContact CB-CG2 3.76Å; R45-V73 HydrophobicContact CG-CG2 3.77Å; V69-V73 WeakPolarHBondContact O-CG2 3.44Å; V69-V73 PolarHBondContact O-N 3.4Å; V69-V73 VanDerWaalsContact O-N 3.13Å; T71-V73 PolarHBondContact O-N 2.89Å; V73-V77 WeakPolarHBondContact O-CG2 3.36Å; V73-L147 HydrophobicContact CB-CD1 4.49Å; V73-L147 HydrophobicContact CG1-CD1 3.94Å; V73-A285 HydrophobicContact CG2-CB 3.9Å; V73-L287 HydrophobicContact CG1-CB 3.61Å
74	L	98.7	Very high	98.5	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-73.1	-42.6	-178.3	-67	-178.8	0	0	0	112.3	M70 T71 A72 V77 G78 L79 P81 L84 F111	M70-L74 PolarHBondContact O-N 2.83Å; T71-L74 PolarHBondContact O-N 2.79Å; A72-L74 VanDerWaalsContact C-N 3.34Å; A72-L74 PolarHBondContact O-N 2.93Å; L74-V77 PolarHBondContact O-N 2.72Å; L74-G78 PolarHBondContact O-N 3.23Å; L74-L79 HydrophobicContact CD2-CB 4.24Å; L74-L79 HydrophobicContact CD2-CD2 4.04Å; L74-L79 HydrophobicContact CD2-CG 4.4Å; L74-L79 PolarHBondContact O-N 3.33Å; L74-P81 HydrophobicContact CD1-CB 3.78Å; L74-P81 HydrophobicContact CD1-CG 3.69Å; L74-L84 HydrophobicContact CD1-CD1 4.47Å; L74-L84 HydrophobicContact CD2-CD1 4.03Å; L74-F111 HydrophobicContact CD1-CE1 4.23Å; L74-F111 HydrophobicContact CD1-CE2 3.76Å; L74-F111 HydrophobicContact CD1-CZ 3.53Å
75	E	98.6	Very high	98.5	Very high	142 Å²	142	32.7 Å²	32.7	66%	0.664	20%	0.204	S	C	*	.	H	α-helix	trans	-61.8	-44.1	177	-74.5	-178.4	164	0	0	112	T71 V77 G78	T71-E75 VanDerWaalsContact CG2-CD 3.49Å; T71-E75 HydrophobicContact CG2-CG 4.04Å; T71-E75 WeakPolarHBondContact CG2-OE1 3.49Å; T71-E75 WeakPolarHBondContact O-CB 3.46Å; T71-E75 WeakPolarHBondContact O-CG 3.27Å; T71-E75 PolarHBondContact O-N 2.67Å; E75-V77 PolarHBondContact O-N 3Å; E75-G78 PolarHBondContact O-N 3.22Å; E75-G78 VanDerWaalsContact O-N 3.14Å
76	D	98.6	Very high	98.5	Very high	83 Å²	83	33.9 Å²	33.9	44%	0.444	21%	0.21	S	C	.	.	H	α-helix	trans	-59.8	-30.1	-178.7	-77.7	-13	0	0	0	113.4	H43 R45 A72	H43-D76 IonicContact CD2-OD2 3.45Å; H43-D76 IonicContact CE1-OD2 2.67Å; H43-D76 WeakPolarHBondContact NE2-CB 3.32Å; H43-D76 IonicContact NE2-OD2 3.61Å; H43-D76 PolarHBondContact NE2-OD2 3.36Å; R45-D76 VanDerWaalsContact CD-OD2 3.28Å; R45-D76 WeakPolarHBondContact CD-OD2 3.42Å; R45-D76 IonicContact CZ-OD2 2.99Å; R45-D76 IonicContact NE-OD2 3.17Å; R45-D76 IonicContact NH1-OD1 2.66Å; R45-D76 PolarHBondContact NH1-OD1 3.42Å; R45-D76 IonicContact NH1-OD2 3.36Å; R45-D76 PolarHBondContact NH1-OD2 2.65Å; A72-D76 VanDerWaalsContact O-CB 3.31Å; A72-D76 WeakPolarHBondContact O-CB 3.26Å; A72-D76 PolarHBondContact O-N 2.87Å
77	V	98.2	Very high	98.5	Very high	29 Å²	29	33.9 Å²	33.9	18%	0.176	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	3.7	-179.4	-55.3	0	0	0	0	113	V42 H43 V73 L74 E75 L79 L287 L299	V42-V77 HydrophobicContact CG1-CG1 4.25Å; H43-V77 HydrophobicContact CB-CG1 3.69Å; V73-V77 WeakPolarHBondContact O-CG2 3.36Å; L74-V77 PolarHBondContact O-N 2.72Å; E75-V77 PolarHBondContact O-N 3Å; V77-L79 VanDerWaalsContact C-N 3.26Å; V77-L79 HydrophobicContact CG2-CB 3.69Å; V77-L79 PolarHBondContact O-N 2.64Å; V77-L287 HydrophobicContact CG2-CD2 3.94Å; V77-L299 HydrophobicContact CB-CD2 3.94Å; V77-L299 HydrophobicContact CG2-CD2 4.19Å
78	G	98.1	Very high	98.5	Very high	71 Å²	71	33.1 Å²	33.1	73%	0.732	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	28.9	-180	0	0	0	0	0	114.4	L74 E75	L74-G78 PolarHBondContact O-N 3.23Å; E75-G78 PolarHBondContact O-N 3.22Å; E75-G78 VanDerWaalsContact O-N 3.14Å
79	L	98.1	Very high	98.5	Very high	12 Å²	12	32 Å²	32	6%	0.063	20%	0.196	C	C	.	.			trans	-95.4	127.5	-176.4	-173.7	70	0	0	0	110.9	L74 V77 Q83 L84 L145 L287 L297 L299	L74-L79 HydrophobicContact CD2-CB 4.24Å; L74-L79 HydrophobicContact CD2-CD2 4.04Å; L74-L79 HydrophobicContact CD2-CG 4.4Å; L74-L79 PolarHBondContact O-N 3.33Å; V77-L79 VanDerWaalsContact C-N 3.26Å; V77-L79 HydrophobicContact CG2-CB 3.69Å; V77-L79 PolarHBondContact O-N 2.64Å; L79-Q83 HydrophobicContact CD1-CB 4.15Å; L79-Q83 VanDerWaalsContact CD1-CD 3.49Å; L79-Q83 HydrophobicContact CD1-CG 4.29Å; L79-Q83 VanDerWaalsContact CD1-OE1 3.25Å; L79-L84 HydrophobicContact CD2-CD2 4.06Å; L79-L145 HydrophobicContact CD1-CD1 4.44Å; L79-L145 HydrophobicContact CD2-CD1 4.19Å; L79-L287 HydrophobicContact CD2-CD1 4.19Å; L79-L287 HydrophobicContact CD2-CD2 3.84Å; L79-L297 HydrophobicContact CD1-CD1 4.47Å; L79-L299 HydrophobicContact CD1-CD1 4.31Å
80	S	97.7	Very high	98.5	Very high	50 Å²	50	32 Å²	32	35%	0.35	20%	0.196	S	C	.	.			trans	-67.3	133.6	171.7	175.9	0	0	0	0	110.4	D82 Q83	S80-D82 WeakPolarHBondContact CB-OD1 3.28Å; S80-D82 PolarHBondContact O-N 3.07Å; S80-D82 PolarHBondContact OG-OD1 3.47Å; S80-Q83 PolarHBondContact O-N 3.36Å
81	P	97.5	Very high	98.5	Very high	25 Å²	25	32 Å²	32	16%	0.162	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-56.5	-26.9	178.7	-18.9	24.9	0	0	0	113.3	L74 Q83 L84 F111 V115	L74-P81 HydrophobicContact CD1-CB 3.78Å; L74-P81 HydrophobicContact CD1-CG 3.69Å; P81-Q83 PolarHBondContact O-N 2.99Å; P81-L84 WeakPolarHBondContact O-CB 3.22Å; P81-L84 PolarHBondContact O-N 2.91Å; P81-L84 VanDerWaalsContact O-N 3.13Å; P81-F111 HydrophobicContact CB-CB 4.18Å; P81-F111 HydrophobicContact CB-CD1 3.71Å; P81-F111 HydrophobicContact CB-CD2 4.03Å; P81-F111 HydrophobicContact CB-CE1 4.1Å; P81-F111 HydrophobicContact CB-CE2 4.36Å; P81-F111 HydrophobicContact CB-CG 3.68Å; P81-F111 HydrophobicContact CB-CZ 4.4Å; P81-F111 HydrophobicContact CG-CD2 4.48Å; P81-V115 WeakPolarHBondContact O-CG2 3.17Å
82	D	97.8	Very high	98.4	Very high	66 Å²	66	31.1 Å²	31.1	35%	0.353	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-70.6	-10.6	-174.9	93.9	-53.5	0	0	0	114.5	S80 P112 K114	S80-D82 WeakPolarHBondContact CB-OD1 3.28Å; S80-D82 PolarHBondContact O-N 3.07Å; S80-D82 PolarHBondContact OG-OD1 3.47Å; D82-P112 HydrophobicContact CB-CG 3.71Å; D82-K114 IonicContact OD2-NZ 3.83Å; D82-K114 PolarHBondContact OD2-NZ 2.87Å
83	Q	97.6	Very high	98.4	Very high	86 Å²	86	32.3 Å²	32.3	40%	0.402	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-84.1	-11.8	173.4	-59.5	-170.2	34.5	0	0	113	L79 S80 P81 L145	L79-Q83 HydrophobicContact CD1-CB 4.15Å; L79-Q83 VanDerWaalsContact CD1-CD 3.49Å; L79-Q83 HydrophobicContact CD1-CG 4.29Å; L79-Q83 VanDerWaalsContact CD1-OE1 3.25Å; S80-Q83 PolarHBondContact O-N 3.36Å; P81-Q83 PolarHBondContact O-N 2.99Å; Q83-L145 HydrophobicContact CB-CD1 4.45Å
84	L	98.6	Very high	98.3	Very high	7 Å²	7	33.3 Å²	33.3	4%	0.037	20%	0.2	C	C	.	.			trans	-78.8	132.9	179.3	-62.4	-178.1	0	0	0	110.9	L74 L79 P81 F111 V115 L145 L147 L287	L74-L84 HydrophobicContact CD1-CD1 4.47Å; L74-L84 HydrophobicContact CD2-CD1 4.03Å; L79-L84 HydrophobicContact CD2-CD2 4.06Å; P81-L84 WeakPolarHBondContact O-CB 3.22Å; P81-L84 PolarHBondContact O-N 2.91Å; P81-L84 VanDerWaalsContact O-N 3.13Å; L84-F111 HydrophobicContact CD1-CE1 3.55Å; L84-F111 HydrophobicContact CD1-CZ 4.08Å; L84-V115 HydrophobicContact CB-CG1 4.19Å; L84-L145 HydrophobicContact CD2-CB 3.77Å; L84-L147 HydrophobicContact CD1-CB 3.9Å; L84-L287 HydrophobicContact CD2-CD1 3.59Å
85	G	98.6	Very high	98.2	Very high	30 Å²	30	37.4 Å²	37.4	31%	0.309	23%	0.228	S	C	.	.	S	Bend	trans	-81.9	-25.7	176.5	0	0	0	0	0	113.2	P116 L145	G85-P116 VanDerWaalsContact O-CD 3.24Å; G85-P116 WeakPolarHBondContact O-CD 3.49Å; G85-P116 WeakPolarHBondContact O-CG 3.38Å; G85-L145 PolarHBondContact N-O 2.93Å
86	D	98.8	Very high	98	Very high	24 Å²	24	33.9 Å²	33.9	13%	0.128	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163	157	179.6	-155	-3.6	0	0	0	112.7	P116 Y118 I134 I143 G146 L147	D86-P116 HydrophobicContact CB-CG 4.37Å; D86-Y118 WeakPolarHBondContact OD1-CD1 3.48Å; D86-Y118 WeakPolarHBondContact OD2-CE1 3.36Å; D86-I134 HydrophobicContact CB-CD1 4.04Å; D86-I143 HydrophobicContact CB-CD1 3.91Å; D86-I143 HydrophobicContact CB-CG2 4.26Å; D86-G146 VanDerWaalsContact O-CA 3.26Å; D86-G146 WeakPolarHBondContact O-CA 3.21Å; D86-L147 PolarHBondContact O-N 3.3Å
87	V	98.9	Very high	98	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	117.7	174.9	-179	0	0	0	0	108.8	M70 V89 F111 V115 P116 V117 Y118 L147	M70-V87 HydrophobicContact CE-CG1 3.56Å; V87-V89 HydrophobicContact CG1-CG2 4.15Å; V87-F111 HydrophobicContact CG2-CD1 4.11Å; V87-F111 HydrophobicContact CG2-CE1 3.56Å; V87-F111 HydrophobicContact CG2-CZ 4.37Å; V87-V115 HydrophobicContact CG2-CG1 4.08Å; V87-P116 PolarHBondContact N-O 3.44Å; V87-P116 VanDerWaalsContact N-O 3.14Å; V87-V117 HydrophobicContact CB-CB 3.98Å; V87-V117 HydrophobicContact CB-CG2 3.89Å; V87-V117 HydrophobicContact CG1-CB 4.42Å; V87-V117 HydrophobicContact CG1-CG2 3.82Å; V87-V117 CarbonylContact O-C 3.48Å; V87-V117 VanDerWaalsContact O-CA 3.24Å; V87-V117 WeakPolarHBondContact O-CA 3.14Å; V87-V117 WeakPolarHBondContact O-CG2 3.4Å; V87-Y118 PolarHBondContact O-N 2.84Å; V87-L147 CarbonylContact C-O 3.49Å; V87-L147 WeakPolarHBondContact CA-O 3.35Å; V87-L147 HydrophobicContact CG1-CB 4.35Å; V87-L147 HydrophobicContact CG2-CB 4.2Å
88	C	98.9	Very high	98	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.7	176.5	-171.2	0	0	0	0	110.4	Y118 A130 I134 L147 C149	C88-Y118 HydrophobicContact CB-CD1 4.32Å; C88-Y118 HydrophobicContact CB-CE1 3.57Å; C88-Y118 HydrophobicContact CB-CE2 4.21Å; C88-Y118 WeakPolarHBondContact SG-CE2 3.48Å; C88-Y118 PolarHBondContact SG-OH 3.17Å; C88-Y118 VanDerWaalsContact SG-OH 3.37Å; C88-A130 HydrophobicContact CB-CB 4.03Å; C88-A130 VanDerWaalsContact SG-CA 3.57Å; C88-I134 HydrophobicContact CB-CD1 3.85Å; C88-I134 HydrophobicContact CB-CG1 3.74Å; C88-L147 PolarHBondContact N-O 2.85Å; C88-C149 PolarHBondContact O-N 2.73Å
89	V	98.9	Very high	98	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	117.9	-178	-175.3	0	0	0	0	111.3	L66 M70 V87 A102 V117 Y118 T119 V120 C149 V151	L66-V89 HydrophobicContact CD1-CG1 4.23Å; L66-V89 HydrophobicContact CD2-CG1 3.73Å; L66-V89 HydrophobicContact CD2-CG2 4.09Å; M70-V89 HydrophobicContact CE-CG2 3.82Å; V87-V89 HydrophobicContact CG1-CG2 4.15Å; V89-A102 HydrophobicContact CB-CB 4.08Å; V89-A102 HydrophobicContact CG1-CB 4.33Å; V89-A102 HydrophobicContact CG2-CB 3.88Å; V89-V117 HydrophobicContact CG2-CG2 4.05Å; V89-Y118 PolarHBondContact N-O 3.13Å; V89-T119 HydrophobicContact CB-CG2 4.08Å; V89-T119 CarbonylContact O-C 3.37Å; V89-T119 WeakPolarHBondContact O-CA 3.3Å; V89-T119 WeakPolarHBondContact O-CB 3.09Å; V89-V120 PolarHBondContact O-N 3.29Å; V89-C149 HydrophobicContact CB-CB 4.49Å; V89-C149 HydrophobicContact CG1-CB 4.34Å; V89-C149 HydrophobicContact CG2-CB 4.13Å; V89-V151 HydrophobicContact CG1-CG1 3.97Å
90	G	98.9	Very high	98	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	119	170.7	0	0	0	0	0	112.2	V120 C149 G150 V151	G90-V120 WeakPolarHBondContact CA-O 3.34Å; G90-C149 PolarHBondContact N-O 3.15Å; G90-G150 CarbonylContact O-C 3.55Å; G90-G150 VanDerWaalsContact O-CA 3.27Å; G90-G150 WeakPolarHBondContact O-CA 3.37Å; G90-V151 PolarHBondContact O-N 3.04Å
91	N	98.8	Very high	98.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	21%	0.213	C	C	.	.			trans	-147.7	149.6	172.3	177.4	-91.3	0	0	0	110.5	L93 Q94 A97 V120 N121 V151 E152	N91-L93 PolarHBondContact OD1-N 3.44Å; N91-Q94 WeakPolarHBondContact OD1-CB 3.4Å; N91-Q94 PolarHBondContact OD1-N 3Å; N91-A97 WeakPolarHBondContact CB-O 3.42Å; N91-V120 PolarHBondContact N-O 3.49Å; N91-N121 WeakPolarHBondContact O-CB 3.47Å; N91-V151 PolarHBondContact ND2-O 2.97Å; N91-E152 PolarHBondContact ND2-OE1 2.88Å
92	V	98.3	Very high	98.1	Very high	16 Å²	16	32 Å²	32	10%	0.097	21%	0.205	C	C	.	.	S	Bend	trans	-110.5	-49.6	-177.2	-172.8	0	0	0	0	112.3	N121 Q123 E152 L380	V92-N121 PolarHBondContact O-ND2 2.74Å; V92-Q123 WeakPolarHBondContact CG2-O 3.43Å; V92-E152 VanDerWaalsContact CB-OE2 3.29Å; V92-E152 WeakPolarHBondContact CB-OE2 3.09Å; V92-E152 PolarHBondContact N-OE2 2.79Å; V92-L380 HydrophobicContact CB-CB 4.21Å; V92-L380 HydrophobicContact CB-CD1 4.14Å; V92-L380 HydrophobicContact CG1-CD1 4.16Å; V92-L380 HydrophobicContact CG2-CB 3.78Å; V92-L380 HydrophobicContact CG2-CD1 4.48Å
93	L	97.5	Very high	98.2	Very high	30 Å²	30	32 Å²	32	16%	0.157	20%	0.2	C	C	.	.	S	Bend	trans	-96.2	-12	-162.4	-54.6	179.3	0	0	0	115.3	N91 E152 M154 R157 M159 L380	N91-L93 PolarHBondContact OD1-N 3.44Å; L93-E152 WeakPolarHBondContact CB-OE1 3.41Å; L93-E152 HydrophobicContact CD1-CG 4.3Å; L93-E152 HydrophobicContact CG-CG 4.48Å; L93-E152 PolarHBondContact N-OE1 2.78Å; L93-M154 HydrophobicContact CD1-CE 4.2Å; L93-M154 HydrophobicContact CD1-CG 3.99Å; L93-R157 HydrophobicContact CB-CB 3.59Å; L93-R157 HydrophobicContact CB-CG 4.28Å; L93-R157 HydrophobicContact CD1-CB 4.18Å; L93-M159 HydrophobicContact CD1-CG 4.19Å; L93-M159 HydrophobicContact CD2-CB 4.44Å; L93-M159 HydrophobicContact CD2-CG 3.64Å; L93-L380 HydrophobicContact CD1-CD1 4.1Å; L93-L380 HydrophobicContact CD2-CD1 3.96Å; L93-L380 HydrophobicContact CG-CD1 4Å
94	Q	97.3	Very high	98.2	Very high	21 Å²	21	30.6 Å²	30.6	10%	0.098	20%	0.197	C	C	.	.	S	Bend	trans	-73.9	145.5	175.6	-69.1	-67.4	-16.1	0	0	110.5	N91 G96 A97 G98 M101 R157	N91-Q94 WeakPolarHBondContact OD1-CB 3.4Å; N91-Q94 PolarHBondContact OD1-N 3Å; Q94-G96 PolarHBondContact O-N 2.77Å; Q94-A97 WeakPolarHBondContact O-CA 3.32Å; Q94-A97 PolarHBondContact O-N 3.16Å; Q94-G98 VanDerWaalsContact CB-CA 3.4Å; Q94-M101 HydrophobicContact CG-CE 4.41Å; Q94-R157 VanDerWaalsContact OE1-NH2 3.12Å
95	P	95.6	Very high	98.2	Very high	94 Å²	94	30.3 Å²	30.3	61%	0.61	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-50.9	135.3	169.8	-26.4	35.1	0	0	0	111.4	A97 G98	P95-A97 PolarHBondContact O-N 3.43Å; P95-G98 PolarHBondContact O-N 2.87Å
96	G	96	Very high	98.2	Very high	67 Å²	67	28.9 Å²	28.9	69%	0.691	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	58.2	33.5	-176.6	0	0	0	0	0	113.6	Q94 G98 A99	Q94-G96 PolarHBondContact O-N 2.77Å; G96-G98 PolarHBondContact O-N 2.66Å; G96-A99 PolarHBondContact O-N 2.86Å
97	A	97.4	Very high	98.2	Very high	16 Å²	16	32.4 Å²	32.4	13%	0.132	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	53.7	23	-172.9	0	0	0	0	0	113.8	N91 Q94 P95 T119 N121	N91-A97 WeakPolarHBondContact CB-O 3.42Å; Q94-A97 WeakPolarHBondContact O-CA 3.32Å; Q94-A97 PolarHBondContact O-N 3.16Å; P95-A97 PolarHBondContact O-N 3.43Å; A97-T119 VanDerWaalsContact O-CB 3.29Å; A97-T119 WeakPolarHBondContact O-CB 3.26Å; A97-T119 VanDerWaalsContact O-CG2 3.23Å; A97-T119 WeakPolarHBondContact O-CG2 3Å; A97-T119 PolarHBondContact O-OG1 3.23Å; A97-N121 HydrophobicContact CB-CB 3.94Å
98	G	98.1	Very high	98.2	Very high	3 Å²	3	37.3 Å²	37.3	3%	0.031	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	77.2	23	175.8	0	0	0	0	0	115.2	Q94 P95 G96 L100 M101 A102	Q94-G98 VanDerWaalsContact CB-CA 3.4Å; P95-G98 PolarHBondContact O-N 2.87Å; G96-G98 PolarHBondContact O-N 2.66Å; G98-L100 VanDerWaalsContact C-N 3.3Å; G98-L100 PolarHBondContact O-N 3.01Å; G98-M101 WeakPolarHBondContact O-CB 3.31Å; G98-M101 PolarHBondContact O-N 3.1Å; G98-M101 VanDerWaalsContact O-N 3.08Å; G98-A102 WeakPolarHBondContact O-CB 3.39Å; G98-A102 PolarHBondContact O-N 2.89Å
99	A	98.6	Very high	98.2	Very high	50 Å²	50	37.9 Å²	37.9	41%	0.413	23%	0.225	S	C	.	.	H	α-helix	trans	-52.7	-45.1	-179.1	0	0	0	0	0	113.4	G96 A102 R103 T119	G96-A99 PolarHBondContact O-N 2.86Å; A99-A102 PolarHBondContact O-N 3.33Å; A99-R103 PolarHBondContact O-N 2.9Å; A99-R103 VanDerWaalsContact O-N 3.1Å; A99-T119 HydrophobicContact CB-CG2 4.39Å
100	L	98.4	Very high	98.2	Very high	143 Å²	143	40.6 Å²	40.6	75%	0.749	25%	0.253	S	S	*	.	H	α-helix	trans	-62.9	-47.9	175.8	178.4	63	0	0	0	111.7	G98 A102 R103 V104	G98-L100 VanDerWaalsContact C-N 3.3Å; G98-L100 PolarHBondContact O-N 3.01Å; L100-A102 VanDerWaalsContact C-N 3.33Å; L100-A102 PolarHBondContact O-N 3.44Å; L100-R103 PolarHBondContact O-N 3.26Å; L100-R103 VanDerWaalsContact O-N 3.17Å; L100-V104 WeakPolarHBondContact O-CG2 3.44Å; L100-V104 PolarHBondContact O-N 3.36Å
101	M	98.6	Very high	98.1	Very high	20 Å²	20	40.8 Å²	40.8	10%	0.099	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-42.7	179.3	176.1	-74.8	-64.5	0	0	111.6	P62 D63 L66 Q94 G98 R103 V104 A105 V151	P62-M101 HydrophobicContact CB-CE 4.28Å; P62-M101 HydrophobicContact CB-CG 4.39Å; P62-M101 HydrophobicContact CB-SD 4.03Å; P62-M101 HydrophobicContact CG-CE 4.5Å; P62-M101 HydrophobicContact CG-CG 3.85Å; P62-M101 HydrophobicContact CG-SD 4.16Å; D63-M101 HydrophobicContact CB-CG 3.96Å; D63-M101 HydrophobicContact CB-SD 4.05Å; L66-M101 HydrophobicContact CD2-SD 4.2Å; Q94-M101 HydrophobicContact CG-CE 4.41Å; G98-M101 WeakPolarHBondContact O-CB 3.31Å; G98-M101 PolarHBondContact O-N 3.1Å; G98-M101 VanDerWaalsContact O-N 3.08Å; M101-R103 VanDerWaalsContact C-N 3.33Å; M101-R103 PolarHBondContact O-N 2.88Å; M101-V104 PolarHBondContact O-N 3.43Å; M101-A105 PolarHBondContact O-N 3.37Å; M101-V151 HydrophobicContact CE-CG1 3.55Å; M101-V151 HydrophobicContact SD-CG1 4.35Å
102	A	98.8	Very high	98.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-40.2	175.8	0	0	0	0	0	111.8	L66 V89 G98 A99 L100 A105 H106 V117 T119	L66-A102 HydrophobicContact CD2-CB 4.38Å; V89-A102 HydrophobicContact CB-CB 4.08Å; V89-A102 HydrophobicContact CG1-CB 4.33Å; V89-A102 HydrophobicContact CG2-CB 3.88Å; G98-A102 WeakPolarHBondContact O-CB 3.39Å; G98-A102 PolarHBondContact O-N 2.89Å; A99-A102 PolarHBondContact O-N 3.33Å; L100-A102 VanDerWaalsContact C-N 3.33Å; L100-A102 PolarHBondContact O-N 3.44Å; A102-A105 PolarHBondContact O-N 2.9Å; A102-H106 VanDerWaalsContact O-CB 3.26Å; A102-H106 WeakPolarHBondContact O-CB 3.43Å; A102-H106 PolarHBondContact O-N 3.12Å; A102-V117 HydrophobicContact CB-CG2 4.15Å; A102-T119 HydrophobicContact CB-CG2 3.74Å
103	R	98.8	Very high	98.1	Very high	64 Å²	64	48.6 Å²	48.6	24%	0.242	29%	0.292	C	S	.	.	H	α-helix	trans	-68	-35.5	176	-169.7	63.8	173.7	-179.9	-5.7	112.7	A99 L100 M101 H106 F107 E113 V115 V117	A99-R103 PolarHBondContact O-N 2.9Å; A99-R103 VanDerWaalsContact O-N 3.1Å; L100-R103 PolarHBondContact O-N 3.26Å; L100-R103 VanDerWaalsContact O-N 3.17Å; M101-R103 VanDerWaalsContact C-N 3.33Å; M101-R103 PolarHBondContact O-N 2.88Å; R103-H106 PolarHBondContact NH1-CE1 3.24Å; R103-H106 PolarHBondContact NH1-ND1 2.95Å; R103-H106 WeakPolarHBondContact O-CB 3.44Å; R103-F107 HydrophobicContact CG-CD2 4.14Å; R103-F107 HydrophobicContact CG-CE2 3.69Å; R103-F107 HydrophobicContact CG-CZ 4.45Å; R103-F107 VanDerWaalsContact NE-CZ 3.28Å; R103-F107 WeakPolarHBondContact O-CD2 3.48Å; R103-F107 PolarHBondContact O-N 3.12Å; R103-E113 PolarHBondContact NH2-O 3.19Å; R103-V115 PolarHBondContact NH1-O 3.04Å; R103-V117 HydrophobicContact CB-CG1 4.06Å; R103-V117 HydrophobicContact CG-CG1 4.27Å
104	V	98.8	Very high	98.1	Very high	58 Å²	58	53.6 Å²	53.6	35%	0.352	31%	0.313	S	S	.	.	H	α-helix	trans	-63.8	-51.6	172.7	172.7	0	0	0	0	110.2	D63 L100 M101 H106 F107 L108	D63-V104 HydrophobicContact CB-CG1 4.24Å; L100-V104 WeakPolarHBondContact O-CG2 3.44Å; L100-V104 PolarHBondContact O-N 3.36Å; M101-V104 PolarHBondContact O-N 3.43Å; V104-H106 VanDerWaalsContact C-N 3.27Å; V104-H106 PolarHBondContact O-N 2.87Å; V104-F107 PolarHBondContact O-N 2.87Å; V104-F107 VanDerWaalsContact O-N 3.12Å; V104-L108 HydrophobicContact CG1-CD1 3.9Å; V104-L108 HydrophobicContact CG1-CG 4.22Å; V104-L108 WeakPolarHBondContact O-CG 3.45Å; V104-L108 PolarHBondContact O-N 2.86Å
105	A	98.8	Very high	98.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-56.9	-40.3	177.4	0	0	0	0	0	113	D63 L66 M101 A102 L108 S109	D63-A105 HydrophobicContact CB-CB 3.97Å; D63-A105 WeakPolarHBondContact O-CB 3.32Å; L66-A105 HydrophobicContact CB-CB 3.87Å; L66-A105 HydrophobicContact CD2-CB 3.63Å; L66-A105 HydrophobicContact CG-CB 3.82Å; M101-A105 PolarHBondContact O-N 3.37Å; A102-A105 PolarHBondContact O-N 2.9Å; A105-L108 PolarHBondContact O-N 2.81Å; A105-S109 WeakPolarHBondContact O-CB 3.39Å; A105-S109 PolarHBondContact O-N 2.92Å; A105-S109 PolarHBondContact O-OG 3.34Å
106	H	98.6	Very high	98.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.2	-49.3	175	174.7	-88.2	0	0	0	111.5	A102 R103 V104 S109 F111 P112 V115 V117	A102-H106 VanDerWaalsContact O-CB 3.26Å; A102-H106 WeakPolarHBondContact O-CB 3.43Å; A102-H106 PolarHBondContact O-N 3.12Å; R103-H106 PolarHBondContact NH1-CE1 3.24Å; R103-H106 PolarHBondContact NH1-ND1 2.95Å; R103-H106 WeakPolarHBondContact O-CB 3.44Å; V104-H106 VanDerWaalsContact C-N 3.27Å; V104-H106 PolarHBondContact O-N 2.87Å; H106-S109 PolarHBondContact O-N 2.87Å; H106-F111 AromaticContact CD2-CD1 3.43Å; H106-F111 VanDerWaalsContact CD2-CD1 3.43Å; H106-F111 WeakPolarHBondContact CD2-CD1 3.31Å; H106-F111 AromaticContact CD2-CG 3.48Å; H106-F111 VanDerWaalsContact CD2-CG 3.48Å; H106-F111 WeakPolarHBondContact CD2-CG 3.25Å; H106-F111 WeakPolarHBondContact CE1-CB 3.5Å; H106-F111 AromaticContact CE1-CG 3.89Å; H106-F111 AromaticContact CG-CG 3.89Å; H106-F111 WeakPolarHBondContact ND1-CB 3.43Å; H106-F111 WeakPolarHBondContact NE2-CB 3.18Å; H106-F111 AromaticContact NE2-CD1 3.3Å; H106-F111 VanDerWaalsContact NE2-CD1 3.3Å; H106-F111 WeakPolarHBondContact NE2-CD1 3.25Å; H106-F111 AromaticContact NE2-CG 3.51Å; H106-F111 WeakPolarHBondContact O-CB 3.21Å; H106-F111 VanDerWaalsContact O-CD2 3.24Å; H106-F111 WeakPolarHBondContact O-CD2 3.41Å; H106-F111 PolarHBondContact O-N 3.19Å; H106-P112 PolarHBondContact CE1-O 3.08Å; H106-V115 PolarHBondContact CE1-O 2.88Å; H106-V115 VanDerWaalsContact CE1-O 3.31Å; H106-V115 PolarHBondContact NE2-O 2.97Å; H106-V117 HydrophobicContact CB-CG1 4.33Å
107	F	98.8	Very high	98.5	Very high	98 Å²	98	49.3 Å²	49.3	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-69.8	-37.5	176.3	-69	-50.2	0	0	0	113.5	R103 V104 S109 G110 F111 E113	R103-F107 HydrophobicContact CG-CD2 4.14Å; R103-F107 HydrophobicContact CG-CE2 3.69Å; R103-F107 HydrophobicContact CG-CZ 4.45Å; R103-F107 VanDerWaalsContact NE-CZ 3.28Å; R103-F107 WeakPolarHBondContact O-CD2 3.48Å; R103-F107 PolarHBondContact O-N 3.12Å; V104-F107 PolarHBondContact O-N 2.87Å; V104-F107 VanDerWaalsContact O-N 3.12Å; F107-S109 PolarHBondContact O-N 3.49Å; F107-G110 PolarHBondContact O-N 3.13Å; F107-F111 WeakPolarHBondContact CD1-O 3.13Å; F107-E113 HydrophobicContact CE1-CB 4.08Å; F107-E113 HydrophobicContact CZ-CB 4.25Å
108	L	98.6	Very high	98.6	Very high	104 Å²	104	52 Å²	52	55%	0.545	28%	0.281	S	S	.	.	H	α-helix	trans	-60.3	-25.7	173.2	-68.3	176.3	0	0	0	112.3	D63 V104 A105 G110	D63-L108 HydrophobicContact CB-CD1 4.49Å; V104-L108 HydrophobicContact CG1-CD1 3.9Å; V104-L108 HydrophobicContact CG1-CG 4.22Å; V104-L108 WeakPolarHBondContact O-CG 3.45Å; V104-L108 PolarHBondContact O-N 2.86Å; A105-L108 PolarHBondContact O-N 2.81Å; L108-G110 VanDerWaalsContact C-N 3.33Å
109	S	98.6	Very high	98.6	Very high	12 Å²	12	53.1 Å²	53.1	8%	0.084	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	9.9	177.7	-46	0	0	0	0	113.6	S67 T71 A105 H106 F107 F111	S67-S109 WeakPolarHBondContact CA-OG 3.27Å; S67-S109 VanDerWaalsContact CB-OG 3.3Å; S67-S109 WeakPolarHBondContact CB-OG 3.47Å; S67-S109 PolarHBondContact O-OG 3.31Å; S67-S109 PolarHBondContact OG-OG 3.2Å; T71-S109 WeakPolarHBondContact OG1-CB 3.33Å; A105-S109 WeakPolarHBondContact O-CB 3.39Å; A105-S109 PolarHBondContact O-N 2.92Å; A105-S109 PolarHBondContact O-OG 3.34Å; H106-S109 PolarHBondContact O-N 2.87Å; F107-S109 PolarHBondContact O-N 3.49Å; S109-F111 PolarHBondContact O-N 3.41Å
110	G	98.1	Very high	98.6	Very high	56 Å²	56	51.8 Å²	51.8	58%	0.577	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	12.9	175.1	0	0	0	0	0	115.4	F107 L108	F107-G110 PolarHBondContact O-N 3.13Å; L108-G110 VanDerWaalsContact C-N 3.33Å
111	F	98.6	Very high	98.6	Very high	5 Å²	5	48.4 Å²	48.4	2%	0.022	26%	0.256	C	S	.	.			trans	-71.4	136.5	175.9	-70.8	-118.3	0	0	0	110.8	M70 L74 P81 L84 V87 H106 F107 S109 V115 L147	M70-F111 HydrophobicContact CB-CE2 4.06Å; M70-F111 HydrophobicContact CB-CZ 4.45Å; M70-F111 HydrophobicContact SD-CE2 4.38Å; L74-F111 HydrophobicContact CD1-CE1 4.23Å; L74-F111 HydrophobicContact CD1-CE2 3.76Å; L74-F111 HydrophobicContact CD1-CZ 3.53Å; P81-F111 HydrophobicContact CB-CB 4.18Å; P81-F111 HydrophobicContact CB-CD1 3.71Å; P81-F111 HydrophobicContact CB-CD2 4.03Å; P81-F111 HydrophobicContact CB-CE1 4.1Å; P81-F111 HydrophobicContact CB-CE2 4.36Å; P81-F111 HydrophobicContact CB-CG 3.68Å; P81-F111 HydrophobicContact CB-CZ 4.4Å; P81-F111 HydrophobicContact CG-CD2 4.48Å; L84-F111 HydrophobicContact CD1-CE1 3.55Å; L84-F111 HydrophobicContact CD1-CZ 4.08Å; V87-F111 HydrophobicContact CG2-CD1 4.11Å; V87-F111 HydrophobicContact CG2-CE1 3.56Å; V87-F111 HydrophobicContact CG2-CZ 4.37Å; H106-F111 AromaticContact CD2-CD1 3.43Å; H106-F111 VanDerWaalsContact CD2-CD1 3.43Å; H106-F111 WeakPolarHBondContact CD2-CD1 3.31Å; H106-F111 AromaticContact CD2-CG 3.48Å; H106-F111 VanDerWaalsContact CD2-CG 3.48Å; H106-F111 WeakPolarHBondContact CD2-CG 3.25Å; H106-F111 WeakPolarHBondContact CE1-CB 3.5Å; H106-F111 AromaticContact CE1-CG 3.89Å; H106-F111 AromaticContact CG-CG 3.89Å; H106-F111 WeakPolarHBondContact ND1-CB 3.43Å; H106-F111 WeakPolarHBondContact NE2-CB 3.18Å; H106-F111 AromaticContact NE2-CD1 3.3Å; H106-F111 VanDerWaalsContact NE2-CD1 3.3Å; H106-F111 WeakPolarHBondContact NE2-CD1 3.25Å; H106-F111 AromaticContact NE2-CG 3.51Å; H106-F111 WeakPolarHBondContact O-CB 3.21Å; H106-F111 VanDerWaalsContact O-CD2 3.24Å; H106-F111 WeakPolarHBondContact O-CD2 3.41Å; H106-F111 PolarHBondContact O-N 3.19Å; F107-F111 WeakPolarHBondContact CD1-O 3.13Å; S109-F111 PolarHBondContact O-N 3.41Å; F111-V115 HydrophobicContact CD1-CB 4.39Å; F111-V115 HydrophobicContact CD1-CG1 3.97Å; F111-L147 HydrophobicContact CZ-CD2 3.87Å
112	P	98.3	Very high	98.6	Very high	35 Å²	35	51.5 Å²	51.5	23%	0.227	27%	0.267	C	S	.	.			trans	-74.3	157.5	176.3	31.8	-34.3	0	0	0	111.2	D82 H106 K114 V115	D82-P112 HydrophobicContact CB-CG 3.71Å; H106-P112 PolarHBondContact CE1-O 3.08Å; P112-K114 HydrophobicContact CB-CG 4.19Å; P112-K114 HydrophobicContact CG-CG 3.93Å; P112-K114 PolarHBondContact O-N 2.92Å; P112-K114 VanDerWaalsContact O-N 3.11Å; P112-V115 HydrophobicContact CG-CG2 3.93Å; P112-V115 PolarHBondContact O-N 3.22Å; P112-V115 VanDerWaalsContact O-N 3.09Å
113	E	98.1	Very high	98.6	Very high	145 Å²	145	54.6 Å²	54.6	68%	0.678	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.3	-177.4	66.6	-83.4	-166.9	0	0	114	R103 F107 V115	R103-E113 PolarHBondContact NH2-O 3.19Å; F107-E113 HydrophobicContact CE1-CB 4.08Å; F107-E113 HydrophobicContact CZ-CB 4.25Å; E113-V115 VanDerWaalsContact C-N 3.27Å; E113-V115 PolarHBondContact O-N 2.54Å
114	K	98.1	Very high	98.6	Very high	135 Å²	135	51.7 Å²	51.7	59%	0.587	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.8	177.4	69.2	174.6	-178.8	176.2	0	113.7	D82 P112	D82-K114 IonicContact OD2-NZ 3.83Å; D82-K114 PolarHBondContact OD2-NZ 2.87Å; P112-K114 HydrophobicContact CB-CG 4.19Å; P112-K114 HydrophobicContact CG-CG 3.93Å; P112-K114 PolarHBondContact O-N 2.92Å; P112-K114 VanDerWaalsContact O-N 3.11Å
115	V	98.8	Very high	98.5	Very high	3 Å²	3	49 Å²	49	2%	0.018	25%	0.254	C	S	.	.	S	Bend	trans	-81.3	122.4	177.3	179.2	0	0	0	0	107.9	P81 L84 V87 R103 H106 F111 P112 E113	P81-V115 WeakPolarHBondContact O-CG2 3.17Å; L84-V115 HydrophobicContact CB-CG1 4.19Å; V87-V115 HydrophobicContact CG2-CG1 4.08Å; R103-V115 PolarHBondContact NH1-O 3.04Å; H106-V115 PolarHBondContact CE1-O 2.88Å; H106-V115 VanDerWaalsContact CE1-O 3.31Å; H106-V115 PolarHBondContact NE2-O 2.97Å; F111-V115 HydrophobicContact CD1-CB 4.39Å; F111-V115 HydrophobicContact CD1-CG1 3.97Å; P112-V115 HydrophobicContact CG-CG2 3.93Å; P112-V115 PolarHBondContact O-N 3.22Å; P112-V115 VanDerWaalsContact O-N 3.09Å; E113-V115 VanDerWaalsContact C-N 3.27Å; E113-V115 PolarHBondContact O-N 2.54Å
116	P	98.8	Very high	98.6	Very high	60 Å²	60	49 Å²	49	39%	0.39	25%	0.254	S	S	.	.			trans	-77.9	157.4	179.2	30.8	-31.5	0	0	0	111.4	G85 D86 V87	G85-P116 VanDerWaalsContact O-CD 3.24Å; G85-P116 WeakPolarHBondContact O-CD 3.49Å; G85-P116 WeakPolarHBondContact O-CG 3.38Å; D86-P116 HydrophobicContact CB-CG 4.37Å; V87-P116 PolarHBondContact N-O 3.44Å; V87-P116 VanDerWaalsContact N-O 3.14Å
117	V	98.9	Very high	98.6	Very high	28 Å²	28	49 Å²	49	17%	0.17	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	140.3	171.3	60.7	0	0	0	0	109.5	V87 V89 A102 R103 H106	V87-V117 HydrophobicContact CB-CB 3.98Å; V87-V117 HydrophobicContact CB-CG2 3.89Å; V87-V117 HydrophobicContact CG1-CB 4.42Å; V87-V117 HydrophobicContact CG1-CG2 3.82Å; V87-V117 CarbonylContact O-C 3.48Å; V87-V117 VanDerWaalsContact O-CA 3.24Å; V87-V117 WeakPolarHBondContact O-CA 3.14Å; V87-V117 WeakPolarHBondContact O-CG2 3.4Å; V89-V117 HydrophobicContact CG2-CG2 4.05Å; A102-V117 HydrophobicContact CB-CG2 4.15Å; R103-V117 HydrophobicContact CB-CG1 4.06Å; R103-V117 HydrophobicContact CG-CG1 4.27Å; H106-V117 HydrophobicContact CB-CG1 4.33Å
118	Y	98.9	Very high	98.6	Very high	73 Å²	73	44.3 Å²	44.3	29%	0.286	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	171.1	173.7	73.4	-75.2	0	0	0	110.8	D86 V87 C88 V89 N133	D86-Y118 WeakPolarHBondContact OD1-CD1 3.48Å; D86-Y118 WeakPolarHBondContact OD2-CE1 3.36Å; V87-Y118 PolarHBondContact O-N 2.84Å; C88-Y118 HydrophobicContact CB-CD1 4.32Å; C88-Y118 HydrophobicContact CB-CE1 3.57Å; C88-Y118 HydrophobicContact CB-CE2 4.21Å; C88-Y118 WeakPolarHBondContact SG-CE2 3.48Å; C88-Y118 PolarHBondContact SG-OH 3.17Å; C88-Y118 VanDerWaalsContact SG-OH 3.37Å; V89-Y118 PolarHBondContact N-O 3.13Å; Y118-N133 WeakPolarHBondContact OH-CB 3.31Å
119	T	98.9	Very high	98.6	Very high	27 Å²	27	40.1 Å²	40.1	17%	0.166	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	154.9	179.8	52.8	0	0	0	0	111.7	V89 A97 A99 A102	V89-T119 HydrophobicContact CB-CG2 4.08Å; V89-T119 CarbonylContact O-C 3.37Å; V89-T119 WeakPolarHBondContact O-CA 3.3Å; V89-T119 WeakPolarHBondContact O-CB 3.09Å; A97-T119 VanDerWaalsContact O-CB 3.29Å; A97-T119 WeakPolarHBondContact O-CB 3.26Å; A97-T119 VanDerWaalsContact O-CG2 3.23Å; A97-T119 WeakPolarHBondContact O-CG2 3Å; A97-T119 PolarHBondContact O-OG1 3.23Å; A99-T119 HydrophobicContact CB-CG2 4.39Å; A102-T119 HydrophobicContact CB-CG2 3.74Å
120	V	98.9	Very high	98.6	Very high	21 Å²	21	39.6 Å²	39.6	13%	0.127	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.8	173.9	66.2	0	0	0	0	110	V89 G90 N91 Q129 A130	V89-V120 PolarHBondContact O-N 3.29Å; G90-V120 WeakPolarHBondContact CA-O 3.34Å; N91-V120 PolarHBondContact N-O 3.49Å; V120-Q129 HydrophobicContact CG1-CB 4.33Å; V120-Q129 HydrophobicContact CG1-CG 4.32Å; V120-Q129 HydrophobicContact CG2-CB 4.43Å; V120-Q129 HydrophobicContact CG2-CG 3.67Å; V120-A130 HydrophobicContact CG1-CB 3.95Å
121	N	98.6	Very high	98.6	Very high	72 Å²	72	37 Å²	37	39%	0.385	18%	0.181	S	C	.	.			trans	-122.3	108.9	172.3	-171.5	-13.4	0	0	0	109.9	N91 V92 A97 Q123 S126	N91-N121 WeakPolarHBondContact O-CB 3.47Å; V92-N121 PolarHBondContact O-ND2 2.74Å; A97-N121 HydrophobicContact CB-CB 3.94Å; N121-Q123 PolarHBondContact OD1-N 2.94Å; N121-S126 WeakPolarHBondContact CA-OG 3.47Å
122	R	98.6	Very high	98.6	Very high	85 Å²	85	37.8 Å²	37.8	32%	0.321	19%	0.185	S	C	.	.			trans	-126.2	50.7	162.8	-163.8	-175	-66.1	-79.1	-0.9	109	C124 S125 S126 Q129 I410 M414	R122-C124 PolarHBondContact O-N 3.41Å; R122-S125 WeakPolarHBondContact CD-OG 3.49Å; R122-S125 PolarHBondContact O-N 3Å; R122-S125 VanDerWaalsContact O-N 3.15Å; R122-S125 PolarHBondContact O-OG 3.29Å; R122-S126 PolarHBondContact N-OG 3Å; R122-Q129 HydrophobicContact CB-CB 4.25Å; R122-Q129 HydrophobicContact CB-CG 4.28Å; R122-I410 HydrophobicContact CG-CD1 4.34Å; R122-I410 HydrophobicContact CG-CG2 4.33Å; R122-I410 WeakPolarHBondContact O-CG2 3.41Å; R122-M414 HydrophobicContact CG-CE 4.44Å; R122-M414 HydrophobicContact CG-SD 4.37Å
123	Q	98.1	Very high	98.7	Very high	65 Å²	65	38.2 Å²	38.2	30%	0.304	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	48.8	-131	179.2	-49	-70.7	8.1	0	0	112.1	V92 N121 S125 S126 I410	V92-Q123 WeakPolarHBondContact CG2-O 3.43Å; N121-Q123 PolarHBondContact OD1-N 2.94Å; Q123-S125 PolarHBondContact O-N 3.16Å; Q123-S126 PolarHBondContact N-OG 3.47Å; Q123-S126 WeakPolarHBondContact O-CB 3.48Å; Q123-S126 PolarHBondContact O-N 3.33Å; Q123-S126 PolarHBondContact O-OG 3.13Å; Q123-I410 HydrophobicContact CB-CG2 3.7Å; Q123-I410 HydrophobicContact CG-CG2 4.17Å
124	C	97.9	Very high	98.7	Very high	4 Å²	4	31.3 Å²	31.3	3%	0.027	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-59.2	-17.5	-175.7	-49.8	0	0	0	0	114.5	R122 C409	R122-C124 PolarHBondContact O-N 3.41Å; C124-C409 WeakPolarHBondContact CB-O 3.41Å
125	S	98.7	Very high	98.7	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-97.3	4.3	178	76.6	0	0	0	0	114	R122 Q123 G127 L128 Q129 M408 I410	R122-S125 WeakPolarHBondContact CD-OG 3.49Å; R122-S125 PolarHBondContact O-N 3Å; R122-S125 VanDerWaalsContact O-N 3.15Å; R122-S125 PolarHBondContact O-OG 3.29Å; Q123-S125 PolarHBondContact O-N 3.16Å; S125-G127 VanDerWaalsContact C-N 3.28Å; S125-G127 PolarHBondContact O-N 2.97Å; S125-G127 VanDerWaalsContact O-N 3.16Å; S125-L128 CarbonylContact O-C 3.59Å; S125-L128 WeakPolarHBondContact O-CA 3.22Å; S125-L128 PolarHBondContact O-N 2.71Å; S125-Q129 PolarHBondContact O-N 3.24Å; S125-M408 VanDerWaalsContact CB-SD 3.58Å; S125-I410 WeakPolarHBondContact OG-CD1 3.5Å
126	S	98.9	Very high	98.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-52.9	-41.5	-171.3	-62.5	0	0	0	0	113.7	N121 R122 Q123 L128 Q129 A130	N121-S126 WeakPolarHBondContact CA-OG 3.47Å; R122-S126 PolarHBondContact N-OG 3Å; Q123-S126 PolarHBondContact N-OG 3.47Å; Q123-S126 WeakPolarHBondContact O-CB 3.48Å; Q123-S126 PolarHBondContact O-N 3.33Å; Q123-S126 PolarHBondContact O-OG 3.13Å; S126-L128 PolarHBondContact O-N 2.71Å; S126-Q129 PolarHBondContact O-N 2.93Å; S126-A130 PolarHBondContact O-N 2.82Å
127	G	98.8	Very high	98.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-66.5	-33.9	176.9	0	0	0	0	0	113.9	S125 G381	S125-G127 VanDerWaalsContact C-N 3.28Å; S125-G127 PolarHBondContact O-N 2.97Å; S125-G127 VanDerWaalsContact O-N 3.16Å; G127-G381 WeakPolarHBondContact CA-O 3.41Å; G127-G381 PolarHBondContact N-O 2.8Å
128	L	98.9	Very high	98.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-73.6	-39.5	172.4	-178.4	61.8	0	0	0	110.3	S125 S126 A130 L131 L132 V388 V406 M408 A416 A418	S125-L128 CarbonylContact O-C 3.59Å; S125-L128 WeakPolarHBondContact O-CA 3.22Å; S125-L128 PolarHBondContact O-N 2.71Å; S126-L128 PolarHBondContact O-N 2.71Å; L128-A130 VanDerWaalsContact C-N 3.27Å; L128-A130 PolarHBondContact O-N 2.81Å; L128-L131 WeakPolarHBondContact O-CB 3.4Å; L128-L131 PolarHBondContact O-N 3.47Å; L128-L131 VanDerWaalsContact O-N 3.1Å; L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 2.83Å; L128-V388 HydrophobicContact CD1-CG2 4Å; L128-V406 HydrophobicContact CD1-CG1 4.48Å; L128-V406 HydrophobicContact CD2-CG1 4.18Å; L128-M408 HydrophobicContact CB-CE 4.36Å; L128-M408 HydrophobicContact CB-SD 4.23Å; L128-M408 HydrophobicContact CD2-CE 4Å; L128-M408 HydrophobicContact CD2-SD 3.64Å; L128-A416 HydrophobicContact CD2-CB 4.23Å; L128-A418 HydrophobicContact CD1-CB 3.86Å; L128-A418 HydrophobicContact CD2-CB 4.24Å
129	Q	98.9	Very high	98.6	Very high	17 Å²	17	26.6 Å²	26.6	8%	0.079	14%	0.136	C	C	.	.	H	α-helix	trans	-61.6	-36.9	176.8	-174	62.1	58.3	0	0	111.8	V120 R122 S125 S126 L131 L132 N133	V120-Q129 HydrophobicContact CG1-CB 4.33Å; V120-Q129 HydrophobicContact CG1-CG 4.32Å; V120-Q129 HydrophobicContact CG2-CB 4.43Å; V120-Q129 HydrophobicContact CG2-CG 3.67Å; R122-Q129 HydrophobicContact CB-CB 4.25Å; R122-Q129 HydrophobicContact CB-CG 4.28Å; S125-Q129 PolarHBondContact O-N 3.24Å; S126-Q129 PolarHBondContact O-N 2.93Å; Q129-L131 VanDerWaalsContact C-N 3.29Å; Q129-L131 PolarHBondContact O-N 2.77Å; Q129-L132 PolarHBondContact O-N 2.85Å; Q129-N133 PolarHBondContact NE2-OD1 2.91Å; Q129-N133 VanDerWaalsContact O-CG 3.29Å; Q129-N133 PolarHBondContact O-N 3.07Å; Q129-N133 PolarHBondContact O-OD1 3.16Å
130	A	98.9	Very high	98.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-44	173.5	0	0	0	0	0	111.4	C88 V120 S126 L128 N133 I134 A148 C149	C88-A130 HydrophobicContact CB-CB 4.03Å; C88-A130 VanDerWaalsContact SG-CA 3.57Å; V120-A130 HydrophobicContact CG1-CB 3.95Å; S126-A130 PolarHBondContact O-N 2.82Å; L128-A130 VanDerWaalsContact C-N 3.27Å; L128-A130 PolarHBondContact O-N 2.81Å; A130-N133 PolarHBondContact O-N 3.19Å; A130-I134 WeakPolarHBondContact O-CG1 3.35Å; A130-I134 PolarHBondContact O-N 3.39Å; A130-A148 HydrophobicContact CB-CB 4.34Å; A130-C149 WeakPolarHBondContact CB-O 3.37Å
131	L	98.9	Very high	98.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-62.1	-44.6	174.5	-173	151.3	0	0	0	111.9	L128 Q129 N133 I134 A135 A148 V286 L288 L305 V388 F420	L128-L131 WeakPolarHBondContact O-CB 3.4Å; L128-L131 PolarHBondContact O-N 3.47Å; L128-L131 VanDerWaalsContact O-N 3.1Å; Q129-L131 VanDerWaalsContact C-N 3.29Å; Q129-L131 PolarHBondContact O-N 2.77Å; L131-N133 VanDerWaalsContact C-N 3.31Å; L131-N133 PolarHBondContact O-N 2.89Å; L131-I134 PolarHBondContact O-N 2.99Å; L131-A135 VanDerWaalsContact O-CB 3.3Å; L131-A135 WeakPolarHBondContact O-CB 3.33Å; L131-A135 PolarHBondContact O-N 3.32Å; L131-A148 HydrophobicContact CB-CB 3.84Å; L131-A148 HydrophobicContact CG-CB 4.43Å; L131-V286 HydrophobicContact CD1-CB 4.24Å; L131-V286 HydrophobicContact CD1-CG1 3.88Å; L131-L288 HydrophobicContact CD1-CD1 4.26Å; L131-L288 HydrophobicContact CD1-CD2 4.1Å; L131-L288 HydrophobicContact CD2-CD2 3.89Å; L131-L288 HydrophobicContact CG-CD1 3.92Å; L131-L288 HydrophobicContact CG-CD2 3.65Å; L131-L288 HydrophobicContact CG-CG 4.37Å; L131-L305 HydrophobicContact CD2-CD1 4.49Å; L131-L305 HydrophobicContact CD2-CD2 4.18Å; L131-V388 HydrophobicContact CD1-CB 4.41Å; L131-V388 HydrophobicContact CD1-CG1 3.9Å; L131-V388 HydrophobicContact CD1-CG2 4.08Å; L131-F420 HydrophobicContact CD1-CE1 4.33Å; L131-F420 HydrophobicContact CD1-CZ 4.11Å; L131-F420 HydrophobicContact CD2-CE1 4.22Å; L131-F420 HydrophobicContact CD2-CZ 3.98Å
132	L	98.8	Very high	98.4	Very high	22 Å²	22	31.3 Å²	31.3	12%	0.115	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-35.7	178.1	-61.1	-170.8	0	0	0	112.5	L128 Q129 G136 L305 S308 V310 A418	L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 2.83Å; Q129-L132 PolarHBondContact O-N 2.85Å; L132-G136 PolarHBondContact O-N 3.44Å; L132-L305 HydrophobicContact CD2-CD2 4.32Å; L132-S308 VanDerWaalsContact CD2-CB 3.41Å; L132-V310 HydrophobicContact CD1-CG2 4.38Å; L132-A418 HydrophobicContact CD2-CB 4.38Å
133	N	98.9	Very high	98.4	Very high	44 Å²	44	28.1 Å²	28.1	24%	0.235	17%	0.173	C	C	.	.	H	α-helix	trans	-69	-46.5	176.6	-68.7	-1.7	0	0	0	111.5	Y118 Q129 A130 L131 A135 G136 S137	Y118-N133 WeakPolarHBondContact OH-CB 3.31Å; Q129-N133 PolarHBondContact NE2-OD1 2.91Å; Q129-N133 VanDerWaalsContact O-CG 3.29Å; Q129-N133 PolarHBondContact O-N 3.07Å; Q129-N133 PolarHBondContact O-OD1 3.16Å; A130-N133 PolarHBondContact O-N 3.19Å; L131-N133 VanDerWaalsContact C-N 3.31Å; L131-N133 PolarHBondContact O-N 2.89Å; N133-A135 VanDerWaalsContact C-N 3.31Å; N133-A135 PolarHBondContact O-N 2.91Å; N133-G136 WeakPolarHBondContact O-CA 3.44Å; N133-G136 PolarHBondContact O-N 2.88Å; N133-S137 PolarHBondContact O-N 2.98Å; N133-S137 PolarHBondContact O-OG 3.47Å
134	I	98.9	Very high	98.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.8	-44.1	175.4	-68.3	-64	0	0	0	110.5	D86 C88 A130 L131 G136 S137 I138 I143 A148 L288	D86-I134 HydrophobicContact CB-CD1 4.04Å; C88-I134 HydrophobicContact CB-CD1 3.85Å; C88-I134 HydrophobicContact CB-CG1 3.74Å; A130-I134 WeakPolarHBondContact O-CG1 3.35Å; A130-I134 PolarHBondContact O-N 3.39Å; L131-I134 PolarHBondContact O-N 2.99Å; I134-G136 VanDerWaalsContact C-N 3.27Å; I134-G136 PolarHBondContact O-N 2.98Å; I134-S137 PolarHBondContact O-N 3.16Å; I134-I138 HydrophobicContact CG2-CD1 3.94Å; I134-I138 WeakPolarHBondContact O-CG1 3.01Å; I134-I138 PolarHBondContact O-N 3.45Å; I134-I143 HydrophobicContact CD1-CD1 4.22Å; I134-I143 HydrophobicContact CG2-CD1 4.32Å; I134-A148 HydrophobicContact CB-CB 4.48Å; I134-A148 HydrophobicContact CG1-CB 4.14Å; I134-L288 HydrophobicContact CB-CD1 4.35Å; I134-L288 HydrophobicContact CG2-CB 3.97Å; I134-L288 HydrophobicContact CG2-CD1 3.91Å; I134-L288 HydrophobicContact CG2-CG 4.47Å
135	A	98.7	Very high	98.4	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-59.7	-38.2	173.9	0	0	0	0	0	112.4	V39 L131 N133 I138 R139 L305	V39-A135 HydrophobicContact CB-CB 4.45Å; V39-A135 HydrophobicContact CG1-CB 3.82Å; V39-A135 HydrophobicContact CG2-CB 4.28Å; L131-A135 VanDerWaalsContact O-CB 3.3Å; L131-A135 WeakPolarHBondContact O-CB 3.33Å; L131-A135 PolarHBondContact O-N 3.32Å; N133-A135 VanDerWaalsContact C-N 3.31Å; N133-A135 PolarHBondContact O-N 2.91Å; A135-I138 PolarHBondContact O-N 2.98Å; A135-R139 WeakPolarHBondContact O-CB 3.43Å; A135-R139 VanDerWaalsContact O-CG 3.3Å; A135-R139 WeakPolarHBondContact O-CG 3.14Å; A135-R139 PolarHBondContact O-N 3.23Å; A135-L305 HydrophobicContact CB-CD2 3.53Å
136	G	98.4	Very high	98.4	Very high	35 Å²	35	28.9 Å²	28.9	36%	0.361	18%	0.177	S	C	.	.	H	α-helix	trans	-60.5	-48.1	172.9	0	0	0	0	0	112.4	L132 N133 I134 I138 R139 S140	L132-G136 PolarHBondContact O-N 3.44Å; N133-G136 WeakPolarHBondContact O-CA 3.44Å; N133-G136 PolarHBondContact O-N 2.88Å; I134-G136 VanDerWaalsContact C-N 3.27Å; I134-G136 PolarHBondContact O-N 2.98Å; G136-I138 VanDerWaalsContact C-N 3.31Å; G136-I138 PolarHBondContact O-N 2.83Å; G136-R139 PolarHBondContact O-N 2.83Å; G136-S140 PolarHBondContact O-N 2.96Å; G136-S140 PolarHBondContact O-OG 3.3Å
137	S	98.7	Very high	98.4	Very high	26 Å²	26	28.9 Å²	28.9	18%	0.182	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-34.1	177.4	-59.5	0	0	0	0	113.2	N133 I134 S140 G141 S142 I143	N133-S137 PolarHBondContact O-N 2.98Å; N133-S137 PolarHBondContact O-OG 3.47Å; I134-S137 PolarHBondContact O-N 3.16Å; S137-S140 WeakPolarHBondContact CA-OG 3.44Å; S137-S140 PolarHBondContact O-OG 3.42Å; S137-S140 VanDerWaalsContact O-OG 3.06Å; S137-G141 PolarHBondContact O-N 3.15Å; S137-S142 WeakPolarHBondContact O-CB 3.32Å; S137-S142 PolarHBondContact O-N 3.17Å; S137-I143 PolarHBondContact O-N 2.9Å
138	I	98.6	Very high	98.5	Very high	7 Å²	7	28.9 Å²	28.9	4%	0.036	18%	0.177	C	C	.	.	H	α-helix	trans	-67.9	-48.3	173.5	-67.4	164.3	0	0	0	110.3	V39 I134 A135 G136 S140 G141 I143 L288 R290	V39-I138 HydrophobicContact CG1-CD1 4.16Å; V39-I138 HydrophobicContact CG2-CB 4.18Å; V39-I138 HydrophobicContact CG2-CG2 3.93Å; I134-I138 HydrophobicContact CG2-CD1 3.94Å; I134-I138 WeakPolarHBondContact O-CG1 3.01Å; I134-I138 PolarHBondContact O-N 3.45Å; A135-I138 PolarHBondContact O-N 2.98Å; G136-I138 VanDerWaalsContact C-N 3.31Å; G136-I138 PolarHBondContact O-N 2.83Å; I138-S140 VanDerWaalsContact C-N 3.3Å; I138-S140 PolarHBondContact O-N 3.21Å; I138-G141 PolarHBondContact O-N 3.43Å; I138-I143 WeakPolarHBondContact CA-O 3.46Å; I138-I143 HydrophobicContact CG1-CD1 4.23Å; I138-I143 HydrophobicContact CG1-CG1 3.79Å; I138-L288 HydrophobicContact CD1-CB 3.86Å; I138-R290 HydrophobicContact CG2-CB 3.81Å
139	R	96.7	Very high	98.5	Very high	132 Å²	132	28.9 Å²	28.9	50%	0.498	18%	0.177	S	C	.	.	H	α-helix	trans	-63.6	-32.3	179.3	-73.7	171.8	-179.9	178.2	-1.2	113.2	V39 A135 G136 G141	V39-R139 HydrophobicContact CG2-CG 3.63Å; A135-R139 WeakPolarHBondContact O-CB 3.43Å; A135-R139 VanDerWaalsContact O-CG 3.3Å; A135-R139 WeakPolarHBondContact O-CG 3.14Å; A135-R139 PolarHBondContact O-N 3.23Å; G136-R139 PolarHBondContact O-N 2.83Å; R139-G141 PolarHBondContact O-N 3.47Å
140	S	97.1	Very high	98.4	Very high	79 Å²	79	28 Å²	28	55%	0.552	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-4.1	174.8	63.3	0	0	0	0	113.5	G136 S137 I138 S142	G136-S140 PolarHBondContact O-N 2.96Å; G136-S140 PolarHBondContact O-OG 3.3Å; S137-S140 WeakPolarHBondContact CA-OG 3.44Å; S137-S140 PolarHBondContact O-OG 3.42Å; S137-S140 VanDerWaalsContact O-OG 3.06Å; I138-S140 VanDerWaalsContact C-N 3.3Å; I138-S140 PolarHBondContact O-N 3.21Å; S140-S142 PolarHBondContact O-N 3.37Å; S140-S142 PolarHBondContact OG-OG 3Å
141	G	96.6	Very high	98.4	Very high	52 Å²	52	28 Å²	28	54%	0.536	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	73	12.4	-176.4	0	0	0	0	0	114.1	S137 I138 R139	S137-G141 PolarHBondContact O-N 3.15Å; I138-G141 PolarHBondContact O-N 3.43Å; R139-G141 PolarHBondContact O-N 3.47Å
142	S	98	Very high	98.4	Very high	87 Å²	87	28 Å²	28	61%	0.608	17%	0.173	S	C	*	.	S	Bend	trans	-73.5	-30.9	-179.5	-56.5	0	0	0	0	112.4	S137 S140	S137-S142 WeakPolarHBondContact O-CB 3.32Å; S137-S142 PolarHBondContact O-N 3.17Å; S140-S142 PolarHBondContact O-N 3.37Å; S140-S142 PolarHBondContact OG-OG 3Å
143	I	98.6	Very high	98.4	Very high	18 Å²	18	27 Å²	27	9%	0.092	17%	0.167	C	C	.	.			trans	-141.2	158.2	175.2	66.7	-178.4	0	0	0	110	D86 I134 S137 I138	D86-I143 HydrophobicContact CB-CD1 3.91Å; D86-I143 HydrophobicContact CB-CG2 4.26Å; I134-I143 HydrophobicContact CD1-CD1 4.22Å; I134-I143 HydrophobicContact CG2-CD1 4.32Å; S137-I143 PolarHBondContact O-N 2.9Å; I138-I143 WeakPolarHBondContact CA-O 3.46Å; I138-I143 HydrophobicContact CG1-CD1 4.23Å; I138-I143 HydrophobicContact CG1-CG1 3.79Å
144	Q	98.4	Very high	98.4	Very high	78 Å²	78	25.5 Å²	25.5	36%	0.364	16%	0.159	S	C	.	.	S	Bend	trans	-99.8	-32.8	173	-61.8	-57.2	-43.6	0	0	112.6	G289 R290 A293	Q144-G289 CarbonylContact O-C 3.56Å; Q144-G289 WeakPolarHBondContact O-CA 3.22Å; Q144-R290 PolarHBondContact O-N 3.38Å; Q144-A293 HydrophobicContact CB-CB 3.94Å
145	L	98.7	Very high	98.3	Very high	7 Å²	7	25.8 Å²	25.8	4%	0.037	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.6	178.1	-64.4	172.3	0	0	0	109.5	L79 Q83 L84 G85 L288 V294 L297	L79-L145 HydrophobicContact CD1-CD1 4.44Å; L79-L145 HydrophobicContact CD2-CD1 4.19Å; Q83-L145 HydrophobicContact CB-CD1 4.45Å; L84-L145 HydrophobicContact CD2-CB 3.77Å; G85-L145 PolarHBondContact N-O 2.93Å; L145-L288 WeakPolarHBondContact CA-O 3.5Å; L145-V294 HydrophobicContact CD2-CG2 3.89Å; L145-L297 HydrophobicContact CD1-CD1 3.55Å
146	G	98.8	Very high	98.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	158.3	174.4	0	0	0	0	0	112.5	D86 L288	D86-G146 VanDerWaalsContact O-CA 3.26Å; D86-G146 WeakPolarHBondContact O-CA 3.21Å; G146-L288 PolarHBondContact N-O 2.8Å; G146-L288 PolarHBondContact O-N 3.16Å
147	L	98.9	Very high	98.1	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.4	179.6	-166.3	70.7	0	0	0	110.2	M70 V73 L84 D86 V87 C88 F111 A285 L287	M70-L147 HydrophobicContact CB-CD2 4.19Å; M70-L147 HydrophobicContact CG-CD2 3.81Å; V73-L147 HydrophobicContact CB-CD1 4.49Å; V73-L147 HydrophobicContact CG1-CD1 3.94Å; L84-L147 HydrophobicContact CD1-CB 3.9Å; D86-L147 PolarHBondContact O-N 3.3Å; V87-L147 CarbonylContact C-O 3.49Å; V87-L147 WeakPolarHBondContact CA-O 3.35Å; V87-L147 HydrophobicContact CG1-CB 4.35Å; V87-L147 HydrophobicContact CG2-CB 4.2Å; C88-L147 PolarHBondContact N-O 2.85Å; F111-L147 HydrophobicContact CZ-CD2 3.87Å; L147-A285 HydrophobicContact CD1-CB 4.29Å; L147-A285 HydrophobicContact CG-CB 4.48Å; L147-L287 HydrophobicContact CD1-CB 4.08Å; L147-L287 HydrophobicContact CD1-CD1 4.45Å
148	A	98.9	Very high	97.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119	173.7	0	0	0	0	0	110	A130 L131 I134 A285 V286 L288	A130-A148 HydrophobicContact CB-CB 4.34Å; L131-A148 HydrophobicContact CB-CB 3.84Å; L131-A148 HydrophobicContact CG-CB 4.43Å; I134-A148 HydrophobicContact CB-CB 4.48Å; I134-A148 HydrophobicContact CG1-CB 4.14Å; A148-A285 CarbonylContact O-C 3.59Å; A148-A285 WeakPolarHBondContact O-CA 3.41Å; A148-V286 PolarHBondContact N-O 3.47Å; A148-V286 PolarHBondContact O-N 2.93Å; A148-L288 HydrophobicContact CB-CD1 3.58Å
149	C	98.9	Very high	96.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	164.5	-178.9	-53.5	0	0	0	0	111.7	L66 M70 C88 V89 G90 A130 A284 A285	L66-C149 HydrophobicContact CD1-CB 3.57Å; M70-C149 HydrophobicContact CE-CB 4.37Å; C88-C149 PolarHBondContact O-N 2.73Å; V89-C149 HydrophobicContact CB-CB 4.49Å; V89-C149 HydrophobicContact CG1-CB 4.34Å; V89-C149 HydrophobicContact CG2-CB 4.13Å; G90-C149 PolarHBondContact N-O 3.15Å; A130-C149 WeakPolarHBondContact CB-O 3.37Å; C149-A284 CarbonylContact C-O 3.56Å; C149-A284 WeakPolarHBondContact CA-O 3.49Å; C149-A285 HydrophobicContact CB-CB 4.49Å
150	G	98.9	Very high	95.9	Very high	0 Å²	0	37 Å²	37	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	140.9	163.5	0	0	0	0	0	110.1	G90 A283 A284 G381 C382	G90-G150 CarbonylContact O-C 3.55Å; G90-G150 VanDerWaalsContact O-CA 3.27Å; G90-G150 WeakPolarHBondContact O-CA 3.37Å; G150-A283 CarbonylContact O-C 3.58Å; G150-A283 WeakPolarHBondContact O-CA 3.46Å; G150-A284 PolarHBondContact N-O 2.71Å; G150-A284 PolarHBondContact O-N 3.17Å; G150-G381 VanDerWaalsContact CA-O 3.29Å; G150-G381 WeakPolarHBondContact CA-O 3.47Å; G150-C382 VanDerWaalsContact C-CA 3.48Å
151	V	98.9	Very high	95.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	145.1	177.8	62.8	0	0	0	0	111	P62 L65 L66 V89 G90 N91 M101 G282 A283	P62-V151 HydrophobicContact CB-CG2 3.8Å; P62-V151 WeakPolarHBondContact O-CG2 3.43Å; L65-V151 HydrophobicContact CB-CG2 4.3Å; L66-V151 HydrophobicContact CB-CB 4.24Å; L66-V151 HydrophobicContact CB-CG1 4.26Å; L66-V151 HydrophobicContact CB-CG2 4.28Å; L66-V151 HydrophobicContact CD1-CB 4.28Å; L66-V151 HydrophobicContact CD1-CG1 4.33Å; L66-V151 HydrophobicContact CD2-CG1 4.05Å; L66-V151 HydrophobicContact CG-CG1 4.47Å; V89-V151 HydrophobicContact CG1-CG1 3.97Å; G90-V151 PolarHBondContact O-N 3.04Å; N91-V151 PolarHBondContact ND2-O 2.97Å; M101-V151 HydrophobicContact CE-CG1 3.55Å; M101-V151 HydrophobicContact SD-CG1 4.35Å; V151-G282 WeakPolarHBondContact CA-O 3.31Å; V151-A283 HydrophobicContact CB-CB 3.95Å; V151-A283 HydrophobicContact CG2-CB 3.79Å
152	E	98.8	Very high	94.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	142.7	168.3	-156.4	63.6	-98.2	0	0	111.2	N91 V92 L93 M154 D281 G282 P379 L380 G381	N91-E152 PolarHBondContact ND2-OE1 2.88Å; V92-E152 VanDerWaalsContact CB-OE2 3.29Å; V92-E152 WeakPolarHBondContact CB-OE2 3.09Å; V92-E152 PolarHBondContact N-OE2 2.79Å; L93-E152 WeakPolarHBondContact CB-OE1 3.41Å; L93-E152 HydrophobicContact CD1-CG 4.3Å; L93-E152 HydrophobicContact CG-CG 4.48Å; L93-E152 PolarHBondContact N-OE1 2.78Å; E152-M154 HydrophobicContact CG-CG 3.79Å; E152-D281 WeakPolarHBondContact O-CA 3.49Å; E152-G282 PolarHBondContact N-O 2.96Å; E152-G282 PolarHBondContact O-N 2.92Å; E152-P379 HydrophobicContact CB-CB 3.95Å; E152-L380 HydrophobicContact CG-CB 4.14Å; E152-G381 PolarHBondContact OE2-N 3.05Å
153	S	98.4	Very high	94.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	91.2	167.6	178.2	0	0	0	0	109	S155 L156 R157 D281	S153-S155 PolarHBondContact O-N 3.03Å; S153-L156 PolarHBondContact O-N 2.85Å; S153-L156 WeakPolarHBondContact OG-CG 3.45Å; S153-L156 PolarHBondContact OG-N 2.86Å; S153-R157 PolarHBondContact O-N 2.99Å; S153-D281 VanDerWaalsContact C-OD1 3.3Å; S153-D281 VanDerWaalsContact CA-OD1 3.29Å; S153-D281 WeakPolarHBondContact CA-OD1 3.42Å
154	M	98.2	Very high	94.3	Very high	13 Å²	13	46.7 Å²	46.7	6%	0.064	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.3	175.1	-55.8	-173.9	86.5	0	0	111.5	A52 K53 L93 E152 R157 M159 V279 S280 D281 L380	A52-M154 HydrophobicContact CB-CB 4.01Å; K53-M154 WeakPolarHBondContact CE-O 3.39Å; L93-M154 HydrophobicContact CD1-CE 4.2Å; L93-M154 HydrophobicContact CD1-CG 3.99Å; E152-M154 HydrophobicContact CG-CG 3.79Å; M154-R157 CarbonylContact C-O 3.6Å; M154-R157 WeakPolarHBondContact CA-O 3.45Å; M154-M159 HydrophobicContact CE-CE 3.81Å; M154-M159 HydrophobicContact CE-CG 4.26Å; M154-M159 HydrophobicContact CE-SD 3.98Å; M154-V279 HydrophobicContact CB-CG1 4.48Å; M154-V279 HydrophobicContact CE-CG1 3.48Å; M154-V279 VanDerWaalsContact CE-CG1 3.48Å; M154-V279 HydrophobicContact SD-CB 4.38Å; M154-V279 HydrophobicContact SD-CG1 3.78Å; M154-S280 VanDerWaalsContact CG-O 3.24Å; M154-S280 WeakPolarHBondContact CG-O 3.27Å; M154-D281 PolarHBondContact N-OD1 2.93Å; M154-L380 HydrophobicContact CE-CD1 3.88Å; M154-L380 HydrophobicContact CE-CD2 4.38Å; M154-L380 HydrophobicContact CE-CG 3.92Å; M154-L380 HydrophobicContact SD-CG 4.1Å
155	S	97.6	Very high	94.2	Very high	6 Å²	6	47.4 Å²	47.4	4%	0.042	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-35.3	164.9	-75.3	0	0	0	0	113	A52 K53 K58 S153 D281	A52-S155 WeakPolarHBondContact CA-OG 3.48Å; K53-S155 WeakPolarHBondContact CD-O 3.34Å; K53-S155 WeakPolarHBondContact CE-O 3.26Å; K53-S155 PolarHBondContact N-OG 2.92Å; K53-S155 PolarHBondContact NZ-O 2.95Å; K58-S155 WeakPolarHBondContact CA-OG 3.47Å; S153-S155 PolarHBondContact O-N 3.03Å; S155-D281 WeakPolarHBondContact CB-OD1 3.32Å; S155-D281 VanDerWaalsContact CB-OD2 3.27Å; S155-D281 WeakPolarHBondContact CB-OD2 3.46Å; S155-D281 PolarHBondContact N-OD1 3.32Å; S155-D281 VanDerWaalsContact OG-CG 3.3Å; S155-D281 PolarHBondContact OG-OD1 2.89Å; S155-D281 PolarHBondContact OG-OD2 2.86Å
156	L	96.9	Very high	94.1	Very high	72 Å²	72	51.3 Å²	51.3	38%	0.377	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-16.4	-176.3	-60.1	179.4	0	0	0	113.1	T60 T61 S153	T60-L156 WeakPolarHBondContact O-CD1 3.5Å; T61-L156 HydrophobicContact CG2-CD1 4.06Å; S153-L156 PolarHBondContact O-N 2.85Å; S153-L156 WeakPolarHBondContact OG-CG 3.45Å; S153-L156 PolarHBondContact OG-N 2.86Å
157	R	94.8	Very high	93.8	Very high	108 Å²	108	57 Å²	57	41%	0.408	35%	0.347	S	S	.	.			trans	-128	156.8	176.3	-60.7	-63	-177.3	-162.4	0.7	111.9	L93 Q94 S153 M154	L93-R157 HydrophobicContact CB-CB 3.59Å; L93-R157 HydrophobicContact CB-CG 4.28Å; L93-R157 HydrophobicContact CD1-CB 4.18Å; Q94-R157 VanDerWaalsContact OE1-NH2 3.12Å; S153-R157 PolarHBondContact O-N 2.99Å; M154-R157 CarbonylContact C-O 3.6Å; M154-R157 WeakPolarHBondContact CA-O 3.45Å
158	S	88.4	Confident	93.6	Very high	92 Å²	92	58.6 Å²	58.6	64%	0.643	36%	0.364	S	S	*	.			trans	-131.9	151.4	179.6	74.4	0	0	0	0	110.6	G160	S158-G160 PolarHBondContact O-N 3.13Å; S158-G160 VanDerWaalsContact O-N 3.09Å
159	M	82.6	Confident	93.3	Very high	102 Å²	102	60.6 Å²	60.6	50%	0.502	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	15.7	-177.9	-66.7	-173.8	-72.1	0	0	114.3	L93 M154 M182 L380	L93-M159 HydrophobicContact CD1-CG 4.19Å; L93-M159 HydrophobicContact CD2-CB 4.44Å; L93-M159 HydrophobicContact CD2-CG 3.64Å; M154-M159 HydrophobicContact CE-CE 3.81Å; M154-M159 HydrophobicContact CE-CG 4.26Å; M154-M159 HydrophobicContact CE-SD 3.98Å; M159-M182 HydrophobicContact CE-CE 4.11Å; M159-M182 HydrophobicContact SD-CE 3.4Å; M159-M182 WeakPolarHBondContact SD-CE 3.43Å; M159-L380 HydrophobicContact CG-CD1 4.28Å; M159-L380 HydrophobicContact SD-CD1 3.87Å
160	G	77.8	Confident	92.9	Very high	64 Å²	64	64.3 Å²	64.3	66%	0.66	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-13.9	-166.4	0	0	0	0	0	116	S158 P162	S158-G160 PolarHBondContact O-N 3.13Å; S158-G160 VanDerWaalsContact O-N 3.09Å; G160-P162 WeakPolarHBondContact O-CD 3.35Å
161	D	85.9	Confident	92.8	Very high	137 Å²	137	68.5 Å²	68.5	73%	0.733	44%	0.435	S	S	*	.			trans	-109.6	105.8	-175.8	-174.4	1.5	0	0	0	110.6	G163	D161-G163 VanDerWaalsContact C-N 3.29Å; D161-G163 PolarHBondContact OD1-N 2.94Å
162	P	86.1	Confident	92.7	Very high	86 Å²	86	72.8 Å²	72.8	56%	0.558	46%	0.458	S	S	*	.			trans	-80.8	-5.8	178.9	34.2	-35.8	0	0	0	113.7	G160 L165 L179	G160-P162 WeakPolarHBondContact O-CD 3.35Å; P162-L165 HydrophobicContact CB-CD1 4.01Å; P162-L165 HydrophobicContact CG-CD1 4.37Å; P162-L179 HydrophobicContact CB-CD2 4.35Å
163	G	90.9	Very high	92.5	Very high	41 Å²	41	75 Å²	75	42%	0.423	48%	0.476	S	S	.	.			trans	72.1	-161.1	-171.9	0	0	0	0	0	113.9	D161 L165	D161-G163 VanDerWaalsContact C-N 3.29Å; D161-G163 PolarHBondContact OD1-N 2.94Å; G163-L165 PolarHBondContact O-N 2.83Å
164	D	94.5	Very high	92.4	Very high	174 Å²	174	80 Å²	80	93%	0.93	50%	0.498	S	S	*	.			trans	-79.8	113.7	-175.6	-63.2	-44	0	0	0	111.9
165	L	95.1	Very high	92.3	Very high	93 Å²	93	81 Å²	81	49%	0.487	51%	0.509	S	S	.	.			trans	-115.6	146.5	178.4	-59.9	178.9	0	0	0	111.4	P162 G163 L169 L179	P162-L165 HydrophobicContact CB-CD1 4.01Å; P162-L165 HydrophobicContact CG-CD1 4.37Å; G163-L165 PolarHBondContact O-N 2.83Å; L165-L169 HydrophobicContact CB-CD1 4.3Å; L165-L169 HydrophobicContact CD1-CD1 3.88Å; L165-L179 HydrophobicContact CD1-CD1 4.15Å; L165-L179 HydrophobicContact CD1-CD2 3.7Å; L165-L179 HydrophobicContact CD1-CG 4.4Å
166	S	95.8	Very high	92.2	Very high	90 Å²	90	86.2 Å²	86.2	63%	0.629	53%	0.527	S	S	*	.			trans	-61.4	140.6	179.4	179.8	0	0	0	0	112.1	G168 L169	S166-G168 PolarHBondContact O-N 3.43Å; S166-G168 VanDerWaalsContact O-N 3.13Å; S166-G168 PolarHBondContact OG-N 3.04Å; S166-G168 VanDerWaalsContact OG-N 3.16Å; S166-L169 WeakPolarHBondContact O-CB 3.35Å; S166-L169 PolarHBondContact O-N 3.24Å
167	S	92.7	Very high	92.3	Very high	118 Å²	118	84.3 Å²	84.3	83%	0.825	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-59.3	-21.4	169.9	56.7	0	0	0	0	113.2	L169	S167-L169 PolarHBondContact O-N 3.25Å
168	G	94.5	Very high	92.3	Very high	35 Å²	35	81.8 Å²	81.8	36%	0.361	52%	0.516	S	S	.	.	G	3₁₀ helix	trans	-72.9	-5.3	174	0	0	0	0	0	114.6	S166 S170 A171	S166-G168 PolarHBondContact O-N 3.43Å; S166-G168 VanDerWaalsContact O-N 3.13Å; S166-G168 PolarHBondContact OG-N 3.04Å; S166-G168 VanDerWaalsContact OG-N 3.16Å; G168-S170 PolarHBondContact O-N 3.03Å; G168-A171 WeakPolarHBondContact O-CB 3.33Å; G168-A171 PolarHBondContact O-N 3.06Å
169	L	93.4	Very high	92.7	Very high	41 Å²	41	81.6 Å²	81.6	22%	0.215	51%	0.507	C	S	.	.	G	3₁₀ helix	trans	-53.4	-40.1	178	178.7	141.7	0	0	0	111.7	L165 S166 S167 A171 N172 A175 R176 L179	L165-L169 HydrophobicContact CB-CD1 4.3Å; L165-L169 HydrophobicContact CD1-CD1 3.88Å; S166-L169 WeakPolarHBondContact O-CB 3.35Å; S166-L169 PolarHBondContact O-N 3.24Å; S167-L169 PolarHBondContact O-N 3.25Å; L169-A171 PolarHBondContact O-N 3.32Å; L169-N172 PolarHBondContact O-N 3.44Å; L169-A175 HydrophobicContact CG-CB 4.33Å; L169-R176 HydrophobicContact CD2-CB 4.43Å; L169-R176 HydrophobicContact CD2-CG 3.91Å; L169-R176 WeakPolarHBondContact O-CG 3.13Å; L169-L179 HydrophobicContact CD1-CD1 3.65Å; L169-L179 HydrophobicContact CD1-CG 4.1Å; L169-L179 HydrophobicContact CD2-CD1 3.77Å; L169-L179 HydrophobicContact CG-CD1 4.38Å
170	S	90.9	Very high	93.3	Very high	79 Å²	79	78.8 Å²	78.8	55%	0.552	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-63.5	-23.5	179.4	63.4	0	0	0	0	113.5	G168 R176	G168-S170 PolarHBondContact O-N 3.03Å; S170-R176 PolarHBondContact O-NH1 3Å
171	A	96.2	Very high	94.2	Very high	88 Å²	88	79.5 Å²	79.5	73%	0.727	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-85.8	-17	-178.6	0	0	0	0	0	113.7	G168 L169	G168-A171 WeakPolarHBondContact O-CB 3.33Å; G168-A171 PolarHBondContact O-N 3.06Å; L169-A171 PolarHBondContact O-N 3.32Å
172	N	96.9	Very high	94.7	Very high	89 Å²	89	75.6 Å²	75.6	48%	0.476	46%	0.464	S	S	.	.			trans	-114.5	113.6	-179.7	-176.1	-47.7	0	0	0	110.9	L169 K174 A175 R176	L169-N172 PolarHBondContact O-N 3.44Å; N172-K174 VanDerWaalsContact C-N 3.31Å; N172-K174 PolarHBondContact O-N 2.84Å; N172-K174 PolarHBondContact OD1-N 2.88Å; N172-A175 HydrophobicContact CB-CB 3.86Å; N172-A175 WeakPolarHBondContact O-CB 3.44Å; N172-A175 PolarHBondContact O-N 3.21Å; N172-A175 VanDerWaalsContact O-N 3.13Å; N172-A175 PolarHBondContact OD1-N 3.36Å; N172-A175 VanDerWaalsContact OD1-N 3.08Å; N172-R176 WeakPolarHBondContact O-CG 3.3Å; N172-R176 PolarHBondContact O-N 3.03Å
173	A	95.9	Very high	95.3	Very high	47 Å²	47	71.6 Å²	71.6	39%	0.388	44%	0.439	S	S	.	.	H	α-helix	trans	-55.7	-42.2	-177.5	0	0	0	0	0	113.3	R176 D177	A173-R176 PolarHBondContact O-N 2.94Å; A173-D177 PolarHBondContact O-N 2.67Å
174	K	95.9	Very high	95.6	Very high	105 Å²	105	71.3 Å²	71.3	46%	0.457	43%	0.429	S	S	.	.	H	α-helix	trans	-71	-34	179.6	-66.3	-62.2	174.1	-158.6	0	113	N172 D177 C178 D316	N172-K174 VanDerWaalsContact C-N 3.31Å; N172-K174 PolarHBondContact O-N 2.84Å; N172-K174 PolarHBondContact OD1-N 2.88Å; K174-D177 IonicContact NZ-OD2 3.29Å; K174-D177 PolarHBondContact NZ-OD2 3.45Å; K174-D177 PolarHBondContact O-N 3.22Å; K174-C178 PolarHBondContact O-N 3.23Å; K174-C178 PolarHBondContact O-SG 3.1Å; K174-C178 VanDerWaalsContact O-SG 3.37Å; K174-D316 IonicContact NZ-OD1 2.72Å
175	A	96.6	Very high	95.8	Very high	35 Å²	35	63.2 Å²	63.2	29%	0.289	39%	0.386	S	S	.	.	H	α-helix	trans	-64.3	-41.3	171.6	0	0	0	0	0	111.5	L169 N172 C178	L169-A175 HydrophobicContact CG-CB 4.33Å; N172-A175 HydrophobicContact CB-CB 3.86Å; N172-A175 WeakPolarHBondContact O-CB 3.44Å; N172-A175 PolarHBondContact O-N 3.21Å; N172-A175 VanDerWaalsContact O-N 3.13Å; N172-A175 PolarHBondContact OD1-N 3.36Å; N172-A175 VanDerWaalsContact OD1-N 3.08Å; A175-C178 WeakPolarHBondContact O-CB 3.24Å; A175-C178 PolarHBondContact O-N 2.97Å
176	R	95.8	Very high	95.9	Very high	115 Å²	115	58.9 Å²	58.9	43%	0.434	36%	0.363	S	S	.	.	H	α-helix	trans	-63	-41.7	173.1	-60.9	-170.2	-54.5	-114.5	1	112.2	L169 S170 N172 A173 C178 L179	L169-R176 HydrophobicContact CD2-CB 4.43Å; L169-R176 HydrophobicContact CD2-CG 3.91Å; L169-R176 WeakPolarHBondContact O-CG 3.13Å; S170-R176 PolarHBondContact O-NH1 3Å; N172-R176 WeakPolarHBondContact O-CG 3.3Å; N172-R176 PolarHBondContact O-N 3.03Å; A173-R176 PolarHBondContact O-N 2.94Å; R176-C178 PolarHBondContact O-N 3.34Å; R176-L179 WeakPolarHBondContact O-CB 3.44Å; R176-L179 PolarHBondContact O-N 2.92Å
177	D	97.1	Very high	96.1	Very high	32 Å²	32	54.6 Å²	54.6	17%	0.171	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-26	-177.9	-66.7	-14.4	0	0	0	112	A173 K174 L179 I180 P315	A173-D177 PolarHBondContact O-N 2.67Å; K174-D177 IonicContact NZ-OD2 3.29Å; K174-D177 PolarHBondContact NZ-OD2 3.45Å; K174-D177 PolarHBondContact O-N 3.22Å; D177-L179 PolarHBondContact O-N 2.73Å; D177-I180 HydrophobicContact CB-CD1 3.89Å; D177-I180 WeakPolarHBondContact O-CB 3.3Å; D177-I180 WeakPolarHBondContact O-CG1 3.43Å; D177-I180 PolarHBondContact O-N 3.07Å; D177-I180 VanDerWaalsContact O-N 3.13Å; D177-P315 HydrophobicContact CB-CB 3.85Å; D177-P315 HydrophobicContact CB-CG 4.19Å
178	C	96.4	Very high	96.4	Very high	55 Å²	55	50.2 Å²	50.2	37%	0.372	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.1	173.6	-66.4	0	0	0	0	113.9	K174 A175 R176 T412	K174-C178 PolarHBondContact O-N 3.23Å; K174-C178 PolarHBondContact O-SG 3.1Å; K174-C178 VanDerWaalsContact O-SG 3.37Å; A175-C178 WeakPolarHBondContact O-CB 3.24Å; A175-C178 PolarHBondContact O-N 2.97Å; R176-C178 PolarHBondContact O-N 3.34Å; C178-T412 HydrophobicContact CB-CG2 4.24Å
179	L	95.4	Very high	96.6	Very high	87 Å²	87	48.5 Å²	48.5	46%	0.455	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-1.1	176.5	-60.6	-175.2	0	0	0	113.4	P162 L165 L169 R176 D177 P181	P162-L179 HydrophobicContact CB-CD2 4.35Å; L165-L179 HydrophobicContact CD1-CD1 4.15Å; L165-L179 HydrophobicContact CD1-CD2 3.7Å; L165-L179 HydrophobicContact CD1-CG 4.4Å; L169-L179 HydrophobicContact CD1-CD1 3.65Å; L169-L179 HydrophobicContact CD1-CG 4.1Å; L169-L179 HydrophobicContact CD2-CD1 3.77Å; L169-L179 HydrophobicContact CG-CD1 4.38Å; R176-L179 WeakPolarHBondContact O-CB 3.44Å; R176-L179 PolarHBondContact O-N 2.92Å; D177-L179 PolarHBondContact O-N 2.73Å; L179-P181 WeakPolarHBondContact O-CD 3.48Å
180	I	96.1	Very high	96.8	Very high	44 Å²	44	46.9 Å²	46.9	23%	0.226	28%	0.276	C	S	.	.	S	Bend	trans	-64.1	125.6	176.3	-65	170.6	0	0	0	108.2	D177 M182 V184 T185 D316	D177-I180 HydrophobicContact CB-CD1 3.89Å; D177-I180 WeakPolarHBondContact O-CB 3.3Å; D177-I180 WeakPolarHBondContact O-CG1 3.43Å; D177-I180 PolarHBondContact O-N 3.07Å; D177-I180 VanDerWaalsContact O-N 3.13Å; I180-M182 PolarHBondContact O-N 3.43Å; I180-V184 HydrophobicContact CG2-CB 3.71Å; I180-V184 HydrophobicContact CG2-CG1 3.66Å; I180-T185 HydrophobicContact CB-CG2 4.21Å; I180-T185 HydrophobicContact CG2-CG2 3.67Å; I180-D316 HydrophobicContact CD1-CB 3.88Å
181	P	96.4	Very high	97.2	Very high	78 Å²	78	48.8 Å²	48.8	51%	0.506	28%	0.276	S	S	.	.			trans	-55.4	136.4	176.2	-25.5	34.1	0	0	0	110.7	L179 G183 V184 T185	L179-P181 WeakPolarHBondContact O-CD 3.48Å; P181-G183 PolarHBondContact O-N 2.93Å; P181-G183 VanDerWaalsContact O-N 3.1Å; P181-V184 HydrophobicContact CB-CG2 4.11Å; P181-V184 HydrophobicContact CG-CG2 4.23Å; P181-V184 WeakPolarHBondContact O-CA 3.43Å; P181-V184 WeakPolarHBondContact O-CB 3.39Å; P181-V184 PolarHBondContact O-N 2.78Å; P181-T185 PolarHBondContact O-N 2.82Å
182	M	96.9	Very high	97.3	Very high	55 Å²	55	51.4 Å²	51.4	27%	0.271	27%	0.267	S	S	.	.	H	α-helix	trans	-55.4	-36.4	-176.1	-69.1	-172.3	-81	0	0	112.8	M159 I180 V184 T185 S186 M318 F349	M159-M182 HydrophobicContact CE-CE 4.11Å; M159-M182 HydrophobicContact SD-CE 3.4Å; M159-M182 WeakPolarHBondContact SD-CE 3.43Å; I180-M182 PolarHBondContact O-N 3.43Å; M182-V184 VanDerWaalsContact C-N 3.27Å; M182-V184 PolarHBondContact O-N 2.72Å; M182-T185 PolarHBondContact O-N 3.07Å; M182-T185 VanDerWaalsContact O-N 3.1Å; M182-T185 PolarHBondContact O-OG1 3.29Å; M182-S186 PolarHBondContact O-N 2.94Å; M182-M318 HydrophobicContact CB-CE 3.82Å; M182-M318 HydrophobicContact CG-CE 3.88Å; M182-M318 HydrophobicContact SD-CE 4.16Å; M182-F349 HydrophobicContact CB-CE2 3.98Å; M182-F349 HydrophobicContact CB-CZ 4.21Å
183	G	97.1	Very high	97.4	Very high	3 Å²	3	51.2 Å²	51.2	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-28.6	174	0	0	0	0	0	114.5	P181 S186 E187 F265	P181-G183 PolarHBondContact O-N 2.93Å; P181-G183 VanDerWaalsContact O-N 3.1Å; G183-S186 VanDerWaalsContact O-CB 3.31Å; G183-S186 WeakPolarHBondContact O-CB 3.35Å; G183-S186 PolarHBondContact O-N 3.45Å; G183-E187 PolarHBondContact O-N 3.13Å; G183-F265 VanDerWaalsContact CA-CD2 3.45Å; G183-F265 VanDerWaalsContact CA-CE2 3.5Å
184	V	98.1	Very high	97.5	Very high	34 Å²	34	51.7 Å²	51.7	21%	0.206	27%	0.272	C	S	.	.	H	α-helix	trans	-73.4	-37.1	172	175.2	0	0	0	0	110.7	I180 P181 M182 S186 E187 N188 F265	I180-V184 HydrophobicContact CG2-CB 3.71Å; I180-V184 HydrophobicContact CG2-CG1 3.66Å; P181-V184 HydrophobicContact CB-CG2 4.11Å; P181-V184 HydrophobicContact CG-CG2 4.23Å; P181-V184 WeakPolarHBondContact O-CA 3.43Å; P181-V184 WeakPolarHBondContact O-CB 3.39Å; P181-V184 PolarHBondContact O-N 2.78Å; M182-V184 VanDerWaalsContact C-N 3.27Å; M182-V184 PolarHBondContact O-N 2.72Å; V184-S186 PolarHBondContact O-N 3.38Å; V184-E187 WeakPolarHBondContact O-CB 3.41Å; V184-E187 PolarHBondContact O-N 3.07Å; V184-E187 VanDerWaalsContact O-N 3.15Å; V184-N188 VanDerWaalsContact O-CG 3.23Å; V184-N188 PolarHBondContact O-N 2.92Å; V184-N188 PolarHBondContact O-OD1 2.88Å; V184-F265 HydrophobicContact CG2-CB 4.37Å
185	T	98.4	Very high	97.6	Very high	4 Å²	4	46.9 Å²	46.9	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-31.6	173.1	75	0	0	0	0	112.1	I180 P181 M182 N188 V189 M318	I180-T185 HydrophobicContact CB-CG2 4.21Å; I180-T185 HydrophobicContact CG2-CG2 3.67Å; P181-T185 PolarHBondContact O-N 2.82Å; M182-T185 PolarHBondContact O-N 3.07Å; M182-T185 VanDerWaalsContact O-N 3.1Å; M182-T185 PolarHBondContact O-OG1 3.29Å; T185-N188 PolarHBondContact O-N 3.22Å; T185-V189 WeakPolarHBondContact O-CG2 3.42Å; T185-V189 PolarHBondContact O-N 2.8Å; T185-M318 HydrophobicContact CG2-CG 4.27Å; T185-M318 WeakPolarHBondContact OG1-CE 3.26Å
186	S	98.7	Very high	97.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-60	-47	170.6	173.5	0	0	0	0	111.8	M182 G183 V184 N188 V189 A190 T271 F349 S351	M182-S186 PolarHBondContact O-N 2.94Å; G183-S186 VanDerWaalsContact O-CB 3.31Å; G183-S186 WeakPolarHBondContact O-CB 3.35Å; G183-S186 PolarHBondContact O-N 3.45Å; V184-S186 PolarHBondContact O-N 3.38Å; S186-N188 VanDerWaalsContact C-N 3.33Å; S186-N188 PolarHBondContact O-N 3.22Å; S186-V189 PolarHBondContact O-N 2.85Å; S186-A190 PolarHBondContact O-N 3.39Å; S186-T271 WeakPolarHBondContact CB-OG1 3.38Å; S186-T271 PolarHBondContact OG-OG1 3.5Å; S186-F349 VanDerWaalsContact CB-CG 3.48Å; S186-F349 WeakPolarHBondContact OG-CB 3Å; S186-F349 WeakPolarHBondContact OG-CG 3.5Å; S186-S351 WeakPolarHBondContact CB-OG 3.44Å; S186-S351 PolarHBondContact O-OG 3.34Å; S186-S351 PolarHBondContact OG-OG 3.39Å
187	E	98.6	Very high	97.8	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-41.5	174.7	-58.4	-65	-176.6	0	0	111.6	G183 V184 V189 A190 E191 K266 G269 T270 T271	G183-E187 PolarHBondContact O-N 3.13Å; V184-E187 WeakPolarHBondContact O-CB 3.41Å; V184-E187 PolarHBondContact O-N 3.07Å; V184-E187 VanDerWaalsContact O-N 3.15Å; E187-V189 VanDerWaalsContact C-N 3.33Å; E187-V189 PolarHBondContact O-N 3.16Å; E187-A190 PolarHBondContact O-N 3.4Å; E187-E191 WeakPolarHBondContact O-CB 3.46Å; E187-E191 VanDerWaalsContact O-CG 3.25Å; E187-E191 WeakPolarHBondContact O-CG 3.22Å; E187-E191 PolarHBondContact O-N 3.03Å; E187-K266 HydrophobicContact CB-CD 3.87Å; E187-K266 HydrophobicContact CG-CB 4.43Å; E187-K266 HydrophobicContact CG-CD 3.93Å; E187-K266 HydrophobicContact CG-CG 4.1Å; E187-G269 VanDerWaalsContact CD-CA 3.49Å; E187-G269 WeakPolarHBondContact OE1-CA 3.26Å; E187-T270 VanDerWaalsContact CD-N 3.31Å; E187-T270 PolarHBondContact OE1-N 2.86Å; E187-T270 PolarHBondContact OE2-N 2.92Å; E187-T270 PolarHBondContact OE2-OG1 2.94Å; E187-T271 VanDerWaalsContact CD-OG1 3.29Å; E187-T271 WeakPolarHBondContact OE1-CA 3.47Å; E187-T271 WeakPolarHBondContact OE1-CB 3.32Å; E187-T271 PolarHBondContact OE1-N 3.44Å; E187-T271 PolarHBondContact OE1-OG1 3.03Å; E187-T271 PolarHBondContact OE2-N 3.02Å; E187-T271 PolarHBondContact OE2-OG1 3.41Å
188	N	98.6	Very high	97.9	Very high	25 Å²	25	50.6 Å²	50.6	13%	0.134	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-39.9	178.9	-63.3	-12.1	0	0	0	112.2	V184 T185 S186 R192 K266 D316 L317	V184-N188 VanDerWaalsContact O-CG 3.23Å; V184-N188 PolarHBondContact O-N 2.92Å; V184-N188 PolarHBondContact O-OD1 2.88Å; T185-N188 PolarHBondContact O-N 3.22Å; S186-N188 VanDerWaalsContact C-N 3.33Å; S186-N188 PolarHBondContact O-N 3.22Å; N188-R192 WeakPolarHBondContact O-CB 3.37Å; N188-R192 PolarHBondContact O-N 3.47Å; N188-K266 PolarHBondContact OD1-NZ 2.93Å; N188-D316 WeakPolarHBondContact CB-O 3.48Å; N188-D316 PolarHBondContact ND2-O 2.89Å; N188-D316 VanDerWaalsContact ND2-O 3.08Å; N188-L317 HydrophobicContact CB-CD2 4.01Å
189	V	98.8	Very high	98	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-46.2	174.4	170	0	0	0	0	110.4	T185 S186 E187 R192 F193 L317 I320 Q352 F355	T185-V189 WeakPolarHBondContact O-CG2 3.42Å; T185-V189 PolarHBondContact O-N 2.8Å; S186-V189 PolarHBondContact O-N 2.85Å; E187-V189 VanDerWaalsContact C-N 3.33Å; E187-V189 PolarHBondContact O-N 3.16Å; V189-R192 PolarHBondContact O-N 3.1Å; V189-F193 HydrophobicContact CB-CD2 4.48Å; V189-F193 HydrophobicContact CG1-CD2 3.99Å; V189-F193 VanDerWaalsContact O-CD2 3.32Å; V189-F193 WeakPolarHBondContact O-CD2 3.28Å; V189-F193 PolarHBondContact O-N 2.58Å; V189-L317 HydrophobicContact CG2-CB 4.47Å; V189-L317 HydrophobicContact CG2-CD2 3.99Å; V189-I320 HydrophobicContact CG2-CG2 4.23Å; V189-Q352 HydrophobicContact CG1-CB 4.33Å; V189-F355 HydrophobicContact CG1-CB 4.07Å; V189-F355 HydrophobicContact CG1-CG 4.28Å
190	A	98.7	Very high	98.2	Very high	6 Å²	6	47 Å²	47	5%	0.05	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-47.9	178.8	0	0	0	0	0	112.3	S186 E187 G194 V195	S186-A190 PolarHBondContact O-N 3.39Å; E187-A190 PolarHBondContact O-N 3.4Å; A190-G194 CarbonylContact O-C 3.3Å; A190-G194 WeakPolarHBondContact O-CA 3.2Å; A190-G194 PolarHBondContact O-N 3.11Å; A190-V195 HydrophobicContact CB-CB 4.44Å; A190-V195 PolarHBondContact O-N 3.35Å
191	E	98.3	Very high	98.3	Very high	119 Å²	119	45.2 Å²	45.2	56%	0.556	24%	0.236	S	C	*	.	H	α-helix	trans	-64.3	-47.4	178.9	-71.3	166	-159.6	0	0	111.5	E187 K266	E187-E191 WeakPolarHBondContact O-CB 3.46Å; E187-E191 VanDerWaalsContact O-CG 3.25Å; E187-E191 WeakPolarHBondContact O-CG 3.22Å; E187-E191 PolarHBondContact O-N 3.03Å; E191-K266 IonicContact OE1-NZ 3.76Å; E191-K266 PolarHBondContact OE1-NZ 3.39Å; E191-K266 IonicContact OE2-NZ 3.35Å; E191-K266 PolarHBondContact OE2-NZ 2.91Å
192	R	98.4	Very high	98.4	Very high	143 Å²	143	43.7 Å²	43.7	54%	0.54	23%	0.23	S	C	.	.	H	α-helix	trans	-73.7	-30	-173.1	-167.4	170.1	-65.8	174	10.9	113.4	N188 V189 D316	N188-R192 WeakPolarHBondContact O-CB 3.37Å; N188-R192 PolarHBondContact O-N 3.47Å; V189-R192 PolarHBondContact O-N 3.1Å; R192-D316 IonicContact CZ-OD2 3.36Å; R192-D316 IonicContact NH1-OD2 2.65Å; R192-D316 PolarHBondContact NH1-OD2 3.49Å; R192-D316 IonicContact NH2-OD2 3.76Å; R192-D316 PolarHBondContact NH2-OD2 3.03Å
193	F	98.5	Very high	98.5	Very high	85 Å²	85	42.5 Å²	42.5	37%	0.373	22%	0.223	S	C	.	.	H	α-helix	trans	-113.6	7.3	-176.4	-55.7	-67.9	0	0	0	113.8	V189 L317 I320 F355	V189-F193 HydrophobicContact CB-CD2 4.48Å; V189-F193 HydrophobicContact CG1-CD2 3.99Å; V189-F193 VanDerWaalsContact O-CD2 3.32Å; V189-F193 WeakPolarHBondContact O-CD2 3.28Å; V189-F193 PolarHBondContact O-N 2.58Å; F193-L317 HydrophobicContact CE2-CD1 4.23Å; F193-L317 HydrophobicContact CE2-CD2 4.28Å; F193-L317 HydrophobicContact CZ-CD1 4.19Å; F193-I320 HydrophobicContact CE2-CG2 3.74Å; F193-I320 HydrophobicContact CZ-CG2 4.29Å; F193-F355 HydrophobicContact CB-CD2 3.6Å; F193-F355 HydrophobicContact CB-CE2 3.89Å; F193-F355 HydrophobicContact CD1-CD2 4.2Å; F193-F355 AromaticContact CD1-CE2 3.59Å; F193-F355 HydrophobicContact CD1-CE2 3.59Å; F193-F355 HydrophobicContact CD1-CZ 4.35Å; F193-F355 AromaticContact CD2-CD2 3.8Å; F193-F355 HydrophobicContact CD2-CD2 3.8Å; F193-F355 AromaticContact CD2-CE2 3.73Å; F193-F355 HydrophobicContact CD2-CE2 3.73Å; F193-F355 HydrophobicContact CD2-CG 4.37Å; F193-F355 HydrophobicContact CD2-CZ 4.27Å; F193-F355 AromaticContact CE1-CE2 3.98Å; F193-F355 HydrophobicContact CE1-CE2 3.98Å; F193-F355 HydrophobicContact CE1-CZ 4.3Å; F193-F355 HydrophobicContact CE2-CE2 4.11Å; F193-F355 HydrophobicContact CE2-CZ 4.22Å; F193-F355 AromaticContact CG-CD2 3.6Å; F193-F355 HydrophobicContact CG-CD2 3.6Å; F193-F355 AromaticContact CG-CE2 3.44Å; F193-F355 HydrophobicContact CG-CE2 3.44Å; F193-F355 VanDerWaalsContact CG-CE2 3.44Å; F193-F355 HydrophobicContact CG-CZ 4.33Å; F193-F355 HydrophobicContact CZ-CE2 4.23Å; F193-F355 HydrophobicContact CZ-CZ 4.23Å
194	G	98.1	Very high	98.6	Very high	58 Å²	58	42.4 Å²	42.4	60%	0.598	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.2	33.2	173.2	0	0	0	0	0	114.4	A190 S196	A190-G194 CarbonylContact O-C 3.3Å; A190-G194 WeakPolarHBondContact O-CA 3.2Å; A190-G194 PolarHBondContact O-N 3.11Å; G194-S196 PolarHBondContact O-N 3.2Å
195	V	98.7	Very high	98.6	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.024	22%	0.22	C	C	.	.			trans	-82.2	97.8	177.4	-171.4	0	0	0	0	109.4	A190 Q199 Q200 V354 F355	A190-V195 HydrophobicContact CB-CB 4.44Å; A190-V195 PolarHBondContact O-N 3.35Å; V195-Q199 HydrophobicContact CG1-CB 4.36Å; V195-Q200 HydrophobicContact CG1-CG 3.93Å; V195-Q200 PolarHBondContact O-NE2 2.78Å; V195-V354 HydrophobicContact CG1-CB 3.85Å; V195-V354 HydrophobicContact CG1-CG1 3.7Å; V195-F355 HydrophobicContact CG2-CB 4.06Å
196	S	98.6	Very high	98.6	Very high	50 Å²	50	45.1 Å²	45.1	35%	0.35	24%	0.235	S	C	.	.			trans	-62.6	155.3	-175.1	67.4	0	0	0	0	113.1	G194 Q198 Q199 Q200	G194-S196 PolarHBondContact O-N 3.2Å; S196-Q198 PolarHBondContact O-N 3.26Å; S196-Q199 PolarHBondContact O-N 2.87Å; S196-Q199 VanDerWaalsContact O-N 3.14Å; S196-Q199 VanDerWaalsContact OG-CG 3.28Å; S196-Q199 WeakPolarHBondContact OG-CG 3.48Å; S196-Q199 PolarHBondContact OG-N 3.12Å; S196-Q199 PolarHBondContact OG-OE1 2.83Å; S196-Q200 WeakPolarHBondContact O-CG 3.37Å; S196-Q200 PolarHBondContact O-N 2.85Å; S196-Q200 VanDerWaalsContact O-N 3.08Å
197	R	98.5	Very high	98.6	Very high	56 Å²	56	45 Å²	45	21%	0.211	24%	0.235	C	C	.	.	H	α-helix	trans	-53.8	-40.5	172.5	175.5	59.1	-179.7	-80.4	-6.8	112.5	Q199 Q200 D201 L258 A259 L261 T270 T272	R197-Q199 PolarHBondContact O-N 2.98Å; R197-Q200 PolarHBondContact O-N 3.24Å; R197-D201 IonicContact CZ-OD2 3.19Å; R197-D201 VanDerWaalsContact NE-CG 3.27Å; R197-D201 IonicContact NE-OD1 2.8Å; R197-D201 PolarHBondContact NE-OD1 2.79Å; R197-D201 VanDerWaalsContact NE-OD1 3.09Å; R197-D201 IonicContact NE-OD2 3.28Å; R197-D201 PolarHBondContact NE-OD2 3.11Å; R197-D201 IonicContact NH2-OD2 3.24Å; R197-D201 PolarHBondContact NH2-OD2 3.17Å; R197-D201 PolarHBondContact O-N 2.91Å; R197-L258 PolarHBondContact NH2-O 2.97Å; R197-A259 PolarHBondContact NH2-O 3.01Å; R197-L261 PolarHBondContact NH2-O 3.34Å; R197-T270 HydrophobicContact CB-CG2 4.07Å; R197-T270 VanDerWaalsContact CD-O 3.26Å; R197-T270 WeakPolarHBondContact CD-O 3.24Å; R197-T272 VanDerWaalsContact CZ-CG2 3.42Å
198	Q	98.6	Very high	98.6	Very high	153 Å²	153	45.6 Å²	45.6	72%	0.715	24%	0.237	S	C	*	.	H	α-helix	trans	-63	-42	179	-173.6	-178.4	9.8	0	0	111.9	S196 A202	S196-Q198 PolarHBondContact O-N 3.26Å; Q198-A202 VanDerWaalsContact O-CB 3.22Å; Q198-A202 WeakPolarHBondContact O-CB 3.33Å; Q198-A202 PolarHBondContact O-N 3.5Å
199	Q	98.6	Very high	98.6	Very high	68 Å²	68	47.1 Å²	47.1	32%	0.318	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-40.8	175.6	-73	165.3	-54.4	0	0	111.6	V195 S196 R197 F203 V354 Q358	V195-Q199 HydrophobicContact CG1-CB 4.36Å; S196-Q199 PolarHBondContact O-N 2.87Å; S196-Q199 VanDerWaalsContact O-N 3.14Å; S196-Q199 VanDerWaalsContact OG-CG 3.28Å; S196-Q199 WeakPolarHBondContact OG-CG 3.48Å; S196-Q199 PolarHBondContact OG-N 3.12Å; S196-Q199 PolarHBondContact OG-OE1 2.83Å; R197-Q199 PolarHBondContact O-N 2.98Å; Q199-F203 WeakPolarHBondContact O-CB 3.47Å; Q199-F203 PolarHBondContact O-N 3.21Å; Q199-V354 HydrophobicContact CB-CG1 4.3Å; Q199-Q358 VanDerWaalsContact NE2-NE2 3.15Å
200	Q	98.9	Very high	98.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.4	-47.5	177.6	-67.1	178.1	54	0	0	111.7	V195 S196 R197 F203 A204 T270 N275 A350	V195-Q200 HydrophobicContact CG1-CG 3.93Å; V195-Q200 PolarHBondContact O-NE2 2.78Å; S196-Q200 WeakPolarHBondContact O-CG 3.37Å; S196-Q200 PolarHBondContact O-N 2.85Å; S196-Q200 VanDerWaalsContact O-N 3.08Å; R197-Q200 PolarHBondContact O-N 3.24Å; Q200-F203 PolarHBondContact O-N 2.89Å; Q200-A204 WeakPolarHBondContact O-CB 3.06Å; Q200-A204 PolarHBondContact O-N 3.44Å; Q200-T270 PolarHBondContact NE2-OG1 3.36Å; Q200-N275 HydrophobicContact CB-CB 4.2Å; Q200-A350 HydrophobicContact CB-CB 3.86Å; Q200-A350 HydrophobicContact CG-CB 4.25Å; Q200-A350 VanDerWaalsContact O-CB 3.31Å; Q200-A350 WeakPolarHBondContact O-CB 3.48Å
201	D	98.8	Very high	98.6	Very high	5 Å²	5	48 Å²	48	3%	0.027	25%	0.248	C	C	.	.	H	α-helix	trans	-70.4	-37.4	-179.6	-69.9	-3.2	0	0	0	111.8	R197 F203 A204 L205 L255 L258 N275	R197-D201 IonicContact CZ-OD2 3.19Å; R197-D201 VanDerWaalsContact NE-CG 3.27Å; R197-D201 IonicContact NE-OD1 2.8Å; R197-D201 PolarHBondContact NE-OD1 2.79Å; R197-D201 VanDerWaalsContact NE-OD1 3.09Å; R197-D201 IonicContact NE-OD2 3.28Å; R197-D201 PolarHBondContact NE-OD2 3.11Å; R197-D201 IonicContact NH2-OD2 3.24Å; R197-D201 PolarHBondContact NH2-OD2 3.17Å; R197-D201 PolarHBondContact O-N 2.91Å; D201-F203 PolarHBondContact O-N 3.38Å; D201-A204 PolarHBondContact O-N 3.44Å; D201-L205 WeakPolarHBondContact O-CB 3.28Å; D201-L205 PolarHBondContact O-N 3.3Å; D201-L255 HydrophobicContact CB-CD2 4.34Å; D201-L258 HydrophobicContact CB-CB 3.94Å; D201-L258 HydrophobicContact CB-CD1 4.13Å; D201-L258 VanDerWaalsContact O-CD1 3.24Å; D201-L258 WeakPolarHBondContact O-CD1 3.37Å; D201-N275 PolarHBondContact OD1-ND2 3.42Å
202	A	98.7	Very high	98.7	Very high	46 Å²	46	42.7 Å²	42.7	38%	0.38	22%	0.224	S	C	.	.	H	α-helix	trans	-62.5	-42.3	174.1	0	0	0	0	0	112.3	Q198 A204 L205 D206 L255	Q198-A202 VanDerWaalsContact O-CB 3.22Å; Q198-A202 WeakPolarHBondContact O-CB 3.33Å; Q198-A202 PolarHBondContact O-N 3.5Å; A202-A204 VanDerWaalsContact C-N 3.35Å; A202-L205 PolarHBondContact O-N 2.81Å; A202-D206 PolarHBondContact O-N 3.04Å; A202-L255 HydrophobicContact CB-CD2 4.42Å
203	F	98.8	Very high	98.7	Very high	30 Å²	30	44.1 Å²	44.1	13%	0.132	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-41.7	175.3	-173.5	-86.1	0	0	0	111.7	Q199 Q200 D201 D206 S207 E347 A350 A353 V354 I374	Q199-F203 WeakPolarHBondContact O-CB 3.47Å; Q199-F203 PolarHBondContact O-N 3.21Å; Q200-F203 PolarHBondContact O-N 2.89Å; D201-F203 PolarHBondContact O-N 3.38Å; F203-D206 PolarHBondContact O-N 3.47Å; F203-S207 PolarHBondContact O-N 2.97Å; F203-E347 HydrophobicContact CE1-CB 4.35Å; F203-E347 HydrophobicContact CE1-CG 3.79Å; F203-E347 HydrophobicContact CZ-CG 4.2Å; F203-A350 HydrophobicContact CB-CB 4.4Å; F203-A350 HydrophobicContact CD1-CB 4.08Å; F203-A353 HydrophobicContact CD1-CB 4.37Å; F203-A353 HydrophobicContact CE1-CB 3.64Å; F203-A353 HydrophobicContact CE2-CB 4.34Å; F203-A353 HydrophobicContact CZ-CB 3.63Å; F203-V354 HydrophobicContact CB-CG2 3.54Å; F203-V354 HydrophobicContact CD1-CG2 4.47Å; F203-V354 HydrophobicContact CD2-CG2 3.65Å; F203-V354 HydrophobicContact CG-CG2 3.63Å; F203-I374 HydrophobicContact CD1-CD1 3.95Å; F203-I374 HydrophobicContact CE1-CD1 4.18Å
204	A	98.8	Very high	98.7	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-42.1	176.7	0	0	0	0	0	113	Q200 D201 A202 S207 Q208 L258 G274 N275 I374	Q200-A204 WeakPolarHBondContact O-CB 3.06Å; Q200-A204 PolarHBondContact O-N 3.44Å; D201-A204 PolarHBondContact O-N 3.44Å; A202-A204 VanDerWaalsContact C-N 3.35Å; A204-S207 PolarHBondContact O-N 3.44Å; A204-Q208 PolarHBondContact O-N 3.45Å; A204-Q208 VanDerWaalsContact O-N 3.1Å; A204-L258 HydrophobicContact CB-CD1 4.2Å; A204-G274 WeakPolarHBondContact CB-O 3.2Å; A204-N275 HydrophobicContact CB-CB 3.97Å; A204-I374 HydrophobicContact CB-CD1 4.2Å; A204-I374 HydrophobicContact CB-CG2 3.88Å
205	L	98.8	Very high	98.7	Very high	30 Å²	30	40.7 Å²	40.7	16%	0.157	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-47.2	175	175.5	59.8	0	0	0	111.3	D201 A202 S207 Q208 I209 T253 L255 L258	D201-L205 WeakPolarHBondContact O-CB 3.28Å; D201-L205 PolarHBondContact O-N 3.3Å; A202-L205 PolarHBondContact O-N 2.81Å; L205-S207 VanDerWaalsContact C-N 3.3Å; L205-S207 PolarHBondContact O-N 3.1Å; L205-Q208 PolarHBondContact O-N 3.41Å; L205-Q208 VanDerWaalsContact O-N 3.16Å; L205-I209 HydrophobicContact CD1-CD1 3.82Å; L205-I209 HydrophobicContact CD1-CG1 4.02Å; L205-I209 HydrophobicContact CD2-CD1 4.37Å; L205-I209 HydrophobicContact CG-CD1 3.75Å; L205-I209 HydrophobicContact CG-CG1 4.36Å; L205-I209 WeakPolarHBondContact O-CG1 3.35Å; L205-I209 PolarHBondContact O-N 3.43Å; L205-T253 HydrophobicContact CD1-CG2 4.06Å; L205-T253 WeakPolarHBondContact CD1-O 3.22Å; L205-L255 HydrophobicContact CB-CD2 4.33Å; L205-L255 HydrophobicContact CD2-CD2 3.94Å; L205-L255 HydrophobicContact CD2-CG 3.68Å; L205-L258 HydrophobicContact CB-CD1 4.01Å
206	D	98.7	Very high	98.6	Very high	65 Å²	65	45.9 Å²	45.9	35%	0.348	22%	0.224	S	C	.	.	H	α-helix	trans	-59	-42.3	177.8	-175.6	59.5	0	0	0	111.5	A202 F203 Q208 I209 K210	A202-D206 PolarHBondContact O-N 3.04Å; F203-D206 PolarHBondContact O-N 3.47Å; D206-Q208 PolarHBondContact O-N 3.11Å; D206-I209 PolarHBondContact O-N 3.32Å; D206-K210 WeakPolarHBondContact O-CB 3.42Å; D206-K210 VanDerWaalsContact O-CG 3.31Å; D206-K210 WeakPolarHBondContact O-CG 3.41Å; D206-K210 PolarHBondContact O-N 3.19Å; D206-K210 WeakPolarHBondContact OD2-CD 3.3Å; D206-K210 WeakPolarHBondContact OD2-CE 3.3Å; D206-K210 IonicContact OD2-NZ 3.93Å; D206-K210 PolarHBondContact OD2-NZ 3.2Å
207	S	98.9	Very high	98.6	Very high	1 Å²	1	47 Å²	47	1%	0.007	23%	0.232	C	C	.	.	H	α-helix	trans	-57.9	-46.1	174.1	-175.5	0	0	0	0	112.4	F203 A204 L205 A211 E347 G371 G372	F203-S207 PolarHBondContact O-N 2.97Å; A204-S207 PolarHBondContact O-N 3.44Å; L205-S207 VanDerWaalsContact C-N 3.3Å; L205-S207 PolarHBondContact O-N 3.1Å; S207-A211 WeakPolarHBondContact O-CB 3.47Å; S207-A211 PolarHBondContact O-N 2.89Å; S207-E347 WeakPolarHBondContact CB-OE2 3.29Å; S207-E347 PolarHBondContact OG-OE1 2.91Å; S207-E347 PolarHBondContact OG-OE2 2.9Å; S207-G371 WeakPolarHBondContact O-CA 3.41Å; S207-G372 PolarHBondContact OG-N 3Å
208	Q	98.8	Very high	98.6	Very high	12 Å²	12	45.4 Å²	45.4	6%	0.056	23%	0.233	C	C	.	.	H	α-helix	trans	-64.7	-42.3	177	-72.7	-71.9	4.6	0	0	112.8	A204 L205 D206 A211 A212 G248 T253 A375	A204-Q208 PolarHBondContact O-N 3.45Å; A204-Q208 VanDerWaalsContact O-N 3.1Å; L205-Q208 PolarHBondContact O-N 3.41Å; L205-Q208 VanDerWaalsContact O-N 3.16Å; D206-Q208 PolarHBondContact O-N 3.11Å; Q208-A211 PolarHBondContact O-N 3.24Å; Q208-A212 VanDerWaalsContact O-CB 3.32Å; Q208-A212 WeakPolarHBondContact O-CB 3.42Å; Q208-A212 PolarHBondContact O-N 3.07Å; Q208-G248 PolarHBondContact NE2-O 3.03Å; Q208-T253 HydrophobicContact CG-CG2 4.45Å; Q208-A375 HydrophobicContact CG-CB 4.22Å
209	I	98.6	Very high	98.5	Very high	57 Å²	57	42.6 Å²	42.6	29%	0.292	22%	0.215	S	C	.	.	H	α-helix	trans	-63.1	-47.9	178	-70.7	171.4	0	0	0	110.5	L205 D206 A212 R213	L205-I209 HydrophobicContact CD1-CD1 3.82Å; L205-I209 HydrophobicContact CD1-CG1 4.02Å; L205-I209 HydrophobicContact CD2-CD1 4.37Å; L205-I209 HydrophobicContact CG-CD1 3.75Å; L205-I209 HydrophobicContact CG-CG1 4.36Å; L205-I209 WeakPolarHBondContact O-CG1 3.35Å; L205-I209 PolarHBondContact O-N 3.43Å; D206-I209 PolarHBondContact O-N 3.32Å; I209-A212 PolarHBondContact O-N 3.42Å; I209-R213 VanDerWaalsContact CG2-CZ 3.44Å; I209-R213 WeakPolarHBondContact O-CG 3.49Å; I209-R213 PolarHBondContact O-N 2.95Å
210	K	98.8	Very high	98.5	Very high	26 Å²	26	39.6 Å²	39.6	11%	0.113	20%	0.201	C	C	.	.	H	α-helix	trans	-62.2	-44.7	178.6	-70.4	-178.9	-55.9	-163.6	0	111.4	D206 R213 A214 V367 N368	D206-K210 WeakPolarHBondContact O-CB 3.42Å; D206-K210 VanDerWaalsContact O-CG 3.31Å; D206-K210 WeakPolarHBondContact O-CG 3.41Å; D206-K210 PolarHBondContact O-N 3.19Å; D206-K210 WeakPolarHBondContact OD2-CD 3.3Å; D206-K210 WeakPolarHBondContact OD2-CE 3.3Å; D206-K210 IonicContact OD2-NZ 3.93Å; D206-K210 PolarHBondContact OD2-NZ 3.2Å; K210-R213 PolarHBondContact O-N 2.92Å; K210-A214 WeakPolarHBondContact O-CB 3.45Å; K210-A214 PolarHBondContact O-N 3.06Å; K210-V367 PolarHBondContact NZ-O 2.77Å; K210-N368 WeakPolarHBondContact CD-O 3.32Å; K210-N368 WeakPolarHBondContact CE-O 3.5Å; K210-N368 PolarHBondContact NZ-O 2.92Å; K210-N368 VanDerWaalsContact NZ-O 3.16Å
211	A	98.8	Very high	98.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-41.9	177.2	0	0	0	0	0	112.8	S207 Q208 A214 R215 I249 L370 A375 L376	S207-A211 WeakPolarHBondContact O-CB 3.47Å; S207-A211 PolarHBondContact O-N 2.89Å; Q208-A211 PolarHBondContact O-N 3.24Å; A211-A214 PolarHBondContact O-N 3.29Å; A211-R215 WeakPolarHBondContact O-CB 3.42Å; A211-R215 PolarHBondContact O-N 2.86Å; A211-I249 HydrophobicContact CB-CD1 4.02Å; A211-I249 HydrophobicContact CB-CG1 3.96Å; A211-I249 HydrophobicContact CB-CG2 4.24Å; A211-L370 WeakPolarHBondContact CA-O 3.17Å; A211-L370 PolarHBondContact N-O 3.37Å; A211-A375 HydrophobicContact CB-CB 3.49Å; A211-A375 VanDerWaalsContact CB-CB 3.49Å; A211-L376 HydrophobicContact CB-CD2 4.13Å
212	A	98.7	Very high	98.2	Very high	7 Å²	7	49.5 Å²	49.5	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-47.8	175.5	0	0	0	0	0	111.4	Q208 I209 A214 R215 D216 I249 A251	Q208-A212 VanDerWaalsContact O-CB 3.32Å; Q208-A212 WeakPolarHBondContact O-CB 3.42Å; Q208-A212 PolarHBondContact O-N 3.07Å; I209-A212 PolarHBondContact O-N 3.42Å; A212-A214 PolarHBondContact O-N 2.91Å; A212-R215 PolarHBondContact O-N 2.89Å; A212-D216 WeakPolarHBondContact O-CB 3.32Å; A212-D216 PolarHBondContact O-N 3.4Å; A212-I249 HydrophobicContact CB-CG2 3.95Å; A212-A251 HydrophobicContact CB-CB 3.86Å
213	R	98.6	Very high	98.2	Very high	173 Å²	173	47.3 Å²	47.3	65%	0.653	23%	0.233	S	C	*	.	H	α-helix	trans	-60.8	-42.5	175.9	-70.9	174.6	-176.8	167.3	2.9	112.2	I209 K210 D216 S217	I209-R213 VanDerWaalsContact CG2-CZ 3.44Å; I209-R213 WeakPolarHBondContact O-CG 3.49Å; I209-R213 PolarHBondContact O-N 2.95Å; K210-R213 PolarHBondContact O-N 2.92Å; R213-D216 PolarHBondContact O-N 3.44Å; R213-S217 WeakPolarHBondContact O-CB 3.49Å; R213-S217 PolarHBondContact O-N 3.33Å; R213-S217 PolarHBondContact O-OG 2.8Å
214	A	98.6	Very high	98.2	Very high	2 Å²	2	46.3 Å²	46.3	2%	0.017	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-43.4	178.5	0	0	0	0	0	111.9	K210 A211 A212 S217 G218 R219 F220 L370	K210-A214 WeakPolarHBondContact O-CB 3.45Å; K210-A214 PolarHBondContact O-N 3.06Å; A211-A214 PolarHBondContact O-N 3.29Å; A212-A214 PolarHBondContact O-N 2.91Å; A214-S217 PolarHBondContact O-OG 2.9Å; A214-G218 PolarHBondContact O-N 3.43Å; A214-R219 HydrophobicContact CB-CB 4.18Å; A214-R219 WeakPolarHBondContact O-CB 3.4Å; A214-R219 PolarHBondContact O-N 3.33Å; A214-F220 HydrophobicContact CB-CD2 4.49Å; A214-F220 HydrophobicContact CB-CE1 4.3Å; A214-F220 HydrophobicContact CB-CE2 3.68Å; A214-F220 HydrophobicContact CB-CZ 3.58Å; A214-L370 HydrophobicContact CB-CB 3.91Å; A214-L370 HydrophobicContact CB-CD2 4.02Å; A214-L370 HydrophobicContact CB-CG 4.48Å
215	R	98	Very high	98.2	Very high	68 Å²	68	47.1 Å²	47.1	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-49.4	173.5	179.2	-162.8	68.5	-161.7	-4.6	111.7	A211 A212 S217 G218 F220 I249	A211-R215 WeakPolarHBondContact O-CB 3.42Å; A211-R215 PolarHBondContact O-N 2.86Å; A212-R215 PolarHBondContact O-N 2.89Å; R215-S217 PolarHBondContact O-N 2.93Å; R215-G218 PolarHBondContact O-N 3.04Å; R215-G218 VanDerWaalsContact O-N 3.07Å; R215-F220 HydrophobicContact CB-CD2 4.36Å; R215-F220 HydrophobicContact CB-CE2 4.36Å; R215-I249 HydrophobicContact CB-CD1 3.98Å; R215-I249 HydrophobicContact CG-CD1 4.45Å
216	D	97.9	Very high	98.1	Very high	114 Å²	114	48.3 Å²	48.3	61%	0.61	24%	0.243	S	C	*	.	H	α-helix	trans	-70.1	-23.3	-174	-62.9	-13	0	0	0	112.1	A212 R213	A212-D216 WeakPolarHBondContact O-CB 3.32Å; A212-D216 PolarHBondContact O-N 3.4Å; R213-D216 PolarHBondContact O-N 3.44Å
217	S	97.4	Very high	98.1	Very high	73 Å²	73	45.6 Å²	45.6	51%	0.51	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	8.8	172.6	57.1	0	0	0	0	114.4	R213 A214 R215 R219	R213-S217 WeakPolarHBondContact O-CB 3.49Å; R213-S217 PolarHBondContact O-N 3.33Å; R213-S217 PolarHBondContact O-OG 2.8Å; A214-S217 PolarHBondContact O-OG 2.9Å; R215-S217 PolarHBondContact O-N 2.93Å; S217-R219 VanDerWaalsContact C-N 3.26Å; S217-R219 PolarHBondContact O-N 2.84Å; S217-R219 WeakPolarHBondContact OG-CG 3.36Å
218	G	97.8	Very high	98	Very high	22 Å²	22	48.6 Å²	48.6	23%	0.227	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.4	18.5	176	0	0	0	0	0	114.8	A214 R215 F220 D221	A214-G218 PolarHBondContact O-N 3.43Å; R215-G218 PolarHBondContact O-N 3.04Å; R215-G218 VanDerWaalsContact O-N 3.07Å; G218-F220 PolarHBondContact O-N 2.94Å; G218-F220 VanDerWaalsContact O-N 3.13Å; G218-D221 VanDerWaalsContact CA-OD2 3.3Å; G218-D221 WeakPolarHBondContact CA-OD2 3.12Å; G218-D221 WeakPolarHBondContact O-CB 3.24Å; G218-D221 PolarHBondContact O-N 3.35Å; G218-D221 VanDerWaalsContact O-N 3.08Å
219	R	97.9	Very high	97.9	Very high	94 Å²	94	48.2 Å²	48.2	36%	0.355	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.3	-175.9	-70.5	-173.2	176.5	-118.5	0.7	113.8	A214 S217 L370 E394 R397	A214-R219 HydrophobicContact CB-CB 4.18Å; A214-R219 WeakPolarHBondContact O-CB 3.4Å; A214-R219 PolarHBondContact O-N 3.33Å; S217-R219 VanDerWaalsContact C-N 3.26Å; S217-R219 PolarHBondContact O-N 2.84Å; S217-R219 WeakPolarHBondContact OG-CG 3.36Å; R219-L370 HydrophobicContact CB-CD1 4.47Å; R219-E394 IonicContact NH1-OE1 2.93Å; R219-E394 PolarHBondContact NH1-OE1 2.95Å; R219-E394 IonicContact NH1-OE2 3.86Å; R219-E394 PolarHBondContact NH1-OE2 2.86Å; R219-R397 PolarHBondContact O-NH1 3.25Å
220	F	98.5	Very high	97.7	Very high	5 Å²	5	48.5 Å²	48.5	2%	0.022	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-7.5	177.5	-56.5	-51.1	0	0	0	113.8	R46 A214 R215 G218 Q222 E223 I224 I249 L370 L376	R46-F220 VanDerWaalsContact NH2-CD1 3.31Å; A214-F220 HydrophobicContact CB-CD2 4.49Å; A214-F220 HydrophobicContact CB-CE1 4.3Å; A214-F220 HydrophobicContact CB-CE2 3.68Å; A214-F220 HydrophobicContact CB-CZ 3.58Å; R215-F220 HydrophobicContact CB-CD2 4.36Å; R215-F220 HydrophobicContact CB-CE2 4.36Å; G218-F220 PolarHBondContact O-N 2.94Å; G218-F220 VanDerWaalsContact O-N 3.13Å; F220-Q222 VanDerWaalsContact C-N 3.28Å; F220-Q222 PolarHBondContact O-N 2.53Å; F220-E223 HydrophobicContact CB-CG 4.23Å; F220-E223 HydrophobicContact CD1-CG 4.4Å; F220-E223 WeakPolarHBondContact CD1-OE1 3.48Å; F220-E223 WeakPolarHBondContact O-CG 3.44Å; F220-E223 PolarHBondContact O-N 3.14Å; F220-E223 VanDerWaalsContact O-N 3.12Å; F220-I224 HydrophobicContact CB-CD1 3.78Å; F220-I224 HydrophobicContact CB-CG1 4.26Å; F220-I224 WeakPolarHBondContact O-CG1 3.42Å; F220-I224 PolarHBondContact O-N 3.17Å; F220-I249 HydrophobicContact CE2-CD1 4.33Å; F220-L370 HydrophobicContact CE1-CB 3.97Å; F220-L370 HydrophobicContact CE1-CD1 4.26Å; F220-L370 HydrophobicContact CZ-CB 4.07Å; F220-L370 WeakPolarHBondContact CZ-O 3.43Å; F220-L376 HydrophobicContact CE2-CD2 4.13Å; F220-L376 HydrophobicContact CZ-CD1 4.44Å; F220-L376 HydrophobicContact CZ-CD2 3.97Å
221	D	96.4	Very high	97.4	Very high	112 Å²	112	48.2 Å²	48.2	60%	0.599	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-32.1	-171.1	-65.1	-13.2	0	0	0	112.2	G218	G218-D221 VanDerWaalsContact CA-OD2 3.3Å; G218-D221 WeakPolarHBondContact CA-OD2 3.12Å; G218-D221 WeakPolarHBondContact O-CB 3.24Å; G218-D221 PolarHBondContact O-N 3.35Å; G218-D221 VanDerWaalsContact O-N 3.08Å
222	Q	94.9	Very high	97.1	Very high	102 Å²	102	54.7 Å²	54.7	48%	0.477	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-23.3	177.8	-67.3	-176.8	-10.5	0	0	113.5	F220	F220-Q222 VanDerWaalsContact C-N 3.28Å; F220-Q222 PolarHBondContact O-N 2.53Å
223	E	98.1	Very high	96.5	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-28.4	-176.7	52	-174.1	-109.2	0	0	112.8	R46 F220 V389 T390	R46-E223 HydrophobicContact CG-CB 4.33Å; R46-E223 WeakPolarHBondContact CG-O 3.07Å; R46-E223 IonicContact CZ-OE1 3.51Å; R46-E223 PolarHBondContact N-O 2.84Å; R46-E223 IonicContact NE-OE1 2.76Å; R46-E223 PolarHBondContact NE-OE1 3.27Å; R46-E223 IonicContact NH2-OE1 3.47Å; R46-E223 PolarHBondContact NH2-OE1 3.3Å; R46-E223 VanDerWaalsContact NH2-OE1 3.15Å; F220-E223 HydrophobicContact CB-CG 4.23Å; F220-E223 HydrophobicContact CD1-CG 4.4Å; F220-E223 WeakPolarHBondContact CD1-OE1 3.48Å; F220-E223 WeakPolarHBondContact O-CG 3.44Å; F220-E223 PolarHBondContact O-N 3.14Å; F220-E223 VanDerWaalsContact O-N 3.12Å; E223-V389 HydrophobicContact CB-CG1 3.51Å; E223-T390 PolarHBondContact OE1-OG1 3.44Å; E223-T390 WeakPolarHBondContact OE2-CA 3.3Å
224	I	98.8	Very high	95.8	Very high	9 Å²	9	60 Å²	60	5%	0.046	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.8	-179	-68.6	175.9	0	0	0	111.3	R45 R46 A48 F220	R45-I224 PolarHBondContact NH2-O 3.47Å; R46-I224 HydrophobicContact CG-CG1 4.35Å; R46-I224 VanDerWaalsContact CZ-CG1 3.46Å; R46-I224 CarbonylContact O-C 3.58Å; R46-I224 VanDerWaalsContact O-CA 3.25Å; R46-I224 WeakPolarHBondContact O-CA 3.49Å; A48-I224 HydrophobicContact CB-CD1 4.48Å; A48-I224 HydrophobicContact CB-CG2 4.38Å; F220-I224 HydrophobicContact CB-CD1 3.78Å; F220-I224 HydrophobicContact CB-CG1 4.26Å; F220-I224 WeakPolarHBondContact O-CG1 3.42Å; F220-I224 PolarHBondContact O-N 3.17Å
225	V	98.6	Very high	95.3	Very high	17 Å²	17	64.7 Å²	64.7	10%	0.103	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128	160.2	61.7	0	0	0	0	109.7	R46 T47 V69 A72 V227	R46-V225 PolarHBondContact O-N 3.36Å; T47-V225 HydrophobicContact CG2-CG1 4.47Å; V69-V225 HydrophobicContact CG1-CG1 3.73Å; A72-V225 HydrophobicContact CB-CB 4.04Å; A72-V225 HydrophobicContact CB-CG1 4.47Å; A72-V225 HydrophobicContact CB-CG2 3.77Å; V225-V227 PolarHBondContact O-N 2.82Å
226	P	98.1	Very high	94.8	Very high	56 Å²	56	63.7 Å²	63.7	36%	0.364	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-65.6	126.4	171.7	-21.9	33.8	0	0	0	111.8	Q242 V243 R244	P226-Q242 HydrophobicContact CB-CG 3.78Å; P226-V243 CarbonylContact C-O 3.58Å; P226-V243 VanDerWaalsContact CA-O 3.31Å; P226-V243 WeakPolarHBondContact CA-O 3.2Å; P226-R244 HydrophobicContact CB-CB 4.23Å; P226-R244 HydrophobicContact CG-CB 4.32Å
227	V	98.3	Very high	94.5	Very high	8 Å²	8	67.2 Å²	67.2	5%	0.048	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	126.2	179.4	-171.5	0	0	0	0	109.8	T47 F57 L65 A68 V225 V229 Q242 V243	T47-V227 HydrophobicContact CG2-CG2 3.66Å; F57-V227 HydrophobicContact CE1-CB 3.99Å; F57-V227 HydrophobicContact CE1-CG1 4.26Å; F57-V227 HydrophobicContact CE1-CG2 4.49Å; F57-V227 HydrophobicContact CZ-CB 4.19Å; F57-V227 HydrophobicContact CZ-CG2 4.23Å; L65-V227 HydrophobicContact CD2-CG1 4.4Å; A68-V227 HydrophobicContact CB-CG1 4.37Å; A68-V227 HydrophobicContact CB-CG2 4.03Å; V225-V227 PolarHBondContact O-N 2.82Å; V227-V229 HydrophobicContact CB-CG1 4.37Å; V227-V229 HydrophobicContact CG1-CG1 3.71Å; V227-Q242 CarbonylContact O-C 3.56Å; V227-Q242 WeakPolarHBondContact O-CA 3.24Å; V227-V243 PolarHBondContact N-O 3.31Å; V227-V243 PolarHBondContact O-N 3.24Å
228	S	97.3	Very high	94.4	Very high	64 Å²	64	68.9 Å²	68.9	45%	0.448	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	121.7	172.8	-67.5	0	0	0	0	109.7
229	V	95.3	Very high	94.2	Very high	3 Å²	3	76.2 Å²	76.2	2%	0.018	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	157.9	-176.5	-57	0	0	0	0	111.6	F57 T60 V227 V231 R240 L241 V243	F57-V229 HydrophobicContact CD1-CG1 3.86Å; F57-V229 HydrophobicContact CE1-CG1 3.81Å; T60-V229 HydrophobicContact CG2-CG1 3.95Å; T60-V229 WeakPolarHBondContact OG1-CG1 3.36Å; V227-V229 HydrophobicContact CB-CG1 4.37Å; V227-V229 HydrophobicContact CG1-CG1 3.71Å; V229-V231 HydrophobicContact CG2-CG2 4.01Å; V229-R240 WeakPolarHBondContact O-CA 3.13Å; V229-L241 HydrophobicContact CG2-CD1 3.41Å; V229-L241 VanDerWaalsContact CG2-CD1 3.41Å; V229-L241 HydrophobicContact CG2-CG 3.73Å; V229-L241 PolarHBondContact N-O 3.2Å; V229-L241 PolarHBondContact O-N 2.97Å; V229-V243 HydrophobicContact CG2-CG2 3.69Å
230	T	95.1	Very high	94	Very high	63 Å²	63	81 Å²	81	39%	0.387	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	123.2	170.5	-60.6	0	0	0	0	108.6	E238	T230-E238 HydrophobicContact CG2-CB 3.75Å; T230-E238 HydrophobicContact CG2-CG 3.87Å
231	V	92.6	Very high	93.8	Very high	20 Å²	20	82.4 Å²	82.4	12%	0.121	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	136.6	179	-177.6	0	0	0	0	109.6	S56 K58 D59 V229 R239 L241	S56-V231 WeakPolarHBondContact O-CG2 3.29Å; K58-V231 HydrophobicContact CG-CG1 4.42Å; D59-V231 WeakPolarHBondContact OD2-CA 3.48Å; V229-V231 HydrophobicContact CG2-CG2 4.01Å; V231-R239 PolarHBondContact N-O 3.23Å; V231-R239 PolarHBondContact O-N 3.09Å; V231-L241 HydrophobicContact CB-CD2 3.93Å; V231-L241 HydrophobicContact CG2-CD2 3.58Å; V231-L241 HydrophobicContact CG2-CG 4.24Å
232	R	91.5	Very high	93.8	Very high	136 Å²	136	81.7 Å²	81.7	51%	0.513	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.6	173.9	-69.2	175.5	-178.5	173.8	1.8	110.3	K58 D59 R237 E238	K58-R232 WeakPolarHBondContact CE-O 3.37Å; K58-R232 PolarHBondContact NZ-O 3.28Å; D59-R232 PolarHBondContact OD2-N 2.9Å; R232-R237 WeakPolarHBondContact CA-O 3.31Å; R232-E238 HydrophobicContact CG-CG 3.73Å; R232-E238 IonicContact CZ-OE1 3.09Å; R232-E238 IonicContact NE-OE1 3.76Å; R232-E238 PolarHBondContact NE-OE1 3.49Å; R232-E238 IonicContact NH2-OE1 3.67Å; R232-E238 PolarHBondContact NH2-OE1 3.39Å
233	D	85.9	Confident	94	Very high	79 Å²	79	77.1 Å²	77.1	42%	0.422	38%	0.378	S	S	.	.			trans	-76	178.8	170.6	70.1	21.7	0	0	0	112.1	S235 G236 R237	D233-S235 PolarHBondContact O-N 3.29Å; D233-S235 WeakPolarHBondContact OD1-CA 3.37Å; D233-S235 WeakPolarHBondContact OD1-CB 3.22Å; D233-S235 PolarHBondContact OD1-N 3.15Å; D233-S235 PolarHBondContact OD1-OG 3.46Å; D233-S235 PolarHBondContact OD2-OG 3.31Å; D233-G236 PolarHBondContact O-N 3.32Å; D233-G236 PolarHBondContact OD1-N 3.43Å; D233-G236 VanDerWaalsContact OD1-N 3.1Å; D233-R237 PolarHBondContact N-O 2.93Å; D233-R237 PolarHBondContact OD1-N 2.72Å; D233-R237 WeakPolarHBondContact OD2-CB 3.36Å
234	E	85	Confident	93.9	Very high	213 Å²	213	83.4 Å²	83.4	100%	0.995	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.2	-179.8	-63.3	-177.7	166.9	0	0	113.3	G236	E234-G236 VanDerWaalsContact C-N 3.3Å
235	S	88.1	Confident	93.9	Very high	101 Å²	101	91 Å²	91	71%	0.706	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.1	174.9	76.1	0	0	0	0	113.3	D233 R237	D233-S235 PolarHBondContact O-N 3.29Å; D233-S235 WeakPolarHBondContact OD1-CA 3.37Å; D233-S235 WeakPolarHBondContact OD1-CB 3.22Å; D233-S235 PolarHBondContact OD1-N 3.15Å; D233-S235 PolarHBondContact OD1-OG 3.46Å; D233-S235 PolarHBondContact OD2-OG 3.31Å; S235-R237 VanDerWaalsContact C-N 3.32Å
236	G	87	Confident	93.9	Very high	47 Å²	47	90.6 Å²	90.6	49%	0.485	43%	0.427	S	S	.	.			trans	82.4	5	-176.1	0	0	0	0	0	114.2	D233 E234	D233-G236 PolarHBondContact O-N 3.32Å; D233-G236 PolarHBondContact OD1-N 3.43Å; D233-G236 VanDerWaalsContact OD1-N 3.1Å; E234-G236 VanDerWaalsContact C-N 3.3Å
237	R	91.8	Very high	93.9	Very high	187 Å²	187	90.5 Å²	90.5	71%	0.706	42%	0.422	S	S	*	.			trans	-75.2	133	177.8	-177.3	-178.2	-178.6	173.7	2.6	110	R232 D233 S235	R232-R237 WeakPolarHBondContact CA-O 3.31Å; D233-R237 PolarHBondContact N-O 2.93Å; D233-R237 PolarHBondContact OD1-N 2.72Å; D233-R237 WeakPolarHBondContact OD2-CB 3.36Å; S235-R237 VanDerWaalsContact C-N 3.32Å
238	E	94.6	Very high	93.9	Very high	108 Å²	108	90.2 Å²	90.2	51%	0.505	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	134.5	177.3	-72.2	-174.8	172.9	0	0	111.6	T230 R232	T230-E238 HydrophobicContact CG2-CB 3.75Å; T230-E238 HydrophobicContact CG2-CG 3.87Å; R232-E238 HydrophobicContact CG-CG 3.73Å; R232-E238 IonicContact CZ-OE1 3.09Å; R232-E238 IonicContact NE-OE1 3.76Å; R232-E238 PolarHBondContact NE-OE1 3.49Å; R232-E238 IonicContact NH2-OE1 3.67Å; R232-E238 PolarHBondContact NH2-OE1 3.39Å
239	R	93.5	Very high	93.9	Very high	177 Å²	177	88 Å²	88	67%	0.668	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	124.5	174.3	176.4	177.5	159.4	-168.9	-6.4	109.4	V231	V231-R239 PolarHBondContact N-O 3.23Å; V231-R239 PolarHBondContact O-N 3.09Å
240	R	94.5	Very high	94	Very high	193 Å²	193	94.5 Å²	94.5	73%	0.728	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	136	170.9	-165.4	172.2	-178.6	173.1	0.8	110.2	V229	V229-R240 WeakPolarHBondContact O-CA 3.13Å
241	L	94.9	Very high	94	Very high	36 Å²	36	94.5 Å²	94.5	19%	0.188	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	156.7	178.7	60.4	97.7	0	0	0	110.9	V229 V231 V243	V229-L241 HydrophobicContact CG2-CD1 3.41Å; V229-L241 VanDerWaalsContact CG2-CD1 3.41Å; V229-L241 HydrophobicContact CG2-CG 3.73Å; V229-L241 PolarHBondContact N-O 3.2Å; V229-L241 PolarHBondContact O-N 2.97Å; V231-L241 HydrophobicContact CB-CD2 3.93Å; V231-L241 HydrophobicContact CG2-CD2 3.58Å; V231-L241 HydrophobicContact CG2-CG 4.24Å; L241-V243 HydrophobicContact CD1-CG2 3.28Å
242	Q	96.8	Very high	94.1	Very high	96 Å²	96	96.5 Å²	96.5	45%	0.449	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	110.8	176.6	-167.5	-177.7	38.5	0	0	108.9	P226 V227	P226-Q242 HydrophobicContact CB-CG 3.78Å; V227-Q242 CarbonylContact O-C 3.56Å; V227-Q242 WeakPolarHBondContact O-CA 3.24Å
243	V	98	Very high	94.4	Very high	7 Å²	7	91.3 Å²	91.3	4%	0.042	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120.9	179.8	-168.5	0	0	0	0	109	A48 F57 P226 V227 V229 L241	A48-V243 HydrophobicContact CB-CG1 3.87Å; F57-V243 HydrophobicContact CD1-CG2 4.12Å; F57-V243 HydrophobicContact CE1-CB 3.64Å; F57-V243 HydrophobicContact CE1-CG1 3.95Å; F57-V243 HydrophobicContact CE1-CG2 3.54Å; F57-V243 HydrophobicContact CE2-CG1 4.27Å; F57-V243 HydrophobicContact CZ-CB 3.73Å; F57-V243 HydrophobicContact CZ-CG1 3.66Å; F57-V243 HydrophobicContact CZ-CG2 4.13Å; P226-V243 CarbonylContact C-O 3.58Å; P226-V243 VanDerWaalsContact CA-O 3.31Å; P226-V243 WeakPolarHBondContact CA-O 3.2Å; V227-V243 PolarHBondContact N-O 3.31Å; V227-V243 PolarHBondContact O-N 3.24Å; V229-V243 HydrophobicContact CG2-CG2 3.69Å; L241-V243 HydrophobicContact CD1-CG2 3.28Å
244	R	97.3	Very high	94.9	Very high	131 Å²	131	89.9 Å²	89.9	49%	0.494	44%	0.436	S	S	.	.			trans	-138.5	7.4	-177.2	54.3	166	153.6	-95.6	-4.5	114.2	P226	P226-R244 HydrophobicContact CB-CB 4.23Å; P226-R244 HydrophobicContact CG-CB 4.32Å
245	R	97.6	Very high	95.5	Very high	168 Å²	168	83.1 Å²	83.1	63%	0.634	41%	0.407	S	S	*	.	S	Bend	trans	-141.5	140.8	-177.3	-69.1	-176.5	179	-179	-1.6	110	A48	A48-R245 WeakPolarHBondContact CB-O 3.13Å
246	D	98.6	Very high	96	Very high	10 Å²	10	84.2 Å²	84.2	5%	0.053	40%	0.401	C	S	.	.			trans	-63.7	131.3	174.3	-59	-51.3	0	0	0	110.2	R46 A48 I49 I249 L376	R46-D246 IonicContact CZ-OD1 2.94Å; R46-D246 IonicContact CZ-OD2 3.36Å; R46-D246 IonicContact NH1-OD1 2.84Å; R46-D246 PolarHBondContact NH1-OD1 2.9Å; R46-D246 IonicContact NH1-OD2 2.71Å; R46-D246 PolarHBondContact NH1-OD2 3.2Å; R46-D246 IonicContact NH2-OD1 3.33Å; R46-D246 IonicContact NH2-OD2 3.15Å; R46-D246 PolarHBondContact NH2-OD2 2.83Å; A48-D246 WeakPolarHBondContact CA-OD1 2.93Å; I49-D246 PolarHBondContact N-OD1 3.12Å; D246-I249 HydrophobicContact CB-CD1 4.13Å; D246-I249 HydrophobicContact CB-CG1 4.41Å; D246-L376 HydrophobicContact CB-CD2 4.28Å
247	E	98.3	Very high	96.4	Very high	54 Å²	54	85.7 Å²	85.7	25%	0.252	40%	0.398	S	S	.	.	S	Bend	trans	-91.1	-14	-171.2	-62.6	-178	151.2	0	0	113.7	I49 G50 K51 G55 S56 I249	I49-E247 PolarHBondContact O-N 3.11Å; G50-E247 VanDerWaalsContact CA-OE2 3.29Å; G50-E247 WeakPolarHBondContact CA-OE2 3.4Å; K51-E247 HydrophobicContact CD-CB 4.26Å; K51-E247 WeakPolarHBondContact CD-O 3.01Å; K51-E247 HydrophobicContact CG-CB 4.07Å; K51-E247 PolarHBondContact N-OE2 2.96Å; G55-E247 WeakPolarHBondContact CA-OE2 3.19Å; S56-E247 WeakPolarHBondContact CB-OE1 3.32Å; S56-E247 PolarHBondContact N-OE1 2.91Å; S56-E247 PolarHBondContact N-OE2 2.9Å; S56-E247 PolarHBondContact OG-OE1 2.85Å; E247-I249 VanDerWaalsContact C-N 3.35Å
248	G	97.9	Very high	96.7	Very high	2 Å²	2	77.2 Å²	77.2	2%	0.021	37%	0.366	C	S	.	.			trans	-77.7	-16.7	-174.9	0	0	0	0	0	114.7	Q208 R250 Q278 A375	Q208-G248 PolarHBondContact NE2-O 3.03Å; G248-R250 PolarHBondContact O-N 3.1Å; G248-Q278 VanDerWaalsContact CA-OE1 3.31Å; G248-Q278 PolarHBondContact O-NE2 2.93Å; G248-A375 CarbonylContact C-O 3.58Å; G248-A375 VanDerWaalsContact CA-O 3.24Å; G248-A375 WeakPolarHBondContact CA-O 3.33Å
249	I	98.6	Very high	96.9	Very high	16 Å²	16	75 Å²	75	8%	0.082	37%	0.367	C	S	.	.			trans	-74.5	122.4	-170.7	-57.1	173.7	0	0	0	110.7	A211 A212 R215 F220 D246 E247 A375 L376	A211-I249 HydrophobicContact CB-CD1 4.02Å; A211-I249 HydrophobicContact CB-CG1 3.96Å; A211-I249 HydrophobicContact CB-CG2 4.24Å; A212-I249 HydrophobicContact CB-CG2 3.95Å; R215-I249 HydrophobicContact CB-CD1 3.98Å; R215-I249 HydrophobicContact CG-CD1 4.45Å; F220-I249 HydrophobicContact CE2-CD1 4.33Å; D246-I249 HydrophobicContact CB-CD1 4.13Å; D246-I249 HydrophobicContact CB-CG1 4.41Å; E247-I249 VanDerWaalsContact C-N 3.35Å; I249-A375 PolarHBondContact N-O 3.3Å; I249-L376 HydrophobicContact CD1-CD2 3.9Å; I249-L376 HydrophobicContact CG1-CD2 4.11Å
250	R	97.5	Very high	97.1	Very high	140 Å²	140	75.9 Å²	75.9	53%	0.528	37%	0.37	S	S	.	.			trans	-119.8	90.6	179.5	-60.4	-173.1	-167.7	-156.5	8.5	110.2	G248 G252 T253	G248-R250 PolarHBondContact O-N 3.1Å; R250-G252 PolarHBondContact O-N 3.47Å; R250-G252 VanDerWaalsContact O-N 3.16Å; R250-T253 WeakPolarHBondContact CB-OG1 3.23Å; R250-T253 PolarHBondContact O-N 2.81Å; R250-T253 VanDerWaalsContact O-N 3.17Å; R250-T253 PolarHBondContact O-OG1 3.45Å; R250-T253 VanDerWaalsContact O-OG1 3.11Å
251	A	93.8	Very high	97.2	Very high	63 Å²	63	69.9 Å²	69.9	52%	0.521	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.2	-176.9	0	0	0	0	0	114.2	A212	A212-A251 HydrophobicContact CB-CB 3.86Å
252	G	95.1	Very high	97.4	Very high	62 Å²	62	78.7 Å²	78.7	64%	0.639	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	8.9	179	0	0	0	0	0	115	R250 T254	R250-G252 PolarHBondContact O-N 3.47Å; R250-G252 VanDerWaalsContact O-N 3.16Å; G252-T254 PolarHBondContact O-N 3.25Å
253	T	96.6	Very high	97.4	Very high	27 Å²	27	76.3 Å²	76.3	17%	0.166	38%	0.376	C	S	.	.			trans	-60.2	133.3	176.8	-67.4	0	0	0	0	110.5	L205 Q208 R250 L258	L205-T253 HydrophobicContact CD1-CG2 4.06Å; L205-T253 WeakPolarHBondContact CD1-O 3.22Å; Q208-T253 HydrophobicContact CG-CG2 4.45Å; R250-T253 WeakPolarHBondContact CB-OG1 3.23Å; R250-T253 PolarHBondContact O-N 2.81Å; R250-T253 VanDerWaalsContact O-N 3.17Å; R250-T253 PolarHBondContact O-OG1 3.45Å; R250-T253 VanDerWaalsContact O-OG1 3.11Å; T253-L258 HydrophobicContact CG2-CD1 3.77Å; T253-L258 HydrophobicContact CG2-CD2 3.9Å; T253-L258 HydrophobicContact CG2-CG 3.73Å
254	T	97.9	Very high	97.4	Very high	49 Å²	49	78.6 Å²	78.6	30%	0.301	40%	0.395	S	S	.	.			trans	-123.1	160.3	176.5	65.9	0	0	0	0	110.8	G252 E256 D257 L258	G252-T254 PolarHBondContact O-N 3.25Å; T254-E256 VanDerWaalsContact C-N 3.26Å; T254-E256 WeakPolarHBondContact CB-OE2 3.26Å; T254-E256 PolarHBondContact O-N 3.49Å; T254-D257 PolarHBondContact O-N 2.96Å; T254-D257 WeakPolarHBondContact OG1-CB 3.36Å; T254-D257 PolarHBondContact OG1-N 3.4Å; T254-D257 PolarHBondContact OG1-OD2 3.44Å; T254-L258 WeakPolarHBondContact O-CG 3.09Å; T254-L258 PolarHBondContact O-N 3.37Å; T254-L258 VanDerWaalsContact O-N 3.08Å
255	L	97.3	Very high	97.3	Very high	72 Å²	72	76.8 Å²	76.8	38%	0.377	39%	0.391	S	S	.	.	H	α-helix	trans	-63.6	-36.7	174.1	-77	179.2	0	0	0	111.2	D201 A202 L205 L258 A259	D201-L255 HydrophobicContact CB-CD2 4.34Å; A202-L255 HydrophobicContact CB-CD2 4.42Å; L205-L255 HydrophobicContact CB-CD2 4.33Å; L205-L255 HydrophobicContact CD2-CD2 3.94Å; L205-L255 HydrophobicContact CD2-CG 3.68Å; L255-L258 PolarHBondContact O-N 3.48Å; L255-A259 VanDerWaalsContact O-CB 3.27Å; L255-A259 WeakPolarHBondContact O-CB 3.4Å; L255-A259 PolarHBondContact O-N 3.27Å
256	E	97.5	Very high	97.1	Very high	123 Å²	123	71.3 Å²	71.3	58%	0.575	37%	0.372	S	S	*	.	H	α-helix	trans	-62.3	-43.1	178.2	-65.6	74.3	-164.8	0	0	111.3	T254 R260	T254-E256 VanDerWaalsContact C-N 3.26Å; T254-E256 WeakPolarHBondContact CB-OE2 3.26Å; T254-E256 PolarHBondContact O-N 3.49Å; E256-R260 VanDerWaalsContact O-CG 3.29Å; E256-R260 WeakPolarHBondContact O-CG 3.44Å; E256-R260 PolarHBondContact O-N 3.14Å
257	D	97.1	Very high	96.8	Very high	79 Å²	79	76.7 Å²	76.7	42%	0.422	41%	0.407	S	S	.	.	H	α-helix	trans	-67.4	-42.1	176.7	-68.4	-36.2	0	0	0	111.8	T254 R260	T254-D257 PolarHBondContact O-N 2.96Å; T254-D257 WeakPolarHBondContact OG1-CB 3.36Å; T254-D257 PolarHBondContact OG1-N 3.4Å; T254-D257 PolarHBondContact OG1-OD2 3.44Å; D257-R260 PolarHBondContact O-N 3.08Å
258	L	98.1	Very high	96.5	Very high	9 Å²	9	81.8 Å²	81.8	5%	0.047	44%	0.436	C	S	.	.	H	α-helix	trans	-63.2	-43.4	176.5	-69.6	175.4	0	0	0	111.4	R197 D201 A204 L205 T253 T254 L255 R260 L261	R197-L258 PolarHBondContact NH2-O 2.97Å; D201-L258 HydrophobicContact CB-CB 3.94Å; D201-L258 HydrophobicContact CB-CD1 4.13Å; D201-L258 VanDerWaalsContact O-CD1 3.24Å; D201-L258 WeakPolarHBondContact O-CD1 3.37Å; A204-L258 HydrophobicContact CB-CD1 4.2Å; L205-L258 HydrophobicContact CB-CD1 4.01Å; T253-L258 HydrophobicContact CG2-CD1 3.77Å; T253-L258 HydrophobicContact CG2-CD2 3.9Å; T253-L258 HydrophobicContact CG2-CG 3.73Å; T254-L258 WeakPolarHBondContact O-CG 3.09Å; T254-L258 PolarHBondContact O-N 3.37Å; T254-L258 VanDerWaalsContact O-N 3.08Å; L255-L258 PolarHBondContact O-N 3.48Å; L258-R260 VanDerWaalsContact C-N 3.25Å; L258-R260 PolarHBondContact O-N 3.4Å; L258-L261 HydrophobicContact CD2-CD1 4.13Å; L258-L261 WeakPolarHBondContact O-CB 3.06Å; L258-L261 PolarHBondContact O-N 2.89Å; L258-L261 VanDerWaalsContact O-N 3.08Å
259	A	97.5	Very high	96.5	Very high	62 Å²	62	82.1 Å²	82.1	51%	0.512	44%	0.439	S	S	.	.	H	α-helix	trans	-62.8	-30.7	179.6	0	0	0	0	0	112.8	R197 L255 L261	R197-A259 PolarHBondContact NH2-O 3.01Å; L255-A259 VanDerWaalsContact O-CB 3.27Å; L255-A259 WeakPolarHBondContact O-CB 3.4Å; L255-A259 PolarHBondContact O-N 3.27Å; A259-L261 VanDerWaalsContact C-N 3.28Å; A259-L261 PolarHBondContact O-N 3.28Å
260	R	97.6	Very high	96.5	Very high	194 Å²	194	83 Å²	83	73%	0.732	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-16.6	176.5	-73	169.6	-179.3	179.1	1.5	113.8	E256 D257 L258 R262	E256-R260 VanDerWaalsContact O-CG 3.29Å; E256-R260 WeakPolarHBondContact O-CG 3.44Å; E256-R260 PolarHBondContact O-N 3.14Å; D257-R260 PolarHBondContact O-N 3.08Å; L258-R260 VanDerWaalsContact C-N 3.25Å; L258-R260 PolarHBondContact O-N 3.4Å; R260-R262 PolarHBondContact O-N 2.98Å
261	L	98.1	Very high	96.5	Very high	67 Å²	67	76.3 Å²	76.3	35%	0.351	42%	0.421	S	S	.	.	S	Bend	trans	-68.1	133.7	-179.1	-63.3	176.8	0	0	0	111	R197 L258 A259 T272 G274	R197-L261 PolarHBondContact NH2-O 3.34Å; L258-L261 HydrophobicContact CD2-CD1 4.13Å; L258-L261 WeakPolarHBondContact O-CB 3.06Å; L258-L261 PolarHBondContact O-N 2.89Å; L258-L261 VanDerWaalsContact O-N 3.08Å; A259-L261 VanDerWaalsContact C-N 3.28Å; A259-L261 PolarHBondContact O-N 3.28Å; L261-T272 HydrophobicContact CB-CG2 4.09Å; L261-G274 VanDerWaalsContact CD1-CA 3.47Å
262	R	97.8	Very high	96.8	Very high	221 Å²	221	73.3 Å²	73.3	83%	0.834	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-71.1	145.3	175.3	-72.7	-176.8	-93.6	-177.9	-6.2	110.5	R260	R260-R262 PolarHBondContact O-N 2.98Å
263	P	98.2	Very high	96.9	Very high	47 Å²	47	74.2 Å²	74.2	31%	0.305	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-54.6	139.9	170.7	-27.2	38.1	0	0	0	111.8	K266 G269 T271	P263-K266 WeakPolarHBondContact CB-O 3.36Å; P263-G269 WeakPolarHBondContact CG-O 3.41Å; P263-T271 CarbonylContact C-O 3.59Å; P263-T271 WeakPolarHBondContact CA-O 3.18Å
264	A	96.9	Very high	97	Very high	55 Å²	55	73.7 Å²	73.7	46%	0.455	40%	0.397	S	S	.	.	S	Bend	trans	-93.5	-23.1	-173.2	0	0	0	0	0	113.8	T271	A264-T271 PolarHBondContact N-O 3.01Å
265	F	95.4	Very high	97	Very high	92 Å²	92	71.4 Å²	71.4	40%	0.404	38%	0.383	S	S	.	.	S	Bend	trans	-127	-34.1	-167.9	-56.8	-73.5	0	0	0	115.1	G183 V184 T271 F349	G183-F265 VanDerWaalsContact CA-CD2 3.45Å; G183-F265 VanDerWaalsContact CA-CE2 3.5Å; V184-F265 HydrophobicContact CG2-CB 4.37Å; F265-T271 HydrophobicContact CD2-CG2 3.69Å; F265-T271 HydrophobicContact CE2-CG2 3.61Å; F265-F349 AromaticContact CE2-CE1 3.82Å; F265-F349 HydrophobicContact CE2-CE1 3.82Å; F265-F349 HydrophobicContact CZ-CE1 4.12Å
266	K	93.8	Very high	97.1	Very high	54 Å²	54	68.4 Å²	68.4	24%	0.235	37%	0.368	C	S	.	.	S	Bend	trans	-126.4	142.9	173.8	-70.5	-176.8	-172.2	174.1	0	109.2	E187 N188 E191 P263 N268 G269	E187-K266 HydrophobicContact CB-CD 3.87Å; E187-K266 HydrophobicContact CG-CB 4.43Å; E187-K266 HydrophobicContact CG-CD 3.93Å; E187-K266 HydrophobicContact CG-CG 4.1Å; N188-K266 PolarHBondContact OD1-NZ 2.93Å; E191-K266 IonicContact OE1-NZ 3.76Å; E191-K266 PolarHBondContact OE1-NZ 3.39Å; E191-K266 IonicContact OE2-NZ 3.35Å; E191-K266 PolarHBondContact OE2-NZ 2.91Å; P263-K266 WeakPolarHBondContact CB-O 3.36Å; K266-N268 VanDerWaalsContact C-N 3.28Å; K266-N268 PolarHBondContact O-N 3.28Å; K266-G269 PolarHBondContact O-N 3.48Å
267	P	91.9	Very high	97.1	Very high	123 Å²	123	63.8 Å²	63.8	80%	0.799	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-40.2	179.7	-28.6	35.5	0	0	0	114.4
268	N	92.4	Very high	97.2	Very high	161 Å²	161	61.3 Å²	61.3	86%	0.861	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	23.1	176.6	-61.4	-23.9	0	0	0	112.1	K266	K266-N268 VanDerWaalsContact C-N 3.28Å; K266-N268 PolarHBondContact O-N 3.28Å
269	G	97.1	Very high	97.2	Very high	8 Å²	8	65 Å²	65	8%	0.082	36%	0.358	C	S	.	.			trans	-72.9	170.1	-179.3	0	0	0	0	0	113.1	E187 P263 K266	E187-G269 VanDerWaalsContact CD-CA 3.49Å; E187-G269 WeakPolarHBondContact OE1-CA 3.26Å; P263-G269 WeakPolarHBondContact CG-O 3.41Å; K266-G269 PolarHBondContact O-N 3.48Å
270	T	98.6	Very high	97.2	Very high	35 Å²	35	62.1 Å²	62.1	22%	0.215	33%	0.334	C	S	.	.			trans	-113.1	-16.1	176.7	56.9	0	0	0	0	112.5	E187 R197 Q200 N275	E187-T270 VanDerWaalsContact CD-N 3.31Å; E187-T270 PolarHBondContact OE1-N 2.86Å; E187-T270 PolarHBondContact OE2-N 2.92Å; E187-T270 PolarHBondContact OE2-OG1 2.94Å; R197-T270 HydrophobicContact CB-CG2 4.07Å; R197-T270 VanDerWaalsContact CD-O 3.26Å; R197-T270 WeakPolarHBondContact CD-O 3.24Å; Q200-T270 PolarHBondContact NE2-OG1 3.36Å; T270-N275 PolarHBondContact O-ND2 3.09Å
271	T	98.8	Very high	97.3	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.299	C	S	.	.			trans	-79.4	125	178.1	-53.5	0	0	0	0	109.8	S186 E187 P263 A264 F265 N275 S276 F349	S186-T271 WeakPolarHBondContact CB-OG1 3.38Å; S186-T271 PolarHBondContact OG-OG1 3.5Å; E187-T271 VanDerWaalsContact CD-OG1 3.29Å; E187-T271 WeakPolarHBondContact OE1-CA 3.47Å; E187-T271 WeakPolarHBondContact OE1-CB 3.32Å; E187-T271 PolarHBondContact OE1-N 3.44Å; E187-T271 PolarHBondContact OE1-OG1 3.03Å; E187-T271 PolarHBondContact OE2-N 3.02Å; E187-T271 PolarHBondContact OE2-OG1 3.41Å; P263-T271 CarbonylContact C-O 3.59Å; P263-T271 WeakPolarHBondContact CA-O 3.18Å; A264-T271 PolarHBondContact N-O 3.01Å; F265-T271 HydrophobicContact CD2-CG2 3.69Å; F265-T271 HydrophobicContact CE2-CG2 3.61Å; T271-N275 WeakPolarHBondContact CA-OD1 3.28Å; T271-S276 WeakPolarHBondContact CG2-OG 3.42Å; T271-F349 HydrophobicContact CG2-CD1 3.51Å; T271-F349 HydrophobicContact CG2-CE1 3.94Å
272	T	98.8	Very high	97.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-128.1	169.2	-179.6	73.8	0	0	0	0	110.8	R197 L261 G274 N275 S276	R197-T272 VanDerWaalsContact CZ-CG2 3.42Å; L261-T272 HydrophobicContact CB-CG2 4.09Å; T272-G274 PolarHBondContact O-N 3.24Å; T272-G274 VanDerWaalsContact O-N 3.17Å; T272-G274 PolarHBondContact OG1-N 3.26Å; T272-G274 VanDerWaalsContact OG1-N 3.15Å; T272-N275 PolarHBondContact N-OD1 2.87Å; T272-N275 PolarHBondContact O-N 2.68Å; T272-N275 PolarHBondContact O-OD1 2.84Å; T272-N275 PolarHBondContact OG1-N 2.88Å; T272-N275 PolarHBondContact OG1-ND2 3.28Å; T272-S276 VanDerWaalsContact O-CB 3.3Å; T272-S276 WeakPolarHBondContact O-CB 3.44Å; T272-S276 PolarHBondContact O-N 3.34Å; T272-S276 VanDerWaalsContact O-N 3.16Å; T272-S276 PolarHBondContact O-OG 3.08Å
273	A	97.9	Very high	97.4	Very high	80 Å²	80	39.2 Å²	39.2	66%	0.661	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.6	172.3	0	0	0	0	0	113.7
274	G	98.2	Very high	97.4	Very high	17 Å²	17	37 Å²	37	18%	0.175	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-26.8	-179.8	0	0	0	0	0	113.7	A204 L261 T272 I374	A204-G274 WeakPolarHBondContact CB-O 3.2Å; L261-G274 VanDerWaalsContact CD1-CA 3.47Å; T272-G274 PolarHBondContact O-N 3.24Å; T272-G274 VanDerWaalsContact O-N 3.17Å; T272-G274 PolarHBondContact OG1-N 3.26Å; T272-G274 VanDerWaalsContact OG1-N 3.15Å; G274-I374 WeakPolarHBondContact O-CG2 3.42Å
275	N	98.7	Very high	97.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.207	C	C	.	.	S	Bend	trans	-111.2	17.7	179.2	67.3	29.8	0	0	0	113	Q200 D201 A204 T270 T271 T272 A350	Q200-N275 HydrophobicContact CB-CB 4.2Å; D201-N275 PolarHBondContact OD1-ND2 3.42Å; A204-N275 HydrophobicContact CB-CB 3.97Å; T270-N275 PolarHBondContact O-ND2 3.09Å; T271-N275 WeakPolarHBondContact CA-OD1 3.28Å; T272-N275 PolarHBondContact N-OD1 2.87Å; T272-N275 PolarHBondContact O-N 2.68Å; T272-N275 PolarHBondContact O-OD1 2.84Å; T272-N275 PolarHBondContact OG1-N 2.88Å; T272-N275 PolarHBondContact OG1-ND2 3.28Å; N275-A350 HydrophobicContact CB-CB 3.95Å; N275-A350 VanDerWaalsContact O-CB 3.32Å; N275-A350 WeakPolarHBondContact O-CB 3.19Å; N275-A350 PolarHBondContact O-N 2.91Å
276	S	98.8	Very high	97.7	Very high	9 Å²	9	30 Å²	30	6%	0.063	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-116.7	154.2	171.6	-54.1	0	0	0	0	110	T271 T272 F349	T271-S276 WeakPolarHBondContact CG2-OG 3.42Å; T272-S276 VanDerWaalsContact O-CB 3.3Å; T272-S276 WeakPolarHBondContact O-CB 3.44Å; T272-S276 PolarHBondContact O-N 3.34Å; T272-S276 VanDerWaalsContact O-N 3.16Å; T272-S276 PolarHBondContact O-OG 3.08Å; S276-F349 VanDerWaalsContact OG-CD1 3.28Å; S276-F349 WeakPolarHBondContact OG-CD1 3.44Å
277	S	98.3	Very high	97.9	Very high	27 Å²	27	27.5 Å²	27.5	19%	0.189	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-58.5	147.4	168.9	58.8	0	0	0	0	112.2	E347 A348 A373	S277-E347 WeakPolarHBondContact CB-O 3.48Å; S277-A348 WeakPolarHBondContact CB-O 3.31Å; S277-A348 PolarHBondContact N-O 3.29Å; S277-A348 PolarHBondContact OG-O 3.08Å; S277-A373 WeakPolarHBondContact CA-O 3.47Å
278	Q	98.2	Very high	98.2	Very high	27 Å²	27	21.6 Å²	21.6	13%	0.126	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-79.5	137.9	175.9	-59.2	176.5	54.1	0	0	109.7	G248 S280 I374 A375 H378	G248-Q278 VanDerWaalsContact CA-OE1 3.31Å; G248-Q278 PolarHBondContact O-NE2 2.93Å; Q278-S280 PolarHBondContact O-N 3.4Å; Q278-S280 PolarHBondContact O-OG 3.29Å; Q278-S280 VanDerWaalsContact O-OG 3.14Å; Q278-I374 PolarHBondContact NE2-O 3.46Å; Q278-A375 PolarHBondContact NE2-O 3.08Å; Q278-H378 PolarHBondContact O-N 3.06Å
279	V	97.8	Very high	98.5	Very high	87 Å²	87	14 Å²	14	53%	0.527	10%	0.098	S	C	.	.	P	Polyproline II helix	trans	-63.7	127.1	165.1	-109.1	0	0	0	0	108.7	A52 M154	A52-V279 HydrophobicContact CB-CB 3.97Å; A52-V279 WeakPolarHBondContact CB-O 3.45Å; A52-V279 PolarHBondContact N-O 3.23Å; M154-V279 HydrophobicContact CB-CG1 4.48Å; M154-V279 HydrophobicContact CE-CG1 3.48Å; M154-V279 VanDerWaalsContact CE-CG1 3.48Å; M154-V279 HydrophobicContact SD-CB 4.38Å; M154-V279 HydrophobicContact SD-CG1 3.78Å
280	S	98.6	Very high	98.6	Very high	1 Å²	1	17.1 Å²	17.1	1%	0.007	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	160.6	-163	-70	0	0	0	0	113.9	I49 G50 M154 Q278 G377	I49-S280 VanDerWaalsContact CG2-CB 3.43Å; G50-S280 CarbonylContact O-C 3.56Å; G50-S280 WeakPolarHBondContact O-CA 3.35Å; G50-S280 VanDerWaalsContact O-CB 3.26Å; G50-S280 WeakPolarHBondContact O-CB 3.47Å; G50-S280 PolarHBondContact O-OG 3.46Å; M154-S280 VanDerWaalsContact CG-O 3.24Å; M154-S280 WeakPolarHBondContact CG-O 3.27Å; Q278-S280 PolarHBondContact O-N 3.4Å; Q278-S280 PolarHBondContact O-OG 3.29Å; Q278-S280 VanDerWaalsContact O-OG 3.14Å; S280-G377 VanDerWaalsContact OG-CA 3.28Å; S280-G377 WeakPolarHBondContact OG-CA 3.23Å
281	D	98.8	Very high	98.6	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143.1	172.9	-49.7	-50.3	0	0	0	109.9	G50 F57 L65 E152 S153 M154 S155	G50-D281 PolarHBondContact N-O 3.23Å; G50-D281 PolarHBondContact O-N 3.47Å; F57-D281 HydrophobicContact CB-CB 3.82Å; F57-D281 HydrophobicContact CD2-CB 4.27Å; L65-D281 HydrophobicContact CD1-CB 4.36Å; E152-D281 WeakPolarHBondContact O-CA 3.49Å; S153-D281 VanDerWaalsContact C-OD1 3.3Å; S153-D281 VanDerWaalsContact CA-OD1 3.29Å; S153-D281 WeakPolarHBondContact CA-OD1 3.42Å; M154-D281 PolarHBondContact N-OD1 2.93Å; S155-D281 WeakPolarHBondContact CB-OD1 3.32Å; S155-D281 VanDerWaalsContact CB-OD2 3.27Å; S155-D281 WeakPolarHBondContact CB-OD2 3.46Å; S155-D281 PolarHBondContact N-OD1 3.32Å; S155-D281 VanDerWaalsContact OG-CG 3.3Å; S155-D281 PolarHBondContact OG-OD1 2.89Å; S155-D281 PolarHBondContact OG-OD2 2.86Å
282	G	98.8	Very high	98.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169	168.5	174.2	0	0	0	0	0	113.8	T47 V151 E152 C382	T47-G282 WeakPolarHBondContact OG1-CA 3.35Å; V151-G282 WeakPolarHBondContact CA-O 3.31Å; E152-G282 PolarHBondContact N-O 2.96Å; E152-G282 PolarHBondContact O-N 2.92Å; G282-C382 VanDerWaalsContact O-CB 3.28Å; G282-C382 WeakPolarHBondContact O-CB 3.39Å
283	A	98.9	Very high	98.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	158.4	176.6	0	0	0	0	0	112.1	R46 T47 L65 V69 G150 V151	R46-A283 CarbonylContact C-O 3.49Å; R46-A283 WeakPolarHBondContact CA-O 3.24Å; T47-A283 HydrophobicContact CG2-CB 4.12Å; T47-A283 PolarHBondContact N-O 2.8Å; T47-A283 PolarHBondContact OG1-N 2.74Å; T47-A283 PolarHBondContact OG1-O 3.32Å; L65-A283 HydrophobicContact CB-CB 4.02Å; L65-A283 WeakPolarHBondContact O-CB 3.23Å; V69-A283 HydrophobicContact CG1-CB 4.35Å; V69-A283 HydrophobicContact CG2-CB 3.77Å; G150-A283 CarbonylContact O-C 3.58Å; G150-A283 WeakPolarHBondContact O-CA 3.46Å; V151-A283 HydrophobicContact CB-CB 3.95Å; V151-A283 HydrophobicContact CG2-CB 3.79Å
284	A	98.9	Very high	98.5	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	151.3	170.8	0	0	0	0	0	110.5	R45 R46 C149 G150 A385 R386	R45-A284 CarbonylContact O-C 3.53Å; R45-A284 WeakPolarHBondContact O-CA 3.3Å; R46-A284 HydrophobicContact CB-CB 3.86Å; C149-A284 CarbonylContact C-O 3.56Å; C149-A284 WeakPolarHBondContact CA-O 3.49Å; G150-A284 PolarHBondContact N-O 2.71Å; G150-A284 PolarHBondContact O-N 3.17Å; A284-A385 HydrophobicContact CB-CB 3.85Å; A284-R386 HydrophobicContact CB-CB 4.16Å
285	A	98.9	Very high	98.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.6	176.7	0	0	0	0	0	110.2	G44 R45 V69 V73 L147 A148 C149	G44-A285 CarbonylContact C-O 3.5Å; G44-A285 WeakPolarHBondContact CA-O 3.43Å; R45-A285 PolarHBondContact N-O 3.44Å; R45-A285 PolarHBondContact O-N 3.19Å; V69-A285 HydrophobicContact CB-CB 4Å; V69-A285 HydrophobicContact CG2-CB 3.92Å; V73-A285 HydrophobicContact CG2-CB 3.9Å; L147-A285 HydrophobicContact CD1-CB 4.29Å; L147-A285 HydrophobicContact CG-CB 4.48Å; A148-A285 CarbonylContact O-C 3.59Å; A148-A285 WeakPolarHBondContact O-CA 3.41Å; C149-A285 HydrophobicContact CB-CB 4.49Å
286	V	98.9	Very high	98.4	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.012	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	120.8	-179.7	-175.9	0	0	0	0	108	V41 L131 A148 L288 A385 V388 V389	V41-V286 HydrophobicContact CB-CG1 4.45Å; V41-V286 HydrophobicContact CG1-CG1 3.47Å; V41-V286 VanDerWaalsContact CG1-CG1 3.47Å; V41-V286 HydrophobicContact CG2-CG1 4.19Å; L131-V286 HydrophobicContact CD1-CB 4.24Å; L131-V286 HydrophobicContact CD1-CG1 3.88Å; A148-V286 PolarHBondContact N-O 3.47Å; A148-V286 PolarHBondContact O-N 2.93Å; V286-L288 HydrophobicContact CB-CD1 4.48Å; V286-L288 HydrophobicContact CG1-CD1 4.23Å; V286-L288 HydrophobicContact CG1-CG 4.43Å; V286-L288 WeakPolarHBondContact O-CD1 3.39Å; V286-A385 HydrophobicContact CG2-CB 4.46Å; V286-V388 HydrophobicContact CG1-CG1 4.27Å; V286-V388 HydrophobicContact CG2-CB 4.36Å; V286-V388 HydrophobicContact CG2-CG1 4.21Å; V286-V389 HydrophobicContact CG2-CG2 3.84Å
287	L	98.9	Very high	98.4	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.3	175.8	176.4	63.9	0	0	0	109.6	V42 H43 V73 V77 L79 L84 L147	V42-L287 HydrophobicContact CB-CB 4.28Å; V42-L287 HydrophobicContact CB-CD2 3.85Å; V42-L287 HydrophobicContact CB-CG 3.91Å; V42-L287 HydrophobicContact CG1-CD2 3.84Å; V42-L287 HydrophobicContact CG1-CG 4.47Å; V42-L287 HydrophobicContact CG2-CD2 4.3Å; V42-L287 HydrophobicContact CG2-CG 4.17Å; V42-L287 PolarHBondContact N-O 2.67Å; H43-L287 PolarHBondContact O-N 3.29Å; V73-L287 HydrophobicContact CG1-CB 3.61Å; V77-L287 HydrophobicContact CG2-CD2 3.94Å; L79-L287 HydrophobicContact CD2-CD1 4.19Å; L79-L287 HydrophobicContact CD2-CD2 3.84Å; L84-L287 HydrophobicContact CD2-CD1 3.59Å; L147-L287 HydrophobicContact CD1-CB 4.08Å; L147-L287 HydrophobicContact CD1-CD1 4.45Å
288	L	98.8	Very high	98.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	153.6	178.3	-61.8	104.6	0	0	0	111	V39 V40 V41 L131 I134 I138 L145 G146 A148 V286	V39-L288 HydrophobicContact CG1-CB 4.48Å; V39-L288 HydrophobicContact CG1-CD2 3.86Å; V40-L288 CarbonylContact O-C 3.53Å; V40-L288 VanDerWaalsContact O-CA 3.27Å; V40-L288 WeakPolarHBondContact O-CA 3.27Å; V41-L288 HydrophobicContact CG2-CD2 4.12Å; V41-L288 HydrophobicContact CG2-CG 4.43Å; L131-L288 HydrophobicContact CD1-CD1 4.26Å; L131-L288 HydrophobicContact CD1-CD2 4.1Å; L131-L288 HydrophobicContact CD2-CD2 3.89Å; L131-L288 HydrophobicContact CG-CD1 3.92Å; L131-L288 HydrophobicContact CG-CD2 3.65Å; L131-L288 HydrophobicContact CG-CG 4.37Å; I134-L288 HydrophobicContact CB-CD1 4.35Å; I134-L288 HydrophobicContact CG2-CB 3.97Å; I134-L288 HydrophobicContact CG2-CD1 3.91Å; I134-L288 HydrophobicContact CG2-CG 4.47Å; I138-L288 HydrophobicContact CD1-CB 3.86Å; L145-L288 WeakPolarHBondContact CA-O 3.5Å; G146-L288 PolarHBondContact N-O 2.8Å; G146-L288 PolarHBondContact O-N 3.16Å; A148-L288 HydrophobicContact CB-CD1 3.58Å; V286-L288 HydrophobicContact CB-CD1 4.48Å; V286-L288 HydrophobicContact CG1-CD1 4.23Å; V286-L288 HydrophobicContact CG1-CG 4.43Å; V286-L288 WeakPolarHBondContact O-CD1 3.39Å
289	G	98.6	Very high	98.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	164.8	174.1	0	0	0	0	0	113.8	V40 Q144	V40-G289 WeakPolarHBondContact CG2-O 3.48Å; V40-G289 PolarHBondContact N-O 3.32Å; V40-G289 PolarHBondContact O-N 3.32Å; Q144-G289 CarbonylContact O-C 3.56Å; Q144-G289 WeakPolarHBondContact O-CA 3.22Å
290	R	98.5	Very high	98.3	Very high	75 Å²	75	31.9 Å²	31.9	28%	0.283	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	134	160.5	-175.3	-178	177.3	-164	-2.8	108.4	E36 D37 I138 Q144 A292 A293 V294	E36-R290 VanDerWaalsContact O-CG 3.31Å; E36-R290 WeakPolarHBondContact O-CG 3.41Å; D37-R290 IonicContact OD1-CZ 3.57Å; D37-R290 IonicContact OD1-NE 2.79Å; D37-R290 PolarHBondContact OD1-NE 3.28Å; D37-R290 IonicContact OD1-NH2 3.09Å; D37-R290 PolarHBondContact OD1-NH2 2.86Å; I138-R290 HydrophobicContact CG2-CB 3.81Å; Q144-R290 PolarHBondContact O-N 3.38Å; R290-A292 VanDerWaalsContact C-N 3.32Å; R290-A292 PolarHBondContact O-N 3.3Å; R290-A293 HydrophobicContact CB-CB 4.36Å; R290-A293 PolarHBondContact O-N 2.87Å; R290-A293 VanDerWaalsContact O-N 3.08Å; R290-V294 WeakPolarHBondContact O-CG2 3.48Å; R290-V294 PolarHBondContact O-N 3.14Å
291	R	98.3	Very high	98.2	Very high	39 Å²	39	33.4 Å²	33.4	15%	0.147	19%	0.187	C	C	.	.	H	α-helix	trans	-47.3	-52.5	-178.8	175.8	177.7	-64.2	-79.3	-0.9	112.4	P35 E38 V40 A293 V294 E295	P35-R291 WeakPolarHBondContact O-CD 3.42Å; P35-R291 PolarHBondContact O-NE 3.06Å; E38-R291 HydrophobicContact CB-CB 4.31Å; E38-R291 PolarHBondContact O-N 3.01Å; E38-R291 IonicContact OE2-CZ 2.84Å; E38-R291 VanDerWaalsContact OE2-CZ 3.29Å; E38-R291 IonicContact OE2-NE 3.3Å; E38-R291 PolarHBondContact OE2-NE 2.89Å; E38-R291 IonicContact OE2-NH2 2.71Å; E38-R291 PolarHBondContact OE2-NH2 3.13Å; V40-R291 HydrophobicContact CG1-CB 3.97Å; R291-A293 VanDerWaalsContact C-N 3.33Å; R291-A293 PolarHBondContact O-N 3.24Å; R291-V294 PolarHBondContact O-N 3.43Å; R291-V294 VanDerWaalsContact O-N 3.16Å; R291-E295 VanDerWaalsContact CD-OE1 3.24Å; R291-E295 WeakPolarHBondContact CD-OE1 3.33Å; R291-E295 VanDerWaalsContact CG-CD 3.47Å; R291-E295 HydrophobicContact CG-CG 4.23Å; R291-E295 WeakPolarHBondContact CG-OE1 3.27Å; R291-E295 IonicContact NH1-OE1 3.42Å; R291-E295 PolarHBondContact NH1-OE1 2.76Å; R291-E295 VanDerWaalsContact NH1-OE1 3.13Å; R291-E295 WeakPolarHBondContact O-CG 3.29Å; R291-E295 PolarHBondContact O-N 3.45Å
292	A	97.8	Very high	98.2	Very high	28 Å²	28	33.9 Å²	33.9	23%	0.231	19%	0.19	C	C	.	.	H	α-helix	trans	-56.8	-43.9	-178.7	0	0	0	0	0	113.2	E36 R290 E295 E296	E36-A292 HydrophobicContact CB-CB 4.18Å; E36-A292 PolarHBondContact O-N 3.4Å; E36-A292 VanDerWaalsContact O-N 3.1Å; R290-A292 VanDerWaalsContact C-N 3.32Å; R290-A292 PolarHBondContact O-N 3.3Å; A292-E295 PolarHBondContact O-N 2.92Å; A292-E296 WeakPolarHBondContact O-CB 3.3Å; A292-E296 PolarHBondContact O-N 3.25Å
293	A	97.8	Very high	98.2	Very high	12 Å²	12	33.9 Å²	33.9	10%	0.099	19%	0.19	C	C	.	.	H	α-helix	trans	-69	-36.9	179.4	0	0	0	0	0	112.2	Q144 R290 R291 L297	Q144-A293 HydrophobicContact CB-CB 3.94Å; R290-A293 HydrophobicContact CB-CB 4.36Å; R290-A293 PolarHBondContact O-N 2.87Å; R290-A293 VanDerWaalsContact O-N 3.08Å; R291-A293 VanDerWaalsContact C-N 3.33Å; R291-A293 PolarHBondContact O-N 3.24Å; A293-L297 WeakPolarHBondContact O-CD1 3.32Å; A293-L297 VanDerWaalsContact O-CG 3.3Å; A293-L297 WeakPolarHBondContact O-CG 3.24Å; A293-L297 PolarHBondContact O-N 3.06Å; A293-L297 VanDerWaalsContact O-N 3.17Å
294	V	98.3	Very high	98.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-43.1	175.7	168.3	0	0	0	0	110.7	V40 V42 L145 R290 R291 L297 G298 L299 V301	V40-V294 HydrophobicContact CG2-CB 3.95Å; V40-V294 HydrophobicContact CG2-CG1 4.05Å; V40-V294 HydrophobicContact CG2-CG2 3.65Å; V42-V294 HydrophobicContact CG2-CB 4.38Å; V42-V294 HydrophobicContact CG2-CG1 3.86Å; V42-V294 HydrophobicContact CG2-CG2 3.55Å; L145-V294 HydrophobicContact CD2-CG2 3.89Å; R290-V294 WeakPolarHBondContact O-CG2 3.48Å; R290-V294 PolarHBondContact O-N 3.14Å; R291-V294 PolarHBondContact O-N 3.43Å; R291-V294 VanDerWaalsContact O-N 3.16Å; V294-L297 PolarHBondContact O-N 3.23Å; V294-G298 PolarHBondContact O-N 3.26Å; V294-L299 HydrophobicContact CG1-CB 3.79Å; V294-L299 WeakPolarHBondContact O-CB 3.33Å; V294-L299 PolarHBondContact O-N 2.95Å; V294-V301 HydrophobicContact CG1-CG2 4.06Å
295	E	97.1	Very high	98.1	Very high	102 Å²	102	34.1 Å²	34.1	48%	0.477	19%	0.191	S	C	.	.	H	α-helix	trans	-69.1	-40	178	-71.2	172	-176.8	0	0	112.1	R291 A292 L297 G298	R291-E295 VanDerWaalsContact CD-OE1 3.24Å; R291-E295 WeakPolarHBondContact CD-OE1 3.33Å; R291-E295 VanDerWaalsContact CG-CD 3.47Å; R291-E295 HydrophobicContact CG-CG 4.23Å; R291-E295 WeakPolarHBondContact CG-OE1 3.27Å; R291-E295 IonicContact NH1-OE1 3.42Å; R291-E295 PolarHBondContact NH1-OE1 2.76Å; R291-E295 VanDerWaalsContact NH1-OE1 3.13Å; R291-E295 WeakPolarHBondContact O-CG 3.29Å; R291-E295 PolarHBondContact O-N 3.45Å; A292-E295 PolarHBondContact O-N 2.92Å; E295-L297 VanDerWaalsContact C-N 3.27Å; E295-L297 PolarHBondContact O-N 2.99Å; E295-G298 PolarHBondContact O-N 3.05Å
296	E	97.5	Very high	98.1	Very high	173 Å²	173	37.6 Å²	37.6	81%	0.808	20%	0.204	S	C	*	.	H	α-helix	trans	-59.3	-37.6	174.5	-176.5	179.5	175.9	0	0	112.3	A292 G298	A292-E296 WeakPolarHBondContact O-CB 3.3Å; A292-E296 PolarHBondContact O-N 3.25Å; E296-G298 VanDerWaalsContact C-N 3.27Å; E296-G298 PolarHBondContact O-N 2.92Å
297	L	97.6	Very high	98	Very high	76 Å²	76	37.5 Å²	37.5	40%	0.398	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-1.4	177.5	-67	169.9	0	0	0	113.5	L79 L145 A293 V294 E295 L299	L79-L297 HydrophobicContact CD1-CD1 4.47Å; L145-L297 HydrophobicContact CD1-CD1 3.55Å; A293-L297 WeakPolarHBondContact O-CD1 3.32Å; A293-L297 VanDerWaalsContact O-CG 3.3Å; A293-L297 WeakPolarHBondContact O-CG 3.24Å; A293-L297 PolarHBondContact O-N 3.06Å; A293-L297 VanDerWaalsContact O-N 3.17Å; V294-L297 PolarHBondContact O-N 3.23Å; E295-L297 VanDerWaalsContact C-N 3.27Å; E295-L297 PolarHBondContact O-N 2.99Å; L297-L299 HydrophobicContact CB-CD1 3.97Å; L297-L299 HydrophobicContact CB-CG 3.88Å; L297-L299 HydrophobicContact CD1-CD1 4.09Å; L297-L299 PolarHBondContact O-N 2.9Å
298	G	97.6	Very high	98	Very high	68 Å²	68	38.5 Å²	38.5	70%	0.701	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.5	24.4	-177.5	0	0	0	0	0	113.9	V294 E295 E296	V294-G298 PolarHBondContact O-N 3.26Å; E295-G298 PolarHBondContact O-N 3.05Å; E296-G298 VanDerWaalsContact C-N 3.27Å; E296-G298 PolarHBondContact O-N 2.92Å
299	L	97.9	Very high	98	Very high	20 Å²	20	38.9 Å²	38.9	11%	0.105	21%	0.214	C	C	.	.			trans	-84	150.4	-179.2	-67.9	174.8	0	0	0	111.3	V42 V77 L79 V294 L297	V42-L299 HydrophobicContact CG1-CB 3.91Å; V42-L299 HydrophobicContact CG1-CD1 4.35Å; V77-L299 HydrophobicContact CB-CD2 3.94Å; V77-L299 HydrophobicContact CG2-CD2 4.19Å; L79-L299 HydrophobicContact CD1-CD1 4.31Å; V294-L299 HydrophobicContact CG1-CB 3.79Å; V294-L299 WeakPolarHBondContact O-CB 3.33Å; V294-L299 PolarHBondContact O-N 2.95Å; L297-L299 HydrophobicContact CB-CD1 3.97Å; L297-L299 HydrophobicContact CB-CG 3.88Å; L297-L299 HydrophobicContact CD1-CD1 4.09Å; L297-L299 PolarHBondContact O-N 2.9Å
300	P	96.8	Very high	98	Very high	73 Å²	73	41.5 Å²	41.5	47%	0.474	23%	0.23	S	C	.	.			trans	-72	156.6	-179.9	30.4	-35.9	0	0	0	112.4	V42	V42-P300 WeakPolarHBondContact CA-O 3.41Å; V42-P300 HydrophobicContact CG1-CG 4.11Å; V42-P300 WeakPolarHBondContact CG1-O 3.4Å
301	V	97.7	Very high	98	Very high	33 Å²	33	39.6 Å²	39.6	20%	0.2	23%	0.227	C	C	.	.			trans	-108.5	98.7	169.4	177.1	0	0	0	0	109	V40 V294 V304 P423	V40-V301 HydrophobicContact CB-CG1 4.03Å; V40-V301 HydrophobicContact CB-CG2 4.42Å; V40-V301 HydrophobicContact CG1-CG1 4.01Å; V40-V301 HydrophobicContact CG1-CG2 4.46Å; V40-V301 HydrophobicContact CG2-CG2 4.35Å; V294-V301 HydrophobicContact CG1-CG2 4.06Å; V301-V304 HydrophobicContact CG1-CG2 4.31Å; V301-P423 HydrophobicContact CG1-CG 4.24Å
302	L	98.2	Very high	98	Very high	10 Å²	10	40.8 Å²	40.8	5%	0.052	25%	0.251	C	S	.	.			trans	-76.8	-28.1	176.7	178.1	62.7	0	0	0	112.2	V41 V42 L392 R396 F422	V41-L302 HydrophobicContact CG1-CD2 4.5Å; V41-L302 WeakPolarHBondContact O-CA 3.45Å; V41-L302 WeakPolarHBondContact O-CB 3.46Å; V41-L302 PolarHBondContact O-N 2.79Å; V42-L302 WeakPolarHBondContact O-CB 3.21Å; L302-L392 HydrophobicContact CD1-CB 4.37Å; L302-L392 HydrophobicContact CD2-CB 3.98Å; L302-L392 HydrophobicContact CD2-CD1 4.19Å; L302-L392 HydrophobicContact CG-CB 3.91Å; L302-L392 HydrophobicContact CG-CD1 4.18Å; L302-R396 HydrophobicContact CD1-CB 4.24Å; L302-F422 WeakPolarHBondContact O-CD2 3.2Å
303	G	98.4	Very high	98.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	173.7	174.8	0	0	0	0	0	113.7	V40 V41 E421	V40-G303 CarbonylContact C-O 3.39Å; V40-G303 WeakPolarHBondContact CA-O 3.45Å; V41-G303 PolarHBondContact N-O 2.93Å; V41-G303 PolarHBondContact O-N 3.37Å; V41-G303 VanDerWaalsContact O-N 3.16Å; G303-E421 CarbonylContact C-O 3.54Å; G303-E421 WeakPolarHBondContact CA-O 3.5Å
304	V	98.6	Very high	98.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131	-178.3	-167.9	0	0	0	0	109.8	E38 V40 V301 R306 F420 E421	E38-V304 HydrophobicContact CB-CG1 4.04Å; E38-V304 HydrophobicContact CG-CG1 4.33Å; V40-V304 HydrophobicContact CG1-CG1 4.47Å; V40-V304 HydrophobicContact CG1-CG2 4.26Å; V301-V304 HydrophobicContact CG1-CG2 4.31Å; V304-R306 PolarHBondContact O-N 2.93Å; V304-F420 CarbonylContact O-C 3.59Å; V304-F420 VanDerWaalsContact O-CA 3.28Å; V304-F420 WeakPolarHBondContact O-CA 3.49Å; V304-E421 HydrophobicContact CB-CB 4.32Å; V304-E421 PolarHBondContact N-O 2.72Å; V304-E421 PolarHBondContact O-N 3.41Å
305	L	98.6	Very high	98.1	Very high	6 Å²	6	42.9 Å²	42.9	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	111.9	176	177.9	67.3	0	0	0	110.3	V39 L131 L132 A135 A418 F420	V39-L305 HydrophobicContact CB-CB 4.47Å; V39-L305 PolarHBondContact O-N 2.93Å; L131-L305 HydrophobicContact CD2-CD1 4.49Å; L131-L305 HydrophobicContact CD2-CD2 4.18Å; L132-L305 HydrophobicContact CD2-CD2 4.32Å; A135-L305 HydrophobicContact CB-CD2 3.53Å; L305-A418 HydrophobicContact CD1-CB 4.11Å; L305-F420 HydrophobicContact CB-CD1 4.5Å; L305-F420 HydrophobicContact CB-CE1 4.3Å; L305-F420 HydrophobicContact CD1-CD1 4.31Å; L305-F420 HydrophobicContact CD1-CE1 3.82Å; L305-F420 HydrophobicContact CD1-CE2 4.49Å; L305-F420 HydrophobicContact CD1-CZ 3.93Å
306	R	98.2	Very high	98.2	Very high	72 Å²	72	38.9 Å²	38.9	27%	0.272	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-32.5	-173.8	-65.3	-57.7	-175.1	-166.5	-2.4	114.8	E38 V304 A333 F403 V419 E421	E38-R306 IonicContact OE1-CZ 2.68Å; E38-R306 IonicContact OE1-NH1 3.83Å; E38-R306 PolarHBondContact OE1-NH1 3.02Å; E38-R306 IonicContact OE1-NH2 3.79Å; E38-R306 PolarHBondContact OE1-NH2 2.99Å; E38-R306 IonicContact OE2-NH1 3.05Å; E38-R306 IonicContact OE2-NH2 3.52Å; V304-R306 PolarHBondContact O-N 2.93Å; R306-A333 HydrophobicContact CB-CB 3.94Å; R306-F403 HydrophobicContact CG-CE1 4.42Å; R306-V419 HydrophobicContact CB-CB 4.33Å; R306-V419 HydrophobicContact CB-CG1 4.22Å; R306-V419 PolarHBondContact N-O 3Å; R306-E421 HydrophobicContact CG-CB 3.94Å; R306-E421 IonicContact CZ-OE2 3.01Å; R306-E421 IonicContact NE-OE2 3.54Å; R306-E421 PolarHBondContact NE-OE2 2.97Å; R306-E421 IonicContact NH2-OE1 3Å; R306-E421 IonicContact NH2-OE2 3.7Å; R306-E421 PolarHBondContact NH2-OE2 3.21Å
307	G	97.6	Very high	98.2	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	154.9	-179.9	0	0	0	0	0	111	A418 V419	G307-A418 CarbonylContact O-C 3.53Å; G307-A418 WeakPolarHBondContact O-CA 3.48Å; G307-V419 PolarHBondContact O-N 3.21Å
308	S	98.4	Very high	98.2	Very high	20 Å²	20	27.6 Å²	27.6	14%	0.14	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	147	176.2	58.6	0	0	0	0	111.9	L132 Q332 A417	L132-S308 VanDerWaalsContact CD2-CB 3.41Å; S308-Q332 PolarHBondContact O-NE2 3.1Å; S308-Q332 PolarHBondContact O-OE1 2.94Å; S308-A417 CarbonylContact C-O 3.57Å; S308-A417 VanDerWaalsContact CA-O 3.24Å; S308-A417 WeakPolarHBondContact CA-O 3.35Å
309	A	98.6	Very high	98.2	Very high	8 Å²	8	24.5 Å²	24.5	7%	0.066	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	145.6	179.1	0	0	0	0	0	111	A328 A329 A416 A417	A309-A328 HydrophobicContact CB-CB 3.53Å; A309-A329 HydrophobicContact CB-CB 4.01Å; A309-A416 CarbonylContact O-C 3.58Å; A309-A416 VanDerWaalsContact O-CA 3.3Å; A309-A416 WeakPolarHBondContact O-CA 3.44Å; A309-A417 PolarHBondContact N-O 3.08Å; A309-A417 PolarHBondContact O-N 3.26Å
310	V	98.8	Very high	98.3	Very high	55 Å²	55	24.4 Å²	24.4	33%	0.333	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.2	166.4	-177.4	0	0	0	0	107.4	L132 G415 A416	L132-V310 HydrophobicContact CD1-CG2 4.38Å; V310-G415 CarbonylContact C-O 3.57Å; V310-G415 VanDerWaalsContact CA-O 3.31Å; V310-G415 WeakPolarHBondContact CA-O 3.41Å; V310-A416 HydrophobicContact CG2-CB 4.11Å
311	V	98.8	Very high	98.4	Very high	36 Å²	36	20.9 Å²	20.9	22%	0.218	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	149.2	-175.4	-59	0	0	0	0	110.8	L324 A325 A328 M414 G415	V311-L324 HydrophobicContact CG2-CB 3.8Å; V311-A325 HydrophobicContact CG2-CB 3.97Å; V311-A328 HydrophobicContact CG1-CB 4.34Å; V311-M414 CarbonylContact O-C 3.55Å; V311-M414 WeakPolarHBondContact O-CA 3.37Å; V311-M414 VanDerWaalsContact O-CB 3.27Å; V311-M414 WeakPolarHBondContact O-CB 3.24Å; V311-G415 PolarHBondContact N-O 3.28Å; V311-G415 PolarHBondContact O-N 3.44Å
312	G	98.6	Very high	98.4	Very high	63 Å²	63	19.3 Å²	19.3	65%	0.649	12%	0.123	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	143.7	172.4	0	0	0	0	0	112
313	V	98.6	Very high	98.5	Very high	18 Å²	18	19.2 Å²	19.2	11%	0.109	12%	0.123	C	C	.	.			trans	-140.1	167.6	176.5	-56.9	0	0	0	0	109.8	I320 L324 G413	V313-I320 HydrophobicContact CB-CD1 4.24Å; V313-I320 HydrophobicContact CB-CG1 3.98Å; V313-I320 HydrophobicContact CG1-CD1 4.47Å; V313-I320 HydrophobicContact CG1-CG1 4.06Å; V313-I320 HydrophobicContact CG2-CG1 4.14Å; V313-L324 HydrophobicContact CG1-CD2 3.46Å; V313-L324 VanDerWaalsContact CG1-CD2 3.46Å; V313-G413 VanDerWaalsContact CG2-C 3.48Å; V313-G413 PolarHBondContact N-O 3.13Å; V313-G413 CarbonylContact O-C 3.58Å; V313-G413 WeakPolarHBondContact O-CA 3.39Å
314	P	98.5	Very high	98.5	Very high	52 Å²	52	22.9 Å²	22.9	34%	0.338	14%	0.143	S	C	.	.			trans	-57.4	131.4	175.3	-25.7	36.1	0	0	0	112	D316 L317 M318	P314-D316 VanDerWaalsContact C-N 3.29Å; P314-D316 WeakPolarHBondContact CB-OD1 3.5Å; P314-D316 PolarHBondContact O-N 2.81Å; P314-L317 HydrophobicContact CB-CB 4.4Å; P314-L317 CarbonylContact O-C 3.5Å; P314-L317 VanDerWaalsContact O-C 3.3Å; P314-L317 PolarHBondContact O-N 2.95Å; P314-M318 PolarHBondContact O-N 2.74Å; P314-M318 VanDerWaalsContact O-N 3.17Å
315	P	98.3	Very high	98.5	Very high	14 Å²	14	22.9 Å²	22.9	9%	0.091	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-62.1	-34.3	-178.1	-21	30.4	0	0	0	113.5	D177 L317 M318 T412	D177-P315 HydrophobicContact CB-CB 3.85Å; D177-P315 HydrophobicContact CB-CG 4.19Å; P315-L317 PolarHBondContact O-N 3.25Å; P315-M318 PolarHBondContact O-N 3.48Å; P315-T412 WeakPolarHBondContact CB-O 3.48Å; P315-T412 WeakPolarHBondContact CG-O 3.12Å
316	D	98.1	Very high	98.5	Very high	19 Å²	19	22.7 Å²	22.7	10%	0.102	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-65.4	-15.6	176.4	70.1	-51.1	0	0	0	113.7	K174 I180 N188 R192 P314	K174-D316 IonicContact NZ-OD1 2.72Å; I180-D316 HydrophobicContact CD1-CB 3.88Å; N188-D316 WeakPolarHBondContact CB-O 3.48Å; N188-D316 PolarHBondContact ND2-O 2.89Å; N188-D316 VanDerWaalsContact ND2-O 3.08Å; R192-D316 IonicContact CZ-OD2 3.36Å; R192-D316 IonicContact NH1-OD2 2.65Å; R192-D316 PolarHBondContact NH1-OD2 3.49Å; R192-D316 IonicContact NH2-OD2 3.76Å; R192-D316 PolarHBondContact NH2-OD2 3.03Å; P314-D316 VanDerWaalsContact C-N 3.29Å; P314-D316 WeakPolarHBondContact CB-OD1 3.5Å; P314-D316 PolarHBondContact O-N 2.81Å
317	L	98	Very high	98.5	Very high	9 Å²	9	22 Å²	22	5%	0.047	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-127.1	28.4	179.4	-64.8	-179.6	0	0	0	112.2	N188 V189 F193 P314 P315 G319 I320	N188-L317 HydrophobicContact CB-CD2 4.01Å; V189-L317 HydrophobicContact CG2-CB 4.47Å; V189-L317 HydrophobicContact CG2-CD2 3.99Å; F193-L317 HydrophobicContact CE2-CD1 4.23Å; F193-L317 HydrophobicContact CE2-CD2 4.28Å; F193-L317 HydrophobicContact CZ-CD1 4.19Å; P314-L317 HydrophobicContact CB-CB 4.4Å; P314-L317 CarbonylContact O-C 3.5Å; P314-L317 VanDerWaalsContact O-C 3.3Å; P314-L317 PolarHBondContact O-N 2.95Å; P315-L317 PolarHBondContact O-N 3.25Å; L317-G319 PolarHBondContact O-N 2.51Å; L317-I320 HydrophobicContact CB-CD1 4.38Å; L317-I320 HydrophobicContact CB-CG2 4.37Å; L317-I320 WeakPolarHBondContact O-CG1 3.28Å; L317-I320 PolarHBondContact O-N 2.79Å
318	M	98.2	Very high	98.6	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.015	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-50	-28.9	-172.8	70.2	88.3	-177.4	0	0	114.6	M182 T185 P314 P315 I320 G321 F349 C409 I410	M182-M318 HydrophobicContact CB-CE 3.82Å; M182-M318 HydrophobicContact CG-CE 3.88Å; M182-M318 HydrophobicContact SD-CE 4.16Å; T185-M318 HydrophobicContact CG2-CG 4.27Å; T185-M318 WeakPolarHBondContact OG1-CE 3.26Å; P314-M318 PolarHBondContact O-N 2.74Å; P314-M318 VanDerWaalsContact O-N 3.17Å; P315-M318 PolarHBondContact O-N 3.48Å; M318-I320 PolarHBondContact O-N 3Å; M318-I320 VanDerWaalsContact O-N 3.08Å; M318-G321 PolarHBondContact O-N 3.12Å; M318-G321 VanDerWaalsContact O-N 3.13Å; M318-F349 HydrophobicContact CE-CE2 4.31Å; M318-C409 WeakPolarHBondContact O-CB 3.28Å; M318-C409 HydrophobicContact SD-CB 4.01Å; M318-I410 WeakPolarHBondContact CB-O 3.33Å
319	G	98.3	Very high	98.6	Very high	2 Å²	2	22.2 Å²	22.2	2%	0.021	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-53.5	-24.7	175.3	0	0	0	0	0	115.3	L317 G321 P322 Q352	L317-G319 PolarHBondContact O-N 2.51Å; G319-G321 PolarHBondContact O-N 3.36Å; G319-P322 WeakPolarHBondContact O-CD 3.37Å; G319-Q352 PolarHBondContact O-OE1 2.76Å
320	I	98.8	Very high	98.6	Very high	18 Å²	18	22.1 Å²	22.1	9%	0.092	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-75.6	-6.1	-179.1	75.7	-180	0	0	0	113.8	V189 F193 V313 L317 M318 A323 F355	V189-I320 HydrophobicContact CG2-CG2 4.23Å; F193-I320 HydrophobicContact CE2-CG2 3.74Å; F193-I320 HydrophobicContact CZ-CG2 4.29Å; V313-I320 HydrophobicContact CB-CD1 4.24Å; V313-I320 HydrophobicContact CB-CG1 3.98Å; V313-I320 HydrophobicContact CG1-CD1 4.47Å; V313-I320 HydrophobicContact CG1-CG1 4.06Å; V313-I320 HydrophobicContact CG2-CG1 4.14Å; L317-I320 HydrophobicContact CB-CD1 4.38Å; L317-I320 HydrophobicContact CB-CG2 4.37Å; L317-I320 WeakPolarHBondContact O-CG1 3.28Å; L317-I320 PolarHBondContact O-N 2.79Å; M318-I320 PolarHBondContact O-N 3Å; M318-I320 VanDerWaalsContact O-N 3.08Å; I320-A323 WeakPolarHBondContact O-CB 3.29Å; I320-A323 PolarHBondContact O-N 3.1Å; I320-F355 HydrophobicContact CB-CD1 4.31Å; I320-F355 HydrophobicContact CB-CE1 3.65Å; I320-F355 HydrophobicContact CB-CZ 4.43Å; I320-F355 HydrophobicContact CG2-CD1 3.9Å; I320-F355 HydrophobicContact CG2-CE1 3.43Å; I320-F355 VanDerWaalsContact CG2-CE1 3.43Å; I320-F355 HydrophobicContact CG2-CZ 4Å
321	G	98.8	Very high	98.6	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-44.9	-51.4	-175.3	0	0	0	0	0	115.1	M318 G319 A323 L324 A325	M318-G321 PolarHBondContact O-N 3.12Å; M318-G321 VanDerWaalsContact O-N 3.13Å; G319-G321 PolarHBondContact O-N 3.36Å; G321-A323 VanDerWaalsContact C-N 3.27Å; G321-A323 PolarHBondContact O-N 3.44Å; G321-L324 PolarHBondContact O-N 2.8Å; G321-L324 VanDerWaalsContact O-N 3.08Å; G321-A325 WeakPolarHBondContact O-CB 3.27Å; G321-A325 PolarHBondContact O-N 3.49Å
322	P	98.9	Very high	98.5	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-57.8	-35.8	179.2	-27.2	35.9	0	0	0	114	G319 L324 A325 I326 I345 C356 S407 C409	G319-P322 WeakPolarHBondContact O-CD 3.37Å; P322-L324 PolarHBondContact O-N 3.31Å; P322-L324 VanDerWaalsContact O-N 3.08Å; P322-A325 PolarHBondContact O-N 3.45Å; P322-I326 HydrophobicContact CB-CD1 4.08Å; P322-I326 WeakPolarHBondContact O-CB 3.45Å; P322-I326 VanDerWaalsContact O-CG1 3.27Å; P322-I326 WeakPolarHBondContact O-CG1 3.44Å; P322-I326 PolarHBondContact O-N 3.17Å; P322-I345 HydrophobicContact CB-CG2 4.33Å; P322-I345 HydrophobicContact CG-CG2 4.33Å; P322-C356 HydrophobicContact CB-CB 4.17Å; P322-S407 WeakPolarHBondContact CA-OG 3.48Å; P322-S407 WeakPolarHBondContact CB-OG 3.44Å; P322-C409 HydrophobicContact CG-CB 4.45Å
323	A	98.8	Very high	98.4	Very high	7 Å²	7	29.2 Å²	29.2	6%	0.058	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-19.4	179.6	0	0	0	0	0	113.1	I320 G321 P327 F355 R359	I320-A323 WeakPolarHBondContact O-CB 3.29Å; I320-A323 PolarHBondContact O-N 3.1Å; G321-A323 VanDerWaalsContact C-N 3.27Å; G321-A323 PolarHBondContact O-N 3.44Å; A323-P327 WeakPolarHBondContact O-CD 3.12Å; A323-P327 WeakPolarHBondContact O-CG 3.14Å; A323-F355 HydrophobicContact CB-CE1 4.05Å; A323-R359 HydrophobicContact CB-CB 4.43Å; A323-R359 HydrophobicContact CB-CG 4.06Å
324	L	98.8	Very high	98.4	Very high	78 Å²	78	31.7 Å²	31.7	41%	0.408	19%	0.191	S	C	.	.	H	α-helix	trans	-108.4	-37.2	179.3	-79.7	50.5	0	0	0	111.3	V311 V313 G321 P322 A328	V311-L324 HydrophobicContact CG2-CB 3.8Å; V313-L324 HydrophobicContact CG1-CD2 3.46Å; V313-L324 VanDerWaalsContact CG1-CD2 3.46Å; G321-L324 PolarHBondContact O-N 2.8Å; G321-L324 VanDerWaalsContact O-N 3.08Å; P322-L324 PolarHBondContact O-N 3.31Å; P322-L324 VanDerWaalsContact O-N 3.08Å; L324-A328 PolarHBondContact O-N 3.44Å
325	A	98.9	Very high	98.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-70.9	-40	-179.5	0	0	0	0	0	112.7	V311 G321 P322 A328 A329 A417	V311-A325 HydrophobicContact CG2-CB 3.97Å; G321-A325 WeakPolarHBondContact O-CB 3.27Å; G321-A325 PolarHBondContact O-N 3.49Å; P322-A325 PolarHBondContact O-N 3.45Å; A325-A328 PolarHBondContact O-N 2.94Å; A325-A329 PolarHBondContact O-N 3.24Å; A325-A417 HydrophobicContact CB-CB 3.83Å; A325-A417 WeakPolarHBondContact O-CB 3.4Å
326	I	98.9	Very high	98.4	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-60.9	-52.8	-179	-66.9	170.3	0	0	0	110.9	P322 A328 A329 L330 F343 I345 L360 V405 S407 A417	P322-I326 HydrophobicContact CB-CD1 4.08Å; P322-I326 WeakPolarHBondContact O-CB 3.45Å; P322-I326 VanDerWaalsContact O-CG1 3.27Å; P322-I326 WeakPolarHBondContact O-CG1 3.44Å; P322-I326 PolarHBondContact O-N 3.17Å; I326-A328 VanDerWaalsContact C-N 3.28Å; I326-A328 PolarHBondContact O-N 2.77Å; I326-A329 PolarHBondContact O-N 2.56Å; I326-L330 HydrophobicContact CG2-CD1 3.75Å; I326-L330 HydrophobicContact CG2-CG 4.19Å; I326-L330 WeakPolarHBondContact O-CB 3.36Å; I326-L330 VanDerWaalsContact O-CG 3.28Å; I326-L330 WeakPolarHBondContact O-CG 3.17Å; I326-L330 PolarHBondContact O-N 2.98Å; I326-F343 HydrophobicContact CG2-CE1 4.24Å; I326-I345 HydrophobicContact CD1-CD1 3.74Å; I326-I345 HydrophobicContact CD1-CG1 4.1Å; I326-L360 HydrophobicContact CB-CD1 3.95Å; I326-L360 HydrophobicContact CD1-CD1 3.7Å; I326-L360 HydrophobicContact CG1-CD1 4.38Å; I326-L360 HydrophobicContact CG2-CD1 4.12Å; I326-V405 HydrophobicContact CD1-CG1 4.43Å; I326-V405 HydrophobicContact CG1-CG1 3.99Å; I326-V405 HydrophobicContact CG2-CG1 4.37Å; I326-S407 WeakPolarHBondContact CG1-OG 3.34Å; I326-A417 HydrophobicContact CG1-CB 4.02Å
327	P	98.8	Very high	98.4	Very high	57 Å²	57	38.1 Å²	38.1	37%	0.37	22%	0.216	S	C	.	.	H	α-helix	trans	-55.3	-41.2	175.5	-27.8	35.7	0	0	0	113.6	A323 L330 Q331 L360	A323-P327 WeakPolarHBondContact O-CD 3.12Å; A323-P327 WeakPolarHBondContact O-CG 3.14Å; P327-L330 PolarHBondContact O-N 2.98Å; P327-Q331 WeakPolarHBondContact O-CB 3.4Å; P327-Q331 PolarHBondContact O-N 2.84Å; P327-L360 HydrophobicContact CG-CD2 3.63Å
328	A	98.8	Very high	98.3	Very high	26 Å²	26	44 Å²	44	22%	0.215	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-41	179.5	0	0	0	0	0	112.5	A309 V311 L324 A325 I326 Q332	A309-A328 HydrophobicContact CB-CB 3.53Å; V311-A328 HydrophobicContact CG1-CB 4.34Å; L324-A328 PolarHBondContact O-N 3.44Å; A325-A328 PolarHBondContact O-N 2.94Å; I326-A328 VanDerWaalsContact C-N 3.28Å; I326-A328 PolarHBondContact O-N 2.77Å; A328-Q332 PolarHBondContact O-N 2.59Å
329	A	98.7	Very high	98.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70.4	-37.9	177.4	0	0	0	0	0	112	A309 A325 I326 Q332 A333 A417 V419	A309-A329 HydrophobicContact CB-CB 4.01Å; A325-A329 PolarHBondContact O-N 3.24Å; I326-A329 PolarHBondContact O-N 2.56Å; A329-Q332 PolarHBondContact O-N 2.88Å; A329-A333 PolarHBondContact O-N 3.22Å; A329-A333 VanDerWaalsContact O-N 3.07Å; A329-A417 HydrophobicContact CB-CB 3.77Å; A329-V419 HydrophobicContact CB-CG2 3.98Å
330	L	98.7	Very high	98.4	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-63.6	-41.9	174.3	-71.1	176.4	0	0	0	112	I326 P327 Q332 A333 G334 L335 V337 I340 V405 V419	I326-L330 HydrophobicContact CG2-CD1 3.75Å; I326-L330 HydrophobicContact CG2-CG 4.19Å; I326-L330 WeakPolarHBondContact O-CB 3.36Å; I326-L330 VanDerWaalsContact O-CG 3.28Å; I326-L330 WeakPolarHBondContact O-CG 3.17Å; I326-L330 PolarHBondContact O-N 2.98Å; P327-L330 PolarHBondContact O-N 2.98Å; L330-Q332 VanDerWaalsContact C-N 3.34Å; L330-Q332 PolarHBondContact O-N 2.95Å; L330-A333 CarbonylContact O-C 2.94Å; L330-A333 PolarHBondContact O-N 3Å; L330-A333 VanDerWaalsContact O-N 3.13Å; L330-G334 PolarHBondContact O-N 2.84Å; L330-L335 CarbonylContact C-O 3.47Å; L330-L335 HydrophobicContact CD2-CB 4.14Å; L330-L335 PolarHBondContact O-N 2.84Å; L330-V337 HydrophobicContact CD1-CG2 3.79Å; L330-I340 HydrophobicContact CD2-CD1 3.53Å; L330-I340 HydrophobicContact CD2-CG1 3.66Å; L330-V405 HydrophobicContact CD2-CG2 4.08Å; L330-V419 HydrophobicContact CD2-CG2 4.02Å
331	Q	98.3	Very high	98.4	Very high	157 Å²	157	47.4 Å²	47.4	73%	0.734	27%	0.265	S	S	*	.	H	α-helix	trans	-58.4	-45.6	175.3	-176.4	-178.2	12.1	0	0	111.5	P327 A333 G334	P327-Q331 WeakPolarHBondContact O-CB 3.4Å; P327-Q331 PolarHBondContact O-N 2.84Å; Q331-A333 VanDerWaalsContact C-N 3.29Å; Q331-A333 PolarHBondContact O-N 3.4Å; Q331-G334 PolarHBondContact O-N 3.14Å; Q331-G334 VanDerWaalsContact O-N 3.13Å
332	Q	96.9	Very high	98.4	Very high	122 Å²	122	47.4 Å²	47.4	57%	0.57	27%	0.265	S	S	*	.	H	α-helix	trans	-62.7	-36.5	175.6	-72.5	-173.2	21.4	0	0	112.9	S308 A328 A329 L330 G334	S308-Q332 PolarHBondContact O-NE2 3.1Å; S308-Q332 PolarHBondContact O-OE1 2.94Å; A328-Q332 PolarHBondContact O-N 2.59Å; A329-Q332 PolarHBondContact O-N 2.88Å; L330-Q332 VanDerWaalsContact C-N 3.34Å; L330-Q332 PolarHBondContact O-N 2.95Å; Q332-G334 PolarHBondContact O-N 3.19Å
333	A	97.4	Very high	98.4	Very high	25 Å²	25	47.4 Å²	47.4	21%	0.207	27%	0.265	C	S	.	.	H	α-helix	trans	-76.6	-7	177	0	0	0	0	0	113.5	R306 A329 L330 Q331 L335 V419	R306-A333 HydrophobicContact CB-CB 3.94Å; A329-A333 PolarHBondContact O-N 3.22Å; A329-A333 VanDerWaalsContact O-N 3.07Å; L330-A333 CarbonylContact O-C 2.94Å; L330-A333 PolarHBondContact O-N 3Å; L330-A333 VanDerWaalsContact O-N 3.13Å; Q331-A333 VanDerWaalsContact C-N 3.29Å; Q331-A333 PolarHBondContact O-N 3.4Å; A333-L335 VanDerWaalsContact C-N 3.28Å; A333-L335 HydrophobicContact CB-CB 4.45Å; A333-L335 HydrophobicContact CB-CD1 4.04Å; A333-L335 HydrophobicContact CB-CG 4.2Å; A333-L335 PolarHBondContact O-N 3.08Å; A333-V419 HydrophobicContact CB-CB 4.04Å; A333-V419 HydrophobicContact CB-CG1 4.03Å; A333-V419 HydrophobicContact CB-CG2 4.03Å
334	G	97.8	Very high	98.4	Very high	69 Å²	69	47 Å²	47	71%	0.711	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	26.1	-174.1	0	0	0	0	0	113.8	L330 Q331 Q332	L330-G334 PolarHBondContact O-N 2.84Å; Q331-G334 PolarHBondContact O-N 3.14Å; Q331-G334 VanDerWaalsContact O-N 3.13Å; Q332-G334 PolarHBondContact O-N 3.19Å
335	L	98.4	Very high	98.4	Very high	33 Å²	33	43.4 Å²	43.4	17%	0.173	24%	0.243	C	C	.	.			trans	-116.9	163.9	-174.6	-66.2	172.9	0	0	0	112.1	L330 A333 D339 I340 F403 V419	L330-L335 CarbonylContact C-O 3.47Å; L330-L335 HydrophobicContact CD2-CB 4.14Å; L330-L335 PolarHBondContact O-N 2.84Å; A333-L335 VanDerWaalsContact C-N 3.28Å; A333-L335 HydrophobicContact CB-CB 4.45Å; A333-L335 HydrophobicContact CB-CD1 4.04Å; A333-L335 HydrophobicContact CB-CG 4.2Å; A333-L335 PolarHBondContact O-N 3.08Å; L335-D339 HydrophobicContact CB-CB 4.44Å; L335-D339 HydrophobicContact CD2-CB 3.99Å; L335-I340 HydrophobicContact CD1-CD1 4.24Å; L335-F403 HydrophobicContact CD1-CB 4.36Å; L335-F403 HydrophobicContact CD1-CD1 3.56Å; L335-F403 HydrophobicContact CD1-CD2 4.35Å; L335-F403 HydrophobicContact CD1-CE1 3.82Å; L335-F403 HydrophobicContact CD1-CG 3.84Å; L335-F403 HydrophobicContact CD1-CZ 4.31Å; L335-F403 HydrophobicContact CD2-CE2 4.3Å; L335-F403 HydrophobicContact CD2-CZ 4.31Å; L335-V419 HydrophobicContact CD1-CG1 3.91Å
336	K	98.1	Very high	98.4	Very high	155 Å²	155	43.5 Å²	43.5	67%	0.674	24%	0.244	S	C	*	.			trans	-114.9	164.1	172.8	-60.6	176.6	-177.4	174.1	0	110	N338 D339	K336-N338 PolarHBondContact O-N 2.99Å; K336-D339 WeakPolarHBondContact CA-OD2 3.45Å; K336-D339 WeakPolarHBondContact CB-OD2 3.47Å; K336-D339 PolarHBondContact N-OD2 3.47Å; K336-D339 WeakPolarHBondContact O-CB 3.24Å; K336-D339 PolarHBondContact O-N 3.38Å
337	V	97.8	Very high	98.4	Very high	33 Å²	33	43.4 Å²	43.4	20%	0.2	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-52.7	-39.3	176.8	169.3	0	0	0	0	112.1	L330 D339 I340 F343 L362	L330-V337 HydrophobicContact CD1-CG2 3.79Å; V337-D339 PolarHBondContact O-N 3.28Å; V337-I340 PolarHBondContact O-N 2.94Å; V337-F343 HydrophobicContact CG1-CZ 4.12Å; V337-L362 HydrophobicContact CG1-CD2 3.49Å; V337-L362 VanDerWaalsContact CG1-CD2 3.49Å; V337-L362 HydrophobicContact CG2-CD2 4.38Å
338	N	97.3	Very high	98.3	Very high	133 Å²	133	40.9 Å²	40.9	71%	0.711	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-68.4	-20.6	-178.3	-69.2	-10.9	0	0	0	113.6	K336 I340	K336-N338 PolarHBondContact O-N 2.99Å; N338-I340 VanDerWaalsContact C-N 3.26Å; N338-I340 PolarHBondContact O-N 3.15Å
339	D	98.2	Very high	98.3	Very high	73 Å²	73	40.5 Å²	40.5	39%	0.39	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-80.2	-10.9	179.6	-53.3	-41.3	0	0	0	112.2	L335 K336 V337	L335-D339 HydrophobicContact CB-CB 4.44Å; L335-D339 HydrophobicContact CD2-CB 3.99Å; K336-D339 WeakPolarHBondContact CA-OD2 3.45Å; K336-D339 WeakPolarHBondContact CB-OD2 3.47Å; K336-D339 PolarHBondContact N-OD2 3.47Å; K336-D339 WeakPolarHBondContact O-CB 3.24Å; K336-D339 PolarHBondContact O-N 3.38Å; V337-D339 PolarHBondContact O-N 3.28Å
340	I	98.8	Very high	98.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.			trans	-90.1	132.3	-176.2	-53.7	-53.4	0	0	0	110.6	L330 L335 V337 N338 V342 F343 K366 F403 V405 V419	L330-I340 HydrophobicContact CD2-CD1 3.53Å; L330-I340 HydrophobicContact CD2-CG1 3.66Å; L335-I340 HydrophobicContact CD1-CD1 4.24Å; V337-I340 PolarHBondContact O-N 2.94Å; N338-I340 VanDerWaalsContact C-N 3.26Å; N338-I340 PolarHBondContact O-N 3.15Å; I340-V342 VanDerWaalsContact CG2-O 3.26Å; I340-V342 WeakPolarHBondContact CG2-O 3.43Å; I340-F343 HydrophobicContact CB-CD2 4.47Å; I340-F343 HydrophobicContact CB-CE1 4Å; I340-F343 HydrophobicContact CB-CE2 3.62Å; I340-F343 HydrophobicContact CB-CZ 3.35Å; I340-F343 HydrophobicContact CG1-CE1 4.12Å; I340-F343 HydrophobicContact CG1-CZ 3.78Å; I340-F343 HydrophobicContact CG2-CD1 4.07Å; I340-F343 HydrophobicContact CG2-CD2 3.85Å; I340-F343 HydrophobicContact CG2-CE1 3.73Å; I340-F343 HydrophobicContact CG2-CE2 3.49Å; I340-F343 VanDerWaalsContact CG2-CE2 3.49Å; I340-F343 HydrophobicContact CG2-CG 4.13Å; I340-F343 HydrophobicContact CG2-CZ 3.43Å; I340-F343 VanDerWaalsContact CG2-CZ 3.43Å; I340-K366 VanDerWaalsContact O-CD 3.27Å; I340-K366 WeakPolarHBondContact O-CD 3.33Å; I340-K366 WeakPolarHBondContact O-CE 3.43Å; I340-K366 PolarHBondContact O-NZ 2.85Å; I340-F403 HydrophobicContact CD1-CB 3.71Å; I340-V405 HydrophobicContact CD1-CG2 3.94Å; I340-V405 HydrophobicContact CG1-CG2 3.94Å; I340-V405 HydrophobicContact CG2-CB 4.39Å; I340-V405 HydrophobicContact CG2-CG2 3.88Å; I340-V419 HydrophobicContact CD1-CG1 4.38Å
341	D	98.8	Very high	98.3	Very high	20 Å²	20	40.2 Å²	40.2	11%	0.107	22%	0.219	C	C	.	.	S	Bend	trans	-91.6	-31.2	-179.8	-65.4	-92.1	0	0	0	113	K366 L395 R398 R400 A402 F403	D341-K366 WeakPolarHBondContact O-CG 3.47Å; D341-L395 HydrophobicContact CB-CD2 4.3Å; D341-R398 PolarHBondContact O-NH1 3.33Å; D341-R400 IonicContact OD1-CZ 3.29Å; D341-R400 VanDerWaalsContact OD1-CZ 3.29Å; D341-R400 IonicContact OD1-NH1 2.93Å; D341-R400 PolarHBondContact OD1-NH1 3.2Å; D341-R400 IonicContact OD1-NH2 2.74Å; D341-R400 PolarHBondContact OD1-NH2 2.79Å; D341-R400 IonicContact OD2-NH1 3.89Å; D341-A402 HydrophobicContact CB-CB 4.11Å; D341-A402 VanDerWaalsContact OD2-CA 3.26Å; D341-A402 WeakPolarHBondContact OD2-CA 3.48Å; D341-A402 VanDerWaalsContact OD2-CB 3.32Å; D341-A402 WeakPolarHBondContact OD2-CB 3.45Å; D341-F403 WeakPolarHBondContact CB-O 3.16Å; D341-F403 PolarHBondContact N-O 3.23Å; D341-F403 PolarHBondContact OD2-N 3.08Å
342	V	98.9	Very high	98.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	134.7	-178.5	-177.8	0	0	0	0	111.3	I340 K366 P369 L391 E394 L395 R398 F403 G404 V405	I340-V342 VanDerWaalsContact CG2-O 3.26Å; I340-V342 WeakPolarHBondContact CG2-O 3.43Å; V342-K366 WeakPolarHBondContact CA-O 3.28Å; V342-P369 HydrophobicContact CG1-CG 3.86Å; V342-P369 HydrophobicContact CG2-CG 4.49Å; V342-L391 HydrophobicContact CB-CD1 3.61Å; V342-L391 HydrophobicContact CG1-CD1 3.44Å; V342-L391 VanDerWaalsContact CG1-CD1 3.44Å; V342-E394 HydrophobicContact CG2-CG 4.3Å; V342-L395 HydrophobicContact CB-CD2 4.05Å; V342-L395 HydrophobicContact CG2-CD2 3.65Å; V342-R398 VanDerWaalsContact CG2-NH1 3.32Å; V342-R398 VanDerWaalsContact CG2-NH2 3.35Å; V342-F403 PolarHBondContact N-O 2.92Å; V342-G404 CarbonylContact O-C 3.6Å; V342-G404 VanDerWaalsContact O-CA 3.22Å; V342-G404 WeakPolarHBondContact O-CA 3.24Å; V342-V405 PolarHBondContact O-N 2.85Å
343	F	98.9	Very high	98.5	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	113.2	170.3	-64.7	-93.1	0	0	0	109.3	I326 V337 I340 I345 L362 K366 V367 N368 V405	I326-F343 HydrophobicContact CG2-CE1 4.24Å; V337-F343 HydrophobicContact CG1-CZ 4.12Å; I340-F343 HydrophobicContact CB-CD2 4.47Å; I340-F343 HydrophobicContact CB-CE1 4Å; I340-F343 HydrophobicContact CB-CE2 3.62Å; I340-F343 HydrophobicContact CB-CZ 3.35Å; I340-F343 HydrophobicContact CG1-CE1 4.12Å; I340-F343 HydrophobicContact CG1-CZ 3.78Å; I340-F343 HydrophobicContact CG2-CD1 4.07Å; I340-F343 HydrophobicContact CG2-CD2 3.85Å; I340-F343 HydrophobicContact CG2-CE1 3.73Å; I340-F343 HydrophobicContact CG2-CE2 3.49Å; I340-F343 VanDerWaalsContact CG2-CE2 3.49Å; I340-F343 HydrophobicContact CG2-CG 4.13Å; I340-F343 HydrophobicContact CG2-CZ 3.43Å; I340-F343 VanDerWaalsContact CG2-CZ 3.43Å; F343-I345 HydrophobicContact CB-CD1 4.22Å; F343-I345 HydrophobicContact CB-CG1 4.12Å; F343-I345 PolarHBondContact O-N 3.38Å; F343-L362 HydrophobicContact CD1-CD1 4.11Å; F343-L362 HydrophobicContact CD1-CD2 4.47Å; F343-L362 HydrophobicContact CE1-CD1 4.39Å; F343-L362 HydrophobicContact CE1-CD2 3.96Å; F343-L362 HydrophobicContact CE2-CD2 4.17Å; F343-L362 HydrophobicContact CG-CD1 4.19Å; F343-L362 HydrophobicContact CZ-CD2 3.77Å; F343-K366 HydrophobicContact CD2-CB 4.06Å; F343-K366 PolarHBondContact N-O 2.95Å; F343-V367 HydrophobicContact CB-CG2 4.26Å; F343-V367 WeakPolarHBondContact O-CA 3.21Å; F343-N368 PolarHBondContact O-N 3.34Å; F343-N368 PolarHBondContact O-OD1 3.38Å; F343-V405 CarbonylContact C-O 3.48Å; F343-V405 WeakPolarHBondContact CA-O 3.33Å; F343-V405 HydrophobicContact CD1-CB 3.7Å; F343-V405 HydrophobicContact CD1-CG1 4.16Å; F343-V405 HydrophobicContact CD1-CG2 4.13Å; F343-V405 HydrophobicContact CE1-CB 4.08Å; F343-V405 HydrophobicContact CE1-CG2 3.98Å
344	E	98.9	Very high	98.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	89.6	163.9	-82.8	-69.7	141.3	0	0	108.7	N368 R386 Q387 L391 V405 V406 S407	E344-N368 VanDerWaalsContact CA-OD1 3.28Å; E344-N368 WeakPolarHBondContact CA-OD1 3.5Å; E344-R386 IonicContact OE2-NH1 2.85Å; E344-R386 PolarHBondContact OE2-NH1 3.46Å; E344-Q387 HydrophobicContact CB-CB 4.13Å; E344-Q387 HydrophobicContact CB-CG 4.37Å; E344-Q387 PolarHBondContact O-NE2 3.28Å; E344-Q387 VanDerWaalsContact O-NE2 3.12Å; E344-L391 HydrophobicContact CG-CB 3.98Å; E344-L391 HydrophobicContact CG-CD1 4.27Å; E344-V405 PolarHBondContact N-O 2.61Å; E344-V406 HydrophobicContact CB-CG2 4.27Å; E344-V406 CarbonylContact O-C 3.59Å; E344-V406 WeakPolarHBondContact O-CA 3.39Å; E344-S407 PolarHBondContact O-N 3.34Å
345	I	98.9	Very high	98.6	Very high	2 Å²	2	24 Å²	24	1%	0.01	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.2	176.7	-60.5	176.8	0	0	0	108.6	P322 I326 F343 E347 L362 V367 N368 S407	P322-I345 HydrophobicContact CB-CG2 4.33Å; P322-I345 HydrophobicContact CG-CG2 4.33Å; I326-I345 HydrophobicContact CD1-CD1 3.74Å; I326-I345 HydrophobicContact CD1-CG1 4.1Å; F343-I345 HydrophobicContact CB-CD1 4.22Å; F343-I345 HydrophobicContact CB-CG1 4.12Å; F343-I345 PolarHBondContact O-N 3.38Å; I345-E347 PolarHBondContact O-N 3.26Å; I345-L362 HydrophobicContact CD1-CD1 3.37Å; I345-V367 HydrophobicContact CD1-CG1 4.48Å; I345-N368 PolarHBondContact N-OD1 2.94Å; I345-N368 PolarHBondContact O-ND2 2.89Å; I345-N368 PolarHBondContact O-OD1 3.39Å; I345-S407 CarbonylContact C-O 3.58Å; I345-S407 WeakPolarHBondContact CA-O 3.15Å
346	N	98.9	Very high	98.6	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.113	C	C	.	.			trans	-60.1	132.8	-177.7	-174.3	37.2	0	0	0	111.2	A348 Q352 A373 H378 T383 S407 M408	N346-A348 PolarHBondContact O-N 3.44Å; N346-Q352 PolarHBondContact O-NE2 3.13Å; N346-A373 VanDerWaalsContact OD1-CB 3.24Å; N346-A373 WeakPolarHBondContact OD1-CB 3.29Å; N346-H378 PolarHBondContact ND2-CE1 3.08Å; N346-H378 PolarHBondContact ND2-NE2 2.96Å; N346-T383 HydrophobicContact CB-CG2 4.44Å; N346-T383 WeakPolarHBondContact OD1-CG2 3.27Å; N346-S407 PolarHBondContact N-O 3.25Å; N346-M408 HydrophobicContact CB-CB 3.53Å
347	E	98.8	Very high	98.6	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.086	C	C	.	.			trans	-98.5	53.3	-176.1	-52.5	177	165.6	0	0	110.3	F203 S207 S277 I345 F349 N368 G372 A373 I374	F203-E347 HydrophobicContact CE1-CB 4.35Å; F203-E347 HydrophobicContact CE1-CG 3.79Å; F203-E347 HydrophobicContact CZ-CG 4.2Å; S207-E347 WeakPolarHBondContact CB-OE2 3.29Å; S207-E347 PolarHBondContact OG-OE1 2.91Å; S207-E347 PolarHBondContact OG-OE2 2.9Å; S277-E347 WeakPolarHBondContact CB-O 3.48Å; I345-E347 PolarHBondContact O-N 3.26Å; E347-F349 PolarHBondContact O-N 3.08Å; E347-N368 WeakPolarHBondContact CG-ND2 3.3Å; E347-N368 PolarHBondContact OE1-ND2 2.91Å; E347-G372 PolarHBondContact OE1-N 2.77Å; E347-G372 WeakPolarHBondContact OE2-CA 3.44Å; E347-G372 PolarHBondContact OE2-N 3.37Å; E347-A373 HydrophobicContact CB-CB 4.17Å; E347-A373 PolarHBondContact OE2-N 3.29Å; E347-I374 HydrophobicContact CB-CD1 3.95Å; E347-I374 HydrophobicContact CB-CG1 3.8Å; E347-I374 WeakPolarHBondContact OE2-CB 3.39Å; E347-I374 PolarHBondContact OE2-N 3.37Å; E347-I374 VanDerWaalsContact OE2-N 3.11Å
348	A	98.1	Very high	98.7	Very high	4 Å²	4	19.3 Å²	19.3	3%	0.033	10%	0.099	C	C	.	.	S	Bend	trans	-52.4	-45.1	179.6	0	0	0	0	0	110.9	S277 N346	S277-A348 WeakPolarHBondContact CB-O 3.31Å; S277-A348 PolarHBondContact N-O 3.29Å; S277-A348 PolarHBondContact OG-O 3.08Å; N346-A348 PolarHBondContact O-N 3.44Å
349	F	98.9	Very high	98.7	Very high	18 Å²	18	21.2 Å²	21.2	8%	0.079	10%	0.097	C	C	.	.	B	Isolated β-bridge	trans	-141.8	147.3	169.2	-57.1	-82.5	0	0	0	109.4	M182 S186 F265 T271 S276 M318 E347 S351 Q352 A353	M182-F349 HydrophobicContact CB-CE2 3.98Å; M182-F349 HydrophobicContact CB-CZ 4.21Å; S186-F349 VanDerWaalsContact CB-CG 3.48Å; S186-F349 WeakPolarHBondContact OG-CB 3Å; S186-F349 WeakPolarHBondContact OG-CG 3.5Å; F265-F349 AromaticContact CE2-CE1 3.82Å; F265-F349 HydrophobicContact CE2-CE1 3.82Å; F265-F349 HydrophobicContact CZ-CE1 4.12Å; T271-F349 HydrophobicContact CG2-CD1 3.51Å; T271-F349 HydrophobicContact CG2-CE1 3.94Å; S276-F349 VanDerWaalsContact OG-CD1 3.28Å; S276-F349 WeakPolarHBondContact OG-CD1 3.44Å; M318-F349 HydrophobicContact CE-CE2 4.31Å; E347-F349 PolarHBondContact O-N 3.08Å; F349-S351 VanDerWaalsContact C-N 3.3Å; F349-S351 WeakPolarHBondContact CB-OG 3.38Å; F349-S351 PolarHBondContact O-N 3.15Å; F349-Q352 HydrophobicContact CB-CG 4.37Å; F349-Q352 WeakPolarHBondContact O-CG 3.32Å; F349-Q352 PolarHBondContact O-NE2 2.73Å; F349-Q352 VanDerWaalsContact O-NE2 3.17Å; F349-A353 PolarHBondContact O-N 3.09Å
350	A	98.8	Very high	98.7	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-33.6	176.6	0	0	0	0	0	112.1	Q200 F203 N275 Q352 A353 V354 I374	Q200-A350 HydrophobicContact CB-CB 3.86Å; Q200-A350 HydrophobicContact CG-CB 4.25Å; Q200-A350 VanDerWaalsContact O-CB 3.31Å; Q200-A350 WeakPolarHBondContact O-CB 3.48Å; F203-A350 HydrophobicContact CB-CB 4.4Å; F203-A350 HydrophobicContact CD1-CB 4.08Å; N275-A350 HydrophobicContact CB-CB 3.95Å; N275-A350 VanDerWaalsContact O-CB 3.32Å; N275-A350 WeakPolarHBondContact O-CB 3.19Å; N275-A350 PolarHBondContact O-N 2.91Å; A350-Q352 PolarHBondContact O-N 3.47Å; A350-A353 PolarHBondContact O-N 2.81Å; A350-V354 VanDerWaalsContact O-CB 3.31Å; A350-V354 WeakPolarHBondContact O-CB 3.49Å; A350-V354 VanDerWaalsContact O-CG2 3.23Å; A350-V354 WeakPolarHBondContact O-CG2 3.14Å; A350-V354 PolarHBondContact O-N 3.01Å; A350-I374 HydrophobicContact CB-CD1 3.89Å
351	S	98.8	Very high	98.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-49.6	-53.7	175.8	57.8	0	0	0	0	112.2	S186 F349 F355	S186-S351 WeakPolarHBondContact CB-OG 3.44Å; S186-S351 PolarHBondContact O-OG 3.34Å; S186-S351 PolarHBondContact OG-OG 3.39Å; F349-S351 VanDerWaalsContact C-N 3.3Å; F349-S351 WeakPolarHBondContact CB-OG 3.38Å; F349-S351 PolarHBondContact O-N 3.15Å; S351-F355 WeakPolarHBondContact O-CB 3.42Å; S351-F355 PolarHBondContact O-N 2.84Å; S351-F355 VanDerWaalsContact O-N 3.15Å
352	Q	98.6	Very high	98.7	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-75.2	-35.8	-178.9	70.8	72	30.3	0	0	112.9	V189 G319 N346 F349 A350 F355 C356	V189-Q352 HydrophobicContact CG1-CB 4.33Å; G319-Q352 PolarHBondContact O-OE1 2.76Å; N346-Q352 PolarHBondContact O-NE2 3.13Å; F349-Q352 HydrophobicContact CB-CG 4.37Å; F349-Q352 WeakPolarHBondContact O-CG 3.32Å; F349-Q352 PolarHBondContact O-NE2 2.73Å; F349-Q352 VanDerWaalsContact O-NE2 3.17Å; A350-Q352 PolarHBondContact O-N 3.47Å; Q352-F355 PolarHBondContact O-N 3.31Å; Q352-C356 WeakPolarHBondContact O-CB 3.4Å; Q352-C356 PolarHBondContact O-N 3.46Å; Q352-C356 PolarHBondContact O-SG 3.16Å
353	A	98.7	Very high	98.7	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.008	12%	0.122	C	C	.	.	H	α-helix	trans	-66.3	-48.2	-178.9	0	0	0	0	0	110.1	F203 F349 A350 F355 C356 V357	F203-A353 HydrophobicContact CD1-CB 4.37Å; F203-A353 HydrophobicContact CE1-CB 3.64Å; F203-A353 HydrophobicContact CE2-CB 4.34Å; F203-A353 HydrophobicContact CZ-CB 3.63Å; F349-A353 PolarHBondContact O-N 3.09Å; A350-A353 PolarHBondContact O-N 2.81Å; A353-F355 VanDerWaalsContact C-N 3.35Å; A353-F355 PolarHBondContact O-N 3.17Å; A353-C356 PolarHBondContact O-N 2.67Å; A353-V357 WeakPolarHBondContact O-CB 3.26Å; A353-V357 VanDerWaalsContact O-CG2 3.26Å; A353-V357 WeakPolarHBondContact O-CG2 3.48Å; A353-V357 PolarHBondContact O-N 3.17Å
354	V	98.9	Very high	98.5	Very high	9 Å²	9	27.9 Å²	27.9	6%	0.055	15%	0.15	C	C	.	.	H	α-helix	trans	-58.8	-46.9	174.5	172	0	0	0	0	110.7	V195 Q199 F203 A350 C356 V357 Q358	V195-V354 HydrophobicContact CG1-CB 3.85Å; V195-V354 HydrophobicContact CG1-CG1 3.7Å; Q199-V354 HydrophobicContact CB-CG1 4.3Å; F203-V354 HydrophobicContact CB-CG2 3.54Å; F203-V354 HydrophobicContact CD1-CG2 4.47Å; F203-V354 HydrophobicContact CD2-CG2 3.65Å; F203-V354 HydrophobicContact CG-CG2 3.63Å; A350-V354 VanDerWaalsContact O-CB 3.31Å; A350-V354 WeakPolarHBondContact O-CB 3.49Å; A350-V354 VanDerWaalsContact O-CG2 3.23Å; A350-V354 WeakPolarHBondContact O-CG2 3.14Å; A350-V354 PolarHBondContact O-N 3.01Å; V354-C356 PolarHBondContact O-N 2.77Å; V354-V357 PolarHBondContact O-N 3.17Å; V354-Q358 HydrophobicContact CG1-CG 4.32Å; V354-Q358 WeakPolarHBondContact O-CB 3.47Å; V354-Q358 VanDerWaalsContact O-CG 3.32Å; V354-Q358 WeakPolarHBondContact O-CG 3.38Å; V354-Q358 PolarHBondContact O-N 2.99Å
355	F	98.8	Very high	98.5	Very high	21 Å²	21	34.2 Å²	34.2	9%	0.092	18%	0.179	C	C	.	.	H	α-helix	trans	-55.6	-50.4	176.1	167.1	-96.8	0	0	0	111.8	V189 F193 V195 I320 A323 S351 Q352 A353 V357 Q358 R359	V189-F355 HydrophobicContact CG1-CB 4.07Å; V189-F355 HydrophobicContact CG1-CG 4.28Å; F193-F355 HydrophobicContact CB-CD2 3.6Å; F193-F355 HydrophobicContact CB-CE2 3.89Å; F193-F355 HydrophobicContact CD1-CD2 4.2Å; F193-F355 AromaticContact CD1-CE2 3.59Å; F193-F355 HydrophobicContact CD1-CE2 3.59Å; F193-F355 HydrophobicContact CD1-CZ 4.35Å; F193-F355 AromaticContact CD2-CD2 3.8Å; F193-F355 HydrophobicContact CD2-CD2 3.8Å; F193-F355 AromaticContact CD2-CE2 3.73Å; F193-F355 HydrophobicContact CD2-CE2 3.73Å; F193-F355 HydrophobicContact CD2-CG 4.37Å; F193-F355 HydrophobicContact CD2-CZ 4.27Å; F193-F355 AromaticContact CE1-CE2 3.98Å; F193-F355 HydrophobicContact CE1-CE2 3.98Å; F193-F355 HydrophobicContact CE1-CZ 4.3Å; F193-F355 HydrophobicContact CE2-CE2 4.11Å; F193-F355 HydrophobicContact CE2-CZ 4.22Å; F193-F355 AromaticContact CG-CD2 3.6Å; F193-F355 HydrophobicContact CG-CD2 3.6Å; F193-F355 AromaticContact CG-CE2 3.44Å; F193-F355 HydrophobicContact CG-CE2 3.44Å; F193-F355 VanDerWaalsContact CG-CE2 3.44Å; F193-F355 HydrophobicContact CG-CZ 4.33Å; F193-F355 HydrophobicContact CZ-CE2 4.23Å; F193-F355 HydrophobicContact CZ-CZ 4.23Å; V195-F355 HydrophobicContact CG2-CB 4.06Å; I320-F355 HydrophobicContact CB-CD1 4.31Å; I320-F355 HydrophobicContact CB-CE1 3.65Å; I320-F355 HydrophobicContact CB-CZ 4.43Å; I320-F355 HydrophobicContact CG2-CD1 3.9Å; I320-F355 HydrophobicContact CG2-CE1 3.43Å; I320-F355 VanDerWaalsContact CG2-CE1 3.43Å; I320-F355 HydrophobicContact CG2-CZ 4Å; A323-F355 HydrophobicContact CB-CE1 4.05Å; S351-F355 WeakPolarHBondContact O-CB 3.42Å; S351-F355 PolarHBondContact O-N 2.84Å; S351-F355 VanDerWaalsContact O-N 3.15Å; Q352-F355 PolarHBondContact O-N 3.31Å; A353-F355 VanDerWaalsContact C-N 3.35Å; A353-F355 PolarHBondContact O-N 3.17Å; F355-V357 PolarHBondContact O-N 2.94Å; F355-Q358 PolarHBondContact O-N 2.87Å; F355-R359 HydrophobicContact CE1-CB 4.37Å; F355-R359 HydrophobicContact CE1-CG 4.49Å; F355-R359 HydrophobicContact CE2-CB 4.34Å; F355-R359 HydrophobicContact CZ-CB 4.17Å; F355-R359 HydrophobicContact CZ-CG 4.1Å; F355-R359 WeakPolarHBondContact O-CB 3.43Å; F355-R359 PolarHBondContact O-N 3.4Å
356	C	98.8	Very high	98.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-42.6	-177.4	-68.7	0	0	0	0	112	P322 Q352 A353 V354 R359 L360	P322-C356 HydrophobicContact CB-CB 4.17Å; Q352-C356 WeakPolarHBondContact O-CB 3.4Å; Q352-C356 PolarHBondContact O-N 3.46Å; Q352-C356 PolarHBondContact O-SG 3.16Å; A353-C356 PolarHBondContact O-N 2.67Å; V354-C356 PolarHBondContact O-N 2.77Å; C356-R359 PolarHBondContact O-N 3.02Å; C356-L360 WeakPolarHBondContact O-CB 3.31Å; C356-L360 WeakPolarHBondContact O-CG 3.33Å; C356-L360 PolarHBondContact O-N 3.03Å; C356-L360 VanDerWaalsContact O-N 3.1Å
357	V	98.8	Very high	98.5	Very high	17 Å²	17	36.5 Å²	36.5	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-47.6	176.8	168.5	0	0	0	0	111	A353 V354 F355 A361 L362 V367	A353-V357 WeakPolarHBondContact O-CB 3.26Å; A353-V357 VanDerWaalsContact O-CG2 3.26Å; A353-V357 WeakPolarHBondContact O-CG2 3.48Å; A353-V357 PolarHBondContact O-N 3.17Å; V354-V357 PolarHBondContact O-N 3.17Å; F355-V357 PolarHBondContact O-N 2.94Å; V357-A361 PolarHBondContact O-N 3.15Å; V357-A361 VanDerWaalsContact O-N 3.1Å; V357-L362 HydrophobicContact CG1-CB 4.27Å; V357-L362 HydrophobicContact CG2-CD1 4.43Å; V357-L362 PolarHBondContact O-N 2.85Å; V357-V367 HydrophobicContact CG2-CB 4.45Å; V357-V367 HydrophobicContact CG2-CG1 3.93Å; V357-V367 HydrophobicContact CG2-CG2 4.01Å
358	Q	98.6	Very high	98.5	Very high	105 Å²	105	36.5 Å²	36.5	49%	0.491	19%	0.189	S	C	.	.	H	α-helix	trans	-67.9	-44.9	179	-71.3	175.7	-7	0	0	112	Q199 V354 F355 L360 A361	Q199-Q358 VanDerWaalsContact NE2-NE2 3.15Å; V354-Q358 HydrophobicContact CG1-CG 4.32Å; V354-Q358 WeakPolarHBondContact O-CB 3.47Å; V354-Q358 VanDerWaalsContact O-CG 3.32Å; V354-Q358 WeakPolarHBondContact O-CG 3.38Å; V354-Q358 PolarHBondContact O-N 2.99Å; F355-Q358 PolarHBondContact O-N 2.87Å; Q358-L360 VanDerWaalsContact C-N 3.26Å; Q358-L360 PolarHBondContact O-N 2.98Å; Q358-A361 PolarHBondContact O-N 2.85Å; Q358-A361 VanDerWaalsContact O-N 3.07Å
359	R	98.6	Very high	98.5	Very high	174 Å²	174	37.5 Å²	37.5	66%	0.657	20%	0.196	S	C	*	.	H	α-helix	trans	-61.1	-35.6	-177.6	179.8	61.7	-178.8	113.5	-5.1	112.6	A323 F355 C356	A323-R359 HydrophobicContact CB-CB 4.43Å; A323-R359 HydrophobicContact CB-CG 4.06Å; F355-R359 HydrophobicContact CE1-CB 4.37Å; F355-R359 HydrophobicContact CE1-CG 4.49Å; F355-R359 HydrophobicContact CE2-CB 4.34Å; F355-R359 HydrophobicContact CZ-CB 4.17Å; F355-R359 HydrophobicContact CZ-CG 4.1Å; F355-R359 WeakPolarHBondContact O-CB 3.43Å; F355-R359 PolarHBondContact O-N 3.4Å; C356-R359 PolarHBondContact O-N 3.02Å
360	L	98.5	Very high	98.5	Very high	27 Å²	27	36.9 Å²	36.9	14%	0.141	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.1	178.7	-66.7	176.5	0	0	0	113.5	I326 P327 C356 Q358 L362	I326-L360 HydrophobicContact CB-CD1 3.95Å; I326-L360 HydrophobicContact CD1-CD1 3.7Å; I326-L360 HydrophobicContact CG1-CD1 4.38Å; I326-L360 HydrophobicContact CG2-CD1 4.12Å; P327-L360 HydrophobicContact CG-CD2 3.63Å; C356-L360 WeakPolarHBondContact O-CB 3.31Å; C356-L360 WeakPolarHBondContact O-CG 3.33Å; C356-L360 PolarHBondContact O-N 3.03Å; C356-L360 VanDerWaalsContact O-N 3.1Å; Q358-L360 VanDerWaalsContact C-N 3.26Å; Q358-L360 PolarHBondContact O-N 2.98Å; L360-L362 VanDerWaalsContact C-N 3.27Å; L360-L362 HydrophobicContact CB-CD1 4.37Å; L360-L362 HydrophobicContact CB-CD2 3.61Å; L360-L362 HydrophobicContact CB-CG 3.73Å; L360-L362 HydrophobicContact CD1-CD1 4.29Å; L360-L362 HydrophobicContact CD1-CD2 4.35Å; L360-L362 HydrophobicContact CD1-CG 4.49Å; L360-L362 PolarHBondContact O-N 3.36Å
361	A	98.4	Very high	98.5	Very high	79 Å²	79	36.9 Å²	36.9	65%	0.653	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.1	44.3	-175.1	0	0	0	0	0	112.9	V357 Q358	V357-A361 PolarHBondContact O-N 3.15Å; V357-A361 VanDerWaalsContact O-N 3.1Å; Q358-A361 PolarHBondContact O-N 2.85Å; Q358-A361 VanDerWaalsContact O-N 3.07Å
362	L	98.5	Very high	98.5	Very high	7 Å²	7	36.9 Å²	36.9	4%	0.037	19%	0.193	C	C	.	.			trans	-74.5	135.6	-179.7	-51.5	-176.8	0	0	0	110.3	V337 F343 I345 V357 L360 P364 V367	V337-L362 HydrophobicContact CG1-CD2 3.49Å; V337-L362 VanDerWaalsContact CG1-CD2 3.49Å; V337-L362 HydrophobicContact CG2-CD2 4.38Å; F343-L362 HydrophobicContact CD1-CD1 4.11Å; F343-L362 HydrophobicContact CD1-CD2 4.47Å; F343-L362 HydrophobicContact CE1-CD1 4.39Å; F343-L362 HydrophobicContact CE1-CD2 3.96Å; F343-L362 HydrophobicContact CE2-CD2 4.17Å; F343-L362 HydrophobicContact CG-CD1 4.19Å; F343-L362 HydrophobicContact CZ-CD2 3.77Å; I345-L362 HydrophobicContact CD1-CD1 3.37Å; V357-L362 HydrophobicContact CG1-CB 4.27Å; V357-L362 HydrophobicContact CG2-CD1 4.43Å; V357-L362 PolarHBondContact O-N 2.85Å; L360-L362 VanDerWaalsContact C-N 3.27Å; L360-L362 HydrophobicContact CB-CD1 4.37Å; L360-L362 HydrophobicContact CB-CD2 3.61Å; L360-L362 HydrophobicContact CB-CG 3.73Å; L360-L362 HydrophobicContact CD1-CD1 4.29Å; L360-L362 HydrophobicContact CD1-CD2 4.35Å; L360-L362 HydrophobicContact CD1-CG 4.49Å; L360-L362 PolarHBondContact O-N 3.36Å; L362-P364 WeakPolarHBondContact O-CD 3.36Å; L362-V367 HydrophobicContact CB-CG2 3.93Å; L362-V367 HydrophobicContact CD1-CG2 4.16Å
363	P	97.8	Very high	98.5	Very high	31 Å²	31	36.9 Å²	36.9	20%	0.201	19%	0.193	C	C	.	.			trans	-62.2	119.9	172.1	-20.2	32.3	0	0	0	110.3	E365 K366	P363-E365 WeakPolarHBondContact CB-OE1 3.46Å; P363-E365 WeakPolarHBondContact CB-OE2 3.4Å; P363-E365 PolarHBondContact O-N 3.34Å; P363-E365 VanDerWaalsContact O-N 3.16Å; P363-K366 HydrophobicContact CB-CD 4.2Å; P363-K366 HydrophobicContact CB-CG 4.16Å; P363-K366 HydrophobicContact CG-CD 4.07Å; P363-K366 WeakPolarHBondContact O-CB 3.44Å; P363-K366 PolarHBondContact O-N 2.93Å
364	P	96.3	Very high	98.5	Very high	88 Å²	88	36.9 Å²	36.9	57%	0.571	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-56.9	-34.2	-172.6	-27.7	35.7	0	0	0	114.1	L362 K366 V367	L362-P364 WeakPolarHBondContact O-CD 3.36Å; P364-K366 PolarHBondContact O-N 3.25Å; P364-V367 PolarHBondContact O-N 2.86Å; P364-V367 VanDerWaalsContact O-N 3.07Å
365	E	97.5	Very high	98.5	Very high	134 Å²	134	36.5 Å²	36.5	63%	0.626	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-66.3	-18.3	178.7	72.8	-76.4	-179.5	0	0	113.8	P363	P363-E365 WeakPolarHBondContact CB-OE1 3.46Å; P363-E365 WeakPolarHBondContact CB-OE2 3.4Å; P363-E365 PolarHBondContact O-N 3.34Å; P363-E365 VanDerWaalsContact O-N 3.16Å
366	K	98.7	Very high	98.5	Very high	47 Å²	47	35.5 Å²	35.5	20%	0.204	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-89.6	-12.7	174.7	-62.2	-173.4	175.7	-174	0	112.8	I340 D341 V342 F343 P363 P364	I340-K366 VanDerWaalsContact O-CD 3.27Å; I340-K366 WeakPolarHBondContact O-CD 3.33Å; I340-K366 WeakPolarHBondContact O-CE 3.43Å; I340-K366 PolarHBondContact O-NZ 2.85Å; D341-K366 WeakPolarHBondContact O-CG 3.47Å; V342-K366 WeakPolarHBondContact CA-O 3.28Å; F343-K366 HydrophobicContact CD2-CB 4.06Å; F343-K366 PolarHBondContact N-O 2.95Å; P363-K366 HydrophobicContact CB-CD 4.2Å; P363-K366 HydrophobicContact CB-CG 4.16Å; P363-K366 HydrophobicContact CG-CD 4.07Å; P363-K366 WeakPolarHBondContact O-CB 3.44Å; P363-K366 PolarHBondContact O-N 2.93Å; P364-K366 PolarHBondContact O-N 3.25Å
367	V	98.9	Very high	98.5	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.018	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-94.8	118.9	-175	-176.5	0	0	0	0	110.6	K210 F343 I345 V357 L362 P364	K210-V367 PolarHBondContact NZ-O 2.77Å; F343-V367 HydrophobicContact CB-CG2 4.26Å; F343-V367 WeakPolarHBondContact O-CA 3.21Å; I345-V367 HydrophobicContact CD1-CG1 4.48Å; V357-V367 HydrophobicContact CG2-CB 4.45Å; V357-V367 HydrophobicContact CG2-CG1 3.93Å; V357-V367 HydrophobicContact CG2-CG2 4.01Å; L362-V367 HydrophobicContact CB-CG2 3.93Å; L362-V367 HydrophobicContact CD1-CG2 4.16Å; P364-V367 PolarHBondContact O-N 2.86Å; P364-V367 VanDerWaalsContact O-N 3.07Å
368	N	98.9	Very high	98.5	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.183	C	C	.	.	S	Bend	trans	44.8	59.4	-179.6	-55.1	-24.2	0	0	0	111.3	K210 F343 E344 I345 E347 L370 G371	K210-N368 WeakPolarHBondContact CD-O 3.32Å; K210-N368 WeakPolarHBondContact CE-O 3.5Å; K210-N368 PolarHBondContact NZ-O 2.92Å; K210-N368 VanDerWaalsContact NZ-O 3.16Å; F343-N368 PolarHBondContact O-N 3.34Å; F343-N368 PolarHBondContact O-OD1 3.38Å; E344-N368 VanDerWaalsContact CA-OD1 3.28Å; E344-N368 WeakPolarHBondContact CA-OD1 3.5Å; I345-N368 PolarHBondContact N-OD1 2.94Å; I345-N368 PolarHBondContact O-ND2 2.89Å; I345-N368 PolarHBondContact O-OD1 3.39Å; E347-N368 WeakPolarHBondContact CG-ND2 3.3Å; E347-N368 PolarHBondContact OE1-ND2 2.91Å; N368-L370 PolarHBondContact O-N 3.49Å; N368-G371 PolarHBondContact O-N 3.04Å
369	P	98.8	Very high	98.5	Very high	26 Å²	26	30.1 Å²	30.1	17%	0.169	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18	-172.2	25.5	-35	0	0	0	113.1	V342 E394	V342-P369 HydrophobicContact CG1-CG 3.86Å; V342-P369 HydrophobicContact CG2-CG 4.49Å; P369-E394 HydrophobicContact CG-CG 4.17Å
370	L	98.8	Very high	98.4	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.021	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	13.3	178.3	-50.9	-174.7	0	0	0	112.9	A211 A214 R219 F220 N368 T390 E394	A211-L370 WeakPolarHBondContact CA-O 3.17Å; A211-L370 PolarHBondContact N-O 3.37Å; A214-L370 HydrophobicContact CB-CB 3.91Å; A214-L370 HydrophobicContact CB-CD2 4.02Å; A214-L370 HydrophobicContact CB-CG 4.48Å; R219-L370 HydrophobicContact CB-CD1 4.47Å; F220-L370 HydrophobicContact CE1-CB 3.97Å; F220-L370 HydrophobicContact CE1-CD1 4.26Å; F220-L370 HydrophobicContact CZ-CB 4.07Å; F220-L370 WeakPolarHBondContact CZ-O 3.43Å; N368-L370 PolarHBondContact O-N 3.49Å; L370-T390 HydrophobicContact CD1-CG2 4.1Å; L370-E394 HydrophobicContact CD1-CB 4.14Å; L370-E394 HydrophobicContact CD1-CG 4.41Å
371	G	98.7	Very high	98.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.124	C	C	.	.			trans	79.2	159.4	-170.5	0	0	0	0	0	112	S207 N368	S207-G371 WeakPolarHBondContact O-CA 3.41Å; N368-G371 PolarHBondContact O-N 3.04Å
372	G	98.6	Very high	98.4	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.01	9%	0.093	C	C	.	.			trans	-125.6	-156.8	-175.9	0	0	0	0	0	113	S207 E347 I374 A375 L376	S207-G372 PolarHBondContact OG-N 3Å; E347-G372 PolarHBondContact OE1-N 2.77Å; E347-G372 WeakPolarHBondContact OE2-CA 3.44Å; E347-G372 PolarHBondContact OE2-N 3.37Å; G372-I374 VanDerWaalsContact C-N 3.26Å; G372-I374 PolarHBondContact O-N 3.29Å; G372-A375 PolarHBondContact O-N 3.02Å; G372-L376 WeakPolarHBondContact O-CB 3.43Å; G372-L376 WeakPolarHBondContact O-CG 3.38Å; G372-L376 PolarHBondContact O-N 3.27Å
373	A	98.8	Very high	98.5	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-68.2	-17.4	-168.3	0	0	0	0	0	115.3	S277 N346 E347 A375 G377 H378	S277-A373 WeakPolarHBondContact CA-O 3.47Å; N346-A373 VanDerWaalsContact OD1-CB 3.24Å; N346-A373 WeakPolarHBondContact OD1-CB 3.29Å; E347-A373 HydrophobicContact CB-CB 4.17Å; E347-A373 PolarHBondContact OE2-N 3.29Å; A373-A375 VanDerWaalsContact C-N 3.29Å; A373-G377 CarbonylContact O-C 3.52Å; A373-G377 WeakPolarHBondContact O-CA 3.33Å; A373-G377 PolarHBondContact O-N 2.64Å; A373-H378 HydrophobicContact CB-CB 4.1Å
374	I	98.8	Very high	98.5	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-64	-39.9	170.3	-70.4	165.8	0	0	0	110.1	F203 A204 G274 Q278 E347 A350 G372	F203-I374 HydrophobicContact CD1-CD1 3.95Å; F203-I374 HydrophobicContact CE1-CD1 4.18Å; A204-I374 HydrophobicContact CB-CD1 4.2Å; A204-I374 HydrophobicContact CB-CG2 3.88Å; G274-I374 WeakPolarHBondContact O-CG2 3.42Å; Q278-I374 PolarHBondContact NE2-O 3.46Å; E347-I374 HydrophobicContact CB-CD1 3.95Å; E347-I374 HydrophobicContact CB-CG1 3.8Å; E347-I374 WeakPolarHBondContact OE2-CB 3.39Å; E347-I374 PolarHBondContact OE2-N 3.37Å; E347-I374 VanDerWaalsContact OE2-N 3.11Å; A350-I374 HydrophobicContact CB-CD1 3.89Å; G372-I374 VanDerWaalsContact C-N 3.26Å; G372-I374 PolarHBondContact O-N 3.29Å
375	A	98.8	Very high	98.6	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-88.9	-47.3	178.5	0	0	0	0	0	113.1	Q208 A211 G248 I249 Q278 G372 A373	Q208-A375 HydrophobicContact CG-CB 4.22Å; A211-A375 HydrophobicContact CB-CB 3.49Å; A211-A375 VanDerWaalsContact CB-CB 3.49Å; G248-A375 CarbonylContact C-O 3.58Å; G248-A375 VanDerWaalsContact CA-O 3.24Å; G248-A375 WeakPolarHBondContact CA-O 3.33Å; I249-A375 PolarHBondContact N-O 3.3Å; Q278-A375 PolarHBondContact NE2-O 3.08Å; G372-A375 PolarHBondContact O-N 3.02Å; A373-A375 VanDerWaalsContact C-N 3.29Å
376	L	98.6	Very high	98.7	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-81.9	-30.4	-172.8	-59.1	176.6	0	0	0	112.7	I49 A211 F220 D246 I249 G372	I49-L376 VanDerWaalsContact CB-O 3.3Å; I49-L376 WeakPolarHBondContact CB-O 3.46Å; I49-L376 HydrophobicContact CD1-CB 4.26Å; I49-L376 WeakPolarHBondContact CG2-O 3.22Å; A211-L376 HydrophobicContact CB-CD2 4.13Å; F220-L376 HydrophobicContact CE2-CD2 4.13Å; F220-L376 HydrophobicContact CZ-CD1 4.44Å; F220-L376 HydrophobicContact CZ-CD2 3.97Å; D246-L376 HydrophobicContact CB-CD2 4.28Å; I249-L376 HydrophobicContact CD1-CD2 3.9Å; I249-L376 HydrophobicContact CG1-CD2 4.11Å; G372-L376 WeakPolarHBondContact O-CB 3.43Å; G372-L376 WeakPolarHBondContact O-CG 3.38Å; G372-L376 PolarHBondContact O-N 3.27Å
377	G	98.6	Very high	98.7	Very high	0 Å²	0	2.7 Å²	2.7	0%	0	2%	0.016	C	C	.	.			trans	102.6	162.5	-172.1	0	0	0	0	0	114.2	S280 A373	S280-G377 VanDerWaalsContact OG-CA 3.28Å; S280-G377 WeakPolarHBondContact OG-CA 3.23Å; A373-G377 CarbonylContact O-C 3.52Å; A373-G377 WeakPolarHBondContact O-CA 3.33Å; A373-G377 PolarHBondContact O-N 2.64Å
378	H	98.7	Very high	98.7	Very high	9 Å²	9	2.5 Å²	2.5	4%	0.042	2%	0.015	C	C	.	.			trans	-127.1	76.7	-177.7	-173.6	32.8	0	0	0	112	Q278 N346 A373 L380 T383	Q278-H378 PolarHBondContact O-N 3.06Å; N346-H378 PolarHBondContact ND2-CE1 3.08Å; N346-H378 PolarHBondContact ND2-NE2 2.96Å; A373-H378 HydrophobicContact CB-CB 4.1Å; H378-L380 PolarHBondContact O-N 2.96Å; H378-T383 PolarHBondContact CE1-OG1 3.05Å; H378-T383 VanDerWaalsContact ND1-CB 3.35Å; H378-T383 WeakPolarHBondContact ND1-CB 3.29Å; H378-T383 WeakPolarHBondContact ND1-CG2 3.44Å; H378-T383 PolarHBondContact ND1-OG1 2.82Å
379	P	98.4	Very high	98.7	Very high	0 Å²	0	2.6 Å²	2.6	0%	0	2%	0.015	C	C	.	.			trans	-71.2	95.9	167.2	29.4	-31.3	0	0	0	108	I49 E152 G381 C382 T383	I49-P379 HydrophobicContact CD1-CG 4.33Å; I49-P379 HydrophobicContact CG1-CG 4.41Å; I49-P379 HydrophobicContact CG2-CG 4.25Å; E152-P379 HydrophobicContact CB-CB 3.95Å; P379-G381 PolarHBondContact O-N 3.5Å; P379-C382 HydrophobicContact CB-CB 3.96Å; P379-C382 HydrophobicContact CG-CB 3.78Å; P379-C382 WeakPolarHBondContact O-CA 3.17Å; P379-C382 WeakPolarHBondContact O-CB 3.47Å; P379-C382 PolarHBondContact O-N 3.02Å; P379-T383 PolarHBondContact O-N 3.39Å; P379-T383 PolarHBondContact O-OG1 2.99Å; P379-T383 VanDerWaalsContact O-OG1 3.05Å
380	L	98.1	Very high	98.7	Very high	8 Å²	8	1.4 Å²	1.4	4%	0.042	1%	0.007	C	C	.	.	H	α-helix	trans	-30.8	-73.4	-167.8	-56.2	174.6	0	0	0	114	V92 L93 E152 M154 M159 H378 C382 T383	V92-L380 HydrophobicContact CB-CB 4.21Å; V92-L380 HydrophobicContact CB-CD1 4.14Å; V92-L380 HydrophobicContact CG1-CD1 4.16Å; V92-L380 HydrophobicContact CG2-CB 3.78Å; V92-L380 HydrophobicContact CG2-CD1 4.48Å; L93-L380 HydrophobicContact CD1-CD1 4.1Å; L93-L380 HydrophobicContact CD2-CD1 3.96Å; L93-L380 HydrophobicContact CG-CD1 4Å; E152-L380 HydrophobicContact CG-CB 4.14Å; M154-L380 HydrophobicContact CE-CD1 3.88Å; M154-L380 HydrophobicContact CE-CD2 4.38Å; M154-L380 HydrophobicContact CE-CG 3.92Å; M154-L380 HydrophobicContact SD-CG 4.1Å; M159-L380 HydrophobicContact CG-CD1 4.28Å; M159-L380 HydrophobicContact SD-CD1 3.87Å; H378-L380 PolarHBondContact O-N 2.96Å; L380-C382 VanDerWaalsContact C-N 3.26Å; L380-C382 PolarHBondContact O-N 3.49Å; L380-T383 PolarHBondContact O-N 2.99Å
381	G	98.3	Very high	98.7	Very high	0 Å²	0	1.2 Å²	1.2	0%	0	1%	0.006	C	C	.	.	H	α-helix	trans	-62.2	-26.7	-176.9	0	0	0	0	0	115.2	G127 G150 E152 P379	G127-G381 WeakPolarHBondContact CA-O 3.41Å; G127-G381 PolarHBondContact N-O 2.8Å; G150-G381 VanDerWaalsContact CA-O 3.29Å; G150-G381 WeakPolarHBondContact CA-O 3.47Å; E152-G381 PolarHBondContact OE2-N 3.05Å; P379-G381 PolarHBondContact O-N 3.5Å
382	C	98.8	Very high	98.7	Very high	1 Å²	1	1.2 Å²	1.2	1%	0.007	1%	0.007	C	C	.	.	H	α-helix	trans	-77	-32.7	178.9	164.6	0	0	0	0	113.3	G150 G282 P379 L380 G384 A385 R386	G150-C382 VanDerWaalsContact C-CA 3.48Å; G282-C382 VanDerWaalsContact O-CB 3.28Å; G282-C382 WeakPolarHBondContact O-CB 3.39Å; P379-C382 HydrophobicContact CB-CB 3.96Å; P379-C382 HydrophobicContact CG-CB 3.78Å; P379-C382 WeakPolarHBondContact O-CA 3.17Å; P379-C382 WeakPolarHBondContact O-CB 3.47Å; P379-C382 PolarHBondContact O-N 3.02Å; L380-C382 VanDerWaalsContact C-N 3.26Å; L380-C382 PolarHBondContact O-N 3.49Å; C382-G384 PolarHBondContact O-N 3.39Å; C382-A385 PolarHBondContact O-N 3.15Å; C382-A385 VanDerWaalsContact O-N 3.11Å; C382-R386 WeakPolarHBondContact O-CB 3.39Å; C382-R386 PolarHBondContact O-N 3.31Å
383	T	98.9	Very high	98.7	Very high	0 Å²	0	1.3 Å²	1.3	0%	0	1%	0.007	C	C	.	.	H	α-helix	trans	-58.9	-41.9	-162.7	-66.5	0	0	0	0	114.2	N346 H378 P379 L380 A385 R386 Q387	N346-T383 HydrophobicContact CB-CG2 4.44Å; N346-T383 WeakPolarHBondContact OD1-CG2 3.27Å; H378-T383 PolarHBondContact CE1-OG1 3.05Å; H378-T383 VanDerWaalsContact ND1-CB 3.35Å; H378-T383 WeakPolarHBondContact ND1-CB 3.29Å; H378-T383 WeakPolarHBondContact ND1-CG2 3.44Å; H378-T383 PolarHBondContact ND1-OG1 2.82Å; P379-T383 PolarHBondContact O-N 3.39Å; P379-T383 PolarHBondContact O-OG1 2.99Å; P379-T383 VanDerWaalsContact O-OG1 3.05Å; L380-T383 PolarHBondContact O-N 2.99Å; T383-A385 PolarHBondContact O-N 3.21Å; T383-R386 WeakPolarHBondContact O-CB 3.39Å; T383-R386 PolarHBondContact O-N 3.35Å; T383-Q387 HydrophobicContact CG2-CG 4.25Å; T383-Q387 WeakPolarHBondContact O-CB 3.39Å; T383-Q387 WeakPolarHBondContact O-CG 3.37Å; T383-Q387 PolarHBondContact O-N 2.86Å
384	G	98.9	Very high	98.7	Very high	0 Å²	0	1.7 Å²	1.7	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-62.1	-43.1	179.2	0	0	0	0	0	113.3	C382 V388	C382-G384 PolarHBondContact O-N 3.39Å; G384-V388 WeakPolarHBondContact O-CG2 3.41Å; G384-V388 PolarHBondContact O-N 2.84Å
385	A	98.9	Very high	98.7	Very high	0 Å²	0	1.6 Å²	1.6	0%	0	1%	0.008	C	C	.	.	H	α-helix	trans	-69.1	-41.5	175.6	0	0	0	0	0	111	A284 V286 C382 T383 Q387 V388 V389	A284-A385 HydrophobicContact CB-CB 3.85Å; V286-A385 HydrophobicContact CG2-CB 4.46Å; C382-A385 PolarHBondContact O-N 3.15Å; C382-A385 VanDerWaalsContact O-N 3.11Å; T383-A385 PolarHBondContact O-N 3.21Å; A385-Q387 VanDerWaalsContact C-N 3.34Å; A385-Q387 PolarHBondContact O-N 3.17Å; A385-V388 WeakPolarHBondContact O-CB 3.13Å; A385-V388 PolarHBondContact O-N 3.27Å; A385-V389 WeakPolarHBondContact O-CG2 3.32Å; A385-V389 PolarHBondContact O-N 2.69Å; A385-V389 VanDerWaalsContact O-N 3.15Å
386	R	98.9	Very high	98.7	Very high	1 Å²	1	6 Å²	6	0%	0.004	2%	0.024	C	C	.	.	H	α-helix	trans	-55.2	-47.5	175.6	-169.7	-80.3	-64.1	160.7	-0.1	112.1	R46 I49 A284 E344 C382 T383 V388 V389 T390	R46-R386 HydrophobicContact CB-CG 4.43Å; R46-R386 VanDerWaalsContact CD-CG 3.5Å; I49-R386 HydrophobicContact CD1-CG 4.28Å; A284-R386 HydrophobicContact CB-CB 4.16Å; E344-R386 IonicContact OE2-NH1 2.85Å; E344-R386 PolarHBondContact OE2-NH1 3.46Å; C382-R386 WeakPolarHBondContact O-CB 3.39Å; C382-R386 PolarHBondContact O-N 3.31Å; T383-R386 WeakPolarHBondContact O-CB 3.39Å; T383-R386 PolarHBondContact O-N 3.35Å; R386-V388 VanDerWaalsContact C-N 3.3Å; R386-V388 PolarHBondContact O-N 3.48Å; R386-V389 PolarHBondContact O-N 3.3Å; R386-T390 PolarHBondContact O-N 2.84Å; R386-T390 PolarHBondContact O-OG1 3.37Å
387	Q	98.9	Very high	98.6	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.005	4%	0.037	C	C	.	.	H	α-helix	trans	-63.7	-35.2	-179.9	-74.5	-177.2	-72.1	0	0	112.4	E344 T383 A385 T390 L391 V406	E344-Q387 HydrophobicContact CB-CB 4.13Å; E344-Q387 HydrophobicContact CB-CG 4.37Å; E344-Q387 PolarHBondContact O-NE2 3.28Å; E344-Q387 VanDerWaalsContact O-NE2 3.12Å; T383-Q387 HydrophobicContact CG2-CG 4.25Å; T383-Q387 WeakPolarHBondContact O-CB 3.39Å; T383-Q387 WeakPolarHBondContact O-CG 3.37Å; T383-Q387 PolarHBondContact O-N 2.86Å; A385-Q387 VanDerWaalsContact C-N 3.34Å; A385-Q387 PolarHBondContact O-N 3.17Å; Q387-T390 PolarHBondContact O-N 2.85Å; Q387-L391 WeakPolarHBondContact O-CB 3.27Å; Q387-L391 PolarHBondContact O-N 3.03Å; Q387-V406 HydrophobicContact CB-CG1 3.63Å; Q387-V406 HydrophobicContact CB-CG2 4.15Å
388	V	98.9	Very high	98.4	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.4	-45.3	174.1	174.8	0	0	0	0	110.6	L128 L131 V286 G384 A385 R386 L391 L392 V406 F420	L128-V388 HydrophobicContact CD1-CG2 4Å; L131-V388 HydrophobicContact CD1-CB 4.41Å; L131-V388 HydrophobicContact CD1-CG1 3.9Å; L131-V388 HydrophobicContact CD1-CG2 4.08Å; V286-V388 HydrophobicContact CG1-CG1 4.27Å; V286-V388 HydrophobicContact CG2-CB 4.36Å; V286-V388 HydrophobicContact CG2-CG1 4.21Å; G384-V388 WeakPolarHBondContact O-CG2 3.41Å; G384-V388 PolarHBondContact O-N 2.84Å; A385-V388 WeakPolarHBondContact O-CB 3.13Å; A385-V388 PolarHBondContact O-N 3.27Å; R386-V388 VanDerWaalsContact C-N 3.3Å; R386-V388 PolarHBondContact O-N 3.48Å; V388-L391 PolarHBondContact O-N 2.65Å; V388-L392 HydrophobicContact CG1-CD1 3.89Å; V388-L392 HydrophobicContact CG1-CG 4.4Å; V388-L392 WeakPolarHBondContact O-CB 3.07Å; V388-L392 WeakPolarHBondContact O-CG 3.11Å; V388-L392 PolarHBondContact O-N 3.34Å; V388-V406 HydrophobicContact CG2-CB 4.49Å; V388-V406 HydrophobicContact CG2-CG2 3.87Å; V388-F420 HydrophobicContact CG1-CE1 4.15Å; V388-F420 HydrophobicContact CG1-CE2 4.38Å; V388-F420 HydrophobicContact CG1-CZ 3.93Å; V388-F420 HydrophobicContact CG2-CE2 3.81Å; V388-F420 HydrophobicContact CG2-CZ 3.73Å
389	V	98.9	Very high	98.2	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.012	7%	0.072	C	C	.	.	H	α-helix	trans	-59.9	-49.9	176.6	-179.9	0	0	0	0	110.9	E223 V286 A385 R386 N393	E223-V389 HydrophobicContact CB-CG1 3.51Å; V286-V389 HydrophobicContact CG2-CG2 3.84Å; A385-V389 WeakPolarHBondContact O-CG2 3.32Å; A385-V389 PolarHBondContact O-N 2.69Å; A385-V389 VanDerWaalsContact O-N 3.15Å; R386-V389 PolarHBondContact O-N 3.3Å; V389-N393 WeakPolarHBondContact O-CB 3.38Å; V389-N393 PolarHBondContact O-N 3.18Å; V389-N393 VanDerWaalsContact O-N 3.12Å; V389-N393 PolarHBondContact O-ND2 3.27Å
390	T	98.9	Very high	98.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.4	-44.7	179.5	-58.8	0	0	0	0	111.8	E223 L370 R386 Q387 E394	E223-T390 PolarHBondContact OE1-OG1 3.44Å; E223-T390 WeakPolarHBondContact OE2-CA 3.3Å; L370-T390 HydrophobicContact CD1-CG2 4.1Å; R386-T390 PolarHBondContact O-N 2.84Å; R386-T390 PolarHBondContact O-OG1 3.37Å; Q387-T390 PolarHBondContact O-N 2.85Å; T390-E394 WeakPolarHBondContact O-CB 3.48Å; T390-E394 PolarHBondContact O-N 3.29Å
391	L	98.9	Very high	98.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58.5	-55.2	179.2	177.6	65.1	0	0	0	111.3	V342 E344 Q387 V388 N393 E394 L395 V406 F420	V342-L391 HydrophobicContact CB-CD1 3.61Å; V342-L391 HydrophobicContact CG1-CD1 3.44Å; V342-L391 VanDerWaalsContact CG1-CD1 3.44Å; E344-L391 HydrophobicContact CG-CB 3.98Å; E344-L391 HydrophobicContact CG-CD1 4.27Å; Q387-L391 WeakPolarHBondContact O-CB 3.27Å; Q387-L391 PolarHBondContact O-N 3.03Å; V388-L391 PolarHBondContact O-N 2.65Å; L391-N393 VanDerWaalsContact C-N 3.34Å; L391-N393 PolarHBondContact O-N 3.1Å; L391-E394 PolarHBondContact O-N 3.09Å; L391-E394 VanDerWaalsContact O-N 3.13Å; L391-L395 HydrophobicContact CD1-CD1 4.39Å; L391-L395 HydrophobicContact CD1-CG 4.31Å; L391-L395 HydrophobicContact CG-CD1 4.27Å; L391-L395 HydrophobicContact CG-CG 4.48Å; L391-L395 WeakPolarHBondContact O-CG 3.17Å; L391-L395 PolarHBondContact O-N 3.3Å; L391-V406 HydrophobicContact CB-CG2 4.23Å; L391-V406 HydrophobicContact CD2-CG2 3.57Å; L391-F420 HydrophobicContact CD2-CB 4.34Å; L391-F420 HydrophobicContact CD2-CD2 3.9Å; L391-F420 HydrophobicContact CD2-CG 4.48Å
392	L	98.8	Very high	98.2	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-67.1	-36.1	-174.1	-69.2	178.3	0	0	0	112.1	V41 L302 V388 E394 L395 R396 F420	V41-L392 HydrophobicContact CB-CD1 3.79Å; V41-L392 HydrophobicContact CG1-CD1 3.55Å; V41-L392 HydrophobicContact CG2-CD1 4.02Å; L302-L392 HydrophobicContact CD1-CB 4.37Å; L302-L392 HydrophobicContact CD2-CB 3.98Å; L302-L392 HydrophobicContact CD2-CD1 4.19Å; L302-L392 HydrophobicContact CG-CB 3.91Å; L302-L392 HydrophobicContact CG-CD1 4.18Å; V388-L392 HydrophobicContact CG1-CD1 3.89Å; V388-L392 HydrophobicContact CG1-CG 4.4Å; V388-L392 WeakPolarHBondContact O-CB 3.07Å; V388-L392 WeakPolarHBondContact O-CG 3.11Å; V388-L392 PolarHBondContact O-N 3.34Å; L392-E394 VanDerWaalsContact C-N 3.32Å; L392-E394 PolarHBondContact O-N 3Å; L392-L395 PolarHBondContact O-N 3.19Å; L392-R396 VanDerWaalsContact O-CB 3.3Å; L392-R396 WeakPolarHBondContact O-CB 3.49Å; L392-R396 PolarHBondContact O-N 2.95Å; L392-F420 HydrophobicContact CD2-CB 3.92Å; L392-F420 HydrophobicContact CD2-CG 4.37Å
393	N	98.5	Very high	98.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.011	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-36.9	172.9	-84.2	-84.6	0	0	0	112	V389 L391 R396 R397	V389-N393 WeakPolarHBondContact O-CB 3.38Å; V389-N393 PolarHBondContact O-N 3.18Å; V389-N393 VanDerWaalsContact O-N 3.12Å; V389-N393 PolarHBondContact O-ND2 3.27Å; L391-N393 VanDerWaalsContact C-N 3.34Å; L391-N393 PolarHBondContact O-N 3.1Å; N393-R396 PolarHBondContact OD1-NH2 3.11Å; N393-R397 WeakPolarHBondContact O-CG 3.21Å; N393-R397 PolarHBondContact O-N 3.24Å; N393-R397 PolarHBondContact O-NE 3.26Å
394	E	98.5	Very high	98.2	Very high	9 Å²	9	28.6 Å²	28.6	4%	0.042	12%	0.124	C	C	.	.	H	α-helix	trans	-69.9	-41.7	175.4	179.2	54.7	-159.5	0	0	112.7	R219 V342 P369 L370 T390 L391 L392 R397 R398	R219-E394 IonicContact NH1-OE1 2.93Å; R219-E394 PolarHBondContact NH1-OE1 2.95Å; R219-E394 IonicContact NH1-OE2 3.86Å; R219-E394 PolarHBondContact NH1-OE2 2.86Å; V342-E394 HydrophobicContact CG2-CG 4.3Å; P369-E394 HydrophobicContact CG-CG 4.17Å; L370-E394 HydrophobicContact CD1-CB 4.14Å; L370-E394 HydrophobicContact CD1-CG 4.41Å; T390-E394 WeakPolarHBondContact O-CB 3.48Å; T390-E394 PolarHBondContact O-N 3.29Å; L391-E394 PolarHBondContact O-N 3.09Å; L391-E394 VanDerWaalsContact O-N 3.13Å; L392-E394 VanDerWaalsContact C-N 3.32Å; L392-E394 PolarHBondContact O-N 3Å; E394-R397 PolarHBondContact O-N 3.28Å; E394-R397 IonicContact OE2-CZ 2.93Å; E394-R397 IonicContact OE2-NE 3.3Å; E394-R397 PolarHBondContact OE2-NE 3.37Å; E394-R397 IonicContact OE2-NH2 3.57Å; E394-R397 PolarHBondContact OE2-NH2 3.29Å; E394-R398 WeakPolarHBondContact O-CG 3.32Å; E394-R398 PolarHBondContact O-N 2.95Å; E394-R398 IonicContact OE1-CZ 3.13Å; E394-R398 IonicContact OE1-NE 3.16Å; E394-R398 PolarHBondContact OE1-NE 3.08Å; E394-R398 VanDerWaalsContact OE1-NE 3.16Å; E394-R398 IonicContact OE1-NH2 2.6Å
395	L	98.4	Very high	98.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.7	-43.8	174.2	-64	-177.3	0	0	0	111.2	D341 V342 L391 L392 R397 R398 A402 F422	D341-L395 HydrophobicContact CB-CD2 4.3Å; V342-L395 HydrophobicContact CB-CD2 4.05Å; V342-L395 HydrophobicContact CG2-CD2 3.65Å; L391-L395 HydrophobicContact CD1-CD1 4.39Å; L391-L395 HydrophobicContact CD1-CG 4.31Å; L391-L395 HydrophobicContact CG-CD1 4.27Å; L391-L395 HydrophobicContact CG-CG 4.48Å; L391-L395 WeakPolarHBondContact O-CG 3.17Å; L391-L395 PolarHBondContact O-N 3.3Å; L392-L395 PolarHBondContact O-N 3.19Å; L395-R397 VanDerWaalsContact C-N 3.33Å; L395-R397 PolarHBondContact O-N 2.8Å; L395-R398 WeakPolarHBondContact O-CB 3.31Å; L395-R398 PolarHBondContact O-N 3.18Å; L395-A402 HydrophobicContact CD2-CB 3.9Å; L395-F422 HydrophobicContact CB-CB 3.62Å; L395-F422 HydrophobicContact CB-CD1 4.43Å; L395-F422 HydrophobicContact CB-CG 4.15Å; L395-F422 HydrophobicContact CD1-CB 4.08Å; L395-F422 WeakPolarHBondContact O-CD1 3.21Å
396	R	97.8	Very high	98.2	Very high	91 Å²	91	28.6 Å²	28.6	34%	0.343	12%	0.124	S	C	.	.	H	α-helix	trans	-57.4	-44.9	174.9	-176.6	177	70.3	178.7	0.2	111.9	L302 L392 N393 R398 G399 F422	L302-R396 HydrophobicContact CD1-CB 4.24Å; L392-R396 VanDerWaalsContact O-CB 3.3Å; L392-R396 WeakPolarHBondContact O-CB 3.49Å; L392-R396 PolarHBondContact O-N 2.95Å; N393-R396 PolarHBondContact OD1-NH2 3.11Å; R396-R398 PolarHBondContact O-N 3.19Å; R396-G399 PolarHBondContact O-N 2.93Å; R396-F422 HydrophobicContact CB-CD2 4.34Å; R396-F422 HydrophobicContact CB-CE2 3.98Å; R396-F422 HydrophobicContact CB-CZ 4.19Å; R396-F422 HydrophobicContact CG-CE2 4.02Å; R396-F422 HydrophobicContact CG-CZ 4.07Å
397	R	96.8	Very high	98.2	Very high	72 Å²	72	28.6 Å²	28.6	27%	0.272	12%	0.124	S	C	.	.	H	α-helix	trans	-59.9	-28.6	176.7	-81.3	-176.2	-70.7	-94.8	2.9	113.5	R219 N393 E394 L395 G399	R219-R397 PolarHBondContact O-NH1 3.25Å; N393-R397 WeakPolarHBondContact O-CG 3.21Å; N393-R397 PolarHBondContact O-N 3.24Å; N393-R397 PolarHBondContact O-NE 3.26Å; E394-R397 PolarHBondContact O-N 3.28Å; E394-R397 IonicContact OE2-CZ 2.93Å; E394-R397 IonicContact OE2-NE 3.3Å; E394-R397 PolarHBondContact OE2-NE 3.37Å; E394-R397 IonicContact OE2-NH2 3.57Å; E394-R397 PolarHBondContact OE2-NH2 3.29Å; L395-R397 VanDerWaalsContact C-N 3.33Å; L395-R397 PolarHBondContact O-N 2.8Å; R397-G399 PolarHBondContact O-N 3.23Å
398	R	95.5	Very high	98.2	Very high	80 Å²	80	28.5 Å²	28.5	30%	0.302	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-13.7	176.2	-66.7	174.4	-177.8	-155.3	-0.6	112.8	D341 V342 E394 L395 R396 R400	D341-R398 PolarHBondContact O-NH1 3.33Å; V342-R398 VanDerWaalsContact CG2-NH1 3.32Å; V342-R398 VanDerWaalsContact CG2-NH2 3.35Å; E394-R398 WeakPolarHBondContact O-CG 3.32Å; E394-R398 PolarHBondContact O-N 2.95Å; E394-R398 IonicContact OE1-CZ 3.13Å; E394-R398 IonicContact OE1-NE 3.16Å; E394-R398 PolarHBondContact OE1-NE 3.08Å; E394-R398 VanDerWaalsContact OE1-NE 3.16Å; E394-R398 IonicContact OE1-NH2 2.6Å; L395-R398 WeakPolarHBondContact O-CB 3.31Å; L395-R398 PolarHBondContact O-N 3.18Å; R396-R398 PolarHBondContact O-N 3.19Å; R398-R400 PolarHBondContact O-N 3.05Å; R398-R400 VanDerWaalsContact O-N 3.15Å
399	G	94.6	Very high	98.2	Very high	45 Å²	45	28.5 Å²	28.5	46%	0.464	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	16.8	165.8	0	0	0	0	0	115.5	R396 R397	R396-G399 PolarHBondContact O-N 2.93Å; R397-G399 PolarHBondContact O-N 3.23Å
400	R	97.1	Very high	98.1	Very high	126 Å²	126	28.4 Å²	28.4	48%	0.475	12%	0.123	S	C	.	.	S	Bend	trans	-142.5	156.5	177.9	64.1	172.4	177.7	78.5	-2	110.4	D341 R398 A402 F422	D341-R400 IonicContact OD1-CZ 3.29Å; D341-R400 VanDerWaalsContact OD1-CZ 3.29Å; D341-R400 IonicContact OD1-NH1 2.93Å; D341-R400 PolarHBondContact OD1-NH1 3.2Å; D341-R400 IonicContact OD1-NH2 2.74Å; D341-R400 PolarHBondContact OD1-NH2 2.79Å; D341-R400 IonicContact OD2-NH1 3.89Å; R398-R400 PolarHBondContact O-N 3.05Å; R398-R400 VanDerWaalsContact O-N 3.15Å; R400-A402 PolarHBondContact O-N 3.13Å; R400-F422 VanDerWaalsContact O-CD1 3.27Å; R400-F422 WeakPolarHBondContact O-CD1 3.45Å
401	R	98.1	Very high	98	Very high	143 Å²	143	28.7 Å²	28.7	54%	0.54	13%	0.125	S	C	.	.			trans	-49.7	128.7	170.8	-170	179.5	-177.8	-117.1	-2.6	110.4	E421 F422	R401-E421 IonicContact CZ-OE1 3.22Å; R401-E421 IonicContact NE-OE1 2.69Å; R401-E421 PolarHBondContact NE-OE1 3.1Å; R401-E421 VanDerWaalsContact NH2-CD 3.3Å; R401-E421 IonicContact NH2-OE1 2.89Å; R401-E421 PolarHBondContact NH2-OE1 3.36Å; R401-E421 IonicContact NH2-OE2 3.28Å; R401-E421 PolarHBondContact NH2-OE2 3.35Å; R401-F422 VanDerWaalsContact CA-O 3.31Å; R401-F422 WeakPolarHBondContact CA-O 3.4Å
402	A	98.4	Very high	97.9	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	153.5	-172.9	0	0	0	0	0	111.4	D341 L395 R400 F422	D341-A402 HydrophobicContact CB-CB 4.11Å; D341-A402 VanDerWaalsContact OD2-CA 3.26Å; D341-A402 WeakPolarHBondContact OD2-CA 3.48Å; D341-A402 VanDerWaalsContact OD2-CB 3.32Å; D341-A402 WeakPolarHBondContact OD2-CB 3.45Å; L395-A402 HydrophobicContact CD2-CB 3.9Å; R400-A402 PolarHBondContact O-N 3.13Å; A402-F422 PolarHBondContact N-O 3.17Å; A402-F422 PolarHBondContact O-N 3.33Å
403	F	98.8	Very high	97.9	Very high	27 Å²	27	31.5 Å²	31.5	12%	0.118	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	144.1	176.9	-63.5	-81.3	0	0	0	111.6	R306 L335 I340 D341 V342 F420 E421	R306-F403 HydrophobicContact CG-CE1 4.42Å; L335-F403 HydrophobicContact CD1-CB 4.36Å; L335-F403 HydrophobicContact CD1-CD1 3.56Å; L335-F403 HydrophobicContact CD1-CD2 4.35Å; L335-F403 HydrophobicContact CD1-CE1 3.82Å; L335-F403 HydrophobicContact CD1-CG 3.84Å; L335-F403 HydrophobicContact CD1-CZ 4.31Å; L335-F403 HydrophobicContact CD2-CE2 4.3Å; L335-F403 HydrophobicContact CD2-CZ 4.31Å; I340-F403 HydrophobicContact CD1-CB 3.71Å; D341-F403 WeakPolarHBondContact CB-O 3.16Å; D341-F403 PolarHBondContact N-O 3.23Å; D341-F403 PolarHBondContact OD2-N 3.08Å; V342-F403 PolarHBondContact N-O 2.92Å; F403-F420 CarbonylContact C-O 3.58Å; F403-F420 WeakPolarHBondContact CA-O 3.07Å; F403-E421 HydrophobicContact CD1-CB 3.81Å; F403-E421 HydrophobicContact CD1-CG 4.13Å; F403-E421 HydrophobicContact CE1-CB 3.69Å; F403-E421 HydrophobicContact CE1-CG 3.73Å; F403-E421 HydrophobicContact CZ-CG 4.29Å
404	G	98.9	Very high	97.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	151.9	179.8	0	0	0	0	0	112.2	V342 V419 F420	V342-G404 CarbonylContact O-C 3.6Å; V342-G404 VanDerWaalsContact O-CA 3.22Å; V342-G404 WeakPolarHBondContact O-CA 3.24Å; G404-V419 CarbonylContact O-C 3.51Å; G404-V419 WeakPolarHBondContact O-CA 3.38Å; G404-F420 PolarHBondContact N-O 3.13Å; G404-F420 PolarHBondContact O-N 3.4Å
405	V	98.9	Very high	98	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.4	175.3	174	0	0	0	0	109.7	I326 L330 I340 V342 F343 E344 A418 V419	I326-V405 HydrophobicContact CD1-CG1 4.43Å; I326-V405 HydrophobicContact CG1-CG1 3.99Å; I326-V405 HydrophobicContact CG2-CG1 4.37Å; L330-V405 HydrophobicContact CD2-CG2 4.08Å; I340-V405 HydrophobicContact CD1-CG2 3.94Å; I340-V405 HydrophobicContact CG1-CG2 3.94Å; I340-V405 HydrophobicContact CG2-CB 4.39Å; I340-V405 HydrophobicContact CG2-CG2 3.88Å; V342-V405 PolarHBondContact O-N 2.85Å; F343-V405 CarbonylContact C-O 3.48Å; F343-V405 WeakPolarHBondContact CA-O 3.33Å; F343-V405 HydrophobicContact CD1-CB 3.7Å; F343-V405 HydrophobicContact CD1-CG1 4.16Å; F343-V405 HydrophobicContact CD1-CG2 4.13Å; F343-V405 HydrophobicContact CE1-CB 4.08Å; F343-V405 HydrophobicContact CE1-CG2 3.98Å; E344-V405 PolarHBondContact N-O 2.61Å; V405-A418 WeakPolarHBondContact CA-O 3.25Å; V405-V419 HydrophobicContact CG2-CG2 4.26Å
406	V	98.9	Very high	98	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132.4	162.4	176.3	0	0	0	0	108.1	L128 E344 Q387 V388 L391 M408 A417 A418 F420	L128-V406 HydrophobicContact CD1-CG1 4.48Å; L128-V406 HydrophobicContact CD2-CG1 4.18Å; E344-V406 HydrophobicContact CB-CG2 4.27Å; E344-V406 CarbonylContact O-C 3.59Å; E344-V406 WeakPolarHBondContact O-CA 3.39Å; Q387-V406 HydrophobicContact CB-CG1 3.63Å; Q387-V406 HydrophobicContact CB-CG2 4.15Å; V388-V406 HydrophobicContact CG2-CB 4.49Å; V388-V406 HydrophobicContact CG2-CG2 3.87Å; L391-V406 HydrophobicContact CB-CG2 4.23Å; L391-V406 HydrophobicContact CD2-CG2 3.57Å; V406-M408 HydrophobicContact CG1-CE 3.61Å; V406-A417 CarbonylContact O-C 3.54Å; V406-A417 WeakPolarHBondContact O-CA 3.33Å; V406-A418 PolarHBondContact N-O 3.27Å; V406-A418 PolarHBondContact O-N 3Å; V406-F420 HydrophobicContact CB-CE2 4.44Å; V406-F420 HydrophobicContact CG2-CD2 4.37Å; V406-F420 HydrophobicContact CG2-CE2 4.1Å
407	S	98.9	Very high	98	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	152	174.7	-171.2	0	0	0	0	113.6	P322 I326 E344 I345 N346 A416	P322-S407 WeakPolarHBondContact CA-OG 3.48Å; P322-S407 WeakPolarHBondContact CB-OG 3.44Å; I326-S407 WeakPolarHBondContact CG1-OG 3.34Å; E344-S407 PolarHBondContact O-N 3.34Å; I345-S407 CarbonylContact C-O 3.58Å; I345-S407 WeakPolarHBondContact CA-O 3.15Å; N346-S407 PolarHBondContact N-O 3.25Å; S407-A416 WeakPolarHBondContact CA-O 3.11Å; S407-A416 WeakPolarHBondContact CB-O 3.15Å; S407-A416 PolarHBondContact OG-O 3.23Å
408	M	98.9	Very high	98.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	150.7	175.9	60.6	-72.8	-49	0	0	112.4	S125 L128 N346 V406 I410 G415 A416	S125-M408 VanDerWaalsContact CB-SD 3.58Å; L128-M408 HydrophobicContact CB-CE 4.36Å; L128-M408 HydrophobicContact CB-SD 4.23Å; L128-M408 HydrophobicContact CD2-CE 4Å; L128-M408 HydrophobicContact CD2-SD 3.64Å; N346-M408 HydrophobicContact CB-CB 3.53Å; V406-M408 HydrophobicContact CG1-CE 3.61Å; M408-I410 HydrophobicContact CG-CG1 4.45Å; M408-G415 WeakPolarHBondContact O-CA 3.43Å; M408-A416 PolarHBondContact N-O 2.94Å; M408-A416 VanDerWaalsContact N-O 3.09Å; M408-A416 PolarHBondContact O-N 2.91Å; M408-A416 VanDerWaalsContact O-N 3.08Å; M408-A416 HydrophobicContact SD-CB 4.02Å
409	C	98.6	Very high	98.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	158	159.7	64	0	0	0	0	110.1	C124 M318 P322	C124-C409 WeakPolarHBondContact CB-O 3.41Å; M318-C409 WeakPolarHBondContact O-CB 3.28Å; M318-C409 HydrophobicContact SD-CB 4.01Å; P322-C409 HydrophobicContact CG-CB 4.45Å
410	I	98.7	Very high	98.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	125.1	-174.2	-55.7	173.9	0	0	0	107.5	R122 Q123 S125 M318 M408 G413 M414 A416	R122-I410 HydrophobicContact CG-CD1 4.34Å; R122-I410 HydrophobicContact CG-CG2 4.33Å; R122-I410 WeakPolarHBondContact O-CG2 3.41Å; Q123-I410 HydrophobicContact CB-CG2 3.7Å; Q123-I410 HydrophobicContact CG-CG2 4.17Å; S125-I410 WeakPolarHBondContact OG-CD1 3.5Å; M318-I410 WeakPolarHBondContact CB-O 3.33Å; M408-I410 HydrophobicContact CG-CG1 4.45Å; I410-G413 PolarHBondContact O-N 2.95Å; I410-M414 HydrophobicContact CB-CB 3.77Å; I410-M414 WeakPolarHBondContact CB-O 3.49Å; I410-M414 HydrophobicContact CD1-CB 3.82Å; I410-M414 HydrophobicContact CG1-CB 4.29Å; I410-M414 HydrophobicContact CG2-CB 4.08Å; I410-M414 HydrophobicContact CG2-CE 3.85Å; I410-M414 PolarHBondContact N-O 2.98Å; I410-M414 PolarHBondContact O-N 3.34Å; I410-M414 VanDerWaalsContact O-N 3.11Å; I410-A416 HydrophobicContact CD1-CB 3.8Å
411	G	96.4	Very high	98.6	Very high	5 Å²	5	13.7 Å²	13.7	5%	0.052	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	153.2	173.3	0	0	0	0	0	111.8	G413	G411-G413 PolarHBondContact O-N 3.37Å
412	T	97.1	Very high	98.6	Very high	56 Å²	56	7.3 Å²	7.3	34%	0.344	4%	0.041	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	5.9	-170.9	80.5	0	0	0	0	116.2	C178 P315	C178-T412 HydrophobicContact CB-CG2 4.24Å; P315-T412 WeakPolarHBondContact CB-O 3.48Å; P315-T412 WeakPolarHBondContact CG-O 3.12Å
413	G	98.3	Very high	98.3	Very high	5 Å²	5	9.6 Å²	9.6	5%	0.052	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.9	60.2	165.9	0	0	0	0	0	114	V313 I410 G411	V313-G413 VanDerWaalsContact CG2-C 3.48Å; V313-G413 PolarHBondContact N-O 3.13Å; V313-G413 CarbonylContact O-C 3.58Å; V313-G413 WeakPolarHBondContact O-CA 3.39Å; I410-G413 PolarHBondContact O-N 2.95Å; G411-G413 PolarHBondContact O-N 3.37Å
414	M	98.9	Very high	97.8	Very high	38 Å²	38	9.2 Å²	9.2	19%	0.187	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	170.1	170	-66.7	166.4	-82.9	0	0	111.7	R122 V311 I410	R122-M414 HydrophobicContact CG-CE 4.44Å; R122-M414 HydrophobicContact CG-SD 4.37Å; V311-M414 CarbonylContact O-C 3.55Å; V311-M414 WeakPolarHBondContact O-CA 3.37Å; V311-M414 VanDerWaalsContact O-CB 3.27Å; V311-M414 WeakPolarHBondContact O-CB 3.24Å; I410-M414 HydrophobicContact CB-CB 3.77Å; I410-M414 WeakPolarHBondContact CB-O 3.49Å; I410-M414 HydrophobicContact CD1-CB 3.82Å; I410-M414 HydrophobicContact CG1-CB 4.29Å; I410-M414 HydrophobicContact CG2-CB 4.08Å; I410-M414 HydrophobicContact CG2-CE 3.85Å; I410-M414 PolarHBondContact N-O 2.98Å; I410-M414 PolarHBondContact O-N 3.34Å; I410-M414 VanDerWaalsContact O-N 3.11Å
415	G	98.9	Very high	96.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.9	164.7	0	0	0	0	0	110.8	V310 V311 M408	V310-G415 CarbonylContact C-O 3.57Å; V310-G415 VanDerWaalsContact CA-O 3.31Å; V310-G415 WeakPolarHBondContact CA-O 3.41Å; V311-G415 PolarHBondContact N-O 3.28Å; V311-G415 PolarHBondContact O-N 3.44Å; M408-G415 WeakPolarHBondContact O-CA 3.43Å
416	A	98.9	Very high	96.7	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.008	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.5	170.8	0	0	0	0	0	110.9	L128 A309 V310 S407 M408 I410	L128-A416 HydrophobicContact CD2-CB 4.23Å; A309-A416 CarbonylContact O-C 3.58Å; A309-A416 VanDerWaalsContact O-CA 3.3Å; A309-A416 WeakPolarHBondContact O-CA 3.44Å; V310-A416 HydrophobicContact CG2-CB 4.11Å; S407-A416 WeakPolarHBondContact CA-O 3.11Å; S407-A416 WeakPolarHBondContact CB-O 3.15Å; S407-A416 PolarHBondContact OG-O 3.23Å; M408-A416 PolarHBondContact N-O 2.94Å; M408-A416 VanDerWaalsContact N-O 3.09Å; M408-A416 PolarHBondContact O-N 2.91Å; M408-A416 VanDerWaalsContact O-N 3.08Å; M408-A416 HydrophobicContact SD-CB 4.02Å; I410-A416 HydrophobicContact CD1-CB 3.8Å
417	A	98.9	Very high	96.6	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	148.3	171.4	0	0	0	0	0	111.2	S308 A309 A325 I326 A329 V406	S308-A417 CarbonylContact C-O 3.57Å; S308-A417 VanDerWaalsContact CA-O 3.24Å; S308-A417 WeakPolarHBondContact CA-O 3.35Å; A309-A417 PolarHBondContact N-O 3.08Å; A309-A417 PolarHBondContact O-N 3.26Å; A325-A417 HydrophobicContact CB-CB 3.83Å; A325-A417 WeakPolarHBondContact O-CB 3.4Å; I326-A417 HydrophobicContact CG1-CB 4.02Å; A329-A417 HydrophobicContact CB-CB 3.77Å; V406-A417 CarbonylContact O-C 3.54Å; V406-A417 WeakPolarHBondContact O-CA 3.33Å
418	A	98.9	Very high	96.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.5	172.8	0	0	0	0	0	110.4	L128 L132 L305 G307 V405 V406 F420	L128-A418 HydrophobicContact CD1-CB 3.86Å; L128-A418 HydrophobicContact CD2-CB 4.24Å; L132-A418 HydrophobicContact CD2-CB 4.38Å; L305-A418 HydrophobicContact CD1-CB 4.11Å; G307-A418 CarbonylContact O-C 3.53Å; G307-A418 WeakPolarHBondContact O-CA 3.48Å; V405-A418 WeakPolarHBondContact CA-O 3.25Å; V406-A418 PolarHBondContact N-O 3.27Å; V406-A418 PolarHBondContact O-N 3Å; A418-F420 HydrophobicContact CB-CD2 4.44Å; A418-F420 HydrophobicContact CB-CE2 3.64Å; A418-F420 HydrophobicContact CB-CZ 4.1Å
419	V	98.9	Very high	96.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	127.4	179.6	-172.6	0	0	0	0	108.9	R306 G307 A329 L330 A333 L335 I340 G404 V405	R306-V419 HydrophobicContact CB-CB 4.33Å; R306-V419 HydrophobicContact CB-CG1 4.22Å; R306-V419 PolarHBondContact N-O 3Å; G307-V419 PolarHBondContact O-N 3.21Å; A329-V419 HydrophobicContact CB-CG2 3.98Å; L330-V419 HydrophobicContact CD2-CG2 4.02Å; A333-V419 HydrophobicContact CB-CB 4.04Å; A333-V419 HydrophobicContact CB-CG1 4.03Å; A333-V419 HydrophobicContact CB-CG2 4.03Å; L335-V419 HydrophobicContact CD1-CG1 3.91Å; I340-V419 HydrophobicContact CD1-CG1 4.38Å; G404-V419 CarbonylContact O-C 3.51Å; G404-V419 WeakPolarHBondContact O-CA 3.38Å; V405-V419 HydrophobicContact CG2-CG2 4.26Å
420	F	98.9	Very high	96.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	145.4	177.3	-64.2	-88.8	0	0	0	110.7	V41 L131 V304 L305 V388 L391 L392 F403 G404 V406 A418	V41-F420 HydrophobicContact CG2-CD1 4.34Å; V41-F420 HydrophobicContact CG2-CE1 4.03Å; L131-F420 HydrophobicContact CD1-CE1 4.33Å; L131-F420 HydrophobicContact CD1-CZ 4.11Å; L131-F420 HydrophobicContact CD2-CE1 4.22Å; L131-F420 HydrophobicContact CD2-CZ 3.98Å; V304-F420 CarbonylContact O-C 3.59Å; V304-F420 VanDerWaalsContact O-CA 3.28Å; V304-F420 WeakPolarHBondContact O-CA 3.49Å; L305-F420 HydrophobicContact CB-CD1 4.5Å; L305-F420 HydrophobicContact CB-CE1 4.3Å; L305-F420 HydrophobicContact CD1-CD1 4.31Å; L305-F420 HydrophobicContact CD1-CE1 3.82Å; L305-F420 HydrophobicContact CD1-CE2 4.49Å; L305-F420 HydrophobicContact CD1-CZ 3.93Å; V388-F420 HydrophobicContact CG1-CE1 4.15Å; V388-F420 HydrophobicContact CG1-CE2 4.38Å; V388-F420 HydrophobicContact CG1-CZ 3.93Å; V388-F420 HydrophobicContact CG2-CE2 3.81Å; V388-F420 HydrophobicContact CG2-CZ 3.73Å; L391-F420 HydrophobicContact CD2-CB 4.34Å; L391-F420 HydrophobicContact CD2-CD2 3.9Å; L391-F420 HydrophobicContact CD2-CG 4.48Å; L392-F420 HydrophobicContact CD2-CB 3.92Å; L392-F420 HydrophobicContact CD2-CG 4.37Å; F403-F420 CarbonylContact C-O 3.58Å; F403-F420 WeakPolarHBondContact CA-O 3.07Å; G404-F420 PolarHBondContact N-O 3.13Å; G404-F420 PolarHBondContact O-N 3.4Å; V406-F420 HydrophobicContact CB-CE2 4.44Å; V406-F420 HydrophobicContact CG2-CD2 4.37Å; V406-F420 HydrophobicContact CG2-CE2 4.1Å; A418-F420 HydrophobicContact CB-CD2 4.44Å; A418-F420 HydrophobicContact CB-CE2 3.64Å; A418-F420 HydrophobicContact CB-CZ 4.1Å
421	E	98.8	Very high	96	Very high	11 Å²	11	24.7 Å²	24.7	5%	0.051	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	132.4	167.6	179.3	179.4	163.9	0	0	109.4	G303 V304 R306 R401 F403	G303-E421 CarbonylContact C-O 3.54Å; G303-E421 WeakPolarHBondContact CA-O 3.5Å; V304-E421 HydrophobicContact CB-CB 4.32Å; V304-E421 PolarHBondContact N-O 2.72Å; V304-E421 PolarHBondContact O-N 3.41Å; R306-E421 HydrophobicContact CG-CB 3.94Å; R306-E421 IonicContact CZ-OE2 3.01Å; R306-E421 IonicContact NE-OE2 3.54Å; R306-E421 PolarHBondContact NE-OE2 2.97Å; R306-E421 IonicContact NH2-OE1 3Å; R306-E421 IonicContact NH2-OE2 3.7Å; R306-E421 PolarHBondContact NH2-OE2 3.21Å; R401-E421 IonicContact CZ-OE1 3.22Å; R401-E421 IonicContact NE-OE1 2.69Å; R401-E421 PolarHBondContact NE-OE1 3.1Å; R401-E421 VanDerWaalsContact NH2-CD 3.3Å; R401-E421 IonicContact NH2-OE1 2.89Å; R401-E421 PolarHBondContact NH2-OE1 3.36Å; R401-E421 IonicContact NH2-OE2 3.28Å; R401-E421 PolarHBondContact NH2-OE2 3.35Å; F403-E421 HydrophobicContact CD1-CB 3.81Å; F403-E421 HydrophobicContact CD1-CG 4.13Å; F403-E421 HydrophobicContact CE1-CB 3.69Å; F403-E421 HydrophobicContact CE1-CG 3.73Å; F403-E421 HydrophobicContact CZ-CG 4.29Å
422	F	98.5	Very high	95.9	Very high	9 Å²	9	26.1 Å²	26.1	4%	0.039	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	120.1	158.8	171.9	-116.1	0	0	0	107.7	L302 L395 R396 R400 R401 A402 G424	L302-F422 WeakPolarHBondContact O-CD2 3.2Å; L395-F422 HydrophobicContact CB-CB 3.62Å; L395-F422 HydrophobicContact CB-CD1 4.43Å; L395-F422 HydrophobicContact CB-CG 4.15Å; L395-F422 HydrophobicContact CD1-CB 4.08Å; L395-F422 WeakPolarHBondContact O-CD1 3.21Å; R396-F422 HydrophobicContact CB-CD2 4.34Å; R396-F422 HydrophobicContact CB-CE2 3.98Å; R396-F422 HydrophobicContact CB-CZ 4.19Å; R396-F422 HydrophobicContact CG-CE2 4.02Å; R396-F422 HydrophobicContact CG-CZ 4.07Å; R400-F422 VanDerWaalsContact O-CD1 3.27Å; R400-F422 WeakPolarHBondContact O-CD1 3.45Å; R401-F422 VanDerWaalsContact CA-O 3.31Å; R401-F422 WeakPolarHBondContact CA-O 3.4Å; A402-F422 PolarHBondContact N-O 3.17Å; A402-F422 PolarHBondContact O-N 3.33Å; F422-G424 VanDerWaalsContact C-N 3.34Å; F422-G424 VanDerWaalsContact CZ-C 3.44Å; F422-G424 VanDerWaalsContact CZ-O 3.29Å; F422-G424 WeakPolarHBondContact CZ-O 3.44Å; F422-G424 PolarHBondContact O-N 3.16Å
423	P	93.2	Very high	95.8	Very high	50 Å²	50	23.8 Å²	23.8	33%	0.325	15%	0.154	S	C	.	.			trans	-70.6	-27.7	-171	26.9	-34.8	0	0	0	113.7	V301	V301-P423 HydrophobicContact CG1-CG 4.24Å
424	G	87.3	Confident	95.6	Very high	18 Å²	18	25.4 Å²	25.4	19%	0.186	16%	0.163	C	C	.	.			trans	128.4	173.2	-168.8	0	0	0	0	0	111.1	F422	F422-G424 VanDerWaalsContact C-N 3.34Å; F422-G424 VanDerWaalsContact CZ-C 3.44Å; F422-G424 VanDerWaalsContact CZ-O 3.29Å; F422-G424 WeakPolarHBondContact CZ-O 3.44Å; F422-G424 PolarHBondContact O-N 3.16Å
425	P	77.8	Confident	95.4	Very high	178 Å²	178	24.3 Å²	24.3	100%	1.156	16%	0.16	S	C	*	.			trans	-65.5	0	177.2	29.9	-35.4	0	0	0	113.7

Retrieved 425 of 425 residues in 1017.2 ms (Link to these results)

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