A0A087XT22_POEFO Loading...

Neuronal PAS domain-containing protein 1

May control regulatory pathways relevant to schizophrenia and to psychotic illness. May play a role in late central nervous system development by modulating EPO expression in response to cellular oxygen level. Forms a heterodimer that binds core DNA sequence 5'-TACGTG-3' within the hypoxia response element (HRE) leading to transcriptional repression on its target gene TH.

AlphaFold DB , UniProt , Accession A0A087XT22, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 447 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	38.4	Very low	249 Å²	249	143.4 Å²	143.4	100%	1.227	82%	0.821	S	S	*	*				0	120.7	0	-79.1	175.7	170.3	0	0	106.8
2	A	36.7	Very low	39	Very low	105 Å²	105	141.8 Å²	141.8	87%	0.868	82%	0.822	S	S	*	*			cis	-155.8	159	-3.9	0	0	0	0	0	106.2
3	S	31	Very low	39.5	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	82%	0.815	S	S	*	*			trans	-103.3	145.4	-170.5	51.2	0	0	0	0	113.6
4	M	31.6	Very low	40.4	Very low	178 Å²	178	137.8 Å²	137.8	88%	0.877	81%	0.811	S	S	*	*			trans	75.7	168.7	146.6	-62.9	-120.8	172.2	0	0	119.4
5	P	49.1	Very low	41	Very low	95 Å²	95	135.9 Å²	135.9	62%	0.617	80%	0.801	S	S	*	*				-143.4	-171.7	-62.3	44.1	-26.3	0	0	0	114.5
6	F	32	Very low	41.2	Very low	192 Å²	192	136.4 Å²	136.4	84%	0.842	79%	0.793	S	S	*	*			trans	70.5	148.4	156.9	-96.8	-91.3	0	0	0	117.7
7	V	37.3	Very low	41.5	Very low	122 Å²	122	141.1 Å²	141.1	74%	0.739	79%	0.794	S	S	*	*			cis	-156.7	155.7	30.6	-176.8	0	0	0	0	109.4
8	S	45.3	Very low	42	Very low	106 Å²	106	138.2 Å²	138.2	74%	0.741	78%	0.776	S	S	*	*			trans	-68	140.8	169.8	61	0	0	0	0	115
9	E	39.5	Very low	42.2	Very low	170 Å²	170	139.9 Å²	139.9	79%	0.794	78%	0.775	S	S	*	*			trans	-154.1	89.4	149.7	-115.4	-176.5	-154	0	0	110.2	K11	E9-K11 PolarHBondContact O-N 3.01Å
10	G	43.4	Very low	42.5	Very low	81 Å²	81	137.6 Å²	137.6	84%	0.835	76%	0.761	S	S	*	*			trans	-78.5	94.8	167.6	0	0	0	0	0	109.5	C12	G10-C12 PolarHBondContact O-N 3.04Å; G10-C12 VanDerWaalsContact O-N 3.08Å
11	K	39.9	Very low	42.8	Very low	175 Å²	175	137.6 Å²	137.6	76%	0.761	76%	0.755	S	S	*	*			trans	-71.6	99.2	167.6	-85.9	179.2	178.4	171.3	0	109.2	E9 V13	E9-K11 PolarHBondContact O-N 3.01Å; K11-V13 PolarHBondContact O-N 3.07Å
12	C	45.5	Very low	43.3	Very low	124 Å²	124	129.4 Å²	129.4	84%	0.838	73%	0.734	S	S	*	*			trans	-69.7	103.3	164.2	-161.3	0	0	0	0	107.9	G10 S14	G10-C12 PolarHBondContact O-N 3.04Å; G10-C12 VanDerWaalsContact O-N 3.08Å; C12-S14 PolarHBondContact O-N 3.14Å
13	V	45.7	Very low	43.9	Very low	121 Å²	121	130.8 Å²	130.8	73%	0.733	73%	0.726	S	S	*	*			trans	-80.6	94.5	172.2	-177.2	0	0	0	0	107.2	K11 V15	K11-V13 PolarHBondContact O-N 3.07Å; V13-V15 HydrophobicContact CG1-CG2 4.49Å; V13-V15 PolarHBondContact O-N 2.98Å
14	S	51.5	Low	45	Very low	107 Å²	107	132.2 Å²	132.2	75%	0.748	73%	0.725	S	S	*	*			trans	-71.6	106.1	166.1	174.1	0	0	0	0	108	C12 E16	C12-S14 PolarHBondContact O-N 3.14Å; S14-E16 PolarHBondContact O-N 2.87Å
15	V	48.9	Very low	46.3	Very low	110 Å²	110	128.2 Å²	128.2	67%	0.667	72%	0.72	S	S	*	*			trans	-73.5	115	167.3	-173.4	0	0	0	0	106.9	V13 W17	V13-V15 HydrophobicContact CG1-CG2 4.49Å; V13-V15 PolarHBondContact O-N 2.98Å; V15-W17 PolarHBondContact O-N 3.45Å
16	E	45.1	Very low	46.8	Very low	143 Å²	143	132.8 Å²	132.8	67%	0.668	73%	0.731	S	S	*	*			trans	-59.2	120.9	174.9	-158.8	171.5	-149.7	0	0	108.7	S14 D18 F19	S14-E16 PolarHBondContact O-N 2.87Å; E16-D18 HydrophobicContact CG-CB 4.25Å; E16-D18 PolarHBondContact O-N 3.34Å; E16-F19 PolarHBondContact O-N 3.42Å
17	W	45.8	Very low	48.2	Very low	216 Å²	216	129.2 Å²	129.2	82%	0.818	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-60	-8.5	-178.5	-77.5	97.4	0	0	0	113.5	V15 F19 L20	V15-W17 PolarHBondContact O-N 3.45Å; W17-F19 VanDerWaalsContact C-N 3.3Å; W17-F19 PolarHBondContact O-N 3.39Å; W17-L20 HydrophobicContact CE3-CD1 4Å; W17-L20 HydrophobicContact CZ3-CD1 4.02Å; W17-L20 PolarHBondContact O-N 2.99Å
18	D	50.2	Low	49.4	Very low	89 Å²	89	126.7 Å²	126.7	48%	0.476	71%	0.713	S	S	.	*	G	3₁₀ helix	trans	-74.3	-14.9	-179.3	-68.2	-27.9	0	0	0	114	E16 L20 Q21	E16-D18 HydrophobicContact CG-CB 4.25Å; E16-D18 PolarHBondContact O-N 3.34Å; D18-L20 PolarHBondContact O-N 3.24Å; D18-Q21 PolarHBondContact O-N 3.47Å; D18-Q21 PolarHBondContact OD1-NE2 3.27Å
19	F	45.9	Very low	50.5	Low	172 Å²	172	126.2 Å²	126.2	75%	0.754	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-68	-20.8	172.8	-162.5	-99.5	0	0	0	112.9	E16 W17	E16-F19 PolarHBondContact O-N 3.42Å; W17-F19 VanDerWaalsContact C-N 3.3Å; W17-F19 PolarHBondContact O-N 3.39Å
20	L	48.2	Very low	51.7	Low	93 Å²	93	123.7 Å²	123.7	49%	0.487	70%	0.697	S	S	.	*	G	3₁₀ helix	trans	-87.7	-13.8	177.6	-74.1	169.6	0	0	0	113.9	W17 D18 G22 L23	W17-L20 HydrophobicContact CE3-CD1 4Å; W17-L20 HydrophobicContact CZ3-CD1 4.02Å; W17-L20 PolarHBondContact O-N 2.99Å; D18-L20 PolarHBondContact O-N 3.24Å; L20-G22 VanDerWaalsContact C-N 3.27Å; L20-G22 PolarHBondContact O-N 3.17Å; L20-L23 PolarHBondContact O-N 2.75Å
21	Q	48.8	Very low	52.7	Low	138 Å²	138	123.6 Å²	123.6	65%	0.645	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-22.9	179.6	-70.8	-169	13.9	0	0	113.1	D18 L23	D18-Q21 PolarHBondContact O-N 3.47Å; D18-Q21 PolarHBondContact OD1-NE2 3.27Å; Q21-L23 VanDerWaalsContact C-N 3.34Å
22	G	47.3	Very low	54.2	Low	76 Å²	76	118.3 Å²	118.3	78%	0.784	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-16.5	173.6	0	0	0	0	0	114.6	L20	L20-G22 VanDerWaalsContact C-N 3.27Å; L20-G22 PolarHBondContact O-N 3.17Å
23	L	49.3	Very low	55.5	Low	134 Å²	134	115.1 Å²	115.1	70%	0.702	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-7.2	-179.7	-89.3	115.2	0	0	0	113.9	L20 Q21 A25	L20-L23 PolarHBondContact O-N 2.75Å; Q21-L23 VanDerWaalsContact C-N 3.34Å; L23-A25 PolarHBondContact O-N 3.49Å
24	L	55.3	Low	56.7	Low	134 Å²	134	113.7 Å²	113.7	70%	0.702	63%	0.625	S	S	*	*	S	Bend	trans	-81.4	95.8	172.9	-92.2	145.7	0	0	0	109.5	K26	L24-K26 PolarHBondContact O-N 3.2Å
25	A	58.8	Low	58	Low	94 Å²	94	113.3 Å²	113.3	78%	0.777	62%	0.615	S	S	*	*			trans	-49.6	115	170	0	0	0	0	0	109.5	L23	L23-A25 PolarHBondContact O-N 3.49Å
26	K	59.9	Low	59.5	Low	192 Å²	192	112.5 Å²	112.5	84%	0.835	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-50.7	132.9	177.6	-74.6	-179.5	177.1	176.5	0	109.2	L24	L24-K26 PolarHBondContact O-N 3.2Å
27	P	61.6	Low	61.2	Low	116 Å²	116	113.6 Å²	113.6	75%	0.753	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-57	133.1	178.6	22.4	-31.4	0	0	0	108.9	T29	P27-T29 PolarHBondContact O-N 3.49Å
28	P	61.7	Low	63.2	Low	69 Å²	69	110.1 Å²	110.1	45%	0.448	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-58.2	131.1	-174.4	22.3	-33.5	0	0	0	110	C32 L33	P28-C32 HydrophobicContact CB-CB 4.13Å; P28-L33 HydrophobicContact CB-CD2 4.05Å; P28-L33 HydrophobicContact CB-CG 4.01Å; P28-L33 HydrophobicContact CG-CD1 4.33Å; P28-L33 HydrophobicContact CG-CD2 3.45Å; P28-L33 VanDerWaalsContact CG-CD2 3.45Å; P28-L33 HydrophobicContact CG-CG 3.77Å
29	T	67.4	Low	65	Low	96 Å²	96	108.8 Å²	108.8	59%	0.589	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-57.3	149.7	178.8	57.2	0	0	0	0	110.4	P27 P31 C32 L33	P27-T29 PolarHBondContact O-N 3.49Å; T29-P31 VanDerWaalsContact C-N 3.25Å; T29-P31 VanDerWaalsContact O-N 3.12Å; T29-C32 WeakPolarHBondContact O-CA 3.38Å; T29-C32 VanDerWaalsContact O-CB 3.23Å; T29-C32 WeakPolarHBondContact O-CB 3.47Å; T29-C32 PolarHBondContact O-N 3.35Å; T29-C32 WeakPolarHBondContact OG1-CB 3.4Å; T29-L33 PolarHBondContact O-N 3.21Å
30	L	65.3	Low	67.1	Low	118 Å²	118	107.4 Å²	107.4	62%	0.618	58%	0.58	S	S	*	*	H	α-helix	trans	-49.7	-39.1	-178.9	-164	76.8	0	0	0	113.4	L33 Q34	L30-L33 PolarHBondContact O-N 3.29Å; L30-Q34 WeakPolarHBondContact O-CG 3.45Å; L30-Q34 PolarHBondContact O-N 3.09Å
31	P	65.1	Low	69.3	Low	78 Å²	78	106.9 Å²	106.9	51%	0.506	58%	0.584	S	S	.	*	H	α-helix	trans	-65.4	-36.4	172.1	-21.4	34.8	0	0	0	113.9	T29 Q34 N35	T29-P31 VanDerWaalsContact C-N 3.25Å; T29-P31 VanDerWaalsContact O-N 3.12Å; P31-Q34 PolarHBondContact O-N 3.41Å; P31-N35 WeakPolarHBondContact O-CB 3.49Å; P31-N35 VanDerWaalsContact O-CG 3.26Å; P31-N35 PolarHBondContact O-N 3.22Å; P31-N35 PolarHBondContact O-ND2 3.07Å
32	C	71.1	Confident	71.4	Confident	64 Å²	64	107.7 Å²	107.7	43%	0.432	58%	0.581	S	S	.	*	H	α-helix	trans	-65.1	-42.4	174.7	-177.4	0	0	0	0	111.6	P28 T29 N35 L36	P28-C32 HydrophobicContact CB-CB 4.13Å; T29-C32 WeakPolarHBondContact O-CA 3.38Å; T29-C32 VanDerWaalsContact O-CB 3.23Å; T29-C32 WeakPolarHBondContact O-CB 3.47Å; T29-C32 PolarHBondContact O-N 3.35Å; T29-C32 WeakPolarHBondContact OG1-CB 3.4Å; C32-N35 PolarHBondContact O-N 3.44Å; C32-L36 WeakPolarHBondContact O-CB 3.45Å; C32-L36 PolarHBondContact O-N 3Å
33	L	72.6	Confident	73.7	Confident	57 Å²	57	107.9 Å²	107.9	30%	0.298	56%	0.564	S	S	.	*	H	α-helix	trans	-64.5	-39.2	174.1	-74.5	175.8	0	0	0	112.6	P28 T29 L30 L36 R37	P28-L33 HydrophobicContact CB-CD2 4.05Å; P28-L33 HydrophobicContact CB-CG 4.01Å; P28-L33 HydrophobicContact CG-CD1 4.33Å; P28-L33 HydrophobicContact CG-CD2 3.45Å; P28-L33 VanDerWaalsContact CG-CD2 3.45Å; P28-L33 HydrophobicContact CG-CG 3.77Å; T29-L33 PolarHBondContact O-N 3.21Å; L30-L33 PolarHBondContact O-N 3.29Å; L33-L36 PolarHBondContact O-N 3.41Å; L33-R37 VanDerWaalsContact O-CG 3.32Å; L33-R37 WeakPolarHBondContact O-CG 3.47Å; L33-R37 PolarHBondContact O-N 3.2Å
34	Q	72	Confident	75.9	Confident	91 Å²	91	104.2 Å²	104.2	43%	0.425	55%	0.553	S	S	.	*	H	α-helix	trans	-64.9	-41.8	174.2	-73.5	177	2.9	0	0	111.9	L30 P31 R37 K38	L30-Q34 WeakPolarHBondContact O-CG 3.45Å; L30-Q34 PolarHBondContact O-N 3.09Å; P31-Q34 PolarHBondContact O-N 3.41Å; Q34-R37 PolarHBondContact O-N 2.9Å; Q34-K38 WeakPolarHBondContact O-CG 3.07Å; Q34-K38 PolarHBondContact O-N 3.16Å
35	N	78.5	Confident	77.8	Confident	100 Å²	100	98.5 Å²	98.5	54%	0.535	53%	0.525	S	S	.	.	H	α-helix	trans	-63.8	-40.4	174.9	-72.9	-25.5	0	0	0	111.8	P31 C32 R37 K38 E39	P31-N35 WeakPolarHBondContact O-CB 3.49Å; P31-N35 VanDerWaalsContact O-CG 3.26Å; P31-N35 PolarHBondContact O-N 3.22Å; P31-N35 PolarHBondContact O-ND2 3.07Å; C32-N35 PolarHBondContact O-N 3.44Å; N35-R37 PolarHBondContact O-N 3.43Å; N35-K38 PolarHBondContact O-N 3.06Å; N35-E39 WeakPolarHBondContact O-CB 3.31Å; N35-E39 PolarHBondContact O-N 3.22Å
36	L	80	Confident	79.6	Confident	92 Å²	92	103 Å²	103	48%	0.482	52%	0.522	S	S	.	.	H	α-helix	trans	-65.8	-37.6	175.9	-165.1	72.4	0	0	0	112.3	C32 L33 E39 K40	C32-L36 WeakPolarHBondContact O-CB 3.45Å; C32-L36 PolarHBondContact O-N 3Å; L33-L36 PolarHBondContact O-N 3.41Å; L36-E39 PolarHBondContact O-N 3.36Å; L36-K40 WeakPolarHBondContact O-CG 3.28Å; L36-K40 PolarHBondContact O-N 3.13Å
37	R	81.4	Confident	81.4	Confident	167 Å²	167	97 Å²	97	63%	0.63	50%	0.504	S	S	*	.	H	α-helix	trans	-65.3	-44.8	173.4	-73.2	175.6	-166.5	165.6	4.1	111.5	L33 Q34 N35 E39 K40 S41	L33-R37 VanDerWaalsContact O-CG 3.32Å; L33-R37 WeakPolarHBondContact O-CG 3.47Å; L33-R37 PolarHBondContact O-N 3.2Å; Q34-R37 PolarHBondContact O-N 2.9Å; N35-R37 PolarHBondContact O-N 3.43Å; R37-E39 VanDerWaalsContact C-N 3.28Å; R37-E39 PolarHBondContact O-N 3.08Å; R37-K40 PolarHBondContact O-N 2.96Å; R37-S41 WeakPolarHBondContact O-CB 3.38Å; R37-S41 PolarHBondContact O-N 2.77Å
38	K	86.7	Confident	83.1	Confident	142 Å²	142	98.9 Å²	98.9	62%	0.617	50%	0.496	S	S	*	.	H	α-helix	trans	-60.5	-39.9	174.4	-72.3	174.8	-177.9	178	0	111	Q34 N35 S41 R42	Q34-K38 WeakPolarHBondContact O-CG 3.07Å; Q34-K38 PolarHBondContact O-N 3.16Å; N35-K38 PolarHBondContact O-N 3.06Å; K38-S41 PolarHBondContact O-N 2.9Å; K38-R42 WeakPolarHBondContact O-CB 3.36Å; K38-R42 PolarHBondContact O-N 3.41Å
39	E	87.4	Confident	84.8	Confident	62 Å²	62	102.8 Å²	102.8	29%	0.29	50%	0.502	S	S	.	.	H	α-helix	trans	-65.2	-47.6	178	-171.1	56.6	-146.5	0	0	112.5	N35 L36 R37 S41 R42 N43	N35-E39 WeakPolarHBondContact O-CB 3.31Å; N35-E39 PolarHBondContact O-N 3.22Å; L36-E39 PolarHBondContact O-N 3.36Å; R37-E39 VanDerWaalsContact C-N 3.28Å; R37-E39 PolarHBondContact O-N 3.08Å; E39-S41 VanDerWaalsContact C-N 3.32Å; E39-S41 PolarHBondContact O-N 3.45Å; E39-R42 WeakPolarHBondContact O-CB 3.15Å; E39-R42 PolarHBondContact O-N 2.89Å; E39-R42 IonicContact OE1-CZ 3.46Å; E39-R42 IonicContact OE1-NE 3.86Å; E39-R42 PolarHBondContact OE1-NE 3.23Å; E39-R42 IonicContact OE1-NH2 2.77Å; E39-R42 PolarHBondContact OE1-NH2 3.07Å; E39-R42 IonicContact OE2-CZ 3.01Å; E39-R42 IonicContact OE2-NE 2.93Å; E39-R42 PolarHBondContact OE2-NE 3.23Å; E39-R42 VanDerWaalsContact OE2-NE 3.15Å; E39-R42 IonicContact OE2-NH1 3.75Å; E39-R42 IonicContact OE2-NH2 2.7Å; E39-R42 PolarHBondContact OE2-NH2 2.69Å; E39-N43 PolarHBondContact O-N 3.19Å; E39-N43 PolarHBondContact O-ND2 3.46Å; E39-N43 PolarHBondContact OE1-ND2 2.9Å; E39-N43 VanDerWaalsContact OE1-ND2 3.13Å
40	K	91.2	Very high	86.2	Confident	143 Å²	143	100.1 Å²	100.1	62%	0.622	49%	0.494	S	S	*	.	H	α-helix	trans	-59.1	-44.4	174.2	-74	-179	-179.9	-173.4	0	111.3	L36 R37 R42 N43 A44	L36-K40 WeakPolarHBondContact O-CG 3.28Å; L36-K40 PolarHBondContact O-N 3.13Å; R37-K40 PolarHBondContact O-N 2.96Å; K40-R42 VanDerWaalsContact C-N 3.33Å; K40-R42 PolarHBondContact O-N 3.39Å; K40-N43 PolarHBondContact O-N 3.3Å; K40-A44 VanDerWaalsContact O-CB 3.27Å; K40-A44 WeakPolarHBondContact O-CB 3.25Å; K40-A44 PolarHBondContact O-N 3.26Å
41	S	93.1	Very high	87.8	Confident	81 Å²	81	101.3 Å²	101.3	57%	0.566	49%	0.494	S	S	*	.	H	α-helix	trans	-61.3	-41	175.7	-176	0	0	0	0	112	R37 K38 E39 A45	R37-S41 WeakPolarHBondContact O-CB 3.38Å; R37-S41 PolarHBondContact O-N 2.77Å; K38-S41 PolarHBondContact O-N 2.9Å; E39-S41 VanDerWaalsContact C-N 3.32Å; E39-S41 PolarHBondContact O-N 3.45Å; S41-A45 VanDerWaalsContact O-CB 3.24Å; S41-A45 WeakPolarHBondContact O-CB 3.1Å; S41-A45 PolarHBondContact O-N 2.81Å
42	R	94.1	Very high	89.3	Confident	156 Å²	156	101.1 Å²	101.1	59%	0.589	49%	0.487	S	S	*	.	H	α-helix	trans	-64.3	-46.4	177.7	-175.9	173.9	72	167.4	8.2	111.6	K38 E39 K40 A45 R46	K38-R42 WeakPolarHBondContact O-CB 3.36Å; K38-R42 PolarHBondContact O-N 3.41Å; E39-R42 WeakPolarHBondContact O-CB 3.15Å; E39-R42 PolarHBondContact O-N 2.89Å; E39-R42 IonicContact OE1-CZ 3.46Å; E39-R42 IonicContact OE1-NE 3.86Å; E39-R42 PolarHBondContact OE1-NE 3.23Å; E39-R42 IonicContact OE1-NH2 2.77Å; E39-R42 PolarHBondContact OE1-NH2 3.07Å; E39-R42 IonicContact OE2-CZ 3.01Å; E39-R42 IonicContact OE2-NE 2.93Å; E39-R42 PolarHBondContact OE2-NE 3.23Å; E39-R42 VanDerWaalsContact OE2-NE 3.15Å; E39-R42 IonicContact OE2-NH1 3.75Å; E39-R42 IonicContact OE2-NH2 2.7Å; E39-R42 PolarHBondContact OE2-NH2 2.69Å; K40-R42 VanDerWaalsContact C-N 3.33Å; K40-R42 PolarHBondContact O-N 3.39Å; R42-A45 PolarHBondContact O-N 2.7Å; R42-R46 WeakPolarHBondContact O-CB 3.47Å; R42-R46 PolarHBondContact O-N 2.88Å
43	N	94.4	Very high	90.5	Very high	79 Å²	79	101.9 Å²	101.9	42%	0.422	49%	0.486	S	S	.	.	H	α-helix	trans	-68.2	-40	179.2	-69.3	-26.5	0	0	0	111.9	E39 K40 R46 S47	E39-N43 PolarHBondContact O-N 3.19Å; E39-N43 PolarHBondContact O-ND2 3.46Å; E39-N43 PolarHBondContact OE1-ND2 2.9Å; E39-N43 VanDerWaalsContact OE1-ND2 3.13Å; K40-N43 PolarHBondContact O-N 3.3Å; N43-R46 PolarHBondContact O-N 3.47Å; N43-S47 WeakPolarHBondContact O-CB 3.37Å; N43-S47 PolarHBondContact O-N 2.88Å
44	A	95.6	Very high	91.7	Very high	57 Å²	57	104.7 Å²	104.7	47%	0.471	50%	0.496	S	S	.	.	H	α-helix	trans	-62.1	-44.3	172.3	0	0	0	0	0	111.9	K40 S47 R48	K40-A44 VanDerWaalsContact O-CB 3.27Å; K40-A44 WeakPolarHBondContact O-CB 3.25Å; K40-A44 PolarHBondContact O-N 3.26Å; A44-S47 PolarHBondContact O-N 3.09Å; A44-R48 WeakPolarHBondContact O-CB 3.4Å; A44-R48 PolarHBondContact O-N 2.68Å
45	A	96	Very high	93	Very high	15 Å²	15	106.1 Å²	106.1	12%	0.124	50%	0.503	C	S	.	.	H	α-helix	trans	-64.8	-38.9	176.4	0	0	0	0	0	112.3	S41 R42 R48 R49	S41-A45 VanDerWaalsContact O-CB 3.24Å; S41-A45 WeakPolarHBondContact O-CB 3.1Å; S41-A45 PolarHBondContact O-N 2.81Å; R42-A45 PolarHBondContact O-N 2.7Å; A45-R48 PolarHBondContact O-N 2.64Å; A45-R49 VanDerWaalsContact O-CG 3.32Å; A45-R49 WeakPolarHBondContact O-CG 3.4Å; A45-R49 PolarHBondContact O-N 3.16Å
46	R	96.4	Very high	93.9	Very high	188 Å²	188	103.4 Å²	103.4	71%	0.709	49%	0.486	S	S	*	.	H	α-helix	trans	-65.8	-44.9	175.5	-166.3	179.1	-164.2	174.6	4.2	111.5	R42 N43 R49 G50	R42-R46 WeakPolarHBondContact O-CB 3.47Å; R42-R46 PolarHBondContact O-N 2.88Å; N43-R46 PolarHBondContact O-N 3.47Å; R46-R49 PolarHBondContact O-N 2.92Å; R46-G50 PolarHBondContact O-N 3.15Å
47	S	97.4	Very high	94.7	Very high	65 Å²	65	104 Å²	104	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-45.1	175	-178.4	0	0	0	0	111.3	N43 A44 G50 K51	N43-S47 WeakPolarHBondContact O-CB 3.37Å; N43-S47 PolarHBondContact O-N 2.88Å; A44-S47 PolarHBondContact O-N 3.09Å; S47-G50 PolarHBondContact O-N 3.38Å; S47-K51 WeakPolarHBondContact O-CG 3.16Å; S47-K51 PolarHBondContact O-N 3.27Å
48	R	97.7	Very high	95.4	Very high	156 Å²	156	99 Å²	99	59%	0.589	47%	0.469	S	S	*	.	H	α-helix	trans	-59	-48.2	175.4	-174.4	178.3	65.8	-127.2	2.4	112.1	A44 A45 G50 K51 E52	A44-R48 WeakPolarHBondContact O-CB 3.4Å; A44-R48 PolarHBondContact O-N 2.68Å; A45-R48 PolarHBondContact O-N 2.64Å; R48-G50 VanDerWaalsContact C-N 3.3Å; R48-G50 PolarHBondContact O-N 2.85Å; R48-K51 PolarHBondContact O-N 2.77Å; R48-E52 WeakPolarHBondContact O-CB 3.25Å; R48-E52 PolarHBondContact O-N 3.27Å
49	R	97.5	Very high	96	Very high	151 Å²	151	94.5 Å²	94.5	57%	0.57	45%	0.451	S	S	*	.	H	α-helix	trans	-62.6	-36.3	176.3	-72.1	175.3	-168.7	155.9	2	112.4	A45 R46 N53	A45-R49 VanDerWaalsContact O-CG 3.32Å; A45-R49 WeakPolarHBondContact O-CG 3.4Å; A45-R49 PolarHBondContact O-N 3.16Å; R46-R49 PolarHBondContact O-N 2.92Å; R49-N53 WeakPolarHBondContact O-CB 3.48Å; R49-N53 PolarHBondContact O-N 3.44Å; R49-N53 PolarHBondContact O-OD1 2.87Å
50	G	97.5	Very high	96.4	Very high	41 Å²	41	91.9 Å²	91.9	42%	0.423	44%	0.44	S	S	.	.	H	α-helix	trans	-63.2	-48.4	175.7	0	0	0	0	0	112	R46 S47 R48 N53 F54	R46-G50 PolarHBondContact O-N 3.15Å; S47-G50 PolarHBondContact O-N 3.38Å; R48-G50 VanDerWaalsContact C-N 3.3Å; R48-G50 PolarHBondContact O-N 2.85Å; G50-N53 PolarHBondContact O-N 2.86Å; G50-F54 PolarHBondContact O-N 2.94Å
51	K	97.7	Very high	96.7	Very high	142 Å²	142	90.3 Å²	90.3	62%	0.617	43%	0.434	S	S	*	.	H	α-helix	trans	-61.2	-47.5	174.2	-68.4	-178	179.9	-172.8	0	111.5	S47 R48 N53 F54 E55	S47-K51 WeakPolarHBondContact O-CG 3.16Å; S47-K51 PolarHBondContact O-N 3.27Å; R48-K51 PolarHBondContact O-N 2.77Å; K51-N53 PolarHBondContact O-N 3.43Å; K51-F54 WeakPolarHBondContact O-CB 3.31Å; K51-F54 PolarHBondContact O-N 3.18Å; K51-F54 VanDerWaalsContact O-N 3.12Å; K51-E55 WeakPolarHBondContact O-CG 3.09Å; K51-E55 PolarHBondContact O-N 3.32Å
52	E	97.2	Very high	96.9	Very high	75 Å²	75	93.3 Å²	93.3	35%	0.35	44%	0.44	S	S	.	.	H	α-helix	trans	-55.3	-48.5	176.4	-174.3	-157	135.1	0	0	111.7	R48 F54 E55 F56 K75	R48-E52 WeakPolarHBondContact O-CB 3.25Å; R48-E52 PolarHBondContact O-N 3.27Å; E52-F54 VanDerWaalsContact C-N 3.29Å; E52-F54 PolarHBondContact O-N 3.29Å; E52-E55 PolarHBondContact O-N 3Å; E52-F56 HydrophobicContact CG-CD2 3.93Å; E52-F56 HydrophobicContact CG-CE2 3.77Å; E52-F56 VanDerWaalsContact O-CD2 3.24Å; E52-F56 WeakPolarHBondContact O-CD2 3.26Å; E52-F56 PolarHBondContact O-N 3.1Å; E52-K75 IonicContact OE1-NZ 3.36Å; E52-K75 PolarHBondContact OE1-NZ 2.98Å
53	N	97	Very high	97	Very high	80 Å²	80	86.5 Å²	86.5	43%	0.428	42%	0.416	S	S	.	.	H	α-helix	trans	-62	-37.3	177.8	-72.2	-6	0	0	0	112.5	R49 G50 K51 F56 F57 K75	R49-N53 WeakPolarHBondContact O-CB 3.48Å; R49-N53 PolarHBondContact O-N 3.44Å; R49-N53 PolarHBondContact O-OD1 2.87Å; G50-N53 PolarHBondContact O-N 2.86Å; K51-N53 PolarHBondContact O-N 3.43Å; N53-F56 PolarHBondContact O-N 3Å; N53-F57 WeakPolarHBondContact O-CB 3.46Å; N53-F57 PolarHBondContact O-N 2.79Å; N53-K75 WeakPolarHBondContact OD1-CE 3.42Å; N53-K75 PolarHBondContact OD1-NZ 2.84Å
54	F	97.4	Very high	97	Very high	115 Å²	115	86.9 Å²	86.9	50%	0.504	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-46.5	175.3	176.9	-97.5	0	0	0	111.3	G50 K51 E52 F56 F57 E58	G50-F54 PolarHBondContact O-N 2.94Å; K51-F54 WeakPolarHBondContact O-CB 3.31Å; K51-F54 PolarHBondContact O-N 3.18Å; K51-F54 VanDerWaalsContact O-N 3.12Å; E52-F54 VanDerWaalsContact C-N 3.29Å; E52-F54 PolarHBondContact O-N 3.29Å; F54-F56 VanDerWaalsContact C-N 3.33Å; F54-F56 PolarHBondContact O-N 2.89Å; F54-F57 WeakPolarHBondContact O-CB 3.13Å; F54-F57 PolarHBondContact O-N 3.16Å; F54-F57 VanDerWaalsContact O-N 3.13Å; F54-E58 HydrophobicContact CD1-CG 4.4Å; F54-E58 HydrophobicContact CE1-CG 3.88Å; F54-E58 HydrophobicContact CE2-CG 4.14Å; F54-E58 HydrophobicContact CZ-CG 3.74Å; F54-E58 PolarHBondContact O-N 2.7Å
55	E	97.9	Very high	97	Very high	121 Å²	121	85.9 Å²	85.9	57%	0.565	41%	0.409	S	S	*	.	H	α-helix	trans	-61.5	-40.4	176.1	-61.7	-52.7	146	0	0	112.1	K51 E52 F57 E58 L59	K51-E55 WeakPolarHBondContact O-CG 3.09Å; K51-E55 PolarHBondContact O-N 3.32Å; E52-E55 PolarHBondContact O-N 3Å; E55-F57 VanDerWaalsContact C-N 3.3Å; E55-F57 PolarHBondContact O-N 3.48Å; E55-E58 PolarHBondContact O-N 3.16Å; E55-L59 VanDerWaalsContact O-CB 3.25Å; E55-L59 WeakPolarHBondContact O-CB 3.35Å; E55-L59 PolarHBondContact O-N 3.47Å
56	F	97.8	Very high	96.9	Very high	43 Å²	43	89.2 Å²	89.2	19%	0.189	43%	0.429	C	S	.	.	H	α-helix	trans	-60.7	-39.5	174.3	-90.5	-71.3	0	0	0	112.7	E52 N53 F54 A60 K75 V78 I79	E52-F56 HydrophobicContact CG-CD2 3.93Å; E52-F56 HydrophobicContact CG-CE2 3.77Å; E52-F56 VanDerWaalsContact O-CD2 3.24Å; E52-F56 WeakPolarHBondContact O-CD2 3.26Å; E52-F56 PolarHBondContact O-N 3.1Å; N53-F56 PolarHBondContact O-N 3Å; F54-F56 VanDerWaalsContact C-N 3.33Å; F54-F56 PolarHBondContact O-N 2.89Å; F56-A60 WeakPolarHBondContact O-CB 3.38Å; F56-A60 PolarHBondContact O-N 3.33Å; F56-K75 HydrophobicContact CD1-CB 4.07Å; F56-K75 HydrophobicContact CD1-CG 4.01Å; F56-K75 HydrophobicContact CD2-CD 3.88Å; F56-K75 HydrophobicContact CD2-CG 4.08Å; F56-K75 HydrophobicContact CE1-CB 3.79Å; F56-K75 HydrophobicContact CE1-CG 4.13Å; F56-K75 HydrophobicContact CE2-CB 4.49Å; F56-K75 HydrophobicContact CE2-CD 3.83Å; F56-K75 HydrophobicContact CE2-CG 4.23Å; F56-K75 HydrophobicContact CG-CD 4.31Å; F56-K75 HydrophobicContact CG-CG 3.99Å; F56-K75 HydrophobicContact CZ-CB 4.04Å; F56-K75 HydrophobicContact CZ-CD 4.18Å; F56-K75 HydrophobicContact CZ-CG 4.26Å; F56-V78 HydrophobicContact CD1-CB 4.28Å; F56-V78 HydrophobicContact CD1-CG1 4.21Å; F56-I79 HydrophobicContact CD1-CD1 4.48Å; F56-I79 HydrophobicContact CE1-CD1 3.59Å; F56-I79 HydrophobicContact CE1-CG1 3.69Å; F56-I79 HydrophobicContact CZ-CD1 4.11Å; F56-I79 HydrophobicContact CZ-CG1 4.2Å
57	F	96.4	Very high	96.8	Very high	104 Å²	104	82.8 Å²	82.8	46%	0.456	42%	0.422	S	S	.	.	H	α-helix	trans	-68.5	-44.9	178.8	177.8	-111.5	0	0	0	111.9	N53 F54 E55 A60 K61	N53-F57 WeakPolarHBondContact O-CB 3.46Å; N53-F57 PolarHBondContact O-N 2.79Å; F54-F57 WeakPolarHBondContact O-CB 3.13Å; F54-F57 PolarHBondContact O-N 3.16Å; F54-F57 VanDerWaalsContact O-N 3.13Å; E55-F57 VanDerWaalsContact C-N 3.3Å; E55-F57 PolarHBondContact O-N 3.48Å; F57-A60 PolarHBondContact O-N 3.26Å; F57-K61 HydrophobicContact CE1-CD 4.29Å; F57-K61 WeakPolarHBondContact O-CG 3.35Å; F57-K61 PolarHBondContact O-N 3.13Å; F57-K61 VanDerWaalsContact O-N 3.11Å
58	E	97.6	Very high	96.7	Very high	63 Å²	63	83 Å²	83	29%	0.294	43%	0.428	S	S	.	.	H	α-helix	trans	-65.2	-40.1	175.5	-68.3	-58	114	0	0	111.6	F54 E55 A60 K61 M62	F54-E58 HydrophobicContact CD1-CG 4.4Å; F54-E58 HydrophobicContact CE1-CG 3.88Å; F54-E58 HydrophobicContact CE2-CG 4.14Å; F54-E58 HydrophobicContact CZ-CG 3.74Å; F54-E58 PolarHBondContact O-N 2.7Å; E55-E58 PolarHBondContact O-N 3.16Å; E58-A60 PolarHBondContact O-N 3.08Å; E58-K61 PolarHBondContact O-N 3.13Å; E58-K61 IonicContact OE1-NZ 2.91Å; E58-K61 PolarHBondContact OE1-NZ 3.21Å; E58-M62 WeakPolarHBondContact O-CG 3.19Å; E58-M62 PolarHBondContact O-N 2.79Å
59	L	97.8	Very high	96.6	Very high	47 Å²	47	79 Å²	79	25%	0.246	42%	0.417	C	S	.	.	H	α-helix	trans	-61.7	-42.5	174.2	-177.1	59.3	0	0	0	112.2	E55 K61 M62 V78 I79 T82	E55-L59 VanDerWaalsContact O-CB 3.25Å; E55-L59 WeakPolarHBondContact O-CB 3.35Å; E55-L59 PolarHBondContact O-N 3.47Å; L59-K61 VanDerWaalsContact C-N 3.32Å; L59-K61 PolarHBondContact O-N 3.21Å; L59-M62 HydrophobicContact CD1-CE 3.97Å; L59-M62 PolarHBondContact O-N 2.79Å; L59-V78 HydrophobicContact CB-CG1 4.21Å; L59-V78 HydrophobicContact CD2-CG1 3.88Å; L59-V78 HydrophobicContact CG-CG1 3.85Å; L59-I79 HydrophobicContact CD2-CD1 4.12Å; L59-T82 HydrophobicContact CD1-CG2 3.98Å; L59-T82 HydrophobicContact CD2-CG2 4.46Å
60	A	97.6	Very high	96.4	Very high	7 Å²	7	72.3 Å²	72.3	6%	0.058	39%	0.393	C	S	.	.	H	α-helix	trans	-62.2	-39.4	177.5	0	0	0	0	0	112	F56 F57 E58 M62 L63 T70 V78	F56-A60 WeakPolarHBondContact O-CB 3.38Å; F56-A60 PolarHBondContact O-N 3.33Å; F57-A60 PolarHBondContact O-N 3.26Å; E58-A60 PolarHBondContact O-N 3.08Å; A60-M62 VanDerWaalsContact C-N 3.26Å; A60-M62 PolarHBondContact O-N 2.8Å; A60-L63 WeakPolarHBondContact O-CB 3.43Å; A60-L63 PolarHBondContact O-N 3.33Å; A60-T70 WeakPolarHBondContact O-CB 3.39Å; A60-T70 VanDerWaalsContact O-CG2 3.3Å; A60-T70 WeakPolarHBondContact O-CG2 3.39Å; A60-V78 HydrophobicContact CB-CG1 4.25Å; A60-V78 HydrophobicContact CB-CG2 3.86Å
61	K	96.8	Very high	96.3	Very high	110 Å²	110	74.1 Å²	74.1	48%	0.478	40%	0.399	S	S	.	.	H	α-helix	trans	-63.5	-29.2	176.2	-73.8	176.7	-179.9	167.6	0	113.8	F57 E58 L59 L63	F57-K61 HydrophobicContact CE1-CD 4.29Å; F57-K61 WeakPolarHBondContact O-CG 3.35Å; F57-K61 PolarHBondContact O-N 3.13Å; F57-K61 VanDerWaalsContact O-N 3.11Å; E58-K61 PolarHBondContact O-N 3.13Å; E58-K61 IonicContact OE1-NZ 2.91Å; E58-K61 PolarHBondContact OE1-NZ 3.21Å; L59-K61 VanDerWaalsContact C-N 3.32Å; L59-K61 PolarHBondContact O-N 3.21Å; K61-L63 VanDerWaalsContact C-N 3.29Å
62	M	96.9	Very high	96.1	Very high	144 Å²	144	75.2 Å²	75.2	71%	0.709	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.6	179	-68	-171.4	-70	0	0	113.4	E58 L59 A60	E58-M62 WeakPolarHBondContact O-CG 3.19Å; E58-M62 PolarHBondContact O-N 2.79Å; L59-M62 HydrophobicContact CD1-CE 3.97Å; L59-M62 PolarHBondContact O-N 2.79Å; A60-M62 VanDerWaalsContact C-N 3.26Å; A60-M62 PolarHBondContact O-N 2.8Å
63	L	96.9	Very high	96.1	Very high	13 Å²	13	73.3 Å²	73.3	7%	0.068	40%	0.399	C	S	.	.	S	Bend	trans	-67.1	144.1	175.9	-69.1	172.9	0	0	0	110.6	A60 K61 L65 T70 L73 L81	A60-L63 WeakPolarHBondContact O-CB 3.43Å; A60-L63 PolarHBondContact O-N 3.33Å; K61-L63 VanDerWaalsContact C-N 3.29Å; L63-L65 PolarHBondContact O-N 2.74Å; L63-T70 HydrophobicContact CB-CG2 4.13Å; L63-L73 HydrophobicContact CD1-CD1 3.77Å; L63-L81 HydrophobicContact CD1-CB 4.01Å; L63-L81 HydrophobicContact CD1-CD1 3.98Å; L63-L81 HydrophobicContact CD2-CB 4.02Å
64	P	94.8	Very high	96.1	Very high	88 Å²	88	73.5 Å²	73.5	57%	0.571	40%	0.4	S	S	*	.	S	Bend	trans	-77.9	57.3	179.8	36.3	-39.8	0	0	0	111.3	Y85	P64-Y85 HydrophobicContact CB-CE2 4.39Å; P64-Y85 HydrophobicContact CG-CD2 3.65Å; P64-Y85 HydrophobicContact CG-CE2 3.72Å; P64-Y85 HydrophobicContact CG-CG 4.46Å
65	L	94.5	Very high	96.1	Very high	36 Å²	36	72 Å²	72	19%	0.188	39%	0.393	C	S	.	.	S	Bend	trans	-135.1	152.1	-178.8	-67.2	173.5	0	0	0	109	L63 G67 T70 L81 V165	L63-L65 PolarHBondContact O-N 2.74Å; L65-G67 PolarHBondContact O-N 2.91Å; L65-T70 HydrophobicContact CB-CG2 3.6Å; L65-T70 HydrophobicContact CD1-CG2 4.41Å; L65-L81 HydrophobicContact CD1-CD1 4.03Å; L65-V165 HydrophobicContact CD1-CG2 4.28Å
66	P	94.7	Very high	96.1	Very high	84 Å²	84	69.4 Å²	69.4	55%	0.545	39%	0.392	S	S	.	.			trans	-54.5	140.6	173.4	-25.7	33.5	0	0	0	112.5	A68 I69 T70	P66-A68 PolarHBondContact O-N 2.87Å; P66-A68 VanDerWaalsContact O-N 3.1Å; P66-I69 HydrophobicContact CB-CG1 4.5Å; P66-I69 HydrophobicContact CG-CD1 4.31Å; P66-I69 WeakPolarHBondContact O-CB 3.31Å; P66-I69 PolarHBondContact O-N 2.94Å; P66-T70 PolarHBondContact O-N 2.9Å
67	G	94.1	Very high	96.1	Very high	53 Å²	53	68 Å²	68	55%	0.546	39%	0.388	S	S	.	.	H	α-helix	trans	-56.7	-29.4	-178.8	0	0	0	0	0	114.6	L65 I69 T70 S71	L65-G67 PolarHBondContact O-N 2.91Å; G67-I69 PolarHBondContact O-N 3.23Å; G67-T70 WeakPolarHBondContact CA-OG1 3.39Å; G67-T70 PolarHBondContact O-OG1 3.47Å; G67-S71 WeakPolarHBondContact O-CB 3.46Å; G67-S71 PolarHBondContact O-N 2.91Å; G67-S71 VanDerWaalsContact O-N 3.16Å; G67-S71 PolarHBondContact O-OG 3.44Å
68	A	94.9	Very high	96.1	Very high	71 Å²	71	63.2 Å²	63.2	59%	0.587	37%	0.367	S	S	*	.	H	α-helix	trans	-63.9	-28.6	175.6	0	0	0	0	0	112.9	P66 S71 Q72	P66-A68 PolarHBondContact O-N 2.87Å; P66-A68 VanDerWaalsContact O-N 3.1Å; A68-S71 PolarHBondContact O-OG 3.42Å; A68-Q72 PolarHBondContact O-NE2 3.4Å
69	I	94.7	Very high	96.2	Very high	70 Å²	70	63.6 Å²	63.6	36%	0.359	37%	0.37	S	S	.	.	H	α-helix	trans	-86.6	-49.2	177.7	-58.7	-178	0	0	0	109.8	P66 G67 S71 Q72 V165	P66-I69 HydrophobicContact CB-CG1 4.5Å; P66-I69 HydrophobicContact CG-CD1 4.31Å; P66-I69 WeakPolarHBondContact O-CB 3.31Å; P66-I69 PolarHBondContact O-N 2.94Å; G67-I69 PolarHBondContact O-N 3.23Å; I69-S71 PolarHBondContact O-N 3.48Å; I69-Q72 PolarHBondContact O-N 2.83Å; I69-V165 HydrophobicContact CG2-CG2 3.79Å
70	T	95.3	Very high	96.2	Very high	11 Å²	11	64.3 Å²	64.3	7%	0.067	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-29.5	-174.4	57.9	0	0	0	0	113.4	A60 L63 L65 P66 G67 Q72 L73	A60-T70 WeakPolarHBondContact O-CB 3.39Å; A60-T70 VanDerWaalsContact O-CG2 3.3Å; A60-T70 WeakPolarHBondContact O-CG2 3.39Å; L63-T70 HydrophobicContact CB-CG2 4.13Å; L65-T70 HydrophobicContact CB-CG2 3.6Å; L65-T70 HydrophobicContact CD1-CG2 4.41Å; P66-T70 PolarHBondContact O-N 2.9Å; G67-T70 WeakPolarHBondContact CA-OG1 3.39Å; G67-T70 PolarHBondContact O-OG1 3.47Å; T70-Q72 PolarHBondContact O-N 3.27Å; T70-L73 HydrophobicContact CG2-CD1 4.45Å; T70-L73 PolarHBondContact O-N 2.82Å
71	S	93.9	Very high	96.2	Very high	80 Å²	80	64.4 Å²	64.4	56%	0.559	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-17.4	176.3	54.9	0	0	0	0	114.6	G67 A68 I69	G67-S71 WeakPolarHBondContact O-CB 3.46Å; G67-S71 PolarHBondContact O-N 2.91Å; G67-S71 VanDerWaalsContact O-N 3.16Å; G67-S71 PolarHBondContact O-OG 3.44Å; A68-S71 PolarHBondContact O-OG 3.42Å; I69-S71 PolarHBondContact O-N 3.48Å
72	Q	94.8	Very high	96.3	Very high	165 Å²	165	60.4 Å²	60.4	77%	0.771	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	0.6	-176.8	-58.4	-177.6	19.6	0	0	113.1	A68 I69 T70	A68-Q72 PolarHBondContact O-NE2 3.4Å; I69-Q72 PolarHBondContact O-N 2.83Å; T70-Q72 PolarHBondContact O-N 3.27Å
73	L	96.6	Very high	96.3	Very high	34 Å²	34	57.4 Å²	57.4	18%	0.178	34%	0.34	C	S	.	.			trans	-71.5	140.2	-176.5	-64.3	176.5	0	0	0	112	L63 T70 V78 L81 V165	L63-L73 HydrophobicContact CD1-CD1 3.77Å; T70-L73 HydrophobicContact CG2-CD1 4.45Å; T70-L73 PolarHBondContact O-N 2.82Å; L73-V78 HydrophobicContact CB-CG2 3.75Å; L73-V78 HydrophobicContact CD1-CG2 4.21Å; L73-L81 HydrophobicContact CD1-CD1 3.72Å; L73-L81 HydrophobicContact CD2-CD1 4.2Å; L73-V165 HydrophobicContact CD2-CG1 3.5Å; L73-V165 VanDerWaalsContact CD2-CG1 3.5Å
74	D	96.9	Very high	96.4	Very high	85 Å²	85	57 Å²	57	46%	0.455	34%	0.339	S	S	.	.			trans	-76.3	157.4	166.3	75.1	-71.5	0	0	0	111	A76 S77 V78	D74-A76 VanDerWaalsContact C-N 3.26Å; D74-A76 PolarHBondContact O-N 2.81Å; D74-A76 VanDerWaalsContact OD2-CB 3.31Å; D74-A76 WeakPolarHBondContact OD2-CB 3.22Å; D74-A76 PolarHBondContact OD2-N 3.03Å; D74-S77 PolarHBondContact O-N 3.19Å; D74-S77 VanDerWaalsContact O-N 3.15Å; D74-S77 WeakPolarHBondContact OD1-CB 3.49Å; D74-S77 PolarHBondContact OD1-OG 3.3Å; D74-S77 PolarHBondContact OD2-N 3.27Å; D74-V78 WeakPolarHBondContact O-CG2 3.45Å; D74-V78 PolarHBondContact O-N 3.41Å
75	K	97.1	Very high	96.5	Very high	84 Å²	84	57.7 Å²	57.7	37%	0.365	33%	0.33	S	S	.	.	H	α-helix	trans	-56.5	-37.4	-176.7	-69.3	-176.7	172.9	-172.4	0	113.4	E52 N53 F56 V78 I79	E52-K75 IonicContact OE1-NZ 3.36Å; E52-K75 PolarHBondContact OE1-NZ 2.98Å; N53-K75 WeakPolarHBondContact OD1-CE 3.42Å; N53-K75 PolarHBondContact OD1-NZ 2.84Å; F56-K75 HydrophobicContact CD1-CB 4.07Å; F56-K75 HydrophobicContact CD1-CG 4.01Å; F56-K75 HydrophobicContact CD2-CD 3.88Å; F56-K75 HydrophobicContact CD2-CG 4.08Å; F56-K75 HydrophobicContact CE1-CB 3.79Å; F56-K75 HydrophobicContact CE1-CG 4.13Å; F56-K75 HydrophobicContact CE2-CB 4.49Å; F56-K75 HydrophobicContact CE2-CD 3.83Å; F56-K75 HydrophobicContact CE2-CG 4.23Å; F56-K75 HydrophobicContact CG-CD 4.31Å; F56-K75 HydrophobicContact CG-CG 3.99Å; F56-K75 HydrophobicContact CZ-CB 4.04Å; F56-K75 HydrophobicContact CZ-CD 4.18Å; F56-K75 HydrophobicContact CZ-CG 4.26Å; K75-V78 PolarHBondContact O-N 3.28Å; K75-I79 PolarHBondContact O-N 2.98Å
76	A	97.6	Very high	96.7	Very high	66 Å²	66	59.5 Å²	59.5	55%	0.545	34%	0.34	S	S	.	.	H	α-helix	trans	-70.5	-40.9	-178.3	0	0	0	0	0	110.7	D74 I79 R80	D74-A76 VanDerWaalsContact C-N 3.26Å; D74-A76 PolarHBondContact O-N 2.81Å; D74-A76 VanDerWaalsContact OD2-CB 3.31Å; D74-A76 WeakPolarHBondContact OD2-CB 3.22Å; D74-A76 PolarHBondContact OD2-N 3.03Å; A76-I79 PolarHBondContact O-N 3.11Å; A76-R80 VanDerWaalsContact O-CB 3.3Å; A76-R80 WeakPolarHBondContact O-CB 3.36Å; A76-R80 PolarHBondContact O-N 3.43Å
77	S	97.3	Very high	96.7	Very high	13 Å²	13	59.7 Å²	59.7	9%	0.091	33%	0.333	C	S	.	.	H	α-helix	trans	-63.2	-40.3	172.9	-65	0	0	0	0	112.6	D74 I79 R80 L81	D74-S77 PolarHBondContact O-N 3.19Å; D74-S77 VanDerWaalsContact O-N 3.15Å; D74-S77 WeakPolarHBondContact OD1-CB 3.49Å; D74-S77 PolarHBondContact OD1-OG 3.3Å; D74-S77 PolarHBondContact OD2-N 3.27Å; S77-I79 PolarHBondContact O-N 2.78Å; S77-R80 PolarHBondContact O-N 2.92Å; S77-R80 PolarHBondContact OG-NH2 3.47Å; S77-R80 VanDerWaalsContact OG-NH2 3.12Å; S77-L81 WeakPolarHBondContact O-CB 3.48Å; S77-L81 WeakPolarHBondContact O-CG 3.43Å; S77-L81 PolarHBondContact O-N 2.66Å
78	V	98.2	Very high	96.8	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.024	31%	0.314	C	S	.	.	H	α-helix	trans	-55	-52.8	175.4	175.9	0	0	0	0	110.6	F56 L59 A60 L73 D74 K75 R80 L81 T82	F56-V78 HydrophobicContact CD1-CB 4.28Å; F56-V78 HydrophobicContact CD1-CG1 4.21Å; L59-V78 HydrophobicContact CB-CG1 4.21Å; L59-V78 HydrophobicContact CD2-CG1 3.88Å; L59-V78 HydrophobicContact CG-CG1 3.85Å; A60-V78 HydrophobicContact CB-CG1 4.25Å; A60-V78 HydrophobicContact CB-CG2 3.86Å; L73-V78 HydrophobicContact CB-CG2 3.75Å; L73-V78 HydrophobicContact CD1-CG2 4.21Å; D74-V78 WeakPolarHBondContact O-CG2 3.45Å; D74-V78 PolarHBondContact O-N 3.41Å; K75-V78 PolarHBondContact O-N 3.28Å; V78-R80 PolarHBondContact O-N 2.84Å; V78-L81 PolarHBondContact O-N 2.93Å; V78-T82 WeakPolarHBondContact O-CB 3.31Å; V78-T82 PolarHBondContact O-N 3.04Å; V78-T82 PolarHBondContact O-OG1 2.75Å
79	I	98.3	Very high	96.8	Very high	70 Å²	70	62.4 Å²	62.4	36%	0.359	31%	0.313	S	S	.	.	H	α-helix	trans	-60.4	-46.5	178.2	-61.4	-53.3	0	0	0	111.8	F56 L59 K75 A76 S77 L81 T82 I83	F56-I79 HydrophobicContact CD1-CD1 4.48Å; F56-I79 HydrophobicContact CE1-CD1 3.59Å; F56-I79 HydrophobicContact CE1-CG1 3.69Å; F56-I79 HydrophobicContact CZ-CD1 4.11Å; F56-I79 HydrophobicContact CZ-CG1 4.2Å; L59-I79 HydrophobicContact CD2-CD1 4.12Å; K75-I79 PolarHBondContact O-N 2.98Å; A76-I79 PolarHBondContact O-N 3.11Å; S77-I79 PolarHBondContact O-N 2.78Å; I79-L81 PolarHBondContact O-N 2.91Å; I79-T82 PolarHBondContact O-N 2.88Å; I79-I83 HydrophobicContact CG2-CD1 3.6Å; I79-I83 HydrophobicContact CG2-CG1 4.22Å; I79-I83 VanDerWaalsContact O-CG1 3.31Å; I79-I83 WeakPolarHBondContact O-CG1 3.37Å; I79-I83 PolarHBondContact O-N 2.88Å
80	R	98	Very high	96.7	Very high	62 Å²	62	61.9 Å²	61.9	23%	0.234	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-44.4	-177.7	178.9	171.8	54.9	123.7	7.5	112	A76 S77 V78 S84 V165 E166 T168 S170	A76-R80 VanDerWaalsContact O-CB 3.3Å; A76-R80 WeakPolarHBondContact O-CB 3.36Å; A76-R80 PolarHBondContact O-N 3.43Å; S77-R80 PolarHBondContact O-N 2.92Å; S77-R80 PolarHBondContact OG-NH2 3.47Å; S77-R80 VanDerWaalsContact OG-NH2 3.12Å; V78-R80 PolarHBondContact O-N 2.84Å; R80-S84 WeakPolarHBondContact O-CB 3.47Å; R80-S84 PolarHBondContact O-N 2.86Å; R80-S84 PolarHBondContact O-OG 2.96Å; R80-V165 PolarHBondContact NH2-O 2.73Å; R80-E166 PolarHBondContact NH1-O 3.33Å; R80-T168 PolarHBondContact NH1-O 2.77Å; R80-S170 PolarHBondContact NH1-OG 3.09Å
81	L	98.3	Very high	96.7	Very high	10 Å²	10	61.8 Å²	61.8	5%	0.052	31%	0.312	C	S	.	.	H	α-helix	trans	-67.4	-41.9	177	-65.3	169.3	0	0	0	111.3	L63 L65 L73 S77 V78 I79 S84 Y85 V165 T168	L63-L81 HydrophobicContact CD1-CB 4.01Å; L63-L81 HydrophobicContact CD1-CD1 3.98Å; L63-L81 HydrophobicContact CD2-CB 4.02Å; L65-L81 HydrophobicContact CD1-CD1 4.03Å; L73-L81 HydrophobicContact CD1-CD1 3.72Å; L73-L81 HydrophobicContact CD2-CD1 4.2Å; S77-L81 WeakPolarHBondContact O-CB 3.48Å; S77-L81 WeakPolarHBondContact O-CG 3.43Å; S77-L81 PolarHBondContact O-N 2.66Å; V78-L81 PolarHBondContact O-N 2.93Å; I79-L81 PolarHBondContact O-N 2.91Å; L81-S84 PolarHBondContact O-N 2.78Å; L81-Y85 VanDerWaalsContact O-CB 3.29Å; L81-Y85 WeakPolarHBondContact O-CB 3.49Å; L81-Y85 PolarHBondContact O-N 2.99Å; L81-V165 HydrophobicContact CD1-CG1 4.13Å; L81-T168 HydrophobicContact CD2-CG2 3.85Å
82	T	98.3	Very high	96.6	Very high	26 Å²	26	58.8 Å²	58.8	16%	0.16	29%	0.292	C	S	.	.	H	α-helix	trans	-59.4	-49	175.6	-58.8	0	0	0	0	111.4	L59 V78 I79 S84 Y85 L86	L59-T82 HydrophobicContact CD1-CG2 3.98Å; L59-T82 HydrophobicContact CD2-CG2 4.46Å; V78-T82 WeakPolarHBondContact O-CB 3.31Å; V78-T82 PolarHBondContact O-N 3.04Å; V78-T82 PolarHBondContact O-OG1 2.75Å; I79-T82 PolarHBondContact O-N 2.88Å; T82-S84 VanDerWaalsContact C-N 3.34Å; T82-S84 PolarHBondContact O-N 2.76Å; T82-Y85 PolarHBondContact O-N 3.14Å; T82-L86 HydrophobicContact CG2-CD1 4.23Å; T82-L86 WeakPolarHBondContact O-CG 3.23Å; T82-L86 PolarHBondContact O-N 3.29Å
83	I	97.9	Very high	96.4	Very high	81 Å²	81	54.1 Å²	54.1	42%	0.415	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-47.5	178	-68.8	171	0	0	0	110.1	I79 Y85 L86 H87	I79-I83 HydrophobicContact CG2-CD1 3.6Å; I79-I83 HydrophobicContact CG2-CG1 4.22Å; I79-I83 VanDerWaalsContact O-CG1 3.31Å; I79-I83 WeakPolarHBondContact O-CG1 3.37Å; I79-I83 PolarHBondContact O-N 2.88Å; I83-Y85 VanDerWaalsContact C-N 3.33Å; I83-Y85 PolarHBondContact O-N 2.86Å; I83-L86 PolarHBondContact O-N 3.13Å; I83-H87 WeakPolarHBondContact O-CB 3.44Å; I83-H87 PolarHBondContact O-N 2.96Å
84	S	98.1	Very high	96.1	Very high	5 Å²	5	56.3 Å²	56.3	4%	0.035	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-40.6	-179	-55	0	0	0	0	111.8	R80 L81 T82 H87 M88 G169	R80-S84 WeakPolarHBondContact O-CB 3.47Å; R80-S84 PolarHBondContact O-N 2.86Å; R80-S84 PolarHBondContact O-OG 2.96Å; L81-S84 PolarHBondContact O-N 2.78Å; T82-S84 VanDerWaalsContact C-N 3.34Å; T82-S84 PolarHBondContact O-N 2.76Å; S84-H87 PolarHBondContact O-N 3.42Å; S84-M88 VanDerWaalsContact O-CB 3.24Å; S84-M88 WeakPolarHBondContact O-CB 3.48Å; S84-M88 PolarHBondContact O-N 2.99Å; S84-G169 WeakPolarHBondContact OG-CA 3.44Å; S84-G169 PolarHBondContact OG-N 3.49Å
85	Y	97.5	Very high	95.6	Very high	102 Å²	102	52.3 Å²	52.3	40%	0.4	27%	0.266	S	S	.	.	H	α-helix	trans	-62.7	-45.8	175.2	175.4	-101.9	0	0	0	112.2	P64 L81 T82 I83 H87 M88 R89	P64-Y85 HydrophobicContact CB-CE2 4.39Å; P64-Y85 HydrophobicContact CG-CD2 3.65Å; P64-Y85 HydrophobicContact CG-CE2 3.72Å; P64-Y85 HydrophobicContact CG-CG 4.46Å; L81-Y85 VanDerWaalsContact O-CB 3.29Å; L81-Y85 WeakPolarHBondContact O-CB 3.49Å; L81-Y85 PolarHBondContact O-N 2.99Å; T82-Y85 PolarHBondContact O-N 3.14Å; I83-Y85 VanDerWaalsContact C-N 3.33Å; I83-Y85 PolarHBondContact O-N 2.86Å; Y85-H87 PolarHBondContact O-N 2.71Å; Y85-M88 PolarHBondContact O-N 3.4Å; Y85-R89 PolarHBondContact O-N 3.46Å
86	L	97.4	Very high	94.7	Very high	73 Å²	73	52.4 Å²	52.4	38%	0.382	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-40.3	177.4	-67.8	175.2	0	0	0	111.9	T82 I83 R89 T90	T82-L86 HydrophobicContact CG2-CD1 4.23Å; T82-L86 WeakPolarHBondContact O-CG 3.23Å; T82-L86 PolarHBondContact O-N 3.29Å; I83-L86 PolarHBondContact O-N 3.13Å; L86-R89 PolarHBondContact O-N 3.19Å; L86-T90 PolarHBondContact O-N 2.98Å; L86-T90 PolarHBondContact O-OG1 3.21Å
87	H	96.5	Very high	94.1	Very high	89 Å²	89	53.5 Å²	53.5	41%	0.412	27%	0.272	S	S	.	.	H	α-helix	trans	-64.9	-41.6	173.4	-74	-172	0	0	0	111.6	I83 S84 Y85 R89 T90 F91 L150	I83-H87 WeakPolarHBondContact O-CB 3.44Å; I83-H87 PolarHBondContact O-N 2.96Å; S84-H87 PolarHBondContact O-N 3.42Å; Y85-H87 PolarHBondContact O-N 2.71Å; H87-R89 PolarHBondContact O-N 3.06Å; H87-T90 WeakPolarHBondContact O-CB 3.43Å; H87-T90 PolarHBondContact O-N 3.13Å; H87-F91 VanDerWaalsContact O-CB 3.32Å; H87-F91 WeakPolarHBondContact O-CB 3.37Å; H87-F91 PolarHBondContact O-N 2.91Å; H87-L150 HydrophobicContact CB-CD2 3.67Å
88	M	95.8	Very high	93.6	Very high	30 Å²	30	56.6 Å²	56.6	15%	0.148	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-41.7	176.7	-173.3	58.9	-153.3	0	0	111.6	S84 Y85 T90 F91 A92 W99 V142 L150	S84-M88 VanDerWaalsContact O-CB 3.24Å; S84-M88 WeakPolarHBondContact O-CB 3.48Å; S84-M88 PolarHBondContact O-N 2.99Å; Y85-M88 PolarHBondContact O-N 3.4Å; M88-T90 VanDerWaalsContact C-N 3.32Å; M88-T90 PolarHBondContact O-N 3.45Å; M88-F91 HydrophobicContact CE-CD1 4.21Å; M88-F91 WeakPolarHBondContact O-CB 3.47Å; M88-F91 PolarHBondContact O-N 2.98Å; M88-F91 HydrophobicContact SD-CD1 4.37Å; M88-A92 VanDerWaalsContact O-CB 3.29Å; M88-A92 WeakPolarHBondContact O-CB 3.42Å; M88-A92 PolarHBondContact O-N 3.27Å; M88-W99 HydrophobicContact CE-CE3 3.99Å; M88-W99 HydrophobicContact CE-CH2 4.26Å; M88-W99 HydrophobicContact CE-CZ3 3.33Å; M88-V142 HydrophobicContact CE-CB 4.48Å; M88-V142 HydrophobicContact CE-CG1 4.45Å; M88-V142 HydrophobicContact CE-CG2 4.07Å; M88-V142 HydrophobicContact SD-CB 4.2Å; M88-V142 HydrophobicContact SD-CG1 4.1Å; M88-V142 HydrophobicContact SD-CG2 4.41Å; M88-L150 HydrophobicContact CB-CB 4.2Å; M88-L150 HydrophobicContact SD-CB 3.67Å
89	R	94.4	Very high	93.1	Very high	150 Å²	150	61.8 Å²	61.8	57%	0.566	31%	0.311	S	S	*	.	H	α-helix	trans	-62.2	-40.8	174.8	-168.7	172.7	70.6	-179.4	3.3	111.8	Y85 L86 H87 A92 S93	Y85-R89 PolarHBondContact O-N 3.46Å; L86-R89 PolarHBondContact O-N 3.19Å; H87-R89 PolarHBondContact O-N 3.06Å; R89-A92 PolarHBondContact O-N 2.78Å; R89-S93 PolarHBondContact O-N 3.24Å; R89-S93 PolarHBondContact O-OG 3.49Å
90	T	93	Very high	91.7	Very high	60 Å²	60	62.7 Å²	62.7	37%	0.368	32%	0.324	S	S	.	.	H	α-helix	trans	-66.8	-41	175	-55.1	0	0	0	0	111.6	L86 H87 M88 A92 S93 Q94	L86-T90 PolarHBondContact O-N 2.98Å; L86-T90 PolarHBondContact O-OG1 3.21Å; H87-T90 WeakPolarHBondContact O-CB 3.43Å; H87-T90 PolarHBondContact O-N 3.13Å; M88-T90 VanDerWaalsContact C-N 3.32Å; M88-T90 PolarHBondContact O-N 3.45Å; T90-A92 VanDerWaalsContact C-N 3.34Å; T90-S93 PolarHBondContact O-N 3.26Å; T90-S93 PolarHBondContact O-OG 2.93Å; T90-Q94 HydrophobicContact CG2-CG 4.26Å; T90-Q94 WeakPolarHBondContact O-CB 3.48Å; T90-Q94 WeakPolarHBondContact O-CG 3.37Å; T90-Q94 PolarHBondContact O-N 2.9Å
91	F	93.9	Very high	89.7	Confident	8 Å²	8	64 Å²	64	4%	0.035	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-43.8	175.9	-176.5	-86.8	0	0	0	111.2	H87 M88 G95 W99 V142 L150 R265 M282 V285	H87-F91 VanDerWaalsContact O-CB 3.32Å; H87-F91 WeakPolarHBondContact O-CB 3.37Å; H87-F91 PolarHBondContact O-N 2.91Å; M88-F91 HydrophobicContact CE-CD1 4.21Å; M88-F91 WeakPolarHBondContact O-CB 3.47Å; M88-F91 PolarHBondContact O-N 2.98Å; M88-F91 HydrophobicContact SD-CD1 4.37Å; F91-G95 PolarHBondContact O-N 2.97Å; F91-W99 HydrophobicContact CE1-CH2 4.16Å; F91-V142 HydrophobicContact CD1-CG1 3.87Å; F91-V142 HydrophobicContact CE1-CG1 3.45Å; F91-V142 VanDerWaalsContact CE1-CG1 3.45Å; F91-V142 HydrophobicContact CE2-CG1 4.21Å; F91-V142 HydrophobicContact CG-CG1 4.42Å; F91-V142 HydrophobicContact CZ-CG1 3.64Å; F91-L150 HydrophobicContact CB-CD1 3.84Å; F91-L150 HydrophobicContact CD2-CD1 3.76Å; F91-L150 HydrophobicContact CE2-CD1 4.49Å; F91-L150 HydrophobicContact CG-CD1 3.87Å; F91-R265 HydrophobicContact CE1-CB 4.32Å; F91-R265 HydrophobicContact CE2-CB 4.42Å; F91-R265 HydrophobicContact CZ-CB 3.7Å; F91-R265 HydrophobicContact CZ-CG 4.28Å; F91-R265 PolarHBondContact O-NH1 2.84Å; F91-R265 VanDerWaalsContact O-NH1 3.09Å; F91-M282 HydrophobicContact CB-CE 4.42Å; F91-M282 HydrophobicContact CD2-CB 3.91Å; F91-M282 HydrophobicContact CD2-CE 3.99Å; F91-M282 HydrophobicContact CE2-CB 3.6Å; F91-M282 HydrophobicContact CG-CE 4.29Å; F91-V285 HydrophobicContact CE1-CG2 3.62Å; F91-V285 HydrophobicContact CZ-CG2 3.69Å
92	A	92.9	Very high	87.5	Confident	17 Å²	17	70.8 Å²	70.8	14%	0.14	38%	0.376	C	S	.	.	H	α-helix	trans	-61.5	-46.1	177.4	0	0	0	0	0	112.6	M88 R89 T90 W99 R265	M88-A92 VanDerWaalsContact O-CB 3.29Å; M88-A92 WeakPolarHBondContact O-CB 3.42Å; M88-A92 PolarHBondContact O-N 3.27Å; R89-A92 PolarHBondContact O-N 2.78Å; T90-A92 VanDerWaalsContact C-N 3.34Å; A92-W99 HydrophobicContact CB-CB 4.19Å; A92-W99 HydrophobicContact CB-CE3 4.08Å; A92-W99 PolarHBondContact O-N 2.82Å; A92-R265 PolarHBondContact O-NH2 3.42Å
93	S	90.9	Very high	85.1	Confident	68 Å²	68	77.3 Å²	77.3	48%	0.476	41%	0.409	S	S	.	.	H	α-helix	trans	-79.3	-30.8	-175	64.9	0	0	0	0	114.5	R89 T90 P98	R89-S93 PolarHBondContact O-N 3.24Å; R89-S93 PolarHBondContact O-OG 3.49Å; T90-S93 PolarHBondContact O-N 3.26Å; T90-S93 PolarHBondContact O-OG 2.93Å; S93-P98 WeakPolarHBondContact O-CB 3.31Å
94	Q	89.8	Confident	82.4	Confident	79 Å²	79	81 Å²	81	37%	0.369	43%	0.425	S	S	.	.	H	α-helix	trans	-92.4	-20.9	-175.1	-66.9	-176.3	10.6	0	0	114.6	T90 R267 M282	T90-Q94 HydrophobicContact CG2-CG 4.26Å; T90-Q94 WeakPolarHBondContact O-CB 3.48Å; T90-Q94 WeakPolarHBondContact O-CG 3.37Å; T90-Q94 PolarHBondContact O-N 2.9Å; Q94-R267 WeakPolarHBondContact O-CB 3.29Å; Q94-M282 HydrophobicContact CB-CE 3.78Å
95	G	85.5	Confident	79.8	Confident	1 Å²	1	83.8 Å²	83.8	1%	0.01	45%	0.454	C	S	.	.	S	Bend	trans	-73.8	160.1	179	0	0	0	0	0	112	F91 P97 P98 R265 M282	F91-G95 PolarHBondContact O-N 2.97Å; G95-P97 CarbonylContact C-O 3.54Å; G95-P97 CarbonylContact O-C 3.59Å; G95-P97 VanDerWaalsContact O-O 3.06Å; G95-P98 VanDerWaalsContact O-CA 3.27Å; G95-P98 WeakPolarHBondContact O-CA 3.33Å; G95-P98 WeakPolarHBondContact O-CD 3.06Å; G95-R265 PolarHBondContact O-NH2 3.13Å; G95-M282 VanDerWaalsContact CA-SD 3.55Å
96	D	79.6	Confident	76.9	Confident	86 Å²	86	85.9 Å²	85.9	46%	0.46	47%	0.472	S	S	.	.	S	Bend	trans	-104.5	123.2	-176.8	-173.3	22	0	0	0	111.5	C266 P268	D96-C266 PolarHBondContact N-O 3.14Å; D96-P268 HydrophobicContact CB-CG 4.27Å
97	P	84.6	Confident	74.3	Confident	90 Å²	90	89.1 Å²	89.1	58%	0.584	49%	0.49	S	S	*	.	S	Bend	cis	-69.3	157.3	-14.1	31.3	-35.2	0	0	0	111.5	G95 R265	G95-P97 CarbonylContact C-O 3.54Å; G95-P97 CarbonylContact O-C 3.59Å; G95-P97 VanDerWaalsContact O-O 3.06Å; P97-R265 PolarHBondContact O-NH2 2.96Å
98	P	86.6	Confident	71.7	Confident	78 Å²	78	92.5 Å²	92.5	51%	0.506	51%	0.511	S	S	.	.			trans	-59.2	139	171.8	-25.8	35.4	0	0	0	110.7	S93 G95 S100	S93-P98 WeakPolarHBondContact O-CB 3.31Å; G95-P98 VanDerWaalsContact O-CA 3.27Å; G95-P98 WeakPolarHBondContact O-CA 3.33Å; G95-P98 WeakPolarHBondContact O-CD 3.06Å; P98-S100 PolarHBondContact O-N 3.33Å; P98-S100 VanDerWaalsContact O-N 3.1Å
99	W	88.3	Confident	69.1	Low	113 Å²	113	95.8 Å²	95.8	43%	0.428	54%	0.536	S	S	.	.			trans	-83.3	86.7	172.4	-60.9	-12.7	0	0	0	107.7	M88 F91 A92 V142 R265 V285	M88-W99 HydrophobicContact CE-CE3 3.99Å; M88-W99 HydrophobicContact CE-CH2 4.26Å; M88-W99 HydrophobicContact CE-CZ3 3.33Å; F91-W99 HydrophobicContact CE1-CH2 4.16Å; A92-W99 HydrophobicContact CB-CB 4.19Å; A92-W99 HydrophobicContact CB-CE3 4.08Å; A92-W99 PolarHBondContact O-N 2.82Å; W99-V142 HydrophobicContact CH2-CG2 4.29Å; W99-R265 VanDerWaalsContact CD1-NH2 3.32Å; W99-R265 VanDerWaalsContact CZ2-NH1 3.31Å; W99-V285 HydrophobicContact CH2-CG1 4.03Å; W99-V285 HydrophobicContact CH2-CG2 3.91Å; W99-V285 HydrophobicContact CZ2-CG1 4.22Å; W99-V285 HydrophobicContact CZ2-CG2 4.05Å
100	S	67.9	Low	66.6	Low	89 Å²	89	93.8 Å²	93.8	62%	0.622	54%	0.544	S	S	*	.			trans	-72.1	136.6	172.2	50.3	0	0	0	0	109.8	P98 L102	P98-S100 PolarHBondContact O-N 3.33Å; P98-S100 VanDerWaalsContact O-N 3.1Å; S100-L102 PolarHBondContact O-N 3.21Å
101	P	56.6	Low	64.1	Low	90 Å²	90	100.5 Å²	100.5	58%	0.584	57%	0.569	S	S	*	*			trans	-54.9	127.3	162.3	-17.5	29.8	0	0	0	108	L103 E104	P101-L103 PolarHBondContact O-N 3.03Å; P101-E104 PolarHBondContact O-N 3.33Å
102	L	51.9	Low	61.5	Low	151 Å²	151	105.5 Å²	105.5	79%	0.791	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-11.8	178.6	-82.7	148.1	0	0	0	114	S100	S100-L102 PolarHBondContact O-N 3.21Å
103	L	47.6	Very low	59	Low	164 Å²	164	116.3 Å²	116.3	86%	0.859	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-20.8	-178	-89.9	90.5	0	0	0	115.6	P101 G105	P101-L103 PolarHBondContact O-N 3.03Å; L103-G105 PolarHBondContact O-N 3.49Å
104	E	42.2	Very low	57	Low	159 Å²	159	121.6 Å²	121.6	74%	0.743	65%	0.646	S	S	*	*	S	Bend	trans	-99.6	93.8	-179.9	-74.3	-175	172	0	0	109.6	P101 D106	P101-E104 PolarHBondContact O-N 3.33Å; E104-D106 VanDerWaalsContact C-N 3.29Å; E104-D106 PolarHBondContact O-N 2.97Å
105	G	43.3	Very low	54.9	Low	63 Å²	63	122.9 Å²	122.9	65%	0.649	66%	0.664	S	S	*	*			trans	-61.7	90.5	170.6	0	0	0	0	0	110.5	L103	L103-G105 PolarHBondContact O-N 3.49Å
106	D	36.8	Very low	53.2	Low	146 Å²	146	128.7 Å²	128.7	78%	0.781	70%	0.7	S	S	*	*			trans	-110	127.8	162	-115.5	-13.1	0	0	0	109.9	E104 N108	E104-D106 VanDerWaalsContact C-N 3.29Å; E104-D106 PolarHBondContact O-N 2.97Å; D106-N108 PolarHBondContact O-N 3.36Å
107	N	43.1	Very low	52.1	Low	140 Å²	140	130.7 Å²	130.7	75%	0.749	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	22.9	-165.5	-73.4	-39.2	0	0	0	115.3
108	N	41.5	Very low	51.2	Low	161 Å²	161	129.3 Å²	129.3	86%	0.861	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	7.5	-172.4	-108.8	18.2	0	0	0	115.9	D106 S110	D106-N108 PolarHBondContact O-N 3.36Å; N108-S110 PolarHBondContact O-N 2.93Å
109	C	41.4	Very low	50.1	Low	99 Å²	99	132.6 Å²	132.6	67%	0.669	71%	0.711	S	S	*	*			trans	-97.9	72.9	163.9	-163.5	0	0	0	0	110.3	K111	C109-K111 PolarHBondContact O-N 3.16Å
110	S	40.3	Very low	48.9	Very low	107 Å²	107	129.4 Å²	129.4	75%	0.748	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	77.1	169.5	60.6	0	0	0	0	109.9	N108	N108-S110 PolarHBondContact O-N 2.93Å
111	K	41.1	Very low	48.8	Very low	202 Å²	202	127.7 Å²	127.7	88%	0.878	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-175	-2.5	156.4	-104.3	162.1	-166.3	-173.2	0	117	C109	C109-K111 PolarHBondContact O-N 3.16Å
112	V	40.6	Very low	49.3	Very low	112 Å²	112	126.8 Å²	126.8	68%	0.679	69%	0.685	S	S	*	*			trans	-108.1	91.2	171	-170.8	0	0	0	0	109	R114	V112-R114 PolarHBondContact O-N 3.04Å
113	R	39.8	Very low	50.2	Low	245 Å²	245	126.4 Å²	126.4	93%	0.925	68%	0.68	S	S	*	*			trans	-61.2	101	173.8	-166	178.2	176.6	-171.5	-1.5	107.9	S115	R113-S115 PolarHBondContact O-N 2.92Å; R113-S115 VanDerWaalsContact O-N 3.14Å
114	R	49.5	Very low	51.3	Low	178 Å²	178	125.1 Å²	125.1	67%	0.672	67%	0.668	S	S	*	*			trans	-61.1	112.8	176.7	-76.6	-174	-121.7	115.2	1.4	109.4	V112	V112-R114 PolarHBondContact O-N 3.04Å
115	S	45.6	Very low	52.9	Low	106 Å²	106	122.3 Å²	122.3	74%	0.741	66%	0.655	S	S	*	*			trans	-80.3	132.9	164.5	-172.3	0	0	0	0	108.1	R113	R113-S115 PolarHBondContact O-N 2.92Å; R113-S115 VanDerWaalsContact O-N 3.14Å
116	T	49	Very low	54.6	Low	124 Å²	124	126.6 Å²	126.6	76%	0.761	66%	0.658	S	S	*	*			trans	-1.7	113.7	171.6	46.2	0	0	0	0	117	S118	T116-S118 PolarHBondContact O-N 3.49Å
117	H	56.2	Low	56.7	Low	128 Å²	128	124.7 Å²	124.7	59%	0.593	64%	0.644	S	S	*	*			trans	-56	118.7	170.1	-79.7	-96.8	0	0	0	110.5
118	S	66.4	Low	58.8	Low	60 Å²	60	121.4 Å²	121.4	42%	0.42	63%	0.626	S	S	.	*			trans	-98.2	144.9	174.9	166.4	0	0	0	0	109.2	T116 A120 T121 D122	T116-S118 PolarHBondContact O-N 3.49Å; S118-A120 PolarHBondContact O-N 2.95Å; S118-A120 VanDerWaalsContact O-N 3.07Å; S118-A120 PolarHBondContact OG-N 3.1Å; S118-T121 WeakPolarHBondContact O-CA 3.29Å; S118-T121 WeakPolarHBondContact O-CB 3.2Å; S118-T121 PolarHBondContact O-N 2.88Å; S118-T121 PolarHBondContact O-OG1 3.05Å; S118-D122 PolarHBondContact O-N 2.92Å
119	L	63	Low	60.9	Low	147 Å²	147	116 Å²	116	77%	0.77	61%	0.608	S	S	*	*	H	α-helix	trans	-53.2	-27.9	171.7	-72.4	165.8	0	0	0	112.8	M123	L119-M123 PolarHBondContact O-N 3.46Å
120	A	62.5	Low	63.2	Low	47 Å²	47	113.4 Å²	113.4	39%	0.388	59%	0.594	S	S	.	*	H	α-helix	trans	-66.4	-38.2	174.1	0	0	0	0	0	111.8	S118 D122 M123 F124	S118-A120 PolarHBondContact O-N 2.95Å; S118-A120 VanDerWaalsContact O-N 3.07Å; S118-A120 PolarHBondContact OG-N 3.1Å; A120-D122 VanDerWaalsContact C-N 3.34Å; A120-D122 PolarHBondContact O-N 3.1Å; A120-M123 PolarHBondContact O-N 3.41Å; A120-F124 WeakPolarHBondContact O-CD2 3.39Å; A120-F124 PolarHBondContact O-N 2.91Å
121	T	66.2	Low	65.5	Low	53 Å²	53	112.1 Å²	112.1	33%	0.325	58%	0.576	S	S	.	*	H	α-helix	trans	-61.3	-44.4	177.7	-50.7	0	0	0	0	110.6	S118 M123 F124 E125	S118-T121 WeakPolarHBondContact O-CA 3.29Å; S118-T121 WeakPolarHBondContact O-CB 3.2Å; S118-T121 PolarHBondContact O-N 2.88Å; S118-T121 PolarHBondContact O-OG1 3.05Å; T121-M123 VanDerWaalsContact C-N 3.33Å; T121-M123 PolarHBondContact O-N 2.79Å; T121-F124 PolarHBondContact O-N 2.78Å; T121-E125 HydrophobicContact CG2-CG 4.15Å; T121-E125 VanDerWaalsContact CG2-OE1 3.29Å; T121-E125 WeakPolarHBondContact CG2-OE1 3.37Å; T121-E125 WeakPolarHBondContact O-CB 3.4Å; T121-E125 VanDerWaalsContact O-CG 3.27Å; T121-E125 WeakPolarHBondContact O-CG 3.33Å; T121-E125 PolarHBondContact O-N 3.34Å
122	D	68	Low	68	Low	71 Å²	71	107.1 Å²	107.1	38%	0.38	56%	0.559	S	S	.	*	H	α-helix	trans	-64.1	-35.2	-179.8	-63.3	-15.5	0	0	0	112.7	S118 A120 Q126	S118-D122 PolarHBondContact O-N 2.92Å; A120-D122 VanDerWaalsContact C-N 3.34Å; A120-D122 PolarHBondContact O-N 3.1Å; D122-Q126 WeakPolarHBondContact O-CG 3.46Å
123	M	69.8	Low	70.5	Confident	142 Å²	142	103 Å²	103	70%	0.7	53%	0.533	S	S	*	.	H	α-helix	trans	-70.4	-41.1	177.4	-71.2	-173.8	68	0	0	113	L119 A120 T121	L119-M123 PolarHBondContact O-N 3.46Å; A120-M123 PolarHBondContact O-N 3.41Å; T121-M123 VanDerWaalsContact C-N 3.33Å; T121-M123 PolarHBondContact O-N 2.79Å
124	F	71.1	Confident	73	Confident	138 Å²	138	98.6 Å²	98.6	61%	0.605	52%	0.523	S	S	*	.	H	α-helix	trans	-78	-29.5	-179.8	-71.3	-66.8	0	0	0	112.7	A120 T121 L128	A120-F124 WeakPolarHBondContact O-CD2 3.39Å; A120-F124 PolarHBondContact O-N 2.91Å; T121-F124 PolarHBondContact O-N 2.78Å; F124-L128 WeakPolarHBondContact O-CA 3.42Å; F124-L128 PolarHBondContact O-N 3.09Å; F124-L128 VanDerWaalsContact O-N 3.15Å
125	E	77	Confident	75.1	Confident	100 Å²	100	95 Å²	95	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-67.6	-37.1	-179.8	-80.9	-175.5	178.1	0	0	112.9	T121 H127 L128	T121-E125 HydrophobicContact CG2-CG 4.15Å; T121-E125 VanDerWaalsContact CG2-OE1 3.29Å; T121-E125 WeakPolarHBondContact CG2-OE1 3.37Å; T121-E125 WeakPolarHBondContact O-CB 3.4Å; T121-E125 VanDerWaalsContact O-CG 3.27Å; T121-E125 WeakPolarHBondContact O-CG 3.33Å; T121-E125 PolarHBondContact O-N 3.34Å; E125-H127 VanDerWaalsContact C-N 3.26Å; E125-H127 PolarHBondContact O-N 2.81Å; E125-L128 WeakPolarHBondContact O-CB 3.48Å; E125-L128 PolarHBondContact O-N 2.78Å
126	Q	76.9	Confident	77.3	Confident	153 Å²	153	92.3 Å²	92.3	72%	0.715	50%	0.502	S	S	*	.	H	α-helix	trans	-60	-34.3	-178.8	-74.6	179.5	1	0	0	113.6	D122	D122-Q126 WeakPolarHBondContact O-CG 3.46Å
127	H	82.8	Confident	79.3	Confident	105 Å²	105	91.7 Å²	91.7	49%	0.486	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	14.3	-176.3	-57.7	90.1	0	0	0	112.7	E125 G129 A130 H131	E125-H127 VanDerWaalsContact C-N 3.26Å; E125-H127 PolarHBondContact O-N 2.81Å; H127-G129 VanDerWaalsContact C-N 3.28Å; H127-G129 PolarHBondContact O-N 3.15Å; H127-A130 PolarHBondContact O-N 3.22Å; H127-H131 PolarHBondContact O-CD2 2.88Å; H127-H131 PolarHBondContact O-N 3.2Å
128	L	85.9	Confident	81.2	Confident	71 Å²	71	85.7 Å²	85.7	37%	0.372	47%	0.466	S	S	.	.	H	α-helix	trans	-53.8	-44.5	-173.4	-178.5	61.6	0	0	0	112.2	F124 E125 A130 H131 L132	F124-L128 WeakPolarHBondContact O-CA 3.42Å; F124-L128 PolarHBondContact O-N 3.09Å; F124-L128 VanDerWaalsContact O-N 3.15Å; E125-L128 WeakPolarHBondContact O-CB 3.48Å; E125-L128 PolarHBondContact O-N 2.78Å; L128-A130 VanDerWaalsContact C-N 3.34Å; L128-A130 PolarHBondContact O-N 3.03Å; L128-H131 PolarHBondContact O-N 2.82Å; L128-L132 HydrophobicContact CD1-CD1 4.32Å; L128-L132 HydrophobicContact CD1-CG 4.13Å; L128-L132 HydrophobicContact CG-CD1 3.99Å; L128-L132 HydrophobicContact CG-CG 4.27Å; L128-L132 WeakPolarHBondContact O-CB 3.21Å; L128-L132 VanDerWaalsContact O-CG 3.23Å; L128-L132 WeakPolarHBondContact O-CG 3.39Å; L128-L132 PolarHBondContact O-N 3.4Å
129	G	86.8	Confident	82.6	Confident	47 Å²	47	82.8 Å²	82.8	49%	0.485	45%	0.446	S	S	.	.	H	α-helix	trans	-58.9	-42.3	178.9	0	0	0	0	0	113.2	H127 L133	H127-G129 VanDerWaalsContact C-N 3.28Å; H127-G129 PolarHBondContact O-N 3.15Å; G129-L133 WeakPolarHBondContact O-CG 3.23Å; G129-L133 PolarHBondContact O-N 2.86Å; G129-L133 VanDerWaalsContact O-N 3.15Å
130	A	88	Confident	84.3	Confident	45 Å²	45	77.3 Å²	77.3	37%	0.372	42%	0.419	S	S	.	.	H	α-helix	trans	-68.7	-44.1	177.3	0	0	0	0	0	111.3	H127 L128 L132 L133 Q134	H127-A130 PolarHBondContact O-N 3.22Å; L128-A130 VanDerWaalsContact C-N 3.34Å; L128-A130 PolarHBondContact O-N 3.03Å; A130-L132 VanDerWaalsContact C-N 3.34Å; A130-L132 PolarHBondContact O-N 2.9Å; A130-L133 PolarHBondContact O-N 3.16Å; A130-Q134 WeakPolarHBondContact O-CB 3.42Å; A130-Q134 VanDerWaalsContact O-CG 3.25Å; A130-Q134 WeakPolarHBondContact O-CG 3.36Å; A130-Q134 PolarHBondContact O-N 2.87Å
131	H	90.4	Very high	86	Confident	80 Å²	80	75.1 Å²	75.1	37%	0.37	40%	0.401	S	S	.	.	H	α-helix	trans	-61.9	-40.9	177.2	-69.4	-46.3	0	0	0	112.5	H127 L128 S135	H127-H131 PolarHBondContact O-CD2 2.88Å; H127-H131 PolarHBondContact O-N 3.2Å; L128-H131 PolarHBondContact O-N 2.82Å; H131-S135 WeakPolarHBondContact O-CB 3.16Å; H131-S135 PolarHBondContact O-N 3.18Å; H131-S135 PolarHBondContact O-OG 2.93Å
132	L	92.3	Very high	87.5	Confident	97 Å²	97	72.7 Å²	72.7	51%	0.508	39%	0.386	S	S	.	.	H	α-helix	trans	-59.8	-50.8	175	-73.2	172.8	0	0	0	110.9	L128 A130 S135 L136	L128-L132 HydrophobicContact CD1-CD1 4.32Å; L128-L132 HydrophobicContact CD1-CG 4.13Å; L128-L132 HydrophobicContact CG-CD1 3.99Å; L128-L132 HydrophobicContact CG-CG 4.27Å; L128-L132 WeakPolarHBondContact O-CB 3.21Å; L128-L132 VanDerWaalsContact O-CG 3.23Å; L128-L132 WeakPolarHBondContact O-CG 3.39Å; L128-L132 PolarHBondContact O-N 3.4Å; A130-L132 VanDerWaalsContact C-N 3.34Å; A130-L132 PolarHBondContact O-N 2.9Å; L132-S135 PolarHBondContact O-N 3.48Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.01Å; L132-L136 PolarHBondContact O-N 3.08Å
133	L	94	Very high	88.9	Confident	27 Å²	27	69.3 Å²	69.3	14%	0.141	37%	0.368	C	S	.	.	H	α-helix	trans	-67.9	-36.4	-178.4	-67.8	-179	0	0	0	113	G129 A130 S135 V140 T155	G129-L133 WeakPolarHBondContact O-CG 3.23Å; G129-L133 PolarHBondContact O-N 2.86Å; G129-L133 VanDerWaalsContact O-N 3.15Å; A130-L133 PolarHBondContact O-N 3.16Å; L133-S135 VanDerWaalsContact C-N 3.34Å; L133-V140 HydrophobicContact CD2-CG2 4.04Å; L133-T155 HydrophobicContact CB-CG2 4.1Å
134	Q	91.8	Very high	90.1	Very high	151 Å²	151	63.1 Å²	63.1	71%	0.706	34%	0.338	S	S	*	.	H	α-helix	trans	-73	-26.6	178.3	-73.3	175.1	-4.6	0	0	113.3	A130	A130-Q134 WeakPolarHBondContact O-CB 3.42Å; A130-Q134 VanDerWaalsContact O-CG 3.25Å; A130-Q134 WeakPolarHBondContact O-CG 3.36Å; A130-Q134 PolarHBondContact O-N 2.87Å
135	S	93.2	Very high	91	Very high	103 Å²	103	60.7 Å²	60.7	72%	0.72	33%	0.329	S	S	*	.	H	α-helix	trans	-85.5	-18.3	-179.7	-59.7	0	0	0	0	112.6	H131 L132 L133	H131-S135 WeakPolarHBondContact O-CB 3.16Å; H131-S135 PolarHBondContact O-N 3.18Å; H131-S135 PolarHBondContact O-OG 2.93Å; L132-S135 PolarHBondContact O-N 3.48Å; L133-S135 VanDerWaalsContact C-N 3.34Å
136	L	92.8	Very high	91.7	Very high	50 Å²	50	60.9 Å²	60.9	26%	0.262	33%	0.33	S	S	.	.	S	Bend	trans	-79.3	129.6	175.6	-73.8	169.1	0	0	0	110.6	L132 G138 V140 L287	L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.01Å; L132-L136 PolarHBondContact O-N 3.08Å; L136-G138 PolarHBondContact O-N 3.21Å; L136-V140 HydrophobicContact CD1-CG2 3.68Å; L136-L287 HydrophobicContact CD1-CD2 3.9Å; L136-L287 HydrophobicContact CD2-CD2 4.06Å
137	D	90.8	Very high	92.5	Very high	111 Å²	111	53.6 Å²	53.6	59%	0.594	30%	0.296	S	S	*	.	S	Bend	trans	-83	54.3	171.5	-166.4	22.1	0	0	0	111.9	Y159 H289	D137-Y159 VanDerWaalsContact CA-OH 3.3Å; D137-Y159 WeakPolarHBondContact CA-OH 3.35Å; D137-Y159 PolarHBondContact OD1-OH 2.83Å; D137-H289 PolarHBondContact O-CD2 3.33Å
138	G	94.9	Very high	93.2	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.01	29%	0.294	C	S	.	.	S	Bend	trans	176.5	-155.9	-176.2	0	0	0	0	0	113.8	L136 T155 Y159 A288	L136-G138 PolarHBondContact O-N 3.21Å; G138-T155 PolarHBondContact O-OG1 3.13Å; G138-Y159 VanDerWaalsContact C-CE2 3.45Å; G138-Y159 VanDerWaalsContact CA-CE2 3.44Å; G138-Y159 VanDerWaalsContact N-CZ 3.28Å; G138-Y159 PolarHBondContact N-OH 2.93Å; G138-Y159 VanDerWaalsContact N-OH 3.08Å; G138-Y159 WeakPolarHBondContact O-CE2 3.37Å; G138-A288 CarbonylContact C-O 2.93Å; G138-A288 WeakPolarHBondContact CA-O 3.25Å
139	F	97.6	Very high	93.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	147.7	176.7	59.4	-87.4	0	0	0	111.4	F141 I152 S153 T155 V156 Y159 L160 M239 I258 A288	F139-F141 HydrophobicContact CD2-CD1 4.13Å; F139-F141 AromaticContact CE2-CD1 3.96Å; F139-F141 HydrophobicContact CE2-CD1 3.96Å; F139-F141 HydrophobicContact CE2-CE1 4.47Å; F139-I152 HydrophobicContact CD2-CD1 3.93Å; F139-I152 HydrophobicContact CD2-CG1 4.14Å; F139-I152 HydrophobicContact CE2-CD1 4Å; F139-S153 WeakPolarHBondContact CA-OG 3.18Å; F139-S153 VanDerWaalsContact CB-OG 3.31Å; F139-S153 WeakPolarHBondContact CB-OG 3.34Å; F139-T155 WeakPolarHBondContact CA-OG1 3.37Å; F139-T155 WeakPolarHBondContact CB-OG1 3.36Å; F139-V156 HydrophobicContact CB-CB 4.09Å; F139-V156 HydrophobicContact CD1-CB 4.38Å; F139-V156 HydrophobicContact CD1-CG2 4.21Å; F139-V156 HydrophobicContact CD2-CB 4.12Å; F139-V156 HydrophobicContact CD2-CG2 3.97Å; F139-V156 HydrophobicContact CE1-CG2 4.28Å; F139-V156 HydrophobicContact CE2-CG2 4.04Å; F139-V156 HydrophobicContact CG-CB 3.95Å; F139-V156 HydrophobicContact CG-CG2 4.05Å; F139-V156 HydrophobicContact CZ-CG2 4.19Å; F139-Y159 HydrophobicContact CD1-CD2 4.14Å; F139-Y159 HydrophobicContact CD1-CG 4.35Å; F139-L160 HydrophobicContact CE1-CD1 4.09Å; F139-L160 HydrophobicContact CE1-CG 4.2Å; F139-L160 HydrophobicContact CZ-CD1 3.81Å; F139-L160 HydrophobicContact CZ-CG 4.42Å; F139-M239 HydrophobicContact CE2-SD 4.48Å; F139-M239 HydrophobicContact CZ-SD 4.06Å; F139-I258 HydrophobicContact CE1-CD1 4.41Å; F139-I258 HydrophobicContact CZ-CG2 4.23Å; F139-A288 HydrophobicContact CD1-CB 4.11Å; F139-A288 HydrophobicContact CD2-CB 3.82Å; F139-A288 HydrophobicContact CE1-CB 3.72Å; F139-A288 HydrophobicContact CE2-CB 3.4Å; F139-A288 HydrophobicContact CG-CB 4.17Å; F139-A288 HydrophobicContact CZ-CB 3.34Å; F139-A288 PolarHBondContact N-O 3Å; F139-A288 PolarHBondContact O-N 3.27Å
140	V	97.7	Very high	94.3	Very high	31 Å²	31	49.3 Å²	49.3	19%	0.188	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.2	177.3	-178.8	0	0	0	0	107.8	L133 L136 Y151 I152 S153 L287	L133-V140 HydrophobicContact CD2-CG2 4.04Å; L136-V140 HydrophobicContact CD1-CG2 3.68Å; V140-Y151 HydrophobicContact CB-CE1 4.31Å; V140-Y151 HydrophobicContact CG1-CE1 4.22Å; V140-I152 CarbonylContact O-C 3.4Å; V140-I152 WeakPolarHBondContact O-CA 3.38Å; V140-S153 PolarHBondContact N-OG 2.8Å; V140-S153 PolarHBondContact O-N 3.09Å; V140-L287 HydrophobicContact CG2-CD2 3.62Å
141	F	97.9	Very high	94.8	Very high	2 Å²	2	51 Å²	51	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	156.5	171.1	69.9	-84	0	0	0	112.5	F139 V143 F149 Y151 I152 V260 L284 A286 A288	F139-F141 HydrophobicContact CD2-CD1 4.13Å; F139-F141 AromaticContact CE2-CD1 3.96Å; F139-F141 HydrophobicContact CE2-CD1 3.96Å; F139-F141 HydrophobicContact CE2-CE1 4.47Å; F141-V143 HydrophobicContact CD2-CG2 3.4Å; F141-V143 VanDerWaalsContact CD2-CG2 3.4Å; F141-V143 HydrophobicContact CE2-CG2 3.46Å; F141-V143 VanDerWaalsContact CE2-CG2 3.46Å; F141-F149 HydrophobicContact CB-CD1 4.24Å; F141-F149 HydrophobicContact CB-CE1 4.16Å; F141-F149 HydrophobicContact CD2-CD1 4.16Å; F141-F149 AromaticContact CD2-CE1 3.74Å; F141-F149 HydrophobicContact CD2-CE1 3.74Å; F141-F149 HydrophobicContact CE2-CE1 4.44Å; F141-F149 HydrophobicContact CG-CE1 4.12Å; F141-Y151 CarbonylContact C-O 3.51Å; F141-Y151 VanDerWaalsContact CA-O 3.29Å; F141-Y151 WeakPolarHBondContact CA-O 3.14Å; F141-I152 HydrophobicContact CB-CB 4.05Å; F141-I152 HydrophobicContact CB-CD1 3.9Å; F141-I152 HydrophobicContact CB-CG1 3.89Å; F141-V260 HydrophobicContact CE1-CG1 4.11Å; F141-V260 HydrophobicContact CE1-CG2 4.39Å; F141-V260 HydrophobicContact CZ-CG1 3.73Å; F141-V260 HydrophobicContact CZ-CG2 4.25Å; F141-L284 HydrophobicContact CE2-CD2 4.16Å; F141-L284 HydrophobicContact CZ-CD2 4.34Å; F141-A286 HydrophobicContact CD1-CB 4.43Å; F141-A286 HydrophobicContact CE1-CB 3.79Å; F141-A286 HydrophobicContact CE2-CB 4.22Å; F141-A286 HydrophobicContact CZ-CB 3.69Å; F141-A286 PolarHBondContact N-O 3.49Å; F141-A286 PolarHBondContact O-N 2.91Å; F141-A288 HydrophobicContact CD1-CB 4.02Å; F141-A288 HydrophobicContact CE1-CB 3.68Å
142	V	97.8	Very high	95.2	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123	176.7	-178	0	0	0	0	107.9	M88 F91 W99 F149 L150 Y151 L284 V285	M88-V142 HydrophobicContact CE-CB 4.48Å; M88-V142 HydrophobicContact CE-CG1 4.45Å; M88-V142 HydrophobicContact CE-CG2 4.07Å; M88-V142 HydrophobicContact SD-CB 4.2Å; M88-V142 HydrophobicContact SD-CG1 4.1Å; M88-V142 HydrophobicContact SD-CG2 4.41Å; F91-V142 HydrophobicContact CD1-CG1 3.87Å; F91-V142 HydrophobicContact CE1-CG1 3.45Å; F91-V142 VanDerWaalsContact CE1-CG1 3.45Å; F91-V142 HydrophobicContact CE2-CG1 4.21Å; F91-V142 HydrophobicContact CG-CG1 4.42Å; F91-V142 HydrophobicContact CZ-CG1 3.64Å; W99-V142 HydrophobicContact CH2-CG2 4.29Å; V142-F149 CarbonylContact O-C 3.5Å; V142-F149 WeakPolarHBondContact O-CA 3.46Å; V142-L150 HydrophobicContact CB-CB 4.43Å; V142-L150 HydrophobicContact CG1-CB 4.2Å; V142-L150 HydrophobicContact CG1-CD1 4.33Å; V142-L150 PolarHBondContact O-N 2.8Å; V142-Y151 HydrophobicContact CG2-CD1 4.37Å; V142-Y151 PolarHBondContact N-O 3.46Å; V142-Y151 PolarHBondContact O-N 2.71Å; V142-L284 CarbonylContact C-O 3.58Å; V142-L284 VanDerWaalsContact CA-O 3.31Å; V142-L284 WeakPolarHBondContact CA-O 3.34Å; V142-V285 HydrophobicContact CG1-CG2 4.29Å; V142-V285 HydrophobicContact CG2-CG1 4.32Å; V142-V285 HydrophobicContact CG2-CG2 4.3Å
143	V	97.1	Very high	95.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	133.9	177.2	-168.6	0	0	0	0	108.7	F141 R148 F149 V172 L188 G283 L284	F141-V143 HydrophobicContact CD2-CG2 3.4Å; F141-V143 VanDerWaalsContact CD2-CG2 3.4Å; F141-V143 HydrophobicContact CE2-CG2 3.46Å; F141-V143 VanDerWaalsContact CE2-CG2 3.46Å; V143-R148 CarbonylContact C-O 3.56Å; V143-R148 VanDerWaalsContact CA-O 3.29Å; V143-R148 WeakPolarHBondContact CA-O 3.4Å; V143-F149 HydrophobicContact CG2-CD1 4.07Å; V143-F149 HydrophobicContact CG2-CE1 4.16Å; V143-V172 HydrophobicContact CG1-CB 4.33Å; V143-V172 HydrophobicContact CG1-CG1 4.25Å; V143-L188 HydrophobicContact CB-CD2 4.34Å; V143-L188 HydrophobicContact CG1-CD1 4.34Å; V143-L188 HydrophobicContact CG1-CD2 4.35Å; V143-G283 CarbonylContact O-C 3.51Å; V143-G283 WeakPolarHBondContact O-CA 3.14Å; V143-L284 PolarHBondContact N-O 3.3Å; V143-L284 PolarHBondContact O-N 2.96Å
144	S	94.7	Very high	95.5	Very high	12 Å²	12	46.9 Å²	46.9	8%	0.084	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	166.9	172	71.2	0	0	0	0	111.9	E146 G147 R148	S144-E146 PolarHBondContact O-N 2.94Å; S144-E146 PolarHBondContact OG-N 3.43Å; S144-G147 PolarHBondContact O-N 3.4Å; S144-R148 PolarHBondContact N-O 2.85Å; S144-R148 PolarHBondContact OG-N 3.45Å
145	Q	90.4	Very high	95.8	Very high	87 Å²	87	40.2 Å²	40.2	41%	0.407	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-17.3	168.9	66.6	-178.7	7.9	0	0	114.1	G147 I190 M282	Q145-G147 VanDerWaalsContact C-N 3.34Å; Q145-I190 WeakPolarHBondContact O-CD1 3.44Å; Q145-I190 VanDerWaalsContact O-CG1 3.3Å; Q145-I190 WeakPolarHBondContact O-CG1 3.35Å; Q145-M282 WeakPolarHBondContact CB-O 3.24Å; Q145-M282 PolarHBondContact N-O 3.25Å
146	E	91.4	Very high	95.9	Very high	103 Å²	103	35.3 Å²	35.3	48%	0.481	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-2.8	177.9	-63.5	160.4	-166	0	0	112.4	S144 R148	S144-E146 PolarHBondContact O-N 2.94Å; S144-E146 PolarHBondContact OG-N 3.43Å; E146-R148 IonicContact OE2-CZ 2.74Å; E146-R148 IonicContact OE2-NH1 2.71Å; E146-R148 PolarHBondContact OE2-NH1 2.87Å
147	G	94.4	Very high	96	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	81.4	19.7	-174.6	0	0	0	0	0	113.9	S144 Q145 S171 V172	S144-G147 PolarHBondContact O-N 3.4Å; Q145-G147 VanDerWaalsContact C-N 3.34Å; G147-S171 CarbonylContact O-C 3.56Å; G147-S171 WeakPolarHBondContact O-CA 3.33Å; G147-V172 WeakPolarHBondContact O-CB 3.48Å; G147-V172 VanDerWaalsContact O-CG1 3.3Å; G147-V172 WeakPolarHBondContact O-CG1 3.36Å; G147-V172 PolarHBondContact O-N 3.06Å
148	R	97.1	Very high	96.1	Very high	120 Å²	120	35.8 Å²	35.8	45%	0.453	17%	0.173	S	C	.	.	B	Isolated β-bridge	trans	-99	138.7	176.3	-68	-172.3	177.8	126.4	-9.4	112.5	V143 S144 E146 L150 S170	V143-R148 CarbonylContact C-O 3.56Å; V143-R148 VanDerWaalsContact CA-O 3.29Å; V143-R148 WeakPolarHBondContact CA-O 3.4Å; S144-R148 PolarHBondContact N-O 2.85Å; S144-R148 PolarHBondContact OG-N 3.45Å; E146-R148 IonicContact OE2-CZ 2.74Å; E146-R148 IonicContact OE2-NH1 2.71Å; E146-R148 PolarHBondContact OE2-NH1 2.87Å; R148-L150 PolarHBondContact O-N 2.82Å; R148-L150 VanDerWaalsContact O-N 3.16Å; R148-S170 WeakPolarHBondContact CA-O 3.21Å
149	F	98.5	Very high	96	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	112.8	172.4	-70.3	-71.9	0	0	0	110.7	F141 V142 V143 I152 L167 G169 S170 V172 Y175 M239	F141-F149 HydrophobicContact CB-CD1 4.24Å; F141-F149 HydrophobicContact CB-CE1 4.16Å; F141-F149 HydrophobicContact CD2-CD1 4.16Å; F141-F149 AromaticContact CD2-CE1 3.74Å; F141-F149 HydrophobicContact CD2-CE1 3.74Å; F141-F149 HydrophobicContact CE2-CE1 4.44Å; F141-F149 HydrophobicContact CG-CE1 4.12Å; V142-F149 CarbonylContact O-C 3.5Å; V142-F149 WeakPolarHBondContact O-CA 3.46Å; V143-F149 HydrophobicContact CG2-CD1 4.07Å; V143-F149 HydrophobicContact CG2-CE1 4.16Å; F149-I152 HydrophobicContact CD1-CB 4.47Å; F149-I152 HydrophobicContact CD1-CD1 4.2Å; F149-I152 HydrophobicContact CE1-CD1 3.86Å; F149-I152 HydrophobicContact CZ-CD1 4.3Å; F149-L167 WeakPolarHBondContact CB-O 3.35Å; F149-L167 HydrophobicContact CD2-CB 4.38Å; F149-L167 HydrophobicContact CD2-CD2 4.43Å; F149-L167 WeakPolarHBondContact CD2-O 3.33Å; F149-L167 HydrophobicContact CE2-CD2 3.92Å; F149-L167 HydrophobicContact CZ-CD2 4.49Å; F149-G169 WeakPolarHBondContact O-CA 3.29Å; F149-G169 PolarHBondContact O-N 3.35Å; F149-S170 PolarHBondContact N-O 3.06Å; F149-V172 HydrophobicContact CE1-CG2 4.13Å; F149-V172 HydrophobicContact CE2-CB 4.07Å; F149-V172 HydrophobicContact CE2-CG2 4.04Å; F149-V172 HydrophobicContact CZ-CB 4.1Å; F149-V172 HydrophobicContact CZ-CG2 3.59Å; F149-Y175 HydrophobicContact CE2-CD2 4.13Å; F149-M239 HydrophobicContact CZ-CE 4.08Å
150	L	97.9	Very high	95.8	Very high	13 Å²	13	37.3 Å²	37.3	7%	0.068	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-34.8	170.1	-59.7	-174.1	0	0	0	111.2	H87 M88 F91 V142 R148	H87-L150 HydrophobicContact CB-CD2 3.67Å; M88-L150 HydrophobicContact CB-CB 4.2Å; M88-L150 HydrophobicContact SD-CB 3.67Å; F91-L150 HydrophobicContact CB-CD1 3.84Å; F91-L150 HydrophobicContact CD2-CD1 3.76Å; F91-L150 HydrophobicContact CE2-CD1 4.49Å; F91-L150 HydrophobicContact CG-CD1 3.87Å; V142-L150 HydrophobicContact CB-CB 4.43Å; V142-L150 HydrophobicContact CG1-CB 4.2Å; V142-L150 HydrophobicContact CG1-CD1 4.33Å; V142-L150 PolarHBondContact O-N 2.8Å; R148-L150 PolarHBondContact O-N 2.82Å; R148-L150 VanDerWaalsContact O-N 3.16Å
151	Y	98.1	Very high	95.6	Very high	80 Å²	80	37.1 Å²	37.1	31%	0.314	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	145.7	175.5	173	-97.8	0	0	0	109.4	V140 F141 V142	V140-Y151 HydrophobicContact CB-CE1 4.31Å; V140-Y151 HydrophobicContact CG1-CE1 4.22Å; F141-Y151 CarbonylContact C-O 3.51Å; F141-Y151 VanDerWaalsContact CA-O 3.29Å; F141-Y151 WeakPolarHBondContact CA-O 3.14Å; V142-Y151 HydrophobicContact CG2-CD1 4.37Å; V142-Y151 PolarHBondContact N-O 3.46Å; V142-Y151 PolarHBondContact O-N 2.71Å
152	I	98.4	Very high	95.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	139	165.4	-174.3	149.6	0	0	0	107.6	F139 V140 F141 F149 V156 Q164 L167	F139-I152 HydrophobicContact CD2-CD1 3.93Å; F139-I152 HydrophobicContact CD2-CG1 4.14Å; F139-I152 HydrophobicContact CE2-CD1 4Å; V140-I152 CarbonylContact O-C 3.4Å; V140-I152 WeakPolarHBondContact O-CA 3.38Å; F141-I152 HydrophobicContact CB-CB 4.05Å; F141-I152 HydrophobicContact CB-CD1 3.9Å; F141-I152 HydrophobicContact CB-CG1 3.89Å; F149-I152 HydrophobicContact CD1-CB 4.47Å; F149-I152 HydrophobicContact CD1-CD1 4.2Å; F149-I152 HydrophobicContact CE1-CD1 3.86Å; F149-I152 HydrophobicContact CZ-CD1 4.3Å; I152-V156 HydrophobicContact CD1-CB 4.19Å; I152-V156 HydrophobicContact CD1-CG1 4.44Å; I152-V156 HydrophobicContact CD1-CG2 3.93Å; I152-V156 HydrophobicContact CG1-CB 4.06Å; I152-V156 HydrophobicContact CG1-CG1 4.15Å; I152-V156 HydrophobicContact CG1-CG2 4.36Å; I152-Q164 HydrophobicContact CG2-CB 4.45Å; I152-Q164 HydrophobicContact CG2-CG 4.03Å; I152-Q164 VanDerWaalsContact O-CG 3.3Å; I152-Q164 WeakPolarHBondContact O-CG 3.3Å; I152-Q164 PolarHBondContact O-NE2 2.91Å; I152-L167 HydrophobicContact CD1-CD1 4.01Å; I152-L167 HydrophobicContact CG2-CB 3.87Å; I152-L167 HydrophobicContact CG2-CD1 4.47Å
153	S	97.9	Very high	95.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.			trans	-71.3	149.3	-179.1	60.4	0	0	0	0	111.3	F139 V140 T155 V156	F139-S153 WeakPolarHBondContact CA-OG 3.18Å; F139-S153 VanDerWaalsContact CB-OG 3.31Å; F139-S153 WeakPolarHBondContact CB-OG 3.34Å; V140-S153 PolarHBondContact N-OG 2.8Å; V140-S153 PolarHBondContact O-N 3.09Å; S153-T155 PolarHBondContact O-N 2.93Å; S153-T155 VanDerWaalsContact O-N 3.11Å; S153-T155 PolarHBondContact OG-OG1 3.24Å; S153-V156 VanDerWaalsContact O-CG1 3.26Å; S153-V156 WeakPolarHBondContact O-CG1 3.17Å; S153-V156 PolarHBondContact O-N 3.08Å; S153-V156 VanDerWaalsContact O-N 3.14Å
154	E	95.8	Very high	95.4	Very high	118 Å²	118	42 Å²	42	55%	0.551	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.9	176.9	63.5	-174.5	172.1	0	0	113.3	V156 S157	E154-V156 PolarHBondContact O-N 3.03Å; E154-V156 VanDerWaalsContact O-N 3.11Å; E154-S157 WeakPolarHBondContact O-CB 3.14Å; E154-S157 PolarHBondContact O-N 2.95Å; E154-S157 VanDerWaalsContact O-N 3.17Å; E154-S157 PolarHBondContact O-OG 3.05Å
155	T	96.6	Very high	95.5	Very high	12 Å²	12	42.5 Å²	42.5	7%	0.074	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.9	177.4	59.9	0	0	0	0	113.3	L133 G138 F139 S153 S157 I158 Y159	L133-T155 HydrophobicContact CB-CG2 4.1Å; G138-T155 PolarHBondContact O-OG1 3.13Å; F139-T155 WeakPolarHBondContact CA-OG1 3.37Å; F139-T155 WeakPolarHBondContact CB-OG1 3.36Å; S153-T155 PolarHBondContact O-N 2.93Å; S153-T155 VanDerWaalsContact O-N 3.11Å; S153-T155 PolarHBondContact OG-OG1 3.24Å; T155-S157 PolarHBondContact O-N 2.92Å; T155-I158 HydrophobicContact CG2-CD1 4.39Å; T155-I158 VanDerWaalsContact O-CB 3.32Å; T155-I158 WeakPolarHBondContact O-CB 3.47Å; T155-I158 PolarHBondContact O-N 2.9Å; T155-Y159 WeakPolarHBondContact O-CD2 3.39Å
156	V	97	Very high	95.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-53.3	-30.6	173.3	70.2	0	0	0	0	112.8	F139 I152 S153 E154 I158 Y159 L160 L167	F139-V156 HydrophobicContact CB-CB 4.09Å; F139-V156 HydrophobicContact CD1-CB 4.38Å; F139-V156 HydrophobicContact CD1-CG2 4.21Å; F139-V156 HydrophobicContact CD2-CB 4.12Å; F139-V156 HydrophobicContact CD2-CG2 3.97Å; F139-V156 HydrophobicContact CE1-CG2 4.28Å; F139-V156 HydrophobicContact CE2-CG2 4.04Å; F139-V156 HydrophobicContact CG-CB 3.95Å; F139-V156 HydrophobicContact CG-CG2 4.05Å; F139-V156 HydrophobicContact CZ-CG2 4.19Å; I152-V156 HydrophobicContact CD1-CB 4.19Å; I152-V156 HydrophobicContact CD1-CG1 4.44Å; I152-V156 HydrophobicContact CD1-CG2 3.93Å; I152-V156 HydrophobicContact CG1-CB 4.06Å; I152-V156 HydrophobicContact CG1-CG1 4.15Å; I152-V156 HydrophobicContact CG1-CG2 4.36Å; S153-V156 VanDerWaalsContact O-CG1 3.26Å; S153-V156 WeakPolarHBondContact O-CG1 3.17Å; S153-V156 PolarHBondContact O-N 3.08Å; S153-V156 VanDerWaalsContact O-N 3.14Å; E154-V156 PolarHBondContact O-N 3.03Å; E154-V156 VanDerWaalsContact O-N 3.11Å; V156-I158 VanDerWaalsContact C-N 3.29Å; V156-I158 PolarHBondContact O-N 2.89Å; V156-Y159 PolarHBondContact O-N 2.83Å; V156-L160 HydrophobicContact CG2-CB 4.29Å; V156-L160 HydrophobicContact CG2-CD1 3.91Å; V156-L160 HydrophobicContact CG2-CG 4.3Å; V156-L160 PolarHBondContact O-N 2.83Å; V156-L167 HydrophobicContact CB-CD1 4.49Å; V156-L167 HydrophobicContact CG1-CD1 3.81Å; V156-L167 HydrophobicContact CG2-CD1 3.89Å
157	S	95	Very high	96.1	Very high	57 Å²	57	37.5 Å²	37.5	40%	0.399	19%	0.191	S	C	.	.	H	α-helix	trans	-63.3	-33.5	176.7	61.9	0	0	0	0	113	E154 T155 Y159 G161 L162	E154-S157 WeakPolarHBondContact O-CB 3.14Å; E154-S157 PolarHBondContact O-N 2.95Å; E154-S157 VanDerWaalsContact O-N 3.17Å; E154-S157 PolarHBondContact O-OG 3.05Å; T155-S157 PolarHBondContact O-N 2.92Å; S157-Y159 VanDerWaalsContact C-N 3.35Å; S157-G161 WeakPolarHBondContact O-CA 3.14Å; S157-G161 PolarHBondContact O-N 3.06Å; S157-L162 VanDerWaalsContact CA-O 3.24Å; S157-L162 WeakPolarHBondContact CA-O 3.44Å; S157-L162 WeakPolarHBondContact CB-O 3.43Å; S157-L162 PolarHBondContact N-O 2.94Å
158	I	92.6	Very high	96.3	Very high	114 Å²	114	38.2 Å²	38.2	59%	0.585	20%	0.195	S	C	*	.	H	α-helix	trans	-68.2	-39.3	177.8	-55.8	172.2	0	0	0	110.2	T155 V156 L243	T155-I158 HydrophobicContact CG2-CD1 4.39Å; T155-I158 VanDerWaalsContact O-CB 3.32Å; T155-I158 WeakPolarHBondContact O-CB 3.47Å; T155-I158 PolarHBondContact O-N 2.9Å; V156-I158 VanDerWaalsContact C-N 3.29Å; V156-I158 PolarHBondContact O-N 2.89Å; I158-L243 VanDerWaalsContact O-CD1 3.27Å; I158-L243 WeakPolarHBondContact O-CD1 3.14Å
159	Y	92.1	Very high	96.4	Very high	33 Å²	33	33 Å²	33	13%	0.129	18%	0.179	C	C	.	.	H	α-helix	trans	-92.8	-36.1	-169.8	-67.3	-72.6	0	0	0	113.9	D137 G138 F139 T155 V156 S157 L243 K256 T290	D137-Y159 VanDerWaalsContact CA-OH 3.3Å; D137-Y159 WeakPolarHBondContact CA-OH 3.35Å; D137-Y159 PolarHBondContact OD1-OH 2.83Å; G138-Y159 VanDerWaalsContact C-CE2 3.45Å; G138-Y159 VanDerWaalsContact CA-CE2 3.44Å; G138-Y159 VanDerWaalsContact N-CZ 3.28Å; G138-Y159 PolarHBondContact N-OH 2.93Å; G138-Y159 VanDerWaalsContact N-OH 3.08Å; G138-Y159 WeakPolarHBondContact O-CE2 3.37Å; F139-Y159 HydrophobicContact CD1-CD2 4.14Å; F139-Y159 HydrophobicContact CD1-CG 4.35Å; T155-Y159 WeakPolarHBondContact O-CD2 3.39Å; V156-Y159 PolarHBondContact O-N 2.83Å; S157-Y159 VanDerWaalsContact C-N 3.35Å; Y159-L243 VanDerWaalsContact C-CD1 3.49Å; Y159-L243 VanDerWaalsContact O-CD1 3.29Å; Y159-L243 WeakPolarHBondContact O-CD1 3.24Å; Y159-K256 WeakPolarHBondContact O-CD 3.3Å; Y159-K256 PolarHBondContact O-NZ 3.1Å; Y159-T290 HydrophobicContact CD1-CG2 3.94Å; Y159-T290 VanDerWaalsContact CD1-OG1 3.28Å; Y159-T290 WeakPolarHBondContact CD1-OG1 3.42Å; Y159-T290 HydrophobicContact CG-CG2 4.24Å
160	L	93.4	Very high	96.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-116.8	-19.3	-177	-64	-176.4	0	0	0	113.6	F139 V156 L162 M239 S241 T242 K256 I258	F139-L160 HydrophobicContact CE1-CD1 4.09Å; F139-L160 HydrophobicContact CE1-CG 4.2Å; F139-L160 HydrophobicContact CZ-CD1 3.81Å; F139-L160 HydrophobicContact CZ-CG 4.42Å; V156-L160 HydrophobicContact CG2-CB 4.29Å; V156-L160 HydrophobicContact CG2-CD1 3.91Å; V156-L160 HydrophobicContact CG2-CG 4.3Å; V156-L160 PolarHBondContact O-N 2.83Å; L160-L162 HydrophobicContact CB-CB 4.45Å; L160-L162 HydrophobicContact CB-CD1 4.2Å; L160-L162 HydrophobicContact CB-CG 4.09Å; L160-L162 HydrophobicContact CD1-CD1 4.28Å; L160-M239 HydrophobicContact CD1-CB 3.95Å; L160-M239 HydrophobicContact CD1-CE 4.11Å; L160-M239 HydrophobicContact CD1-SD 4.22Å; L160-M239 HydrophobicContact CD2-CB 4.45Å; L160-S241 CarbonylContact O-C 3.52Å; L160-S241 WeakPolarHBondContact O-CA 3.3Å; L160-S241 PolarHBondContact O-OG 2.92Å; L160-T242 PolarHBondContact O-N 3.23Å; L160-T242 PolarHBondContact O-OG1 2.87Å; L160-K256 HydrophobicContact CD2-CB 4.13Å; L160-K256 HydrophobicContact CD2-CD 4.19Å; L160-I258 HydrophobicContact CD2-CD1 3.83Å; L160-I258 HydrophobicContact CD2-CG1 4.47Å
161	G	93.8	Very high	96.4	Very high	27 Å²	27	34.6 Å²	34.6	28%	0.278	19%	0.192	S	C	.	.			trans	76.1	11.8	-174.3	0	0	0	0	0	113.8	S157 T242	S157-G161 WeakPolarHBondContact O-CA 3.14Å; S157-G161 PolarHBondContact O-N 3.06Å; G161-T242 VanDerWaalsContact CA-OG1 3.24Å; G161-T242 WeakPolarHBondContact CA-OG1 3.3Å; G161-T242 PolarHBondContact O-OG1 3.24Å
162	L	94.8	Very high	96.3	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.047	18%	0.177	C	C	.	.			trans	-95.4	148.4	178	-60.5	177.5	0	0	0	110.4	S157 L160 L167 Y175 K240 T242	S157-L162 VanDerWaalsContact CA-O 3.24Å; S157-L162 WeakPolarHBondContact CA-O 3.44Å; S157-L162 WeakPolarHBondContact CB-O 3.43Å; S157-L162 PolarHBondContact N-O 2.94Å; L160-L162 HydrophobicContact CB-CB 4.45Å; L160-L162 HydrophobicContact CB-CD1 4.2Å; L160-L162 HydrophobicContact CB-CG 4.09Å; L160-L162 HydrophobicContact CD1-CD1 4.28Å; L162-L167 HydrophobicContact CB-CD1 3.72Å; L162-L167 HydrophobicContact CB-CG 4.33Å; L162-L167 HydrophobicContact CD1-CD1 4.38Å; L162-L167 HydrophobicContact CD1-CD2 4.19Å; L162-Y175 HydrophobicContact CD1-CD1 3.77Å; L162-Y175 HydrophobicContact CD1-CE1 4.27Å; L162-K240 HydrophobicContact CD1-CB 4.47Å; L162-K240 WeakPolarHBondContact CD1-O 3.38Å; L162-T242 HydrophobicContact CD2-CG2 3.88Å
163	S	96.1	Very high	96.3	Very high	57 Å²	57	32.9 Å²	32.9	40%	0.399	19%	0.186	S	C	.	.			trans	-86.2	138	179.9	175.7	0	0	0	0	111.8	V165 E166 L167	S163-V165 PolarHBondContact O-N 3.06Å; S163-V165 PolarHBondContact OG-N 2.96Å; S163-E166 WeakPolarHBondContact O-CB 3.44Å; S163-E166 PolarHBondContact O-N 3.23Å; S163-E166 VanDerWaalsContact O-N 3.08Å; S163-L167 WeakPolarHBondContact O-CG 3.4Å; S163-L167 PolarHBondContact O-N 2.78Å
164	Q	97.6	Very high	96.3	Very high	41 Å²	41	37.2 Å²	37.2	19%	0.192	21%	0.209	C	C	.	.	H	α-helix	trans	-53.9	-41.3	171	174.8	-173.1	41.9	0	0	111.8	I152 E166 L167 T168	I152-Q164 HydrophobicContact CG2-CB 4.45Å; I152-Q164 HydrophobicContact CG2-CG 4.03Å; I152-Q164 VanDerWaalsContact O-CG 3.3Å; I152-Q164 WeakPolarHBondContact O-CG 3.3Å; I152-Q164 PolarHBondContact O-NE2 2.91Å; Q164-E166 VanDerWaalsContact C-N 3.28Å; Q164-E166 PolarHBondContact O-N 3.16Å; Q164-L167 PolarHBondContact O-N 2.88Å; Q164-T168 WeakPolarHBondContact O-CB 3.26Å; Q164-T168 PolarHBondContact O-N 3.17Å; Q164-T168 PolarHBondContact O-OG1 3.19Å
165	V	97.3	Very high	96.4	Very high	21 Å²	21	32.5 Å²	32.5	13%	0.127	19%	0.186	C	C	.	.	H	α-helix	trans	-64.1	-35.7	179.8	174.1	0	0	0	0	111.3	L65 I69 L73 R80 L81 S163	L65-V165 HydrophobicContact CD1-CG2 4.28Å; I69-V165 HydrophobicContact CG2-CG2 3.79Å; L73-V165 HydrophobicContact CD2-CG1 3.5Å; L73-V165 VanDerWaalsContact CD2-CG1 3.5Å; R80-V165 PolarHBondContact NH2-O 2.73Å; L81-V165 HydrophobicContact CD1-CG1 4.13Å; S163-V165 PolarHBondContact O-N 3.06Å; S163-V165 PolarHBondContact OG-N 2.96Å
166	E	96.5	Very high	96.4	Very high	85 Å²	85	32.1 Å²	32.1	40%	0.397	18%	0.184	S	C	.	.	H	α-helix	trans	-73.3	-38.3	178.1	-168.5	-157.2	139.2	0	0	111.7	R80 S163 Q164 S170 Y175	R80-E166 PolarHBondContact NH1-O 3.33Å; S163-E166 WeakPolarHBondContact O-CB 3.44Å; S163-E166 PolarHBondContact O-N 3.23Å; S163-E166 VanDerWaalsContact O-N 3.08Å; Q164-E166 VanDerWaalsContact C-N 3.28Å; Q164-E166 PolarHBondContact O-N 3.16Å; E166-S170 PolarHBondContact O-OG 3.39Å; E166-Y175 PolarHBondContact O-OH 2.83Å; E166-Y175 WeakPolarHBondContact OE1-CE1 3.46Å; E166-Y175 PolarHBondContact OE1-OH 2.99Å
167	L	98.1	Very high	96.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-79.6	-38.4	-175.4	-72.9	160.7	0	0	0	112.9	F149 I152 V156 L162 S163 Q164 G169 S170 Y175	F149-L167 WeakPolarHBondContact CB-O 3.35Å; F149-L167 HydrophobicContact CD2-CB 4.38Å; F149-L167 HydrophobicContact CD2-CD2 4.43Å; F149-L167 WeakPolarHBondContact CD2-O 3.33Å; F149-L167 HydrophobicContact CE2-CD2 3.92Å; F149-L167 HydrophobicContact CZ-CD2 4.49Å; I152-L167 HydrophobicContact CD1-CD1 4.01Å; I152-L167 HydrophobicContact CG2-CB 3.87Å; I152-L167 HydrophobicContact CG2-CD1 4.47Å; V156-L167 HydrophobicContact CB-CD1 4.49Å; V156-L167 HydrophobicContact CG1-CD1 3.81Å; V156-L167 HydrophobicContact CG2-CD1 3.89Å; L162-L167 HydrophobicContact CB-CD1 3.72Å; L162-L167 HydrophobicContact CB-CG 4.33Å; L162-L167 HydrophobicContact CD1-CD1 4.38Å; L162-L167 HydrophobicContact CD1-CD2 4.19Å; S163-L167 WeakPolarHBondContact O-CG 3.4Å; S163-L167 PolarHBondContact O-N 2.78Å; Q164-L167 PolarHBondContact O-N 2.88Å; L167-G169 PolarHBondContact O-N 3.1Å; L167-S170 WeakPolarHBondContact O-CB 3.28Å; L167-S170 PolarHBondContact O-N 2.96Å; L167-Y175 HydrophobicContact CD2-CD1 3.56Å; L167-Y175 HydrophobicContact CD2-CD2 3.66Å; L167-Y175 HydrophobicContact CD2-CE1 3.54Å; L167-Y175 HydrophobicContact CD2-CE2 3.66Å; L167-Y175 HydrophobicContact CD2-CG 3.61Å; L167-Y175 HydrophobicContact CG-CE1 4.43Å
168	T	98.5	Very high	96.4	Very high	15 Å²	15	35.7 Å²	35.7	9%	0.092	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	123.9	-174	-58.1	0	0	0	0	111.1	R80 L81 Q164 S170	R80-T168 PolarHBondContact NH1-O 2.77Å; L81-T168 HydrophobicContact CD2-CG2 3.85Å; Q164-T168 WeakPolarHBondContact O-CB 3.26Å; Q164-T168 PolarHBondContact O-N 3.17Å; Q164-T168 PolarHBondContact O-OG1 3.19Å; T168-S170 VanDerWaalsContact C-N 3.29Å; T168-S170 PolarHBondContact O-N 3.31Å
169	G	97.9	Very high	96.5	Very high	10 Å²	10	33.6 Å²	33.6	10%	0.103	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	-10.1	-176.4	0	0	0	0	0	115.6	S84 F149 L167	S84-G169 WeakPolarHBondContact OG-CA 3.44Å; S84-G169 PolarHBondContact OG-N 3.49Å; F149-G169 WeakPolarHBondContact O-CA 3.29Å; F149-G169 PolarHBondContact O-N 3.35Å; L167-G169 PolarHBondContact O-N 3.1Å
170	S	98.3	Very high	96.7	Very high	18 Å²	18	32.2 Å²	32.2	13%	0.126	20%	0.196	C	C	.	.	S	Bend	trans	-80.3	161.2	174.8	-58.4	0	0	0	0	111.7	R80 R148 F149 E166 L167 T168	R80-S170 PolarHBondContact NH1-OG 3.09Å; R148-S170 WeakPolarHBondContact CA-O 3.21Å; F149-S170 PolarHBondContact N-O 3.06Å; E166-S170 PolarHBondContact O-OG 3.39Å; L167-S170 WeakPolarHBondContact O-CB 3.28Å; L167-S170 PolarHBondContact O-N 2.96Å; T168-S170 VanDerWaalsContact C-N 3.29Å; T168-S170 PolarHBondContact O-N 3.31Å
171	S	97.8	Very high	96.9	Very high	30 Å²	30	35 Å²	35	21%	0.21	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-70.9	133.7	172.8	179.7	0	0	0	0	110.1	G147 F173 D174 Y175	G147-S171 CarbonylContact O-C 3.56Å; G147-S171 WeakPolarHBondContact O-CA 3.33Å; S171-F173 PolarHBondContact O-N 2.57Å; S171-F173 WeakPolarHBondContact OG-CD2 3.49Å; S171-F173 PolarHBondContact OG-N 3.15Å; S171-D174 WeakPolarHBondContact CB-OD2 3.42Å; S171-D174 WeakPolarHBondContact O-CB 3.36Å; S171-D174 PolarHBondContact O-N 3.35Å; S171-Y175 WeakPolarHBondContact O-CD2 3.41Å
172	V	97.8	Very high	96.9	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-59.2	-32.9	173.6	72.2	0	0	0	0	111.2	V143 G147 F149 D174 Y175 I176 M184	V143-V172 HydrophobicContact CG1-CB 4.33Å; V143-V172 HydrophobicContact CG1-CG1 4.25Å; G147-V172 WeakPolarHBondContact O-CB 3.48Å; G147-V172 VanDerWaalsContact O-CG1 3.3Å; G147-V172 WeakPolarHBondContact O-CG1 3.36Å; G147-V172 PolarHBondContact O-N 3.06Å; F149-V172 HydrophobicContact CE1-CG2 4.13Å; F149-V172 HydrophobicContact CE2-CB 4.07Å; F149-V172 HydrophobicContact CE2-CG2 4.04Å; F149-V172 HydrophobicContact CZ-CB 4.1Å; F149-V172 HydrophobicContact CZ-CG2 3.59Å; V172-D174 PolarHBondContact O-N 2.9Å; V172-Y175 PolarHBondContact O-N 2.81Å; V172-I176 HydrophobicContact CG1-CD1 4.38Å; V172-I176 HydrophobicContact CG2-CD1 3.59Å; V172-I176 HydrophobicContact CG2-CG1 4.13Å; V172-I176 WeakPolarHBondContact O-CG1 3.07Å; V172-I176 PolarHBondContact O-N 3.14Å; V172-I176 VanDerWaalsContact O-N 3.1Å; V172-M184 HydrophobicContact CG1-CE 4.09Å; V172-M184 HydrophobicContact CG1-CG 4.34Å; V172-M184 HydrophobicContact CG2-CE 4.08Å
173	F	97.7	Very high	96.8	Very high	42 Å²	42	39.6 Å²	39.6	18%	0.184	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-66.5	-23.3	-179.8	-60.2	-75.5	0	0	0	113	S171 Y175 H181 M184 A185 L188 I190	S171-F173 PolarHBondContact O-N 2.57Å; S171-F173 WeakPolarHBondContact OG-CD2 3.49Å; S171-F173 PolarHBondContact OG-N 3.15Å; F173-Y175 PolarHBondContact O-N 2.88Å; F173-H181 HydrophobicContact CD1-CB 4.12Å; F173-H181 AromaticContact CD1-CD2 3.95Å; F173-H181 AromaticContact CD1-CG 3.89Å; F173-H181 HydrophobicContact CE1-CB 4.43Å; F173-H181 PolarHBondContact O-CE1 3.29Å; F173-H181 PolarHBondContact O-NE2 3.37Å; F173-M184 HydrophobicContact CE1-CB 4.04Å; F173-M184 HydrophobicContact CE1-CG 4.03Å; F173-M184 HydrophobicContact CZ-CG 4.38Å; F173-A185 HydrophobicContact CE1-CB 4.33Å; F173-A185 HydrophobicContact CZ-CB 4.17Å; F173-L188 HydrophobicContact CZ-CD1 4.35Å; F173-I190 HydrophobicContact CE2-CD1 4.24Å; F173-I190 HydrophobicContact CZ-CD1 4.22Å
174	D	97.6	Very high	96.7	Very high	91 Å²	91	36.9 Å²	36.9	49%	0.487	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-68.1	-20.4	175.1	-60.6	-23.9	0	0	0	111.6	S171 V172 K240	S171-D174 WeakPolarHBondContact CB-OD2 3.42Å; S171-D174 WeakPolarHBondContact O-CB 3.36Å; S171-D174 PolarHBondContact O-N 3.35Å; V172-D174 PolarHBondContact O-N 2.9Å; D174-K240 VanDerWaalsContact O-CE 3.25Å; D174-K240 WeakPolarHBondContact O-CE 3.42Å; D174-K240 PolarHBondContact O-NZ 2.89Å
175	Y	97.7	Very high	96.4	Very high	20 Å²	20	35.6 Å²	35.6	8%	0.078	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-12.1	-176.4	-60.3	-86.2	0	0	0	113.5	F149 L162 E166 L167 S171 V172 F173 M239 K240	F149-Y175 HydrophobicContact CE2-CD2 4.13Å; L162-Y175 HydrophobicContact CD1-CD1 3.77Å; L162-Y175 HydrophobicContact CD1-CE1 4.27Å; E166-Y175 PolarHBondContact O-OH 2.83Å; E166-Y175 WeakPolarHBondContact OE1-CE1 3.46Å; E166-Y175 PolarHBondContact OE1-OH 2.99Å; L167-Y175 HydrophobicContact CD2-CD1 3.56Å; L167-Y175 HydrophobicContact CD2-CD2 3.66Å; L167-Y175 HydrophobicContact CD2-CE1 3.54Å; L167-Y175 HydrophobicContact CD2-CE2 3.66Å; L167-Y175 HydrophobicContact CD2-CG 3.61Å; L167-Y175 HydrophobicContact CG-CE1 4.43Å; S171-Y175 WeakPolarHBondContact O-CD2 3.41Å; V172-Y175 PolarHBondContact O-N 2.81Å; F173-Y175 PolarHBondContact O-N 2.88Å; Y175-M239 CarbonylContact O-C 3.6Å; Y175-M239 VanDerWaalsContact O-CA 3.29Å; Y175-M239 WeakPolarHBondContact O-CA 3.46Å; Y175-K240 PolarHBondContact O-N 3.1Å
176	I	97.6	Very high	96.1	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-90.7	142.6	175.6	-67	175.7	0	0	0	110.2	V172 D180 H181 M184 I237 R238 M239	V172-I176 HydrophobicContact CG1-CD1 4.38Å; V172-I176 HydrophobicContact CG2-CD1 3.59Å; V172-I176 HydrophobicContact CG2-CG1 4.13Å; V172-I176 WeakPolarHBondContact O-CG1 3.07Å; V172-I176 PolarHBondContact O-N 3.14Å; V172-I176 VanDerWaalsContact O-N 3.1Å; I176-D180 HydrophobicContact CG2-CB 3.82Å; I176-H181 PolarHBondContact O-NE2 2.81Å; I176-M184 HydrophobicContact CD1-CB 3.97Å; I176-M184 HydrophobicContact CD1-CG 3.55Å; I176-M184 HydrophobicContact CD1-SD 3.87Å; I176-I237 HydrophobicContact CD1-CD1 3.68Å; I176-I237 HydrophobicContact CG1-CD1 4.02Å; I176-I237 HydrophobicContact CG2-CB 4.47Å; I176-R238 CarbonylContact C-O 2.98Å; I176-R238 WeakPolarHBondContact CA-O 3.31Å; I176-M239 HydrophobicContact CG1-CG 4.31Å
177	H	95.9	Very high	95.8	Very high	51 Å²	51	41.4 Å²	41.4	24%	0.236	23%	0.228	C	C	.	.			trans	-57.8	132.2	173	-174.4	-81	0	0	0	110.7	A179 D180 H181 R238 Y255	H177-A179 VanDerWaalsContact C-N 3.26Å; H177-A179 WeakPolarHBondContact ND1-CB 3.32Å; H177-A179 PolarHBondContact ND1-N 3.39Å; H177-A179 PolarHBondContact O-N 3.04Å; H177-A179 VanDerWaalsContact O-N 3.08Å; H177-D180 PolarHBondContact O-N 3.28Å; H177-H181 PolarHBondContact O-CD2 3.27Å; H177-R238 HydrophobicContact CB-CB 3.63Å; H177-R238 PolarHBondContact N-O 2.86Å; H177-R238 PolarHBondContact ND1-NH2 3.46Å; H177-Y255 HydrophobicContact CB-CD1 3.85Å; H177-Y255 HydrophobicContact CB-CE1 3.81Å; H177-Y255 HydrophobicContact CB-CG 4.41Å; H177-Y255 AromaticContact CD2-CD2 3.85Å; H177-Y255 AromaticContact CD2-CE2 3.79Å
178	P	95.9	Very high	95.3	Very high	81 Å²	81	41.8 Å²	41.8	53%	0.526	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-53.3	-37.3	-172.8	-30.2	35.9	0	0	0	115.5	D180 H181	P178-D180 PolarHBondContact O-N 3.35Å; P178-D180 VanDerWaalsContact O-N 3.16Å; P178-H181 WeakPolarHBondContact O-CB 3.14Å; P178-H181 PolarHBondContact O-N 3.19Å; P178-H181 VanDerWaalsContact O-N 3.13Å
179	A	95.1	Very high	94.5	Very high	70 Å²	70	44 Å²	44	58%	0.579	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-64.9	-15.9	178.1	0	0	0	0	0	114.3	H177	H177-A179 VanDerWaalsContact C-N 3.26Å; H177-A179 WeakPolarHBondContact ND1-CB 3.32Å; H177-A179 PolarHBondContact ND1-N 3.39Å; H177-A179 PolarHBondContact O-N 3.04Å; H177-A179 VanDerWaalsContact O-N 3.08Å
180	D	96.3	Very high	93.5	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.027	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-101.9	3.1	178.9	-53.2	-19.8	0	0	0	111.8	I176 H177 P178 M184 I237 R238	I176-D180 HydrophobicContact CG2-CB 3.82Å; H177-D180 PolarHBondContact O-N 3.28Å; P178-D180 PolarHBondContact O-N 3.35Å; P178-D180 VanDerWaalsContact O-N 3.16Å; D180-M184 PolarHBondContact O-N 3.29Å; D180-I237 HydrophobicContact CB-CG2 4.27Å; D180-R238 IonicContact OD1-CZ 2.66Å; D180-R238 IonicContact OD1-NE 2.73Å; D180-R238 PolarHBondContact OD1-NE 3.01Å; D180-R238 IonicContact OD1-NH2 3.1Å; D180-R238 PolarHBondContact OD1-NH2 3.05Å; D180-R238 VanDerWaalsContact OD2-CB 3.3Å; D180-R238 WeakPolarHBondContact OD2-CB 3.48Å; D180-R238 IonicContact OD2-CZ 2.73Å; D180-R238 PolarHBondContact OD2-N 3.48Å; D180-R238 IonicContact OD2-NE 3.27Å; D180-R238 PolarHBondContact OD2-NE 3.28Å; D180-R238 IonicContact OD2-NH2 3.76Å
181	H	96	Very high	91.6	Very high	57 Å²	57	52.9 Å²	52.9	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-64.7	-40.8	-177.3	-75.2	-171.3	0	0	0	112.9	F173 I176 H177 P178 M184 A185	F173-H181 HydrophobicContact CD1-CB 4.12Å; F173-H181 AromaticContact CD1-CD2 3.95Å; F173-H181 AromaticContact CD1-CG 3.89Å; F173-H181 HydrophobicContact CE1-CB 4.43Å; F173-H181 PolarHBondContact O-CE1 3.29Å; F173-H181 PolarHBondContact O-NE2 3.37Å; I176-H181 PolarHBondContact O-NE2 2.81Å; H177-H181 PolarHBondContact O-CD2 3.27Å; P178-H181 WeakPolarHBondContact O-CB 3.14Å; P178-H181 PolarHBondContact O-N 3.19Å; P178-H181 VanDerWaalsContact O-N 3.13Å; H181-M184 PolarHBondContact O-N 2.94Å; H181-A185 WeakPolarHBondContact O-CB 3.3Å; H181-A185 PolarHBondContact O-N 2.77Å
182	V	94.3	Very high	89.2	Confident	93 Å²	93	56.6 Å²	56.6	56%	0.564	31%	0.314	S	S	*	.	H	α-helix	trans	-63.7	-48	179.8	179.1	0	0	0	0	110.2	M184 A185 E186	V182-M184 PolarHBondContact O-N 2.89Å; V182-A185 PolarHBondContact O-N 2.86Å; V182-E186 WeakPolarHBondContact O-CG 3.41Å; V182-E186 PolarHBondContact O-N 2.84Å
183	E	93.3	Very high	86.5	Confident	41 Å²	41	63.5 Å²	63.5	19%	0.192	35%	0.346	C	S	.	.	H	α-helix	trans	-58.5	-46.3	176.8	-175.1	178.4	169	0	0	111.1	A185 E186 R187 K361	E183-A185 PolarHBondContact O-N 2.9Å; E183-E186 PolarHBondContact O-N 2.87Å; E183-R187 WeakPolarHBondContact O-CG 3.23Å; E183-R187 PolarHBondContact O-N 3.24Å; E183-K361 VanDerWaalsContact CD-NZ 3.32Å; E183-K361 IonicContact OE1-NZ 3.94Å; E183-K361 PolarHBondContact OE1-NZ 3.21Å; E183-K361 VanDerWaalsContact OE1-NZ 3.13Å; E183-K361 WeakPolarHBondContact OE2-CE 3.24Å; E183-K361 IonicContact OE2-NZ 3.27Å; E183-K361 PolarHBondContact OE2-NZ 3.45Å
184	M	93.5	Very high	83.9	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-41.4	177.2	-176.9	67.6	-172.9	0	0	112.7	V172 F173 I176 D180 H181 V182 R187 L188 F235 I237 L284	V172-M184 HydrophobicContact CG1-CE 4.09Å; V172-M184 HydrophobicContact CG1-CG 4.34Å; V172-M184 HydrophobicContact CG2-CE 4.08Å; F173-M184 HydrophobicContact CE1-CB 4.04Å; F173-M184 HydrophobicContact CE1-CG 4.03Å; F173-M184 HydrophobicContact CZ-CG 4.38Å; I176-M184 HydrophobicContact CD1-CB 3.97Å; I176-M184 HydrophobicContact CD1-CG 3.55Å; I176-M184 HydrophobicContact CD1-SD 3.87Å; D180-M184 PolarHBondContact O-N 3.29Å; H181-M184 PolarHBondContact O-N 2.94Å; V182-M184 PolarHBondContact O-N 2.89Å; M184-R187 PolarHBondContact O-N 2.74Å; M184-L188 HydrophobicContact CE-CD1 3.74Å; M184-L188 HydrophobicContact CE-CD2 4.12Å; M184-L188 HydrophobicContact CE-CG 3.89Å; M184-L188 HydrophobicContact CG-CD1 4.25Å; M184-L188 WeakPolarHBondContact O-CG 3.36Å; M184-L188 PolarHBondContact O-N 2.78Å; M184-F235 HydrophobicContact SD-CE2 3.77Å; M184-F235 HydrophobicContact SD-CZ 3.76Å; M184-I237 HydrophobicContact SD-CD1 4.49Å; M184-L284 HydrophobicContact CE-CD2 4.1Å
185	A	92.3	Very high	80.9	Confident	14 Å²	14	77.2 Å²	77.2	12%	0.116	40%	0.402	C	S	.	.	H	α-helix	trans	-64.1	-43.2	178.8	0	0	0	0	0	111.5	F173 H181 V182 E183 R187 L188 G189 I190	F173-A185 HydrophobicContact CE1-CB 4.33Å; F173-A185 HydrophobicContact CZ-CB 4.17Å; H181-A185 WeakPolarHBondContact O-CB 3.3Å; H181-A185 PolarHBondContact O-N 2.77Å; V182-A185 PolarHBondContact O-N 2.86Å; E183-A185 PolarHBondContact O-N 2.9Å; A185-R187 VanDerWaalsContact C-N 3.35Å; A185-R187 PolarHBondContact O-N 2.94Å; A185-L188 PolarHBondContact O-N 2.78Å; A185-G189 PolarHBondContact O-N 2.84Å; A185-G189 VanDerWaalsContact O-N 3.13Å; A185-I190 HydrophobicContact CB-CB 4.23Å; A185-I190 PolarHBondContact O-N 2.87Å
186	E	90.1	Very high	78	Confident	131 Å²	131	80.6 Å²	80.6	61%	0.612	43%	0.434	S	S	*	.	H	α-helix	trans	-59.8	-44.7	173.9	-72.7	175.3	178.3	0	0	111.5	V182 E183 L188 G189	V182-E186 WeakPolarHBondContact O-CG 3.41Å; V182-E186 PolarHBondContact O-N 2.84Å; E183-E186 PolarHBondContact O-N 2.87Å; E186-L188 VanDerWaalsContact C-N 3.26Å; E186-L188 PolarHBondContact O-N 2.95Å; E186-G189 PolarHBondContact O-N 3.16Å
187	R	89.7	Confident	75.1	Confident	96 Å²	96	89.6 Å²	89.6	36%	0.362	48%	0.476	S	S	.	.	H	α-helix	trans	-62.9	-31.5	177	-66.2	-65.1	177.7	143.6	4	113	E183 M184 A185 G189 R233 F235 I264	E183-R187 WeakPolarHBondContact O-CG 3.23Å; E183-R187 PolarHBondContact O-N 3.24Å; M184-R187 PolarHBondContact O-N 2.74Å; A185-R187 VanDerWaalsContact C-N 3.35Å; A185-R187 PolarHBondContact O-N 2.94Å; R187-G189 VanDerWaalsContact C-N 3.31Å; R187-R233 PolarHBondContact NH1-O 2.9Å; R187-F235 HydrophobicContact CB-CD1 4.49Å; R187-F235 HydrophobicContact CB-CE1 4.1Å; R187-F235 HydrophobicContact CB-CZ 4.13Å; R187-F235 HydrophobicContact CG-CD1 3.91Å; R187-F235 HydrophobicContact CG-CD2 4.13Å; R187-F235 HydrophobicContact CG-CE1 4.01Å; R187-F235 HydrophobicContact CG-CE2 4.23Å; R187-F235 HydrophobicContact CG-CG 3.98Å; R187-F235 HydrophobicContact CG-CZ 4.17Å; R187-I264 WeakPolarHBondContact O-CD1 3.45Å
188	L	87.8	Confident	72.2	Confident	8 Å²	8	92.4 Å²	92.4	4%	0.042	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-8.1	173.9	-71.2	171.7	0	0	0	113.6	V143 F173 M184 A185 E186 I190 L284	V143-L188 HydrophobicContact CB-CD2 4.34Å; V143-L188 HydrophobicContact CG1-CD1 4.34Å; V143-L188 HydrophobicContact CG1-CD2 4.35Å; F173-L188 HydrophobicContact CZ-CD1 4.35Å; M184-L188 HydrophobicContact CE-CD1 3.74Å; M184-L188 HydrophobicContact CE-CD2 4.12Å; M184-L188 HydrophobicContact CE-CG 3.89Å; M184-L188 HydrophobicContact CG-CD1 4.25Å; M184-L188 WeakPolarHBondContact O-CG 3.36Å; M184-L188 PolarHBondContact O-N 2.78Å; A185-L188 PolarHBondContact O-N 2.78Å; E186-L188 VanDerWaalsContact C-N 3.26Å; E186-L188 PolarHBondContact O-N 2.95Å; L188-I190 HydrophobicContact CB-CD1 3.84Å; L188-I190 HydrophobicContact CB-CG1 3.8Å; L188-I190 HydrophobicContact CD1-CD1 3.7Å; L188-I190 HydrophobicContact CG-CD1 4.43Å; L188-I190 PolarHBondContact O-N 2.93Å; L188-L284 HydrophobicContact CD2-CB 3.59Å; L188-L284 HydrophobicContact CD2-CD2 4.44Å
189	G	81.6	Confident	69.1	Low	61 Å²	61	91.8 Å²	91.8	63%	0.629	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	18.8	-171.5	0	0	0	0	0	113.3	A185 E186 R187 K191	A185-G189 PolarHBondContact O-N 2.84Å; A185-G189 VanDerWaalsContact O-N 3.13Å; E186-G189 PolarHBondContact O-N 3.16Å; R187-G189 VanDerWaalsContact C-N 3.31Å; G189-K191 PolarHBondContact O-N 2.91Å; G189-K191 VanDerWaalsContact O-N 3.13Å
190	I	78.2	Confident	65.9	Low	51 Å²	51	93.4 Å²	93.4	26%	0.262	52%	0.522	S	S	.	.			trans	-76.8	97.9	172.3	-60	171.2	0	0	0	106.3	Q145 F173 A185 L188 P192	Q145-I190 WeakPolarHBondContact O-CD1 3.44Å; Q145-I190 VanDerWaalsContact O-CG1 3.3Å; Q145-I190 WeakPolarHBondContact O-CG1 3.35Å; F173-I190 HydrophobicContact CE2-CD1 4.24Å; F173-I190 HydrophobicContact CZ-CD1 4.22Å; A185-I190 HydrophobicContact CB-CB 4.23Å; A185-I190 PolarHBondContact O-N 2.87Å; L188-I190 HydrophobicContact CB-CD1 3.84Å; L188-I190 HydrophobicContact CB-CG1 3.8Å; L188-I190 HydrophobicContact CD1-CD1 3.7Å; L188-I190 HydrophobicContact CG-CD1 4.43Å; L188-I190 PolarHBondContact O-N 2.93Å; I190-P192 WeakPolarHBondContact O-CD 3.47Å
191	K	57.6	Low	62.7	Low	164 Å²	164	101.9 Å²	101.9	71%	0.713	56%	0.561	S	S	*	*			trans	-63	119.1	169	-70.8	-178.2	178.2	178.9	0	107.7	G189 H193	G189-K191 PolarHBondContact O-N 2.91Å; G189-K191 VanDerWaalsContact O-N 3.13Å; K191-H193 PolarHBondContact O-N 2.78Å
192	P	46.6	Very low	59.5	Low	109 Å²	109	108.1 Å²	108.1	71%	0.708	59%	0.593	S	S	*	*			trans	-69.5	83.3	169.3	28.2	-30.2	0	0	0	107.8	I190 L194	I190-P192 WeakPolarHBondContact O-CD 3.47Å; P192-L194 PolarHBondContact O-N 3.5Å
193	H	42.9	Very low	56.4	Low	146 Å²	146	108.3 Å²	108.3	68%	0.676	60%	0.604	S	S	*	*			trans	-70.1	110.7	160.6	-80.1	-67.6	0	0	0	106.7	K191 R195	K191-H193 PolarHBondContact O-N 2.78Å; H193-R195 VanDerWaalsContact C-N 3.32Å; H193-R195 PolarHBondContact O-N 3.24Å
194	L	41.3	Very low	53.9	Low	172 Å²	172	111.6 Å²	111.6	90%	0.901	63%	0.629	S	S	*	*			trans	-2.2	82	149.4	-64.6	163.2	0	0	0	112.5	P192 A196	P192-L194 PolarHBondContact O-N 3.5Å; L194-A196 VanDerWaalsContact C-N 3.33Å
195	R	34.7	Very low	50.7	Low	248 Å²	248	118.3 Å²	118.3	94%	0.936	67%	0.665	S	S	*	*			trans	-100	12.3	177.4	-131.7	179.4	-178.8	163.6	0.8	111.8	H193	H193-R195 VanDerWaalsContact C-N 3.32Å; H193-R195 PolarHBondContact O-N 3.24Å
196	A	37.8	Very low	47.7	Very low	91 Å²	91	123.3 Å²	123.3	75%	0.752	70%	0.699	S	S	*	*	S	Bend	trans	-124.8	61.2	177.6	0	0	0	0	0	109.6	L194	L194-A196 VanDerWaalsContact C-N 3.33Å
197	E	37.3	Very low	44.8	Very low	192 Å²	192	121.4 Å²	121.4	90%	0.897	71%	0.706	S	S	*	*			trans	-177.1	70.9	153.9	-104.8	176.3	-158.5	0	0	108.5
198	A	33.8	Very low	41.9	Very low	110 Å²	110	121.9 Å²	121.9	91%	0.909	72%	0.724	S	S	*	*			trans	-144.4	63	163.1	0	0	0	0	0	108
199	G	30.8	Very low	39.2	Very low	68 Å²	68	127.4 Å²	127.4	70%	0.701	76%	0.763	S	S	*	*			trans	-143.2	77.1	169	0	0	0	0	0	108.2
200	C	28.7	Very low	36.7	Very low	105 Å²	105	129 Å²	129	71%	0.709	77%	0.771	S	S	*	*	S	Bend	trans	168.1	140.5	136.5	60.9	0	0	0	0	113.2
201	H	28.8	Very low	34.4	Very low	182 Å²	182	131 Å²	131	84%	0.843	79%	0.794	S	S	*	*			trans	75.6	112.2	158.7	-56.9	-59.9	0	0	0	122.1
202	M	29.7	Very low	33.1	Very low	189 Å²	189	129 Å²	129	93%	0.931	80%	0.801	S	S	*	*			trans	-77.9	130	156.4	-70.9	-81.9	-166.8	0	0	110.5
203	A	27.7	Very low	32.2	Very low	96 Å²	96	130.5 Å²	130.5	79%	0.793	81%	0.808	S	S	*	*			trans	173.3	148.6	132.3	0	0	0	0	0	110.8
204	P	40.3	Very low	31.6	Very low	110 Å²	110	129.4 Å²	129.4	71%	0.714	82%	0.817	S	S	*	*			trans	-101.2	169.4	-172.5	39.2	-32.1	0	0	0	114.9
205	D	27.3	Very low	31	Very low	142 Å²	142	126 Å²	126	76%	0.759	81%	0.808	S	S	*	*			trans	78.2	113.2	158.7	-59.1	-23.5	0	0	0	120.3
206	S	28.9	Very low	30.9	Very low	118 Å²	118	122.2 Å²	122.2	83%	0.825	81%	0.805	S	S	*	*				162.9	124.6	103.1	-71.2	0	0	0	0	113.7
207	A	28.9	Very low	30.4	Very low	92 Å²	92	123 Å²	123	76%	0.76	81%	0.811	S	S	*	*			trans	44.6	137.4	138.8	0	0	0	0	0	124.3
208	S	29.9	Very low	30	Very low	106 Å²	106	118.9 Å²	118.9	74%	0.741	81%	0.811	S	S	*	*			trans	85.9	108.5	150.5	71.1	0	0	0	0	118.3
209	S	31.2	Very low	29.7	Very low	123 Å²	123	116.7 Å²	116.7	86%	0.86	80%	0.799	S	S	*	*				81.6	127.5	94.5	-53.7	0	0	0	0	111.4
210	A	28.9	Very low	29.8	Very low	96 Å²	96	120 Å²	120	79%	0.793	81%	0.808	S	S	*	*			cis	-163.8	157.4	27.6	0	0	0	0	0	112.1
211	A	28.7	Very low	29.9	Very low	91 Å²	91	120.6 Å²	120.6	75%	0.752	81%	0.813	S	S	*	*			trans	47.2	123.9	147.2	0	0	0	0	0	119.3
212	S	30.1	Very low	29.8	Very low	123 Å²	123	116.5 Å²	116.5	86%	0.86	81%	0.805	S	S	*	*				-160.6	148.7	76.7	-66	0	0	0	0	113.9
213	T	28	Very low	30.4	Very low	140 Å²	140	113 Å²	113	86%	0.859	80%	0.797	S	S	*	*			trans	-72.1	139.7	-173	47.1	0	0	0	0	115.2
214	S	30	Very low	30.4	Very low	123 Å²	123	116.3 Å²	116.3	86%	0.86	80%	0.795	S	S	*	*			trans	-145.3	109.6	137.8	62.2	0	0	0	0	109.9
215	S	30.5	Very low	30.3	Very low	101 Å²	101	116.7 Å²	116.7	71%	0.706	80%	0.8	S	S	*	*			trans	-79.4	137.8	-178.1	45.6	0	0	0	0	113.4
216	L	31.8	Very low	30.5	Very low	168 Å²	168	114.5 Å²	114.5	88%	0.88	80%	0.802	S	S	*	*			trans	58.5	114.9	136	-57.2	170.1	0	0	0	119.8
217	A	26.2	Very low	30.9	Very low	107 Å²	107	113.4 Å²	113.4	88%	0.884	80%	0.8	S	S	*	*				-177.1	91.3	118	0	0	0	0	0	111.1
218	A	30.7	Very low	31.5	Very low	107 Å²	107	116.4 Å²	116.4	88%	0.884	80%	0.804	S	S	*	*			trans	-106.2	105.5	156.6	0	0	0	0	0	106.7
219	G	26.7	Very low	32.3	Very low	64 Å²	64	117.1 Å²	117.1	66%	0.66	80%	0.799	S	S	*	*			trans	-67.6	160.1	178.4	0	0	0	0	0	112.4	S221	G219-S221 PolarHBondContact O-N 3.36Å
220	P	33.5	Very low	33.3	Very low	136 Å²	136	114.5 Å²	114.5	88%	0.883	78%	0.779	S	S	*	*			trans	-78.5	105.8	-179.1	31.7	-29.4	0	0	0	109.2	S222	P220-S222 PolarHBondContact O-N 2.78Å
221	S	29.5	Very low	34.4	Very low	119 Å²	119	115.3 Å²	115.3	83%	0.832	78%	0.776	S	S	*	*			trans	-72.7	125.8	168.9	54.3	0	0	0	0	109.5	G219	G219-S221 PolarHBondContact O-N 3.36Å
222	S	28	Very low	35.9	Very low	96 Å²	96	116.8 Å²	116.8	67%	0.671	77%	0.767	S	S	*	*			trans	-60.9	156.3	-176.7	67	0	0	0	0	113.6	P220	P220-S222 PolarHBondContact O-N 2.78Å
223	P	41.3	Very low	37.6	Very low	116 Å²	116	118.8 Å²	118.8	75%	0.753	76%	0.756	S	S	*	*			trans	-97.1	94.4	178.8	35	-25.9	0	0	0	110.6
224	H	28.2	Very low	40.5	Very low	165 Å²	165	113.4 Å²	113.4	76%	0.764	73%	0.729	S	S	*	*			trans	-139.4	92.4	164.3	-79.4	-61.3	0	0	0	112.1
225	S	38.3	Very low	43.5	Very low	117 Å²	117	108 Å²	108	82%	0.818	69%	0.69	S	S	*	*			trans	30.6	103	137.6	47.9	0	0	0	0	119.8
226	A	30.5	Very low	46.6	Very low	97 Å²	97	103.8 Å²	103.8	80%	0.802	66%	0.659	S	S	*	*			trans	-128.6	134.4	136.4	0	0	0	0	0	107	D228	A226-D228 PolarHBondContact O-N 2.92Å
227	A	37.4	Very low	49.7	Very low	95 Å²	95	95.8 Å²	95.8	79%	0.785	62%	0.617	S	S	*	*			trans	-57.5	135.1	-176.8	0	0	0	0	0	111.5	D229	A227-D229 PolarHBondContact O-N 2.93Å
228	D	43.2	Very low	52.9	Low	155 Å²	155	93.1 Å²	93.1	83%	0.829	58%	0.584	S	S	*	*			trans	-63.5	60.6	176.5	-80.2	-45.9	0	0	0	113	A226	A226-D228 PolarHBondContact O-N 2.92Å
229	D	45.3	Very low	56.1	Low	121 Å²	121	88 Å²	88	65%	0.647	54%	0.542	S	S	*	.			trans	-89.9	121.2	160.1	-88.4	-25.2	0	0	0	108.6	A227 R279	A227-D229 PolarHBondContact O-N 2.93Å; D229-R279 IonicContact OD1-NH1 2.64Å
230	P	52.5	Low	59.3	Low	67 Å²	67	89.1 Å²	89.1	44%	0.435	53%	0.529	S	S	.	.			trans	-58.5	138.7	175.6	25.3	-31.9	0	0	0	108.2	E232	P230-E232 PolarHBondContact O-N 3.14Å
231	P	51.2	Low	62.1	Low	113 Å²	113	83.1 Å²	83.1	73%	0.734	49%	0.49	S	S	*	.			trans	-59.3	109.9	-174.1	22.9	-32.3	0	0	0	109.6	R233	P231-R233 VanDerWaalsContact C-N 3.31Å; P231-R233 PolarHBondContact O-N 2.83Å
232	E	62.1	Low	65	Low	122 Å²	122	81.7 Å²	81.7	57%	0.57	48%	0.476	S	S	*	.			trans	-61.4	94.7	166.5	-76.4	-177.7	-164.5	0	0	108.1	P230 R263	P230-E232 PolarHBondContact O-N 3.14Å; E232-R263 HydrophobicContact CG-CG 4.21Å; E232-R263 IonicContact OE1-CZ 3.99Å; E232-R263 IonicContact OE1-NE 2.92Å; E232-R263 PolarHBondContact OE1-NE 3.46Å; E232-R263 IonicContact OE1-NH2 3.61Å; E232-R263 PolarHBondContact OE1-NH2 2.87Å; E232-R263 IonicContact OE2-CZ 2.87Å; E232-R263 IonicContact OE2-NE 2.91Å; E232-R263 IonicContact OE2-NH2 2.74Å; E232-R263 PolarHBondContact OE2-NH2 3.01Å
233	R	65.6	Low	67.7	Low	165 Å²	165	80.1 Å²	80.1	62%	0.623	46%	0.46	S	S	*	.			trans	-142.1	127.6	169.2	-69.2	-164	178.5	-144.2	-0	110.5	R187 P231	R187-R233 PolarHBondContact NH1-O 2.9Å; P231-R233 VanDerWaalsContact C-N 3.31Å; P231-R233 PolarHBondContact O-N 2.83Å
234	G	87.7	Confident	68.9	Low	28 Å²	28	80 Å²	80	29%	0.289	46%	0.457	S	S	.	.			trans	-61	162	170.5	0	0	0	0	0	111.8	V260	G234-V260 CarbonylContact C-O 3.54Å; G234-V260 WeakPolarHBondContact CA-O 3.49Å
235	F	93.7	Very high	70.5	Confident	10 Å²	10	76.6 Å²	76.6	4%	0.044	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	165	176.3	63.7	-82.1	0	0	0	110	M184 R187 I237 V260 L284	M184-F235 HydrophobicContact SD-CE2 3.77Å; M184-F235 HydrophobicContact SD-CZ 3.76Å; R187-F235 HydrophobicContact CB-CD1 4.49Å; R187-F235 HydrophobicContact CB-CE1 4.1Å; R187-F235 HydrophobicContact CB-CZ 4.13Å; R187-F235 HydrophobicContact CG-CD1 3.91Å; R187-F235 HydrophobicContact CG-CD2 4.13Å; R187-F235 HydrophobicContact CG-CE1 4.01Å; R187-F235 HydrophobicContact CG-CE2 4.23Å; R187-F235 HydrophobicContact CG-CG 3.98Å; R187-F235 HydrophobicContact CG-CZ 4.17Å; F235-I237 HydrophobicContact CD2-CG2 3.72Å; F235-I237 HydrophobicContact CE2-CD1 4.36Å; F235-I237 HydrophobicContact CE2-CG1 4.36Å; F235-I237 HydrophobicContact CE2-CG2 3.55Å; F235-V260 HydrophobicContact CD1-CB 4.16Å; F235-V260 HydrophobicContact CD1-CG1 4.31Å; F235-V260 HydrophobicContact CD2-CB 4.46Å; F235-V260 HydrophobicContact CE1-CB 3.8Å; F235-V260 HydrophobicContact CE1-CG1 3.55Å; F235-V260 HydrophobicContact CE2-CB 4.12Å; F235-V260 HydrophobicContact CE2-CG1 4.41Å; F235-V260 HydrophobicContact CE2-CG2 4.31Å; F235-V260 HydrophobicContact CG-CB 4.47Å; F235-V260 HydrophobicContact CZ-CB 3.78Å; F235-V260 HydrophobicContact CZ-CG1 3.6Å; F235-V260 HydrophobicContact CZ-CG2 4.27Å; F235-V260 PolarHBondContact N-O 3.45Å; F235-V260 PolarHBondContact O-N 2.87Å; F235-L284 HydrophobicContact CE1-CD2 4.42Å; F235-L284 HydrophobicContact CZ-CD2 4.27Å
236	F	95.4	Very high	71	Confident	12 Å²	12	83 Å²	83	5%	0.053	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.4	-176.9	-58.4	-82.4	0	0	0	109.5	V257 I258 H259 L291 D357 K361 V364 V365	F236-V257 HydrophobicContact CB-CG1 4.21Å; F236-V257 HydrophobicContact CD1-CG1 4.28Å; F236-I258 WeakPolarHBondContact CA-O 3.27Å; F236-H259 HydrophobicContact CD1-CB 3.9Å; F236-H259 HydrophobicContact CE1-CB 3.62Å; F236-H259 AromaticContact CE1-CD2 3.46Å; F236-H259 VanDerWaalsContact CE1-CD2 3.46Å; F236-H259 WeakPolarHBondContact CE1-CD2 3.45Å; F236-H259 AromaticContact CE1-CG 3.56Å; F236-H259 AromaticContact CZ-CD2 3.66Å; F236-L291 HydrophobicContact CD1-CD1 4.04Å; F236-L291 HydrophobicContact CE1-CD1 3.98Å; F236-D357 HydrophobicContact CD2-CB 4.46Å; F236-K361 HydrophobicContact CB-CD 3.66Å; F236-K361 WeakPolarHBondContact O-CD 3.27Å; F236-K361 WeakPolarHBondContact O-CE 3.35Å; F236-K361 PolarHBondContact O-NZ 2.8Å; F236-V364 HydrophobicContact CD2-CG2 4.14Å; F236-V364 HydrophobicContact CE2-CG2 3.56Å; F236-V364 HydrophobicContact CZ-CG2 3.79Å; F236-V365 HydrophobicContact CE1-CB 4.26Å; F236-V365 HydrophobicContact CE1-CG2 4.17Å; F236-V365 HydrophobicContact CZ-CB 4.02Å; F236-V365 HydrophobicContact CZ-CG2 4.43Å; F236-V365 WeakPolarHBondContact CZ-O 3.32Å
237	I	95.8	Very high	71.6	Confident	0 Å²	0	82.2 Å²	82.2	0%	0	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	152.1	173	50.2	169.8	0	0	0	109.8	I176 D180 M184 F235 M239 I258 V260	I176-I237 HydrophobicContact CD1-CD1 3.68Å; I176-I237 HydrophobicContact CG1-CD1 4.02Å; I176-I237 HydrophobicContact CG2-CB 4.47Å; D180-I237 HydrophobicContact CB-CG2 4.27Å; M184-I237 HydrophobicContact SD-CD1 4.49Å; F235-I237 HydrophobicContact CD2-CG2 3.72Å; F235-I237 HydrophobicContact CE2-CD1 4.36Å; F235-I237 HydrophobicContact CE2-CG1 4.36Å; F235-I237 HydrophobicContact CE2-CG2 3.55Å; I237-M239 HydrophobicContact CD1-CG 3.92Å; I237-M239 HydrophobicContact CD1-SD 4.04Å; I237-M239 HydrophobicContact CG1-CG 4.26Å; I237-I258 HydrophobicContact CG1-CB 4.36Å; I237-I258 PolarHBondContact N-O 2.81Å; I237-I258 PolarHBondContact O-N 3.25Å; I237-V260 HydrophobicContact CD1-CG2 3.72Å; I237-V260 HydrophobicContact CG1-CG2 3.71Å
238	R	95.4	Very high	71.6	Confident	50 Å²	50	82 Å²	82	19%	0.189	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	120.1	170.7	-68.5	168.2	-69	-172.1	-6.9	109.6	I176 H177 D180 Y255 K256 V257	I176-R238 CarbonylContact C-O 2.98Å; I176-R238 WeakPolarHBondContact CA-O 3.31Å; H177-R238 HydrophobicContact CB-CB 3.63Å; H177-R238 PolarHBondContact N-O 2.86Å; H177-R238 PolarHBondContact ND1-NH2 3.46Å; D180-R238 IonicContact OD1-CZ 2.66Å; D180-R238 IonicContact OD1-NE 2.73Å; D180-R238 PolarHBondContact OD1-NE 3.01Å; D180-R238 IonicContact OD1-NH2 3.1Å; D180-R238 PolarHBondContact OD1-NH2 3.05Å; D180-R238 VanDerWaalsContact OD2-CB 3.3Å; D180-R238 WeakPolarHBondContact OD2-CB 3.48Å; D180-R238 IonicContact OD2-CZ 2.73Å; D180-R238 PolarHBondContact OD2-N 3.48Å; D180-R238 IonicContact OD2-NE 3.27Å; D180-R238 PolarHBondContact OD2-NE 3.28Å; D180-R238 IonicContact OD2-NH2 3.76Å; R238-Y255 HydrophobicContact CB-CD1 4.37Å; R238-K256 CarbonylContact C-O 3.48Å; R238-K256 VanDerWaalsContact CA-O 3.3Å; R238-K256 WeakPolarHBondContact CA-O 3.43Å; R238-V257 HydrophobicContact CG-CG2 4.12Å
239	M	96.2	Very high	71.1	Confident	1 Å²	1	84.7 Å²	84.7	1%	0.005	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	146.9	177.3	-65.8	-171.8	71.4	0	0	111.6	F139 F149 L160 Y175 I176 I237 Y255 K256 I258	F139-M239 HydrophobicContact CE2-SD 4.48Å; F139-M239 HydrophobicContact CZ-SD 4.06Å; F149-M239 HydrophobicContact CZ-CE 4.08Å; L160-M239 HydrophobicContact CD1-CB 3.95Å; L160-M239 HydrophobicContact CD1-CE 4.11Å; L160-M239 HydrophobicContact CD1-SD 4.22Å; L160-M239 HydrophobicContact CD2-CB 4.45Å; Y175-M239 CarbonylContact O-C 3.6Å; Y175-M239 VanDerWaalsContact O-CA 3.29Å; Y175-M239 WeakPolarHBondContact O-CA 3.46Å; I176-M239 HydrophobicContact CG1-CG 4.31Å; I237-M239 HydrophobicContact CD1-CG 3.92Å; I237-M239 HydrophobicContact CD1-SD 4.04Å; I237-M239 HydrophobicContact CG1-CG 4.26Å; M239-Y255 CarbonylContact O-C 3.55Å; M239-Y255 WeakPolarHBondContact O-CA 3.32Å; M239-K256 PolarHBondContact N-O 3.06Å; M239-K256 PolarHBondContact O-N 3.22Å; M239-I258 HydrophobicContact CB-CG1 3.87Å; M239-I258 HydrophobicContact CG-CB 4.43Å; M239-I258 HydrophobicContact CG-CG1 3.85Å; M239-I258 HydrophobicContact SD-CB 4.42Å; M239-I258 HydrophobicContact SD-CG1 4.02Å; M239-I258 HydrophobicContact SD-CG2 4.43Å
240	K	94.8	Very high	70.9	Confident	86 Å²	86	82.7 Å²	82.7	37%	0.374	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.3	140	177.6	-74.9	-178.4	-179	165.9	0	110.6	L162 D174 Y175 G254 Y255	L162-K240 HydrophobicContact CD1-CB 4.47Å; L162-K240 WeakPolarHBondContact CD1-O 3.38Å; D174-K240 VanDerWaalsContact O-CE 3.25Å; D174-K240 WeakPolarHBondContact O-CE 3.42Å; D174-K240 PolarHBondContact O-NZ 2.89Å; Y175-K240 PolarHBondContact O-N 3.1Å; K240-G254 CarbonylContact C-O 3.56Å; K240-G254 WeakPolarHBondContact CA-O 3.38Å; K240-Y255 HydrophobicContact CB-CE1 4.4Å; K240-Y255 HydrophobicContact CG-CD1 4.05Å; K240-Y255 HydrophobicContact CG-CE1 3.43Å; K240-Y255 VanDerWaalsContact CG-CE1 3.43Å
241	S	91.9	Very high	70.4	Confident	10 Å²	10	89.3 Å²	89.3	7%	0.07	45%	0.454	C	S	.	.			trans	-138.8	134.5	174.6	-173.5	0	0	0	0	110.7	L160 L243 G254	L160-S241 CarbonylContact O-C 3.52Å; L160-S241 WeakPolarHBondContact O-CA 3.3Å; L160-S241 PolarHBondContact O-OG 2.92Å; S241-L243 PolarHBondContact OG-N 2.81Å; S241-G254 PolarHBondContact N-O 3.28Å
242	T	90.5	Very high	70.5	Confident	89 Å²	89	86.7 Å²	86.7	55%	0.546	44%	0.438	S	S	.	.			trans	-96	-3.4	174.1	56.6	0	0	0	0	112	L160 G161 L162 T244	L160-T242 PolarHBondContact O-N 3.23Å; L160-T242 PolarHBondContact O-OG1 2.87Å; G161-T242 VanDerWaalsContact CA-OG1 3.24Å; G161-T242 WeakPolarHBondContact CA-OG1 3.3Å; G161-T242 PolarHBondContact O-OG1 3.24Å; L162-T242 HydrophobicContact CD2-CG2 3.88Å; T242-T244 PolarHBondContact O-N 2.86Å
243	L	84.6	Confident	70.5	Confident	64 Å²	64	85.7 Å²	85.7	34%	0.335	45%	0.445	S	S	.	.			trans	-73.9	111.3	178.2	-61.5	176	0	0	0	110	I158 Y159 S241	I158-L243 VanDerWaalsContact O-CD1 3.27Å; I158-L243 WeakPolarHBondContact O-CD1 3.14Å; Y159-L243 VanDerWaalsContact C-CD1 3.49Å; Y159-L243 VanDerWaalsContact O-CD1 3.29Å; Y159-L243 WeakPolarHBondContact O-CD1 3.24Å; S241-L243 PolarHBondContact OG-N 2.81Å
244	T	67.3	Low	71.4	Confident	112 Å²	112	79 Å²	79	69%	0.687	43%	0.427	S	S	*	.			trans	-75.3	128.2	167.3	55.6	0	0	0	0	108.9	T242 R246	T242-T244 PolarHBondContact O-N 2.86Å; T244-R246 PolarHBondContact O-N 3.21Å
245	K	60.9	Low	71.6	Confident	94 Å²	94	80.4 Å²	80.4	41%	0.409	42%	0.424	S	S	.	.			trans	-57.4	114.1	173.2	-164.3	174.7	-176.6	-179.6	0	107.6	G247 L248 T295 E298	K245-G247 PolarHBondContact O-N 3.05Å; K245-G247 VanDerWaalsContact O-N 3.12Å; K245-L248 PolarHBondContact O-N 3.17Å; K245-T295 PolarHBondContact NZ-OG1 2.79Å; K245-E298 WeakPolarHBondContact CE-OE1 3.19Å; K245-E298 IonicContact NZ-OE1 3.15Å; K245-E298 PolarHBondContact NZ-OE1 2.97Å; K245-E298 IonicContact NZ-OE2 3.92Å
246	R	49.1	Very low	71.5	Confident	252 Å²	252	83.3 Å²	83.3	95%	0.951	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	122.6	-179	-69.3	-171.6	-155.4	170.4	7.4	108.2	T244	T244-R246 PolarHBondContact O-N 3.21Å
247	G	42.2	Very low	71.4	Confident	80 Å²	80	83.1 Å²	83.1	83%	0.825	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	103	-5.3	171.6	0	0	0	0	0	117.3	K245	K245-G247 PolarHBondContact O-N 3.05Å; K245-G247 VanDerWaalsContact O-N 3.12Å
248	L	38.1	Very low	71.4	Confident	91 Å²	91	83.1 Å²	83.1	48%	0.476	44%	0.437	S	S	.	.			trans	-123	117.7	166.5	-109.1	79.5	0	0	0	109.5	K245 V250	K245-L248 PolarHBondContact O-N 3.17Å; L248-V250 HydrophobicContact CB-CG2 4.44Å; L248-V250 HydrophobicContact CD2-CG2 4.14Å; L248-V250 HydrophobicContact CG-CG2 4.5Å; L248-V250 PolarHBondContact O-N 3.04Å
249	H	33.8	Very low	71.4	Confident	211 Å²	211	82.4 Å²	82.4	98%	0.977	44%	0.436	S	S	*	.			trans	-68.3	54.5	169.1	-110.7	90.8	0	0	0	110.8
250	V	40.5	Very low	71.4	Confident	80 Å²	80	82.4 Å²	82.4	49%	0.485	44%	0.435	S	S	.	.			trans	-130.8	119.4	178.5	-175.4	0	0	0	0	107	L248 S252	L248-V250 HydrophobicContact CB-CG2 4.44Å; L248-V250 HydrophobicContact CD2-CG2 4.14Å; L248-V250 HydrophobicContact CG-CG2 4.5Å; L248-V250 PolarHBondContact O-N 3.04Å; V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 2.72Å
251	K	42.1	Very low	71.4	Confident	205 Å²	205	80.4 Å²	80.4	89%	0.891	43%	0.431	S	S	*	.			trans	-53.1	100.6	167.5	-59.8	176.2	-177.1	179.3	0	106.2
252	S	52.9	Low	71.4	Confident	58 Å²	58	81.3 Å²	81.3	41%	0.406	44%	0.441	S	S	.	.			trans	-51.3	150.9	157.2	66.7	0	0	0	0	105.5	V250 G254	V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 2.72Å; S252-G254 PolarHBondContact O-N 3.17Å
253	S	62.3	Low	71.4	Confident	101 Å²	101	84 Å²	84	71%	0.706	44%	0.442	S	S	*	.			trans	-56	4.8	-176.1	54.7	0	0	0	0	114.8	Y255	S253-Y255 VanDerWaalsContact C-N 3.26Å; S253-Y255 WeakPolarHBondContact O-CD2 3.43Å
254	G	85.3	Confident	71.7	Confident	25 Å²	25	82.9 Å²	82.9	26%	0.258	44%	0.435	S	S	.	.	S	Bend	trans	82.3	9.5	-177.3	0	0	0	0	0	110.9	K240 S241 S252	K240-G254 CarbonylContact C-O 3.56Å; K240-G254 WeakPolarHBondContact CA-O 3.38Å; S241-G254 PolarHBondContact N-O 3.28Å; S252-G254 PolarHBondContact O-N 3.17Å
255	Y	90	Very high	72.8	Confident	57 Å²	57	78.4 Å²	78.4	22%	0.224	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149	-177.2	-63	-89.6	0	0	0	112.6	H177 R238 M239 K240 S253	H177-Y255 HydrophobicContact CB-CD1 3.85Å; H177-Y255 HydrophobicContact CB-CE1 3.81Å; H177-Y255 HydrophobicContact CB-CG 4.41Å; H177-Y255 AromaticContact CD2-CD2 3.85Å; H177-Y255 AromaticContact CD2-CE2 3.79Å; R238-Y255 HydrophobicContact CB-CD1 4.37Å; M239-Y255 CarbonylContact O-C 3.55Å; M239-Y255 WeakPolarHBondContact O-CA 3.32Å; K240-Y255 HydrophobicContact CB-CE1 4.4Å; K240-Y255 HydrophobicContact CG-CD1 4.05Å; K240-Y255 HydrophobicContact CG-CE1 3.43Å; K240-Y255 VanDerWaalsContact CG-CE1 3.43Å; S253-Y255 VanDerWaalsContact C-N 3.26Å; S253-Y255 WeakPolarHBondContact O-CD2 3.43Å
256	K	91.8	Very high	74	Confident	71 Å²	71	75.2 Å²	75.2	31%	0.309	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	145.1	168.2	-74.5	-174	175	-171.8	0	110	Y159 L160 R238 M239 I258 T290	Y159-K256 WeakPolarHBondContact O-CD 3.3Å; Y159-K256 PolarHBondContact O-NZ 3.1Å; L160-K256 HydrophobicContact CD2-CB 4.13Å; L160-K256 HydrophobicContact CD2-CD 4.19Å; R238-K256 CarbonylContact C-O 3.48Å; R238-K256 VanDerWaalsContact CA-O 3.3Å; R238-K256 WeakPolarHBondContact CA-O 3.43Å; M239-K256 PolarHBondContact N-O 3.06Å; M239-K256 PolarHBondContact O-N 3.22Å; K256-I258 HydrophobicContact CB-CD1 4.32Å; K256-T290 HydrophobicContact CD-CG2 4.35Å
257	V	93.4	Very high	75.8	Confident	9 Å²	9	67.1 Å²	67.1	6%	0.055	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	129.8	170.8	-174.2	0	0	0	0	108.7	F236 R238 L291 K361 Q363	F236-V257 HydrophobicContact CB-CG1 4.21Å; F236-V257 HydrophobicContact CD1-CG1 4.28Å; R238-V257 HydrophobicContact CG-CG2 4.12Å; V257-L291 HydrophobicContact CB-CD1 4.43Å; V257-L291 HydrophobicContact CG1-CD1 3.92Å; V257-K361 HydrophobicContact CG2-CB 4.48Å; V257-K361 WeakPolarHBondContact CG2-O 3.29Å; V257-Q363 HydrophobicContact CB-CB 4.04Å; V257-Q363 HydrophobicContact CB-CG 4.39Å; V257-Q363 HydrophobicContact CG1-CB 4.17Å; V257-Q363 HydrophobicContact CG2-CB 4.04Å; V257-Q363 HydrophobicContact CG2-CG 4.12Å
258	I	95.6	Very high	77.6	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.8	-179.1	-54.2	-60	0	0	0	108.3	F139 L160 F236 I237 M239 K256 V260 A288 T290	F139-I258 HydrophobicContact CE1-CD1 4.41Å; F139-I258 HydrophobicContact CZ-CG2 4.23Å; L160-I258 HydrophobicContact CD2-CD1 3.83Å; L160-I258 HydrophobicContact CD2-CG1 4.47Å; F236-I258 WeakPolarHBondContact CA-O 3.27Å; I237-I258 HydrophobicContact CG1-CB 4.36Å; I237-I258 PolarHBondContact N-O 2.81Å; I237-I258 PolarHBondContact O-N 3.25Å; M239-I258 HydrophobicContact CB-CG1 3.87Å; M239-I258 HydrophobicContact CG-CB 4.43Å; M239-I258 HydrophobicContact CG-CG1 3.85Å; M239-I258 HydrophobicContact SD-CB 4.42Å; M239-I258 HydrophobicContact SD-CG1 4.02Å; M239-I258 HydrophobicContact SD-CG2 4.43Å; K256-I258 HydrophobicContact CB-CD1 4.32Å; I258-V260 HydrophobicContact CG2-CG2 4.02Å; I258-A288 HydrophobicContact CG2-CB 3.38Å; I258-T290 HydrophobicContact CD1-CG2 3.55Å
259	H	95.8	Very high	79.5	Confident	35 Å²	35	64.1 Å²	64.1	16%	0.162	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	111.7	169.5	-178	-149.3	0	0	0	108.8	F236 T261 A288 H289 L291	F236-H259 HydrophobicContact CD1-CB 3.9Å; F236-H259 HydrophobicContact CE1-CB 3.62Å; F236-H259 AromaticContact CE1-CD2 3.46Å; F236-H259 VanDerWaalsContact CE1-CD2 3.46Å; F236-H259 WeakPolarHBondContact CE1-CD2 3.45Å; F236-H259 AromaticContact CE1-CG 3.56Å; F236-H259 AromaticContact CZ-CD2 3.66Å; H259-T261 VanDerWaalsContact CE1-CG2 3.42Å; H259-T261 WeakPolarHBondContact CE1-CG2 3.29Å; H259-T261 WeakPolarHBondContact NE2-CG2 3.4Å; H259-A288 WeakPolarHBondContact O-CA 3.45Å; H259-H289 PolarHBondContact N-O 3.46Å; H259-H289 PolarHBondContact O-N 2.78Å; H259-L291 HydrophobicContact CB-CD2 4.11Å
260	V	96.6	Very high	81.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.2	-179.8	-179.1	0	0	0	0	108.7	F141 G234 F235 I237 I258 L284 A286 L287	F141-V260 HydrophobicContact CE1-CG1 4.11Å; F141-V260 HydrophobicContact CE1-CG2 4.39Å; F141-V260 HydrophobicContact CZ-CG1 3.73Å; F141-V260 HydrophobicContact CZ-CG2 4.25Å; G234-V260 CarbonylContact C-O 3.54Å; G234-V260 WeakPolarHBondContact CA-O 3.49Å; F235-V260 HydrophobicContact CD1-CB 4.16Å; F235-V260 HydrophobicContact CD1-CG1 4.31Å; F235-V260 HydrophobicContact CD2-CB 4.46Å; F235-V260 HydrophobicContact CE1-CB 3.8Å; F235-V260 HydrophobicContact CE1-CG1 3.55Å; F235-V260 HydrophobicContact CE2-CB 4.12Å; F235-V260 HydrophobicContact CE2-CG1 4.41Å; F235-V260 HydrophobicContact CE2-CG2 4.31Å; F235-V260 HydrophobicContact CG-CB 4.47Å; F235-V260 HydrophobicContact CZ-CB 3.78Å; F235-V260 HydrophobicContact CZ-CG1 3.6Å; F235-V260 HydrophobicContact CZ-CG2 4.27Å; F235-V260 PolarHBondContact N-O 3.45Å; F235-V260 PolarHBondContact O-N 2.87Å; I237-V260 HydrophobicContact CD1-CG2 3.72Å; I237-V260 HydrophobicContact CG1-CG2 3.71Å; I258-V260 HydrophobicContact CG2-CG2 4.02Å; V260-L284 HydrophobicContact CG1-CD2 4.37Å; V260-A286 HydrophobicContact CG1-CB 3.6Å; V260-L287 CarbonylContact C-O 3.56Å; V260-L287 WeakPolarHBondContact CA-O 3.41Å
261	T	94.5	Very high	82.5	Confident	45 Å²	45	61.7 Å²	61.7	28%	0.276	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.5	172.4	54	0	0	0	0	109	H259 A286 L287	H259-T261 VanDerWaalsContact CE1-CG2 3.42Å; H259-T261 WeakPolarHBondContact CE1-CG2 3.29Å; H259-T261 WeakPolarHBondContact NE2-CG2 3.4Å; T261-A286 CarbonylContact O-C 3.32Å; T261-A286 VanDerWaalsContact O-CA 3.32Å; T261-A286 WeakPolarHBondContact O-CA 3.43Å; T261-L287 PolarHBondContact N-O 2.96Å; T261-L287 PolarHBondContact O-N 3.01Å
262	G	92.8	Very high	83.7	Confident	28 Å²	28	58.2 Å²	58.2	29%	0.289	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.2	-174.5	-172.4	0	0	0	0	0	113.5	V285	G262-V285 CarbonylContact C-O 3.53Å; G262-V285 WeakPolarHBondContact CA-O 3.13Å
263	R	90.9	Very high	84.4	Confident	147 Å²	147	60 Å²	60	56%	0.555	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	145.4	-177.9	-63.3	-178.8	-178.3	91.9	4	110.6	E232 R265 V285	E232-R263 HydrophobicContact CG-CG 4.21Å; E232-R263 IonicContact OE1-CZ 3.99Å; E232-R263 IonicContact OE1-NE 2.92Å; E232-R263 PolarHBondContact OE1-NE 3.46Å; E232-R263 IonicContact OE1-NH2 3.61Å; E232-R263 PolarHBondContact OE1-NH2 2.87Å; E232-R263 IonicContact OE2-CZ 2.87Å; E232-R263 IonicContact OE2-NE 2.91Å; E232-R263 IonicContact OE2-NH2 2.74Å; E232-R263 PolarHBondContact OE2-NH2 3.01Å; R263-R265 PolarHBondContact O-N 2.7Å; R263-V285 PolarHBondContact N-O 3.48Å; R263-V285 PolarHBondContact O-N 3.4Å
264	I	90.4	Very high	84.7	Confident	39 Å²	39	58.1 Å²	58.1	20%	0.2	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	114	167.2	-62.2	-64.4	0	0	0	107.8	R187 P281 G283 L284	R187-I264 WeakPolarHBondContact O-CD1 3.45Å; I264-P281 HydrophobicContact CG2-CB 3.84Å; I264-G283 CarbonylContact C-O 3.53Å; I264-G283 WeakPolarHBondContact CA-O 3.32Å; I264-L284 HydrophobicContact CD1-CB 3.87Å; I264-L284 HydrophobicContact CD1-CD1 4.04Å
265	R	89.4	Confident	83.6	Confident	19 Å²	19	64.3 Å²	64.3	7%	0.072	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	134.9	175.4	-166	173.2	-173.7	-162.1	-9.3	108.9	F91 A92 G95 P97 W99 R263 M282 G283 V285	F91-R265 HydrophobicContact CE1-CB 4.32Å; F91-R265 HydrophobicContact CE2-CB 4.42Å; F91-R265 HydrophobicContact CZ-CB 3.7Å; F91-R265 HydrophobicContact CZ-CG 4.28Å; F91-R265 PolarHBondContact O-NH1 2.84Å; F91-R265 VanDerWaalsContact O-NH1 3.09Å; A92-R265 PolarHBondContact O-NH2 3.42Å; G95-R265 PolarHBondContact O-NH2 3.13Å; P97-R265 PolarHBondContact O-NH2 2.96Å; W99-R265 VanDerWaalsContact CD1-NH2 3.32Å; W99-R265 VanDerWaalsContact CZ2-NH1 3.31Å; R263-R265 PolarHBondContact O-N 2.7Å; R265-M282 WeakPolarHBondContact O-CB 3.47Å; R265-M282 PolarHBondContact O-N 2.78Å; R265-G283 PolarHBondContact N-O 3.03Å; R265-V285 HydrophobicContact CB-CG2 4.08Å
266	C	87.6	Confident	82.2	Confident	26 Å²	26	71.2 Å²	71.2	18%	0.176	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	156.9	177.8	-66.2	0	0	0	0	110.6	D96 R279 R280	D96-C266 PolarHBondContact N-O 3.14Å; C266-R279 HydrophobicContact CB-CB 3.82Å; C266-R279 HydrophobicContact CB-CG 4.35Å; C266-R280 CarbonylContact C-O 3.46Å; C266-R280 WeakPolarHBondContact CA-O 3.29Å
267	R	86.9	Confident	80.9	Confident	83 Å²	83	72.1 Å²	72.1	31%	0.313	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	148.2	164.8	58.9	-177.5	-177.4	166.8	6.1	110.7	Q94 A269 R280 M282	Q94-R267 WeakPolarHBondContact O-CB 3.29Å; R267-A269 PolarHBondContact O-N 3.04Å; R267-R280 HydrophobicContact CG-CB 4.21Å; R267-R280 PolarHBondContact N-O 3.11Å; R267-R280 PolarHBondContact O-N 3.02Å; R267-M282 HydrophobicContact CB-CG 4.14Å; R267-M282 HydrophobicContact CB-SD 3.6Å; R267-M282 HydrophobicContact CG-CG 3.93Å; R267-M282 HydrophobicContact CG-SD 4.03Å
268	P	79.9	Confident	79.9	Confident	76 Å²	76	75.2 Å²	75.2	49%	0.494	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	133	170.6	-15.4	30.2	0	0	0	109.9	D96	D96-P268 HydrophobicContact CB-CG 4.27Å
269	A	76.2	Confident	79.1	Confident	31 Å²	31	81.6 Å²	81.6	26%	0.256	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.2	168.5	0	0	0	0	0	108.6	R267 V278	R267-A269 PolarHBondContact O-N 3.04Å; A269-V278 WeakPolarHBondContact CA-O 3.19Å; A269-V278 WeakPolarHBondContact CB-O 3.13Å; A269-V278 PolarHBondContact N-O 2.7Å; A269-V278 PolarHBondContact O-N 3.37Å
270	L	70.7	Confident	78.5	Confident	171 Å²	171	86.2 Å²	86.2	90%	0.895	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-78.9	118.9	170.6	-70.5	163.6	0	0	0	107.9
271	V	68.4	Low	78.1	Confident	69 Å²	69	89.4 Å²	89.4	42%	0.418	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-94.5	120.6	170.1	-179	0	0	0	0	107.3	G273 S274 V278	V271-G273 PolarHBondContact O-N 3.33Å; V271-S274 PolarHBondContact O-N 2.8Å; V271-V278 HydrophobicContact CG2-CB 4.19Å; V271-V278 HydrophobicContact CG2-CG2 3.67Å
272	P	65.9	Low	78	Confident	132 Å²	132	88.1 Å²	88.1	86%	0.857	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	126	176.6	-24.8	33.8	0	0	0	110.9
273	G	68	Low	77.9	Confident	96 Å²	96	86.9 Å²	86.9	99%	0.99	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	2.2	176.9	0	0	0	0	0	116.7	V271	V271-G273 PolarHBondContact O-N 3.33Å
274	S	69.1	Low	78.1	Confident	62 Å²	62	80.2 Å²	80.2	43%	0.434	45%	0.451	S	S	.	.			trans	-114.9	135.5	175.2	179	0	0	0	0	111.4	V271 R276	V271-S274 PolarHBondContact O-N 2.8Å; S274-R276 VanDerWaalsContact C-N 3.26Å; S274-R276 PolarHBondContact OG-N 3.26Å
275	T	61.5	Low	78.4	Confident	154 Å²	154	80 Å²	80	95%	0.945	45%	0.452	S	S	*	.	S	Bend	trans	-78.9	-7.7	172.3	55.2	0	0	0	0	113
276	R	61.7	Low	78.7	Confident	202 Å²	202	79.3 Å²	79.3	76%	0.762	45%	0.45	S	S	*	.	S	Bend	trans	-90.8	123.7	176.4	-87.8	-177.3	163.3	-173.7	-5.8	111	S274 V278	S274-R276 VanDerWaalsContact C-N 3.26Å; S274-R276 PolarHBondContact OG-N 3.26Å; R276-V278 PolarHBondContact O-N 2.8Å
277	S	63.4	Low	79.1	Confident	91 Å²	91	81 Å²	81	64%	0.636	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-69.4	125	167.5	54.8	0	0	0	0	109.8
278	V	72.1	Confident	79.6	Confident	73 Å²	73	77 Å²	77	44%	0.442	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	129.4	173.8	178.9	0	0	0	0	107.8	A269 V271 R276	A269-V278 WeakPolarHBondContact CA-O 3.19Å; A269-V278 WeakPolarHBondContact CB-O 3.13Å; A269-V278 PolarHBondContact N-O 2.7Å; A269-V278 PolarHBondContact O-N 3.37Å; V271-V278 HydrophobicContact CG2-CB 4.19Å; V271-V278 HydrophobicContact CG2-CG2 3.67Å; R276-V278 PolarHBondContact O-N 2.8Å
279	R	79.4	Confident	80.2	Confident	135 Å²	135	75.9 Å²	75.9	51%	0.509	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	120.1	176.6	-75.3	-177.3	173	178.6	-3.5	109.5	D229 C266	D229-R279 IonicContact OD1-NH1 2.64Å; C266-R279 HydrophobicContact CB-CB 3.82Å; C266-R279 HydrophobicContact CB-CG 4.35Å
280	R	83.9	Confident	80.8	Confident	132 Å²	132	75.7 Å²	75.7	50%	0.498	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.3	175.9	-173.4	169.5	178.1	172.6	3.5	110.1	C266 R267	C266-R280 CarbonylContact C-O 3.46Å; C266-R280 WeakPolarHBondContact CA-O 3.29Å; R267-R280 HydrophobicContact CG-CB 4.21Å; R267-R280 PolarHBondContact N-O 3.11Å; R267-R280 PolarHBondContact O-N 3.02Å
281	P	87.7	Confident	81.5	Confident	66 Å²	66	68.5 Å²	68.5	43%	0.429	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	139	174.2	-24.3	34	0	0	0	111.5	I264	I264-P281 HydrophobicContact CG2-CB 3.84Å
282	M	91.1	Very high	81.6	Confident	18 Å²	18	67.3 Å²	67.3	9%	0.089	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-35	176.8	-60.5	176.1	70.1	0	0	111.9	F91 Q94 G95 Q145 R265 R267	F91-M282 HydrophobicContact CB-CE 4.42Å; F91-M282 HydrophobicContact CD2-CB 3.91Å; F91-M282 HydrophobicContact CD2-CE 3.99Å; F91-M282 HydrophobicContact CE2-CB 3.6Å; F91-M282 HydrophobicContact CG-CE 4.29Å; Q94-M282 HydrophobicContact CB-CE 3.78Å; G95-M282 VanDerWaalsContact CA-SD 3.55Å; Q145-M282 WeakPolarHBondContact CB-O 3.24Å; Q145-M282 PolarHBondContact N-O 3.25Å; R265-M282 WeakPolarHBondContact O-CB 3.47Å; R265-M282 PolarHBondContact O-N 2.78Å; R267-M282 HydrophobicContact CB-CG 4.14Å; R267-M282 HydrophobicContact CB-SD 3.6Å; R267-M282 HydrophobicContact CG-CG 3.93Å; R267-M282 HydrophobicContact CG-SD 4.03Å
283	G	92.6	Very high	81.6	Confident	2 Å²	2	63.7 Å²	63.7	2%	0.021	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.7	174.1	-174.4	0	0	0	0	0	112.7	V143 I264 R265	V143-G283 CarbonylContact O-C 3.51Å; V143-G283 WeakPolarHBondContact O-CA 3.14Å; I264-G283 CarbonylContact C-O 3.53Å; I264-G283 WeakPolarHBondContact CA-O 3.32Å; R265-G283 PolarHBondContact N-O 3.03Å
284	L	94.9	Very high	81.3	Confident	7 Å²	7	61.4 Å²	61.4	4%	0.037	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.3	179.4	177	69.6	0	0	0	110.7	F141 V142 V143 M184 L188 F235 V260 I264 A286	F141-L284 HydrophobicContact CE2-CD2 4.16Å; F141-L284 HydrophobicContact CZ-CD2 4.34Å; V142-L284 CarbonylContact C-O 3.58Å; V142-L284 VanDerWaalsContact CA-O 3.31Å; V142-L284 WeakPolarHBondContact CA-O 3.34Å; V143-L284 PolarHBondContact N-O 3.3Å; V143-L284 PolarHBondContact O-N 2.96Å; M184-L284 HydrophobicContact CE-CD2 4.1Å; L188-L284 HydrophobicContact CD2-CB 3.59Å; L188-L284 HydrophobicContact CD2-CD2 4.44Å; F235-L284 HydrophobicContact CE1-CD2 4.42Å; F235-L284 HydrophobicContact CZ-CD2 4.27Å; V260-L284 HydrophobicContact CG1-CD2 4.37Å; I264-L284 HydrophobicContact CD1-CB 3.87Å; I264-L284 HydrophobicContact CD1-CD1 4.04Å; L284-A286 HydrophobicContact CD1-CB 4.26Å; L284-A286 HydrophobicContact CD2-CB 4.06Å; L284-A286 HydrophobicContact CG-CB 3.94Å
285	V	95.5	Very high	81.1	Confident	36 Å²	36	60.8 Å²	60.8	22%	0.218	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.7	165.2	-178.3	0	0	0	0	107.1	F91 W99 V142 G262 R263 R265	F91-V285 HydrophobicContact CE1-CG2 3.62Å; F91-V285 HydrophobicContact CZ-CG2 3.69Å; W99-V285 HydrophobicContact CH2-CG1 4.03Å; W99-V285 HydrophobicContact CH2-CG2 3.91Å; W99-V285 HydrophobicContact CZ2-CG1 4.22Å; W99-V285 HydrophobicContact CZ2-CG2 4.05Å; V142-V285 HydrophobicContact CG1-CG2 4.29Å; V142-V285 HydrophobicContact CG2-CG1 4.32Å; V142-V285 HydrophobicContact CG2-CG2 4.3Å; G262-V285 CarbonylContact C-O 3.53Å; G262-V285 WeakPolarHBondContact CA-O 3.13Å; R263-V285 PolarHBondContact N-O 3.48Å; R263-V285 PolarHBondContact O-N 3.4Å; R265-V285 HydrophobicContact CB-CG2 4.08Å
286	A	95.9	Very high	81.2	Confident	4 Å²	4	56.9 Å²	56.9	3%	0.033	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.2	-172.1	0	0	0	0	0	114.2	F141 V260 T261 L284	F141-A286 HydrophobicContact CD1-CB 4.43Å; F141-A286 HydrophobicContact CE1-CB 3.79Å; F141-A286 HydrophobicContact CE2-CB 4.22Å; F141-A286 HydrophobicContact CZ-CB 3.69Å; F141-A286 PolarHBondContact N-O 3.49Å; F141-A286 PolarHBondContact O-N 2.91Å; V260-A286 HydrophobicContact CG1-CB 3.6Å; T261-A286 CarbonylContact O-C 3.32Å; T261-A286 VanDerWaalsContact O-CA 3.32Å; T261-A286 WeakPolarHBondContact O-CA 3.43Å; L284-A286 HydrophobicContact CD1-CB 4.26Å; L284-A286 HydrophobicContact CD2-CB 4.06Å; L284-A286 HydrophobicContact CG-CB 3.94Å
287	L	96.3	Very high	81.1	Confident	60 Å²	60	55 Å²	55	31%	0.314	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	138.3	162.3	-67.1	166.5	0	0	0	108.5	L136 V140 V260 T261	L136-L287 HydrophobicContact CD1-CD2 3.9Å; L136-L287 HydrophobicContact CD2-CD2 4.06Å; V140-L287 HydrophobicContact CG2-CD2 3.62Å; V260-L287 CarbonylContact C-O 3.56Å; V260-L287 WeakPolarHBondContact CA-O 3.41Å; T261-L287 PolarHBondContact N-O 2.96Å; T261-L287 PolarHBondContact O-N 3.01Å
288	A	96.4	Very high	81.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.1	174.4	0	0	0	0	0	109.8	G138 F139 F141 I258 H259	G138-A288 CarbonylContact C-O 2.93Å; G138-A288 WeakPolarHBondContact CA-O 3.25Å; F139-A288 HydrophobicContact CD1-CB 4.11Å; F139-A288 HydrophobicContact CD2-CB 3.82Å; F139-A288 HydrophobicContact CE1-CB 3.72Å; F139-A288 HydrophobicContact CE2-CB 3.4Å; F139-A288 HydrophobicContact CG-CB 4.17Å; F139-A288 HydrophobicContact CZ-CB 3.34Å; F139-A288 PolarHBondContact N-O 3Å; F139-A288 PolarHBondContact O-N 3.27Å; F141-A288 HydrophobicContact CD1-CB 4.02Å; F141-A288 HydrophobicContact CE1-CB 3.68Å; I258-A288 HydrophobicContact CG2-CB 3.38Å; H259-A288 WeakPolarHBondContact O-CA 3.45Å
289	H	93	Very high	80.8	Confident	52 Å²	52	53.2 Å²	53.2	24%	0.241	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134	176.4	-57.9	81.7	0	0	0	109.2	D137 H259	D137-H289 PolarHBondContact O-CD2 3.33Å; H259-H289 PolarHBondContact N-O 3.46Å; H259-H289 PolarHBondContact O-N 2.78Å
290	T	89.5	Confident	80.3	Confident	28 Å²	28	57.1 Å²	57.1	17%	0.172	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	140.7	166.4	50.6	0	0	0	0	109.5	Y159 K256 I258	Y159-T290 HydrophobicContact CD1-CG2 3.94Å; Y159-T290 VanDerWaalsContact CD1-OG1 3.28Å; Y159-T290 WeakPolarHBondContact CD1-OG1 3.42Å; Y159-T290 HydrophobicContact CG-CG2 4.24Å; K256-T290 HydrophobicContact CD-CG2 4.35Å; I258-T290 HydrophobicContact CD1-CG2 3.55Å
291	L	84.6	Confident	79.9	Confident	20 Å²	20	53.9 Å²	53.9	11%	0.105	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-81.6	147.9	176.2	-60.6	177.4	0	0	0	111.1	F236 V257 H259 Q363 V365	F236-L291 HydrophobicContact CD1-CD1 4.04Å; F236-L291 HydrophobicContact CE1-CD1 3.98Å; V257-L291 HydrophobicContact CB-CD1 4.43Å; V257-L291 HydrophobicContact CG1-CD1 3.92Å; H259-L291 HydrophobicContact CB-CD2 4.11Å; L291-Q363 HydrophobicContact CB-CB 4.24Å; L291-Q363 HydrophobicContact CD1-CB 3.52Å; L291-V365 HydrophobicContact CD1-CG2 4.41Å; L291-V365 HydrophobicContact CD2-CG2 3.22Å; L291-V365 HydrophobicContact CG-CG2 4.45Å
292	P	70.7	Confident	79.3	Confident	43 Å²	43	56.1 Å²	56.1	28%	0.279	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-52	148.5	-179.4	-26.3	33.5	0	0	0	112.3	Q363	P292-Q363 PolarHBondContact O-NE2 2.98Å
293	P	65.8	Low	78.5	Confident	56 Å²	56	60.2 Å²	60.2	36%	0.364	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-63.5	157.7	-177.7	23.8	-32	0	0	0	113.3	T295 E298	P293-T295 PolarHBondContact O-N 3.42Å; P293-E298 WeakPolarHBondContact CB-OE2 3.29Å; P293-E298 HydrophobicContact CG-CB 3.71Å; P293-E298 HydrophobicContact CG-CG 4.4Å; P293-E298 WeakPolarHBondContact CG-OE2 3.15Å
294	S	62.8	Low	78.3	Confident	49 Å²	49	62.9 Å²	62.9	34%	0.343	33%	0.332	S	S	.	.	S	Bend	trans	-69.8	6.2	-168.9	-28	0	0	0	0	117.1	T386 S388	S294-T386 VanDerWaalsContact CA-CG2 3.43Å; S294-S388 PolarHBondContact O-OG 2.96Å
295	T	64.9	Low	78.2	Confident	48 Å²	48	62.7 Å²	62.7	29%	0.294	33%	0.331	S	S	.	.			trans	-121.9	125.3	-169.4	33.1	0	0	0	0	110.6	K245 P293 N297 E298	K245-T295 PolarHBondContact NZ-OG1 2.79Å; P293-T295 PolarHBondContact O-N 3.42Å; T295-N297 PolarHBondContact O-N 2.96Å; T295-N297 VanDerWaalsContact O-N 3.14Å; T295-E298 PolarHBondContact O-N 2.96Å; T295-E298 PolarHBondContact OG1-OE1 2.83Å
296	L	62.8	Low	78	Confident	73 Å²	73	61 Å²	61	38%	0.382	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-52.3	-39.8	-177.4	-171.3	52.2	0	0	0	113.2	E298 V299 V307 I400	L296-E298 PolarHBondContact O-N 3.08Å; L296-E298 VanDerWaalsContact O-N 3.11Å; L296-V299 PolarHBondContact O-N 3.23Å; L296-V307 HydrophobicContact CD1-CB 4.3Å; L296-V307 HydrophobicContact CD1-CG1 3.73Å; L296-V307 HydrophobicContact CD1-CG2 3.99Å; L296-I400 HydrophobicContact CB-CD1 3.79Å; L296-I400 HydrophobicContact CD1-CG2 4.09Å
297	N	60.4	Low	77.9	Confident	163 Å²	163	61 Å²	61	87%	0.872	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-65.5	-14.7	-176.4	-62.7	-2.3	0	0	0	113.8	T295	T295-N297 PolarHBondContact O-N 2.96Å; T295-N297 VanDerWaalsContact O-N 3.14Å
298	E	63.3	Low	77.8	Confident	101 Å²	101	58.2 Å²	58.2	47%	0.472	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-96.2	-5.8	177.7	-68.9	170.7	-136.1	0	0	112	K245 P293 T295 L296 R300	K245-E298 WeakPolarHBondContact CE-OE1 3.19Å; K245-E298 IonicContact NZ-OE1 3.15Å; K245-E298 PolarHBondContact NZ-OE1 2.97Å; K245-E298 IonicContact NZ-OE2 3.92Å; P293-E298 WeakPolarHBondContact CB-OE2 3.29Å; P293-E298 HydrophobicContact CG-CB 3.71Å; P293-E298 HydrophobicContact CG-CG 4.4Å; P293-E298 WeakPolarHBondContact CG-OE2 3.15Å; T295-E298 PolarHBondContact O-N 2.96Å; T295-E298 PolarHBondContact OG1-OE1 2.83Å; L296-E298 PolarHBondContact O-N 3.08Å; L296-E298 VanDerWaalsContact O-N 3.11Å; E298-R300 PolarHBondContact O-N 2.89Å
299	V	64.8	Low	77.6	Confident	25 Å²	25	63.8 Å²	63.8	15%	0.152	33%	0.327	C	S	.	.			trans	-84	110	179.1	-164.4	0	0	0	0	109.3	L296 M301 M305 V402	L296-V299 PolarHBondContact O-N 3.23Å; V299-M301 HydrophobicContact CB-CE 3.65Å; V299-M301 HydrophobicContact CG1-CE 3.13Å; V299-M301 PolarHBondContact O-N 3.45Å; V299-M305 HydrophobicContact CG1-CE 4.46Å; V299-V402 HydrophobicContact CG1-CG1 4.32Å; V299-V402 HydrophobicContact CG1-CG2 4.25Å; V299-V402 HydrophobicContact CG2-CG2 4.48Å
300	R	69.7	Low	77.7	Confident	216 Å²	216	61.3 Å²	61.3	82%	0.815	32%	0.316	S	S	*	.			trans	-72.2	111	173.3	-174.5	176	179.4	177.8	-2.3	109.1	E298	E298-R300 PolarHBondContact O-N 2.89Å
301	M	74.4	Confident	78	Confident	65 Å²	65	62.5 Å²	62.5	32%	0.32	32%	0.321	S	S	.	.			trans	-74.5	131.9	179.2	-66.8	-67.9	98.2	0	0	111.5	V299 M305 V307 V402	V299-M301 HydrophobicContact CB-CE 3.65Å; V299-M301 HydrophobicContact CG1-CE 3.13Å; V299-M301 PolarHBondContact O-N 3.45Å; M301-M305 HydrophobicContact CE-CE 4.18Å; M301-V307 HydrophobicContact CE-CG2 3.9Å; M301-V307 HydrophobicContact SD-CG2 3.86Å; M301-V402 HydrophobicContact CE-CG1 4.45Å
302	E	76.4	Confident	78.4	Confident	112 Å²	112	64.2 Å²	64.2	52%	0.523	33%	0.329	S	S	.	.			trans	-107.1	173	171	-60.9	-174.3	173	0	0	111	N304 M305 R322	E302-N304 PolarHBondContact O-N 2.87Å; E302-N304 VanDerWaalsContact O-N 3.15Å; E302-M305 HydrophobicContact CB-CG 4.3Å; E302-M305 HydrophobicContact CB-SD 3.82Å; E302-M305 HydrophobicContact CG-SD 4.09Å; E302-M305 PolarHBondContact O-N 3.25Å; E302-R322 PolarHBondContact O-NH1 3.39Å; E302-R322 PolarHBondContact O-NH2 2.86Å
303	S	74.1	Confident	79.6	Confident	105 Å²	105	66.2 Å²	66.2	73%	0.734	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-3.1	-172	54.4	0	0	0	0	115	Y326	S303-Y326 WeakPolarHBondContact O-CE1 3.17Å; S303-Y326 PolarHBondContact O-OH 3.43Å
304	N	88.6	Confident	81.1	Confident	57 Å²	57	63.5 Å²	63.5	31%	0.305	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	27.2	179.3	64.8	-33.4	0	0	0	112.5	E302 V405	E302-N304 PolarHBondContact O-N 2.87Å; E302-N304 VanDerWaalsContact O-N 3.15Å; N304-V405 PolarHBondContact ND2-O 2.87Å; N304-V405 PolarHBondContact O-N 3.35Å
305	M	91.6	Very high	82.7	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.02	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.7	-178.5	-61.7	174.2	65.6	0	0	111.8	V299 M301 E302 R322 V402 N403 Y404	V299-M305 HydrophobicContact CG1-CE 4.46Å; M301-M305 HydrophobicContact CE-CE 4.18Å; E302-M305 HydrophobicContact CB-CG 4.3Å; E302-M305 HydrophobicContact CB-SD 3.82Å; E302-M305 HydrophobicContact CG-SD 4.09Å; E302-M305 PolarHBondContact O-N 3.25Å; M305-R322 VanDerWaalsContact O-CZ 3.23Å; M305-R322 PolarHBondContact O-NH1 3.31Å; M305-R322 PolarHBondContact O-NH2 3.15Å; M305-V402 HydrophobicContact CE-CG1 3.27Å; M305-N403 VanDerWaalsContact CA-O 3.24Å; M305-N403 WeakPolarHBondContact CA-O 3.24Å; M305-Y404 HydrophobicContact CE-CD1 4.01Å; M305-Y404 HydrophobicContact CE-CE1 3.36Å; M305-Y404 HydrophobicContact CE-CE2 4.07Å; M305-Y404 HydrophobicContact CG-CD1 3.81Å; M305-Y404 HydrophobicContact CG-CE1 4.08Å; M305-Y404 HydrophobicContact CG-CG 4.38Å; M305-Y404 HydrophobicContact SD-CD1 3.9Å; M305-Y404 HydrophobicContact SD-CE1 3.55Å; M305-Y404 VanDerWaalsContact SD-CE1 3.55Å
306	F	92.7	Very high	84.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	158.6	169.8	69.9	-83.1	0	0	0	110.8	F308 E320 R322 I323 Y326 M327 I381 N403 V405	F306-F308 HydrophobicContact CD2-CE1 4.2Å; F306-F308 HydrophobicContact CD2-CZ 4.41Å; F306-F308 HydrophobicContact CE2-CD1 4.24Å; F306-F308 AromaticContact CE2-CE1 3.58Å; F306-F308 HydrophobicContact CE2-CE1 3.58Å; F306-F308 AromaticContact CE2-CE2 3.9Å; F306-F308 HydrophobicContact CE2-CE2 3.9Å; F306-F308 AromaticContact CE2-CZ 3.4Å; F306-F308 HydrophobicContact CE2-CZ 3.4Å; F306-F308 VanDerWaalsContact CE2-CZ 3.4Å; F306-F308 HydrophobicContact CZ-CE2 4.41Å; F306-F308 HydrophobicContact CZ-CZ 4.08Å; F306-E320 WeakPolarHBondContact CA-OE2 3.33Å; F306-R322 HydrophobicContact CB-CB 4.23Å; F306-I323 HydrophobicContact CD2-CB 4.17Å; F306-I323 HydrophobicContact CD2-CG1 4.32Å; F306-I323 HydrophobicContact CE2-CB 4.33Å; F306-I323 HydrophobicContact CE2-CD1 4.11Å; F306-I323 HydrophobicContact CE2-CG1 3.99Å; F306-I323 HydrophobicContact CZ-CG1 4.33Å; F306-Y326 HydrophobicContact CB-CE2 4.37Å; F306-Y326 AromaticContact CD1-CD2 3.86Å; F306-Y326 HydrophobicContact CD1-CD2 3.86Å; F306-Y326 HydrophobicContact CD1-CE2 4.22Å; F306-M327 HydrophobicContact CE1-CE 3.81Å; F306-M327 HydrophobicContact CE2-CE 4.48Å; F306-M327 HydrophobicContact CZ-CE 3.44Å; F306-M327 VanDerWaalsContact CZ-CE 3.44Å; F306-M327 HydrophobicContact CZ-SD 4.34Å; F306-I381 HydrophobicContact CZ-CD1 4.42Å; F306-N403 HydrophobicContact CD1-CB 4Å; F306-N403 HydrophobicContact CD2-CB 4.44Å; F306-N403 HydrophobicContact CE1-CB 3.51Å; F306-N403 HydrophobicContact CE2-CB 4.01Å; F306-N403 VanDerWaalsContact CE2-ND2 3.33Å; F306-N403 WeakPolarHBondContact CE2-ND2 3.39Å; F306-N403 HydrophobicContact CG-CB 4.43Å; F306-N403 HydrophobicContact CZ-CB 3.5Å; F306-N403 PolarHBondContact N-O 2.88Å; F306-N403 PolarHBondContact O-N 3.38Å; F306-N403 PolarHBondContact O-ND2 3.4Å; F306-V405 HydrophobicContact CD1-CG2 3.98Å; F306-V405 HydrophobicContact CE1-CG2 3.71Å
307	V	92.7	Very high	85.8	Confident	5 Å²	5	60.9 Å²	60.9	3%	0.03	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.4	-170.9	178.2	0	0	0	0	113.4	L296 M301 E320 I400 V402	L296-V307 HydrophobicContact CD1-CB 4.3Å; L296-V307 HydrophobicContact CD1-CG1 3.73Å; L296-V307 HydrophobicContact CD1-CG2 3.99Å; M301-V307 HydrophobicContact CE-CG2 3.9Å; M301-V307 HydrophobicContact SD-CG2 3.86Å; V307-E320 PolarHBondContact N-OE2 3.4Å; V307-E320 PolarHBondContact O-N 3.45Å; V307-I400 HydrophobicContact CG1-CG2 4Å; V307-V402 HydrophobicContact CG2-CG1 4.46Å; V307-V402 HydrophobicContact CG2-CG2 4.34Å
308	F	93.8	Very high	87.5	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	150.8	158.7	-52.8	-52.3	0	0	0	111.7	F306 V310 V316 Y318 C319 I323 V334 W371 W401 N403	F306-F308 HydrophobicContact CD2-CE1 4.2Å; F306-F308 HydrophobicContact CD2-CZ 4.41Å; F306-F308 HydrophobicContact CE2-CD1 4.24Å; F306-F308 AromaticContact CE2-CE1 3.58Å; F306-F308 HydrophobicContact CE2-CE1 3.58Å; F306-F308 AromaticContact CE2-CE2 3.9Å; F306-F308 HydrophobicContact CE2-CE2 3.9Å; F306-F308 AromaticContact CE2-CZ 3.4Å; F306-F308 HydrophobicContact CE2-CZ 3.4Å; F306-F308 VanDerWaalsContact CE2-CZ 3.4Å; F306-F308 HydrophobicContact CZ-CE2 4.41Å; F306-F308 HydrophobicContact CZ-CZ 4.08Å; F308-V310 HydrophobicContact CB-CG1 3.78Å; F308-V316 HydrophobicContact CB-CG1 4.41Å; F308-V316 HydrophobicContact CD1-CG1 4.12Å; F308-V316 HydrophobicContact CG-CG1 4.41Å; F308-Y318 CarbonylContact C-O 3.58Å; F308-Y318 VanDerWaalsContact CA-O 3.28Å; F308-Y318 WeakPolarHBondContact CA-O 3.46Å; F308-C319 HydrophobicContact CD1-CB 3.84Å; F308-C319 HydrophobicContact CE1-CB 4.01Å; F308-C319 WeakPolarHBondContact CE1-SG 3.38Å; F308-I323 HydrophobicContact CE1-CD1 3.97Å; F308-I323 HydrophobicContact CZ-CD1 4.14Å; F308-V334 HydrophobicContact CE1-CG1 3.94Å; F308-V334 HydrophobicContact CZ-CG1 4.13Å; F308-W371 HydrophobicContact CD2-CH2 4.49Å; F308-W371 AromaticContact CE2-CH2 3.41Å; F308-W371 HydrophobicContact CE2-CH2 3.41Å; F308-W371 VanDerWaalsContact CE2-CH2 3.41Å; F308-W371 HydrophobicContact CE2-CZ2 4.04Å; F308-W371 AromaticContact CE2-CZ3 3.77Å; F308-W371 HydrophobicContact CE2-CZ3 3.77Å; F308-W371 AromaticContact CZ-CH2 3.63Å; F308-W371 HydrophobicContact CZ-CH2 3.63Å; F308-W371 AromaticContact CZ-CZ2 3.78Å; F308-W371 HydrophobicContact CZ-CZ2 3.78Å; F308-W371 HydrophobicContact CZ-CZ3 4.33Å; F308-W401 HydrophobicContact CB-CB 4.18Å; F308-W401 AromaticContact CD2-CD1 3.9Å; F308-W401 HydrophobicContact CD2-CG 4.44Å; F308-W401 PolarHBondContact N-O 2.95Å; F308-W401 PolarHBondContact O-N 2.93Å; F308-N403 WeakPolarHBondContact CD2-ND2 3.32Å; F308-N403 WeakPolarHBondContact CE2-ND2 3.11Å
309	R	93.1	Very high	89.1	Confident	118 Å²	118	54 Å²	54	45%	0.445	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.2	154.4	-163	-178.3	82.4	171	7.7	108.1	T317 Y318 N398 V399	R309-T317 PolarHBondContact NE-OG1 3.03Å; R309-T317 VanDerWaalsContact NE-OG1 3.08Å; R309-T317 WeakPolarHBondContact O-CA 3.28Å; R309-T317 PolarHBondContact O-N 2.84Å; R309-T317 PolarHBondContact O-OG1 2.77Å; R309-Y318 HydrophobicContact CB-CD1 4.38Å; R309-Y318 PolarHBondContact N-O 2.69Å; R309-Y318 PolarHBondContact O-N 3.48Å; R309-Y318 VanDerWaalsContact O-N 3.09Å; R309-N398 HydrophobicContact CG-CB 4Å; R309-V399 WeakPolarHBondContact CA-O 3.49Å
310	V	95	Very high	90.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.9	-179.1	-49	0	0	0	0	111.3	F308 L314 Q315 V316 V399 W401	F308-V310 HydrophobicContact CB-CG1 3.78Å; V310-L314 HydrophobicContact CG2-CD2 3.79Å; V310-Q315 CarbonylContact C-O 3.46Å; V310-Q315 WeakPolarHBondContact CA-O 3.48Å; V310-Q315 WeakPolarHBondContact CB-O 3.45Å; V310-V316 HydrophobicContact CG1-CB 4.48Å; V310-V316 HydrophobicContact CG1-CG2 4.05Å; V310-V399 HydrophobicContact CG2-CB 3.57Å; V310-V399 HydrophobicContact CG2-CG1 3.84Å; V310-V399 HydrophobicContact CG2-CG2 4.45Å; V310-V399 PolarHBondContact N-O 2.74Å; V310-V399 PolarHBondContact O-N 3.4Å; V310-W401 HydrophobicContact CG1-CB 4.38Å; V310-W401 HydrophobicContact CG2-CB 4.41Å; V310-W401 HydrophobicContact CG2-CE3 4.31Å
311	N	94.9	Very high	91.5	Very high	52 Å²	52	50.3 Å²	50.3	28%	0.278	25%	0.253	S	S	.	.			trans	-73.1	173.8	169.7	-76.3	-20.9	0	0	0	110.6	D313 L314 Q315 T317	N311-D313 WeakPolarHBondContact CB-OD1 2.95Å; N311-D313 PolarHBondContact O-N 3.24Å; N311-D313 VanDerWaalsContact O-N 3.14Å; N311-L314 PolarHBondContact O-N 3.43Å; N311-Q315 HydrophobicContact CB-CB 4.23Å; N311-Q315 PolarHBondContact N-O 2.86Å; N311-Q315 PolarHBondContact ND2-OE1 3.01Å; N311-T317 VanDerWaalsContact CG-CG2 3.49Å; N311-T317 WeakPolarHBondContact OD1-CG2 3.13Å
312	M	94.3	Very high	92.4	Very high	57 Å²	57	49.4 Å²	49.4	28%	0.281	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-8.7	178.4	-61.7	-58.5	-68.5	0	0	113.9	H355 L359 V387 R397 V399	M312-H355 PolarHBondContact O-CE1 2.71Å; M312-H355 PolarHBondContact O-NE2 3.01Å; M312-L359 HydrophobicContact CB-CD2 4.48Å; M312-L359 HydrophobicContact CE-CD2 3.37Å; M312-V387 HydrophobicContact CE-CG1 4.36Å; M312-V387 HydrophobicContact CE-CG2 4.11Å; M312-V387 HydrophobicContact SD-CG1 4.25Å; M312-V387 HydrophobicContact SD-CG2 4.47Å; M312-R397 HydrophobicContact CG-CB 4.02Å; M312-R397 HydrophobicContact SD-CB 3.83Å; M312-V399 HydrophobicContact SD-CG2 3.83Å
313	D	95.6	Very high	93.2	Very high	84 Å²	84	44.1 Å²	44.1	45%	0.449	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	9.3	172.8	62.1	-5	0	0	0	112.5	N311 Q315	N311-D313 WeakPolarHBondContact CB-OD1 2.95Å; N311-D313 PolarHBondContact O-N 3.24Å; N311-D313 VanDerWaalsContact O-N 3.14Å; D313-Q315 VanDerWaalsContact C-N 3.27Å; D313-Q315 PolarHBondContact O-N 3.42Å; D313-Q315 VanDerWaalsContact OD1-CB 3.29Å; D313-Q315 WeakPolarHBondContact OD1-CB 3.36Å; D313-Q315 PolarHBondContact OD1-N 2.83Å
314	L	96.9	Very high	94.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.			trans	63	21.6	-172.9	-50.4	-176.9	0	0	0	115.1	V310 N311 V316 T338 C339 Y340 H355 L358 W401	V310-L314 HydrophobicContact CG2-CD2 3.79Å; N311-L314 PolarHBondContact O-N 3.43Å; L314-V316 PolarHBondContact O-N 3.36Å; L314-T338 CarbonylContact O-C 3.58Å; L314-T338 WeakPolarHBondContact O-CA 3.41Å; L314-C339 HydrophobicContact CB-CB 4.11Å; L314-C339 PolarHBondContact O-N 2.85Å; L314-C339 PolarHBondContact O-SG 3.07Å; L314-Y340 HydrophobicContact CD1-CE2 3.94Å; L314-Y340 HydrophobicContact CG-CE2 4.49Å; L314-H355 HydrophobicContact CD1-CB 4.04Å; L314-L358 HydrophobicContact CD2-CD2 4.48Å; L314-W401 HydrophobicContact CD1-CH2 4.2Å; L314-W401 HydrophobicContact CD1-CZ3 4.12Å; L314-W401 HydrophobicContact CD2-CE3 3.87Å; L314-W401 HydrophobicContact CD2-CH2 4.4Å; L314-W401 HydrophobicContact CD2-CZ3 3.53Å; L314-W401 HydrophobicContact CG-CZ3 4.49Å
315	Q	97.6	Very high	94.4	Very high	70 Å²	70	45.7 Å²	45.7	33%	0.327	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-67.9	126.5	166.1	-170.2	-178.2	46.6	0	0	110.8	V310 N311 D313 T317 G336 T338	V310-Q315 CarbonylContact C-O 3.46Å; V310-Q315 WeakPolarHBondContact CA-O 3.48Å; V310-Q315 WeakPolarHBondContact CB-O 3.45Å; N311-Q315 HydrophobicContact CB-CB 4.23Å; N311-Q315 PolarHBondContact N-O 2.86Å; N311-Q315 PolarHBondContact ND2-OE1 3.01Å; D313-Q315 VanDerWaalsContact C-N 3.27Å; D313-Q315 PolarHBondContact O-N 3.42Å; D313-Q315 VanDerWaalsContact OD1-CB 3.29Å; D313-Q315 WeakPolarHBondContact OD1-CB 3.36Å; D313-Q315 PolarHBondContact OD1-N 2.83Å; Q315-T317 PolarHBondContact O-N 2.74Å; Q315-G336 WeakPolarHBondContact CG-O 3.41Å; Q315-G336 PolarHBondContact NE2-O 3.21Å; Q315-T338 HydrophobicContact CB-CG2 4.33Å
316	V	97.3	Very high	94.4	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	114.3	-179.4	-175	0	0	0	0	110.1	F308 V310 L314 Y318 C319 V334 V335 G336 H337	F308-V316 HydrophobicContact CB-CG1 4.41Å; F308-V316 HydrophobicContact CD1-CG1 4.12Å; F308-V316 HydrophobicContact CG-CG1 4.41Å; V310-V316 HydrophobicContact CG1-CB 4.48Å; V310-V316 HydrophobicContact CG1-CG2 4.05Å; L314-V316 PolarHBondContact O-N 3.36Å; V316-Y318 WeakPolarHBondContact CG1-O 3.48Å; V316-C319 HydrophobicContact CG1-CB 4.31Å; V316-V334 HydrophobicContact CB-CG1 4.3Å; V316-V334 HydrophobicContact CG1-CG1 4.12Å; V316-V334 HydrophobicContact CG2-CG1 4Å; V316-V335 HydrophobicContact CG1-CG2 4.2Å; V316-G336 PolarHBondContact O-N 2.61Å; V316-H337 PolarHBondContact N-O 2.84Å
317	T	95.8	Very high	94.5	Very high	44 Å²	44	48.1 Å²	48.1	27%	0.27	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-24.3	176.8	64.2	0	0	0	0	113.1	R309 N311 Q315	R309-T317 PolarHBondContact NE-OG1 3.03Å; R309-T317 VanDerWaalsContact NE-OG1 3.08Å; R309-T317 WeakPolarHBondContact O-CA 3.28Å; R309-T317 PolarHBondContact O-N 2.84Å; R309-T317 PolarHBondContact O-OG1 2.77Å; N311-T317 VanDerWaalsContact CG-CG2 3.49Å; N311-T317 WeakPolarHBondContact OD1-CG2 3.13Å; Q315-T317 PolarHBondContact O-N 2.74Å
318	Y	95.4	Very high	94.5	Very high	113 Å²	113	50 Å²	50	44%	0.443	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	142.4	176.7	167.6	-95.2	0	0	0	109.3	F308 R309 V316 E320	F308-Y318 CarbonylContact C-O 3.58Å; F308-Y318 VanDerWaalsContact CA-O 3.28Å; F308-Y318 WeakPolarHBondContact CA-O 3.46Å; R309-Y318 HydrophobicContact CB-CD1 4.38Å; R309-Y318 PolarHBondContact N-O 2.69Å; R309-Y318 PolarHBondContact O-N 3.48Å; R309-Y318 VanDerWaalsContact O-N 3.09Å; V316-Y318 WeakPolarHBondContact CG1-O 3.48Å; Y318-E320 HydrophobicContact CE1-CB 4.43Å
319	C	95.9	Very high	94.5	Very high	5 Å²	5	50.5 Å²	50.5	3%	0.034	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	132.2	174	173.9	0	0	0	0	109.3	F308 V316 P331 V335	F308-C319 HydrophobicContact CD1-CB 3.84Å; F308-C319 HydrophobicContact CE1-CB 4.01Å; F308-C319 WeakPolarHBondContact CE1-SG 3.38Å; V316-C319 HydrophobicContact CG1-CB 4.31Å; C319-P331 HydrophobicContact CB-CB 3.94Å; C319-V335 HydrophobicContact CB-CG2 4.01Å
320	E	93.2	Very high	94.6	Very high	39 Å²	39	47.7 Å²	47.7	18%	0.182	24%	0.24	C	C	.	.			trans	-67.4	142.8	173.7	-170	177.2	-173	0	0	111.5	F306 V307 Y318 R322 I323	F306-E320 WeakPolarHBondContact CA-OE2 3.33Å; V307-E320 PolarHBondContact N-OE2 3.4Å; V307-E320 PolarHBondContact O-N 3.45Å; Y318-E320 HydrophobicContact CE1-CB 4.43Å; E320-R322 HydrophobicContact CG-CB 4.16Å; E320-R322 HydrophobicContact CG-CG 4.17Å; E320-R322 PolarHBondContact O-N 2.99Å; E320-R322 VanDerWaalsContact O-N 3.16Å; E320-R322 WeakPolarHBondContact OE1-CD 3.24Å; E320-I323 WeakPolarHBondContact O-CG2 3.46Å; E320-I323 PolarHBondContact O-N 3.36Å
321	N	93.3	Very high	94.7	Very high	125 Å²	125	48.8 Å²	48.8	67%	0.668	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.2	-179.4	-69.6	-19.7	0	0	0	113.5	I323 S324	N321-I323 PolarHBondContact O-N 2.84Å; N321-I323 VanDerWaalsContact O-N 3.1Å; N321-S324 PolarHBondContact O-N 3.27Å
322	R	91.6	Very high	94.7	Very high	47 Å²	47	50.5 Å²	50.5	18%	0.177	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.5	177.8	-68.6	-178.7	68.5	-162	-4.8	113.4	E302 M305 F306 E320 S324 E325 Y326	E302-R322 PolarHBondContact O-NH1 3.39Å; E302-R322 PolarHBondContact O-NH2 2.86Å; M305-R322 VanDerWaalsContact O-CZ 3.23Å; M305-R322 PolarHBondContact O-NH1 3.31Å; M305-R322 PolarHBondContact O-NH2 3.15Å; F306-R322 HydrophobicContact CB-CB 4.23Å; E320-R322 HydrophobicContact CG-CB 4.16Å; E320-R322 HydrophobicContact CG-CG 4.17Å; E320-R322 PolarHBondContact O-N 2.99Å; E320-R322 VanDerWaalsContact O-N 3.16Å; E320-R322 WeakPolarHBondContact OE1-CD 3.24Å; R322-S324 PolarHBondContact O-N 3.44Å; R322-S324 VanDerWaalsContact O-N 3.15Å; R322-E325 IonicContact NE-OE2 3.13Å; R322-E325 VanDerWaalsContact O-CB 3.3Å; R322-E325 WeakPolarHBondContact O-CB 3.31Å; R322-E325 PolarHBondContact O-N 2.91Å; R322-Y326 HydrophobicContact CB-CE2 4.37Å; R322-Y326 PolarHBondContact NH2-OH 2.87Å; R322-Y326 VanDerWaalsContact O-CD2 3.23Å; R322-Y326 WeakPolarHBondContact O-CD2 3.35Å; R322-Y326 WeakPolarHBondContact O-CE2 3.42Å
323	I	94.4	Very high	94.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-51.3	-37.9	172.9	-166.8	174.4	0	0	0	112.1	F306 F308 E320 N321 E325 Y326 M327 P331 V334	F306-I323 HydrophobicContact CD2-CB 4.17Å; F306-I323 HydrophobicContact CD2-CG1 4.32Å; F306-I323 HydrophobicContact CE2-CB 4.33Å; F306-I323 HydrophobicContact CE2-CD1 4.11Å; F306-I323 HydrophobicContact CE2-CG1 3.99Å; F306-I323 HydrophobicContact CZ-CG1 4.33Å; F308-I323 HydrophobicContact CE1-CD1 3.97Å; F308-I323 HydrophobicContact CZ-CD1 4.14Å; E320-I323 WeakPolarHBondContact O-CG2 3.46Å; E320-I323 PolarHBondContact O-N 3.36Å; N321-I323 PolarHBondContact O-N 2.84Å; N321-I323 VanDerWaalsContact O-N 3.1Å; I323-E325 PolarHBondContact O-N 3.32Å; I323-Y326 PolarHBondContact O-N 2.92Å; I323-M327 HydrophobicContact CD1-SD 3.66Å; I323-M327 HydrophobicContact CG1-CB 4.08Å; I323-M327 HydrophobicContact CG1-CG 3.99Å; I323-M327 HydrophobicContact CG1-SD 3.53Å; I323-M327 VanDerWaalsContact CG1-SD 3.53Å; I323-M327 PolarHBondContact O-N 2.9Å; I323-P331 HydrophobicContact CG2-CG 3.8Å; I323-V334 HydrophobicContact CD1-CG2 3.82Å
324	S	94	Very high	94.7	Very high	62 Å²	62	47.3 Å²	47.3	43%	0.434	25%	0.251	S	S	.	.	H	α-helix	trans	-69.5	-12.9	-178.9	-52.2	0	0	0	0	113.6	N321 R322 Y326	N321-S324 PolarHBondContact O-N 3.27Å; R322-S324 PolarHBondContact O-N 3.44Å; R322-S324 VanDerWaalsContact O-N 3.15Å; S324-Y326 VanDerWaalsContact C-N 3.33Å
325	E	93	Very high	94.8	Very high	133 Å²	133	50 Å²	50	62%	0.621	27%	0.267	S	S	*	.	H	α-helix	trans	-77.5	-23.3	172.7	-61.2	175.3	-163.7	0	0	111.6	R322 I323	R322-E325 IonicContact NE-OE2 3.13Å; R322-E325 VanDerWaalsContact O-CB 3.3Å; R322-E325 WeakPolarHBondContact O-CB 3.31Å; R322-E325 PolarHBondContact O-N 2.91Å; I323-E325 PolarHBondContact O-N 3.32Å
326	Y	92.8	Very high	94.7	Very high	45 Å²	45	48.6 Å²	48.6	18%	0.176	27%	0.271	C	S	.	.	H	α-helix	trans	-114.9	-30.8	-174	-49.4	-65.4	0	0	0	113.3	S303 F306 R322 I323 S324 V405	S303-Y326 WeakPolarHBondContact O-CE1 3.17Å; S303-Y326 PolarHBondContact O-OH 3.43Å; F306-Y326 HydrophobicContact CB-CE2 4.37Å; F306-Y326 AromaticContact CD1-CD2 3.86Å; F306-Y326 HydrophobicContact CD1-CD2 3.86Å; F306-Y326 HydrophobicContact CD1-CE2 4.22Å; R322-Y326 HydrophobicContact CB-CE2 4.37Å; R322-Y326 PolarHBondContact NH2-OH 2.87Å; R322-Y326 VanDerWaalsContact O-CD2 3.23Å; R322-Y326 WeakPolarHBondContact O-CD2 3.35Å; R322-Y326 WeakPolarHBondContact O-CE2 3.42Å; I323-Y326 PolarHBondContact O-N 2.92Å; S324-Y326 VanDerWaalsContact C-N 3.33Å; Y326-V405 HydrophobicContact CD1-CB 4.5Å; Y326-V405 HydrophobicContact CD1-CG1 4.4Å; Y326-V405 HydrophobicContact CD1-CG2 4.26Å; Y326-V405 HydrophobicContact CD2-CG2 4.1Å; Y326-V405 HydrophobicContact CG-CG2 3.86Å
327	M	94.1	Very high	94.7	Very high	11 Å²	11	52.3 Å²	52.3	5%	0.054	29%	0.289	C	S	.	.	S	Bend	trans	-120.4	156.7	-173.9	-58.2	-175.5	179.7	0	0	111.3	F306 I323 L329 W371 L379 I381	F306-M327 HydrophobicContact CE1-CE 3.81Å; F306-M327 HydrophobicContact CE2-CE 4.48Å; F306-M327 HydrophobicContact CZ-CE 3.44Å; F306-M327 VanDerWaalsContact CZ-CE 3.44Å; F306-M327 HydrophobicContact CZ-SD 4.34Å; I323-M327 HydrophobicContact CD1-SD 3.66Å; I323-M327 HydrophobicContact CG1-CB 4.08Å; I323-M327 HydrophobicContact CG1-CG 3.99Å; I323-M327 HydrophobicContact CG1-SD 3.53Å; I323-M327 VanDerWaalsContact CG1-SD 3.53Å; I323-M327 PolarHBondContact O-N 2.9Å; M327-L329 HydrophobicContact CB-CB 4.34Å; M327-L329 PolarHBondContact O-N 3.44Å; M327-W371 HydrophobicContact CE-CB 4.32Å; M327-W371 HydrophobicContact CE-CD2 4.16Å; M327-W371 HydrophobicContact CE-CG 3.78Å; M327-W371 HydrophobicContact SD-CG 4.32Å; M327-L379 HydrophobicContact CE-CD1 4.17Å; M327-L379 HydrophobicContact CE-CD2 4.07Å; M327-L379 HydrophobicContact CE-CG 4.41Å; M327-L379 HydrophobicContact CG-CD2 3.71Å; M327-I381 HydrophobicContact CE-CD1 3.43Å; M327-I381 VanDerWaalsContact CE-CD1 3.43Å
328	D	92.6	Very high	94.7	Very high	43 Å²	43	52.7 Å²	52.7	23%	0.23	29%	0.291	C	S	.	.	S	Bend	trans	-85.2	16.9	171.6	67.7	-11.3	0	0	0	113.5	Q373 R374 R375	D328-Q373 WeakPolarHBondContact OD1-CA 3.3Å; D328-Q373 VanDerWaalsContact OD1-CB 3.31Å; D328-Q373 WeakPolarHBondContact OD1-CB 3.31Å; D328-Q373 PolarHBondContact OD1-OE1 3Å; D328-R374 VanDerWaalsContact CG-N 3.26Å; D328-R374 PolarHBondContact O-NE 3.28Å; D328-R374 PolarHBondContact O-NH2 3.29Å; D328-R374 VanDerWaalsContact O-NH2 3.13Å; D328-R374 WeakPolarHBondContact OD1-CB 3.24Å; D328-R374 PolarHBondContact OD1-N 3.34Å; D328-R374 WeakPolarHBondContact OD2-CB 3.16Å; D328-R374 PolarHBondContact OD2-N 2.89Å; D328-R374 VanDerWaalsContact OD2-N 3.13Å; D328-R375 PolarHBondContact OD2-N 3.39Å
329	L	93.4	Very high	94.8	Very high	12 Å²	12	47.4 Å²	47.4	6%	0.063	27%	0.27	C	S	.	.			trans	-108.5	144.8	176.4	-68.6	166.5	0	0	0	110.7	M327 E333 V334 F342 R374	M327-L329 HydrophobicContact CB-CB 4.34Å; M327-L329 PolarHBondContact O-N 3.44Å; L329-E333 HydrophobicContact CD2-CB 4.34Å; L329-V334 HydrophobicContact CB-CG2 4.09Å; L329-V334 HydrophobicContact CD1-CG2 4.26Å; L329-F342 HydrophobicContact CD1-CD1 4.12Å; L329-F342 HydrophobicContact CD1-CE1 4.24Å; L329-R374 HydrophobicContact CD2-CB 3.83Å; L329-R374 HydrophobicContact CD2-CG 4.46Å; L329-R374 HydrophobicContact CG-CB 4.33Å
330	T	95.4	Very high	94.9	Very high	58 Å²	58	50.1 Å²	50.1	36%	0.356	28%	0.28	S	S	.	.			trans	-99	158.6	172.8	64.7	0	0	0	0	111.3	A332 E333 V334	T330-A332 PolarHBondContact O-N 2.74Å; T330-A332 VanDerWaalsContact O-N 3.16Å; T330-E333 WeakPolarHBondContact CB-OE2 3.23Å; T330-E333 PolarHBondContact N-OE2 3.25Å; T330-E333 PolarHBondContact O-N 2.95Å; T330-E333 WeakPolarHBondContact OG1-CG 3.3Å; T330-E333 PolarHBondContact OG1-OE2 3.05Å; T330-V334 PolarHBondContact O-N 3.43Å
331	P	96.6	Very high	95	Very high	23 Å²	23	51.4 Å²	51.4	15%	0.149	29%	0.286	C	S	.	.	H	α-helix	trans	-53.7	-36	174.7	-28.6	35.7	0	0	0	113.8	C319 I323 E333 V334 V335	C319-P331 HydrophobicContact CB-CB 3.94Å; I323-P331 HydrophobicContact CG2-CG 3.8Å; P331-E333 VanDerWaalsContact C-N 3.29Å; P331-E333 PolarHBondContact O-N 3.32Å; P331-V334 PolarHBondContact O-N 3.08Å; P331-V335 WeakPolarHBondContact O-CB 3.43Å; P331-V335 VanDerWaalsContact O-CG2 3.23Å; P331-V335 WeakPolarHBondContact O-CG2 3.19Å; P331-V335 PolarHBondContact O-N 3.29Å
332	A	95.8	Very high	95.2	Very high	88 Å²	88	46.2 Å²	46.2	73%	0.727	26%	0.258	S	S	*	.	H	α-helix	trans	-66.6	-29.4	179.9	0	0	0	0	0	113.1	T330	T330-A332 PolarHBondContact O-N 2.74Å; T330-A332 VanDerWaalsContact O-N 3.16Å
333	E	94.1	Very high	95.5	Very high	74 Å²	74	44.3 Å²	44.3	35%	0.346	25%	0.251	S	S	.	.	H	α-helix	trans	-79.5	-28.2	176.8	-68.8	165.1	124.5	0	0	111.9	L329 T330 P331 H337 R374	L329-E333 HydrophobicContact CD2-CB 4.34Å; T330-E333 WeakPolarHBondContact CB-OE2 3.23Å; T330-E333 PolarHBondContact N-OE2 3.25Å; T330-E333 PolarHBondContact O-N 2.95Å; T330-E333 WeakPolarHBondContact OG1-CG 3.3Å; T330-E333 PolarHBondContact OG1-OE2 3.05Å; P331-E333 VanDerWaalsContact C-N 3.29Å; P331-E333 PolarHBondContact O-N 3.32Å; E333-H337 PolarHBondContact O-ND1 3.25Å; E333-R374 WeakPolarHBondContact OE1-CD 3.27Å; E333-R374 IonicContact OE1-NE 2.89Å
334	V	96.1	Very high	95.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-87.8	-40.8	-177.5	-178.7	0	0	0	0	112.3	F308 V316 I323 L329 T330 P331 H337 F342 W371	F308-V334 HydrophobicContact CE1-CG1 3.94Å; F308-V334 HydrophobicContact CZ-CG1 4.13Å; V316-V334 HydrophobicContact CB-CG1 4.3Å; V316-V334 HydrophobicContact CG1-CG1 4.12Å; V316-V334 HydrophobicContact CG2-CG1 4Å; I323-V334 HydrophobicContact CD1-CG2 3.82Å; L329-V334 HydrophobicContact CB-CG2 4.09Å; L329-V334 HydrophobicContact CD1-CG2 4.26Å; T330-V334 PolarHBondContact O-N 3.43Å; P331-V334 PolarHBondContact O-N 3.08Å; V334-H337 PolarHBondContact O-N 2.97Å; V334-F342 HydrophobicContact CB-CZ 4.39Å; V334-F342 HydrophobicContact CG1-CE2 3.92Å; V334-F342 HydrophobicContact CG1-CZ 4.3Å; V334-F342 HydrophobicContact CG2-CZ 4.3Å; V334-W371 HydrophobicContact CG1-CZ2 4.39Å
335	V	97.6	Very high	95.7	Very high	57 Å²	57	47.5 Å²	47.5	35%	0.345	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	137.7	-178.8	170.5	0	0	0	0	110.9	V316 C319 P331 H337	V316-V335 HydrophobicContact CG1-CG2 4.2Å; C319-V335 HydrophobicContact CB-CG2 4.01Å; P331-V335 WeakPolarHBondContact O-CB 3.43Å; P331-V335 VanDerWaalsContact O-CG2 3.23Å; P331-V335 WeakPolarHBondContact O-CG2 3.19Å; P331-V335 PolarHBondContact O-N 3.29Å; V335-H337 VanDerWaalsContact C-N 3.32Å
336	G	96.5	Very high	95.9	Very high	40 Å²	40	47.4 Å²	47.4	41%	0.412	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	-18.3	-177.9	0	0	0	0	0	114.5	Q315 V316	Q315-G336 WeakPolarHBondContact CG-O 3.41Å; Q315-G336 PolarHBondContact NE2-O 3.21Å; V316-G336 PolarHBondContact O-N 2.61Å
337	H	96.8	Very high	96.2	Very high	80 Å²	80	45.9 Å²	45.9	37%	0.37	26%	0.261	S	S	.	.	S	Bend	trans	-91.8	156.5	175.3	-63.2	86.9	0	0	0	111.3	V316 E333 V334 V335 H341 F342	V316-H337 PolarHBondContact N-O 2.84Å; E333-H337 PolarHBondContact O-ND1 3.25Å; V334-H337 PolarHBondContact O-N 2.97Å; V335-H337 VanDerWaalsContact C-N 3.32Å; H337-H341 HydrophobicContact CB-CB 4.44Å; H337-H341 AromaticContact CD2-CD2 3.67Å; H337-H341 AromaticContact CD2-NE2 3.64Å; H337-F342 HydrophobicContact CB-CE2 3.75Å; H337-F342 HydrophobicContact CB-CZ 3.92Å
338	T	97	Very high	96.3	Very high	52 Å²	52	48 Å²	48	32%	0.319	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-79.2	147.1	170.6	63.4	0	0	0	0	110.2	L314 Q315 Y340 H341	L314-T338 CarbonylContact O-C 3.58Å; L314-T338 WeakPolarHBondContact O-CA 3.41Å; Q315-T338 HydrophobicContact CB-CG2 4.33Å; T338-Y340 PolarHBondContact O-N 2.92Å; T338-Y340 VanDerWaalsContact O-N 3.11Å; T338-H341 WeakPolarHBondContact O-CB 3.29Å; T338-H341 PolarHBondContact O-N 3.44Å
339	C	97.2	Very high	96.5	Very high	2 Å²	2	51 Å²	51	1%	0.014	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-54.7	-32.3	176.2	-67.5	0	0	0	0	112.4	L314 H341 F342 V343 W371	L314-C339 HydrophobicContact CB-CB 4.11Å; L314-C339 PolarHBondContact O-N 2.85Å; L314-C339 PolarHBondContact O-SG 3.07Å; C339-H341 PolarHBondContact O-N 3.17Å; C339-H341 VanDerWaalsContact O-N 3.1Å; C339-F342 PolarHBondContact O-N 3.34Å; C339-V343 WeakPolarHBondContact O-CG2 3.48Å; C339-V343 PolarHBondContact O-N 3.4Å; C339-W371 HydrophobicContact CB-CH2 4.43Å; C339-W371 HydrophobicContact CB-CZ3 4.44Å
340	Y	97.4	Very high	96.6	Very high	62 Å²	62	53.9 Å²	53.9	24%	0.243	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-55.7	-27	176.7	-68.6	-70	0	0	0	113.9	L314 T338 F342 V343 L348 I351 H355	L314-Y340 HydrophobicContact CD1-CE2 3.94Å; L314-Y340 HydrophobicContact CG-CE2 4.49Å; T338-Y340 PolarHBondContact O-N 2.92Å; T338-Y340 VanDerWaalsContact O-N 3.11Å; Y340-F342 PolarHBondContact O-N 2.83Å; Y340-V343 PolarHBondContact O-N 3.06Å; Y340-L348 HydrophobicContact CD1-CD2 3.82Å; Y340-I351 HydrophobicContact CD1-CG2 4.35Å; Y340-I351 HydrophobicContact CE1-CG2 3.83Å; Y340-H355 AromaticContact CE2-ND1 3.91Å; Y340-H355 AromaticContact CZ-ND1 3.82Å; Y340-H355 WeakPolarHBondContact OH-CB 3.38Å; Y340-H355 PolarHBondContact OH-ND1 3.43Å
341	H	95.1	Very high	96.7	Very high	66 Å²	66	51.3 Å²	51.3	31%	0.306	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-63.7	-25.7	177.6	-159.5	65.6	0	0	0	113.3	H337 T338 C339 L419	H337-H341 HydrophobicContact CB-CB 4.44Å; H337-H341 AromaticContact CD2-CD2 3.67Å; H337-H341 AromaticContact CD2-NE2 3.64Å; T338-H341 WeakPolarHBondContact O-CB 3.29Å; T338-H341 PolarHBondContact O-N 3.44Å; C339-H341 PolarHBondContact O-N 3.17Å; C339-H341 VanDerWaalsContact O-N 3.1Å; H341-L419 WeakPolarHBondContact CD2-CD1 3.32Å; H341-L419 WeakPolarHBondContact CE1-CD1 3.33Å; H341-L419 VanDerWaalsContact CE1-CD2 3.4Å; H341-L419 WeakPolarHBondContact CE1-CD2 3.41Å; H341-L419 WeakPolarHBondContact NE2-CD1 3.42Å; H341-L419 WeakPolarHBondContact NE2-CD2 3.34Å; H341-L419 WeakPolarHBondContact O-CD1 3.37Å
342	F	96.8	Very high	96.8	Very high	16 Å²	16	54.7 Å²	54.7	7%	0.07	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-109.2	-3.2	-175.6	-52.7	-75.3	0	0	0	113	L329 V334 H337 C339 Y340 W371 L372	L329-F342 HydrophobicContact CD1-CD1 4.12Å; L329-F342 HydrophobicContact CD1-CE1 4.24Å; V334-F342 HydrophobicContact CB-CZ 4.39Å; V334-F342 HydrophobicContact CG1-CE2 3.92Å; V334-F342 HydrophobicContact CG1-CZ 4.3Å; V334-F342 HydrophobicContact CG2-CZ 4.3Å; H337-F342 HydrophobicContact CB-CE2 3.75Å; H337-F342 HydrophobicContact CB-CZ 3.92Å; C339-F342 PolarHBondContact O-N 3.34Å; Y340-F342 PolarHBondContact O-N 2.83Å; F342-W371 HydrophobicContact CB-CD2 3.82Å; F342-W371 HydrophobicContact CB-CE3 4.36Å; F342-W371 HydrophobicContact CB-CG 4.33Å; F342-W371 HydrophobicContact CB-CH2 3.97Å; F342-W371 HydrophobicContact CB-CZ2 3.41Å; F342-W371 VanDerWaalsContact CB-CZ2 3.41Å; F342-W371 HydrophobicContact CB-CZ3 4.42Å; F342-W371 HydrophobicContact CD1-CZ2 4.4Å; F342-W371 AromaticContact CD2-CH2 3.87Å; F342-W371 HydrophobicContact CD2-CH2 3.87Å; F342-W371 AromaticContact CD2-CZ2 3.43Å; F342-W371 HydrophobicContact CD2-CZ2 3.43Å; F342-W371 VanDerWaalsContact CD2-CZ2 3.43Å; F342-W371 HydrophobicContact CE2-CZ2 4.3Å; F342-W371 AromaticContact CG-CE2 3.77Å; F342-W371 HydrophobicContact CG-CH2 4.23Å; F342-W371 AromaticContact CG-CZ2 3.49Å; F342-W371 HydrophobicContact CG-CZ2 3.49Å; F342-W371 VanDerWaalsContact CG-CZ2 3.49Å; F342-W371 AromaticContact CG-NE1 3.94Å; F342-W371 CarbonylContact O-C 3.56Å; F342-W371 WeakPolarHBondContact O-CA 3.27Å; F342-L372 PolarHBondContact O-N 2.77Å
343	V	98	Very high	96.8	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.042	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-86.7	132.5	-179.5	173.1	0	0	0	0	109.3	C339 Y340 D347 L348 I351 Y369	C339-V343 WeakPolarHBondContact O-CG2 3.48Å; C339-V343 PolarHBondContact O-N 3.4Å; Y340-V343 PolarHBondContact O-N 3.06Å; V343-D347 HydrophobicContact CG1-CB 3.95Å; V343-L348 HydrophobicContact CB-CD2 3.89Å; V343-L348 HydrophobicContact CG1-CD2 3.87Å; V343-L348 HydrophobicContact CG1-CG 4.35Å; V343-I351 HydrophobicContact CG1-CG1 3.93Å; V343-I351 HydrophobicContact CG2-CG1 4.29Å; V343-Y369 HydrophobicContact CG1-CD2 4.42Å; V343-Y369 HydrophobicContact CG2-CD2 4.05Å; V343-Y369 HydrophobicContact CG2-CE2 3.98Å
344	H	97.7	Very high	97	Very high	21 Å²	21	51.3 Å²	51.3	10%	0.097	26%	0.264	C	S	.	.			trans	-57.7	139	173.9	-172.5	-86.8	0	0	0	111.5	E346 D347 L348 R370	H344-E346 VanDerWaalsContact C-N 3.29Å; H344-E346 IonicContact CE1-OE2 3.69Å; H344-E346 PolarHBondContact ND1-N 3.14Å; H344-E346 IonicContact ND1-OE2 3.49Å; H344-E346 PolarHBondContact O-N 3.11Å; H344-E346 VanDerWaalsContact O-N 3.13Å; H344-D347 PolarHBondContact O-N 2.89Å; H344-L348 PolarHBondContact O-N 3Å; H344-R370 HydrophobicContact CB-CB 3.62Å; H344-R370 PolarHBondContact CE1-NH1 3.11Å; H344-R370 PolarHBondContact N-O 3.43Å; H344-R370 VanDerWaalsContact ND1-CZ 3.34Å; H344-R370 PolarHBondContact ND1-NH2 3.42Å
345	V	96.3	Very high	97	Very high	107 Å²	107	52.2 Å²	52.2	65%	0.648	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-53.4	-41.1	-170.4	65.4	0	0	0	0	114.1	D347 L348	V345-D347 PolarHBondContact O-N 3.11Å; V345-L348 HydrophobicContact CB-CD1 4.4Å; V345-L348 HydrophobicContact CG2-CD1 4.08Å; V345-L348 WeakPolarHBondContact O-CB 3.34Å; V345-L348 WeakPolarHBondContact O-CG 3.21Å; V345-L348 PolarHBondContact O-N 2.75Å
346	E	97.4	Very high	97	Very high	132 Å²	132	51.9 Å²	51.9	62%	0.617	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-66.9	-19.7	179.2	-68	178	164.6	0	0	113.6	H344 R370	H344-E346 VanDerWaalsContact C-N 3.29Å; H344-E346 IonicContact CE1-OE2 3.69Å; H344-E346 PolarHBondContact ND1-N 3.14Å; H344-E346 IonicContact ND1-OE2 3.49Å; H344-E346 PolarHBondContact O-N 3.11Å; H344-E346 VanDerWaalsContact O-N 3.13Å; E346-R370 VanDerWaalsContact CB-NH2 3.28Å; E346-R370 IonicContact OE2-CZ 3.61Å; E346-R370 VanDerWaalsContact OE2-CZ 3.3Å; E346-R370 IonicContact OE2-NH1 3.45Å; E346-R370 PolarHBondContact OE2-NH1 3.03Å; E346-R370 IonicContact OE2-NH2 2.71Å; E346-R370 PolarHBondContact OE2-NH2 3.38Å
347	D	98.2	Very high	96.9	Very high	12 Å²	12	51 Å²	51	6%	0.064	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-97.6	-8.3	-178.4	-56.8	-26.3	0	0	0	112.3	V343 H344 V345 E349 N350 I351 R370	V343-D347 HydrophobicContact CG1-CB 3.95Å; H344-D347 PolarHBondContact O-N 2.89Å; V345-D347 PolarHBondContact O-N 3.11Å; D347-E349 VanDerWaalsContact C-N 3.3Å; D347-E349 PolarHBondContact O-N 3.34Å; D347-N350 PolarHBondContact O-N 3.25Å; D347-N350 VanDerWaalsContact O-N 3.16Å; D347-I351 PolarHBondContact O-N 2.94Å; D347-R370 IonicContact OD1-CZ 2.77Å; D347-R370 IonicContact OD1-NE 2.87Å; D347-R370 IonicContact OD1-NH2 3.6Å; D347-R370 PolarHBondContact OD1-NH2 3.35Å; D347-R370 WeakPolarHBondContact OD2-CB 3.06Å; D347-R370 IonicContact OD2-CZ 3.3Å; D347-R370 PolarHBondContact OD2-N 2.87Å; D347-R370 IonicContact OD2-NE 3.64Å; D347-R370 PolarHBondContact OD2-NE 2.97Å; D347-R370 IonicContact OD2-NH2 2.9Å
348	L	96.8	Very high	96.8	Very high	56 Å²	56	47.2 Å²	47.2	29%	0.293	23%	0.232	S	C	.	.	H	α-helix	trans	-56.9	-41.5	-175.8	-72.4	173.6	0	0	0	112.5	Y340 V343 H344 V345 I351 R352	Y340-L348 HydrophobicContact CD1-CD2 3.82Å; V343-L348 HydrophobicContact CB-CD2 3.89Å; V343-L348 HydrophobicContact CG1-CD2 3.87Å; V343-L348 HydrophobicContact CG1-CG 4.35Å; H344-L348 PolarHBondContact O-N 3Å; V345-L348 HydrophobicContact CB-CD1 4.4Å; V345-L348 HydrophobicContact CG2-CD1 4.08Å; V345-L348 WeakPolarHBondContact O-CB 3.34Å; V345-L348 WeakPolarHBondContact O-CG 3.21Å; V345-L348 PolarHBondContact O-N 2.75Å; L348-I351 PolarHBondContact O-N 3.27Å; L348-R352 VanDerWaalsContact O-CB 3.26Å; L348-R352 WeakPolarHBondContact O-CB 3.32Å; L348-R352 PolarHBondContact O-N 3.2Å
349	E	96.6	Very high	96.7	Very high	106 Å²	106	48.9 Å²	48.9	50%	0.495	24%	0.238	S	C	.	.	H	α-helix	trans	-67.4	-38.9	-178.6	-173.7	56	-156.8	0	0	111.9	D347 R352 Q353	D347-E349 VanDerWaalsContact C-N 3.3Å; D347-E349 PolarHBondContact O-N 3.34Å; E349-R352 PolarHBondContact O-N 3.15Å; E349-R352 IonicContact OE1-CZ 3.92Å; E349-R352 IonicContact OE1-NE 3.72Å; E349-R352 PolarHBondContact OE1-NE 3.43Å; E349-R352 IonicContact OE1-NH2 3.62Å; E349-R352 PolarHBondContact OE1-NH2 3.22Å; E349-R352 IonicContact OE2-CZ 3.52Å; E349-R352 IonicContact OE2-NE 3.76Å; E349-R352 PolarHBondContact OE2-NE 3.49Å; E349-R352 IonicContact OE2-NH2 3.63Å; E349-Q353 WeakPolarHBondContact O-CB 3.45Å; E349-Q353 PolarHBondContact O-N 3.33Å
350	N	94.9	Very high	96.5	Very high	73 Å²	73	55.5 Å²	55.5	39%	0.39	26%	0.263	S	S	.	.	H	α-helix	trans	-66.8	-39.1	175.8	-66.5	-46.8	0	0	0	111.5	D347 S354	D347-N350 PolarHBondContact O-N 3.25Å; D347-N350 VanDerWaalsContact O-N 3.16Å; N350-S354 WeakPolarHBondContact O-CB 3.48Å; N350-S354 PolarHBondContact O-N 3.12Å; N350-S354 PolarHBondContact O-OG 3.15Å
351	I	98	Very high	96.2	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.015	26%	0.255	C	S	.	.	H	α-helix	trans	-69.9	-39.2	175.4	-67.3	-58.2	0	0	0	111.4	Y340 V343 D347 L348 S354 H355 T366 Y369	Y340-I351 HydrophobicContact CD1-CG2 4.35Å; Y340-I351 HydrophobicContact CE1-CG2 3.83Å; V343-I351 HydrophobicContact CG1-CG1 3.93Å; V343-I351 HydrophobicContact CG2-CG1 4.29Å; D347-I351 PolarHBondContact O-N 2.94Å; L348-I351 PolarHBondContact O-N 3.27Å; I351-S354 PolarHBondContact O-N 3.18Å; I351-H355 VanDerWaalsContact O-CB 3.31Å; I351-H355 WeakPolarHBondContact O-CB 3.36Å; I351-H355 PolarHBondContact O-N 3.22Å; I351-T366 HydrophobicContact CD1-CG2 3.95Å; I351-Y369 HydrophobicContact CD1-CD1 3.71Å; I351-Y369 HydrophobicContact CD1-CD2 4.04Å; I351-Y369 HydrophobicContact CD1-CE1 4.09Å; I351-Y369 HydrophobicContact CD1-CE2 4.38Å; I351-Y369 HydrophobicContact CD1-CG 3.67Å; I351-Y369 HydrophobicContact CG1-CD2 4.26Å; I351-Y369 HydrophobicContact CG1-CG 4.19Å
352	R	98	Very high	96.1	Very high	95 Å²	95	51.2 Å²	51.2	36%	0.358	25%	0.251	S	S	.	.	H	α-helix	trans	-58.8	-47.6	173.2	-166.8	-171.5	74.4	71.1	8.7	111	L348 E349 S354 H355 E356	L348-R352 VanDerWaalsContact O-CB 3.26Å; L348-R352 WeakPolarHBondContact O-CB 3.32Å; L348-R352 PolarHBondContact O-N 3.2Å; E349-R352 PolarHBondContact O-N 3.15Å; E349-R352 IonicContact OE1-CZ 3.92Å; E349-R352 IonicContact OE1-NE 3.72Å; E349-R352 PolarHBondContact OE1-NE 3.43Å; E349-R352 IonicContact OE1-NH2 3.62Å; E349-R352 PolarHBondContact OE1-NH2 3.22Å; E349-R352 IonicContact OE2-CZ 3.52Å; E349-R352 IonicContact OE2-NE 3.76Å; E349-R352 PolarHBondContact OE2-NE 3.49Å; E349-R352 IonicContact OE2-NH2 3.63Å; R352-S354 PolarHBondContact O-N 3.32Å; R352-H355 WeakPolarHBondContact O-CB 3.19Å; R352-H355 PolarHBondContact O-N 3.35Å; R352-E356 IonicContact CZ-OE1 2.81Å; R352-E356 IonicContact NH1-OE1 2.68Å; R352-E356 PolarHBondContact NH1-OE1 2.78Å; R352-E356 IonicContact NH2-OE1 3.94Å; R352-E356 WeakPolarHBondContact O-CG 2.97Å; R352-E356 PolarHBondContact O-N 3.38Å
353	Q	96.4	Very high	95.9	Very high	77 Å²	77	51.6 Å²	51.6	36%	0.36	25%	0.253	S	S	.	.	H	α-helix	trans	-61	-44.7	175.5	-174.4	59.3	57	0	0	112.1	E349 H355 E356 D357	E349-Q353 WeakPolarHBondContact O-CB 3.45Å; E349-Q353 PolarHBondContact O-N 3.33Å; Q353-H355 VanDerWaalsContact C-N 3.29Å; Q353-H355 PolarHBondContact O-N 3.41Å; Q353-E356 PolarHBondContact O-N 2.97Å; Q353-D357 PolarHBondContact O-N 3.28Å
354	S	97.3	Very high	95.7	Very high	13 Å²	13	51.3 Å²	51.3	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-38.6	176.5	-56.6	0	0	0	0	111.7	N350 I351 R352 D357 L358	N350-S354 WeakPolarHBondContact O-CB 3.48Å; N350-S354 PolarHBondContact O-N 3.12Å; N350-S354 PolarHBondContact O-OG 3.15Å; I351-S354 PolarHBondContact O-N 3.18Å; R352-S354 PolarHBondContact O-N 3.32Å; S354-D357 PolarHBondContact O-N 2.58Å; S354-L358 WeakPolarHBondContact O-CB 3.21Å; S354-L358 PolarHBondContact O-N 3.01Å
355	H	97.9	Very high	95.6	Very high	20 Å²	20	51.2 Å²	51.2	9%	0.093	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-42.5	175.7	-174.8	-164.3	0	0	0	111.3	M312 L314 Y340 I351 R352 Q353 D357 L358 L359	M312-H355 PolarHBondContact O-CE1 2.71Å; M312-H355 PolarHBondContact O-NE2 3.01Å; L314-H355 HydrophobicContact CD1-CB 4.04Å; Y340-H355 AromaticContact CE2-ND1 3.91Å; Y340-H355 AromaticContact CZ-ND1 3.82Å; Y340-H355 WeakPolarHBondContact OH-CB 3.38Å; Y340-H355 PolarHBondContact OH-ND1 3.43Å; I351-H355 VanDerWaalsContact O-CB 3.31Å; I351-H355 WeakPolarHBondContact O-CB 3.36Å; I351-H355 PolarHBondContact O-N 3.22Å; R352-H355 WeakPolarHBondContact O-CB 3.19Å; R352-H355 PolarHBondContact O-N 3.35Å; Q353-H355 VanDerWaalsContact C-N 3.29Å; Q353-H355 PolarHBondContact O-N 3.41Å; H355-D357 PolarHBondContact O-N 2.79Å; H355-L358 WeakPolarHBondContact O-CB 3.31Å; H355-L358 PolarHBondContact O-N 3.24Å; H355-L359 VanDerWaalsContact O-CG 3.31Å; H355-L359 WeakPolarHBondContact O-CG 3.36Å; H355-L359 PolarHBondContact O-N 3.43Å
356	E	96.8	Very high	95.6	Very high	49 Å²	49	46.3 Å²	46.3	23%	0.229	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-42.4	173.9	-66.9	-173.7	177.2	0	0	112.7	R352 Q353 L358 L359 R360	R352-E356 IonicContact CZ-OE1 2.81Å; R352-E356 IonicContact NH1-OE1 2.68Å; R352-E356 PolarHBondContact NH1-OE1 2.78Å; R352-E356 IonicContact NH2-OE1 3.94Å; R352-E356 WeakPolarHBondContact O-CG 2.97Å; R352-E356 PolarHBondContact O-N 3.38Å; Q353-E356 PolarHBondContact O-N 2.97Å; E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 3.07Å; E356-L359 PolarHBondContact O-N 3.21Å; E356-R360 WeakPolarHBondContact O-CG 3.46Å; E356-R360 PolarHBondContact O-N 2.98Å; E356-R360 IonicContact OE2-CZ 2.85Å; E356-R360 VanDerWaalsContact OE2-CZ 3.27Å; E356-R360 IonicContact OE2-NH1 3.91Å; E356-R360 PolarHBondContact OE2-NH1 3.12Å; E356-R360 IonicContact OE2-NH2 3.37Å; E356-R360 PolarHBondContact OE2-NH2 3.01Å
357	D	95.1	Very high	95.4	Very high	23 Å²	23	42 Å²	42	12%	0.123	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-41.1	175.5	-82.6	-44.8	0	0	0	111.6	F236 Q353 S354 H355 L359 R360 K361 V364	F236-D357 HydrophobicContact CD2-CB 4.46Å; Q353-D357 PolarHBondContact O-N 3.28Å; S354-D357 PolarHBondContact O-N 2.58Å; H355-D357 PolarHBondContact O-N 2.79Å; D357-L359 VanDerWaalsContact C-N 3.34Å; D357-L359 PolarHBondContact O-N 3.43Å; D357-R360 PolarHBondContact O-N 2.92Å; D357-K361 WeakPolarHBondContact O-CB 3.26Å; D357-K361 PolarHBondContact O-N 3.27Å; D357-K361 IonicContact OD1-NZ 3.59Å; D357-K361 PolarHBondContact OD1-NZ 2.73Å; D357-V364 HydrophobicContact CB-CG2 4.1Å
358	L	94.8	Very high	95.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.7	-46	173	176.9	65.3	0	0	0	111.6	L314 S354 H355 E356 G362 V364 A385 V387 V399 W401	L314-L358 HydrophobicContact CD2-CD2 4.48Å; S354-L358 WeakPolarHBondContact O-CB 3.21Å; S354-L358 PolarHBondContact O-N 3.01Å; H355-L358 WeakPolarHBondContact O-CB 3.31Å; H355-L358 PolarHBondContact O-N 3.24Å; E356-L358 VanDerWaalsContact C-N 3.32Å; E356-L358 PolarHBondContact O-N 3.07Å; L358-G362 WeakPolarHBondContact O-CA 3.29Å; L358-G362 PolarHBondContact O-N 3.39Å; L358-V364 HydrophobicContact CB-CB 4.17Å; L358-V364 HydrophobicContact CB-CG1 3.78Å; L358-V364 HydrophobicContact CD1-CG1 4.24Å; L358-V364 HydrophobicContact CG-CG1 4.43Å; L358-A385 HydrophobicContact CD1-CB 4.1Å; L358-A385 HydrophobicContact CD2-CB 3.97Å; L358-V387 HydrophobicContact CD1-CG2 3.91Å; L358-V387 HydrophobicContact CG-CG2 4.18Å; L358-V399 HydrophobicContact CD2-CG1 3.74Å; L358-V399 HydrophobicContact CD2-CG2 4.04Å; L358-W401 HydrophobicContact CD2-CZ3 4.07Å
359	L	93.5	Very high	95.4	Very high	87 Å²	87	46.1 Å²	46.1	46%	0.455	23%	0.225	S	C	.	.	H	α-helix	trans	-66.7	-36.9	179.8	-65.8	177.6	0	0	0	112.4	M312 H355 E356 D357	M312-L359 HydrophobicContact CB-CD2 4.48Å; M312-L359 HydrophobicContact CE-CD2 3.37Å; H355-L359 VanDerWaalsContact O-CG 3.31Å; H355-L359 WeakPolarHBondContact O-CG 3.36Å; H355-L359 PolarHBondContact O-N 3.43Å; E356-L359 PolarHBondContact O-N 3.21Å; D357-L359 VanDerWaalsContact C-N 3.34Å; D357-L359 PolarHBondContact O-N 3.43Å
360	R	92.9	Very high	95.5	Very high	141 Å²	141	42.5 Å²	42.5	53%	0.532	21%	0.207	S	C	.	.	H	α-helix	trans	-77.5	-40.4	-179.2	-70.7	177.9	-171.1	120.3	6.3	113.1	E356 D357	E356-R360 WeakPolarHBondContact O-CG 3.46Å; E356-R360 PolarHBondContact O-N 2.98Å; E356-R360 IonicContact OE2-CZ 2.85Å; E356-R360 VanDerWaalsContact OE2-CZ 3.27Å; E356-R360 IonicContact OE2-NH1 3.91Å; E356-R360 PolarHBondContact OE2-NH1 3.12Å; E356-R360 IonicContact OE2-NH2 3.37Å; E356-R360 PolarHBondContact OE2-NH2 3.01Å; D357-R360 PolarHBondContact O-N 2.92Å
361	K	92.7	Very high	95.7	Very high	16 Å²	16	39 Å²	39	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-112.2	-17.9	-166.7	-62.2	167.6	-176.8	155.2	0	112.9	E183 F236 V257 D357	E183-K361 VanDerWaalsContact CD-NZ 3.32Å; E183-K361 IonicContact OE1-NZ 3.94Å; E183-K361 PolarHBondContact OE1-NZ 3.21Å; E183-K361 VanDerWaalsContact OE1-NZ 3.13Å; E183-K361 WeakPolarHBondContact OE2-CE 3.24Å; E183-K361 IonicContact OE2-NZ 3.27Å; E183-K361 PolarHBondContact OE2-NZ 3.45Å; F236-K361 HydrophobicContact CB-CD 3.66Å; F236-K361 WeakPolarHBondContact O-CD 3.27Å; F236-K361 WeakPolarHBondContact O-CE 3.35Å; F236-K361 PolarHBondContact O-NZ 2.8Å; V257-K361 HydrophobicContact CG2-CB 4.48Å; V257-K361 WeakPolarHBondContact CG2-O 3.29Å; D357-K361 WeakPolarHBondContact O-CB 3.26Å; D357-K361 PolarHBondContact O-N 3.27Å; D357-K361 IonicContact OD1-NZ 3.59Å; D357-K361 PolarHBondContact OD1-NZ 2.73Å
362	G	91.2	Very high	95.6	Very high	21 Å²	21	39.4 Å²	39.4	22%	0.216	19%	0.19	C	C	.	.	S	Bend	trans	91.1	-14.1	175.6	0	0	0	0	0	114.7	L358 V387	L358-G362 WeakPolarHBondContact O-CA 3.29Å; L358-G362 PolarHBondContact O-N 3.39Å; G362-V387 PolarHBondContact O-N 3.26Å
363	Q	93.1	Very high	95.5	Very high	25 Å²	25	35 Å²	35	12%	0.117	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	148.3	176.7	-55.8	-172.3	-84.5	0	0	110.4	V257 L291 P292 A385 T386	V257-Q363 HydrophobicContact CB-CB 4.04Å; V257-Q363 HydrophobicContact CB-CG 4.39Å; V257-Q363 HydrophobicContact CG1-CB 4.17Å; V257-Q363 HydrophobicContact CG2-CB 4.04Å; V257-Q363 HydrophobicContact CG2-CG 4.12Å; L291-Q363 HydrophobicContact CB-CB 4.24Å; L291-Q363 HydrophobicContact CD1-CB 3.52Å; P292-Q363 PolarHBondContact O-NE2 2.98Å; Q363-A385 CarbonylContact C-O 3.55Å; Q363-A385 VanDerWaalsContact CA-O 3.26Å; Q363-A385 WeakPolarHBondContact CA-O 3.25Å; Q363-T386 HydrophobicContact CG-CG2 3.73Å; Q363-T386 PolarHBondContact NE2-OG1 3.49Å
364	V	94.9	Very high	95.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	157.2	177	74.6	0	0	0	0	111.4	F236 D357 L358 T384 A385	F236-V364 HydrophobicContact CD2-CG2 4.14Å; F236-V364 HydrophobicContact CE2-CG2 3.56Å; F236-V364 HydrophobicContact CZ-CG2 3.79Å; D357-V364 HydrophobicContact CB-CG2 4.1Å; L358-V364 HydrophobicContact CB-CB 4.17Å; L358-V364 HydrophobicContact CB-CG1 3.78Å; L358-V364 HydrophobicContact CD1-CG1 4.24Å; L358-V364 HydrophobicContact CG-CG1 4.43Å; V364-T384 WeakPolarHBondContact O-CA 3.3Å; V364-A385 HydrophobicContact CG1-CB 3.97Å; V364-A385 PolarHBondContact N-O 3.04Å; V364-A385 PolarHBondContact O-N 3.12Å
365	V	94.9	Very high	95	Very high	19 Å²	19	43.7 Å²	43.7	12%	0.115	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.7	161	-173.7	0	0	0	0	107.1	F236 L291 Q382 S383 T384	F236-V365 HydrophobicContact CE1-CB 4.26Å; F236-V365 HydrophobicContact CE1-CG2 4.17Å; F236-V365 HydrophobicContact CZ-CB 4.02Å; F236-V365 HydrophobicContact CZ-CG2 4.43Å; F236-V365 WeakPolarHBondContact CZ-O 3.32Å; L291-V365 HydrophobicContact CD1-CG2 4.41Å; L291-V365 HydrophobicContact CD2-CG2 3.22Å; L291-V365 HydrophobicContact CG-CG2 4.45Å; V365-Q382 HydrophobicContact CG1-CG 4.01Å; V365-S383 WeakPolarHBondContact CA-O 3.2Å; V365-T384 HydrophobicContact CB-CG2 4.5Å; V365-T384 HydrophobicContact CG1-CG2 4.16Å; V365-T384 HydrophobicContact CG2-CG2 3.94Å
366	T	96.3	Very high	94.8	Very high	4 Å²	4	42.8 Å²	42.8	3%	0.025	20%	0.197	C	C	.	.			trans	-72.1	162.3	176.8	69	0	0	0	0	110.7	I351 Y369 Q382 S383 W401	I351-T366 HydrophobicContact CD1-CG2 3.95Å; T366-Y369 HydrophobicContact CG2-CE1 4.47Å; T366-Q382 PolarHBondContact O-NE2 3.32Å; T366-Q382 VanDerWaalsContact O-NE2 3.1Å; T366-S383 PolarHBondContact N-O 3.41Å; T366-S383 PolarHBondContact OG1-N 2.94Å; T366-S383 PolarHBondContact OG1-O 3.46Å; T366-W401 HydrophobicContact CG2-CH2 4.08Å; T366-W401 HydrophobicContact CG2-CZ2 3.84Å
367	G	93.9	Very high	94.8	Very high	42 Å²	42	40.5 Å²	40.5	43%	0.433	19%	0.187	S	C	.	.			trans	-63.4	177.4	155.7	0	0	0	0	0	111.2
368	Y	96.8	Very high	94.9	Very high	149 Å²	149	40.3 Å²	40.3	58%	0.584	18%	0.184	S	C	*	.			trans	-70	131.6	166.8	-50.5	-35.7	0	0	0	108.8	I381 Q382 L406	Y368-I381 WeakPolarHBondContact CA-O 3.4Å; Y368-Q382 HydrophobicContact CD1-CB 3.97Å; Y368-Q382 HydrophobicContact CD1-CG 4.31Å; Y368-Q382 HydrophobicContact CE1-CB 4.24Å; Y368-Q382 HydrophobicContact CE1-CG 4.4Å; Y368-L406 HydrophobicContact CD1-CD1 3.53Å; Y368-L406 HydrophobicContact CE1-CD1 3.98Å; Y368-L406 HydrophobicContact CG-CD1 4.05Å
369	Y	98.4	Very high	95	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	159.2	-179.1	72	-82.4	0	0	0	110.6	V343 I351 T366 W371 I381 S383 N403	V343-Y369 HydrophobicContact CG1-CD2 4.42Å; V343-Y369 HydrophobicContact CG2-CD2 4.05Å; V343-Y369 HydrophobicContact CG2-CE2 3.98Å; I351-Y369 HydrophobicContact CD1-CD1 3.71Å; I351-Y369 HydrophobicContact CD1-CD2 4.04Å; I351-Y369 HydrophobicContact CD1-CE1 4.09Å; I351-Y369 HydrophobicContact CD1-CE2 4.38Å; I351-Y369 HydrophobicContact CD1-CG 3.67Å; I351-Y369 HydrophobicContact CG1-CD2 4.26Å; I351-Y369 HydrophobicContact CG1-CG 4.19Å; T366-Y369 HydrophobicContact CG2-CE1 4.47Å; Y369-W371 AromaticContact CE2-CE3 3.8Å; Y369-W371 HydrophobicContact CE2-CE3 3.8Å; Y369-W371 HydrophobicContact CE2-CZ3 4.41Å; Y369-I381 HydrophobicContact CD1-CB 4.32Å; Y369-I381 VanDerWaalsContact CD1-O 3.23Å; Y369-I381 WeakPolarHBondContact CD1-O 3.25Å; Y369-I381 HydrophobicContact CE1-CB 3.84Å; Y369-I381 HydrophobicContact CE1-CG2 3.73Å; Y369-I381 HydrophobicContact CE2-CB 4.36Å; Y369-I381 PolarHBondContact N-O 3.35Å; Y369-I381 PolarHBondContact O-N 2.9Å; Y369-S383 WeakPolarHBondContact CE1-OG 3.34Å; Y369-S383 PolarHBondContact OH-OG 3.35Å; Y369-N403 PolarHBondContact OH-OD1 3.46Å
370	R	98.4	Very high	95.2	Very high	30 Å²	30	39.7 Å²	39.7	11%	0.113	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126.1	-176.2	-66.7	166.4	-76.5	-173.4	-10.2	110.5	H344 E346 D347 Y378 L379 W380	H344-R370 HydrophobicContact CB-CB 3.62Å; H344-R370 PolarHBondContact CE1-NH1 3.11Å; H344-R370 PolarHBondContact N-O 3.43Å; H344-R370 VanDerWaalsContact ND1-CZ 3.34Å; H344-R370 PolarHBondContact ND1-NH2 3.42Å; E346-R370 VanDerWaalsContact CB-NH2 3.28Å; E346-R370 IonicContact OE2-CZ 3.61Å; E346-R370 VanDerWaalsContact OE2-CZ 3.3Å; E346-R370 IonicContact OE2-NH1 3.45Å; E346-R370 PolarHBondContact OE2-NH1 3.03Å; E346-R370 IonicContact OE2-NH2 2.71Å; E346-R370 PolarHBondContact OE2-NH2 3.38Å; D347-R370 IonicContact OD1-CZ 2.77Å; D347-R370 IonicContact OD1-NE 2.87Å; D347-R370 IonicContact OD1-NH2 3.6Å; D347-R370 PolarHBondContact OD1-NH2 3.35Å; D347-R370 WeakPolarHBondContact OD2-CB 3.06Å; D347-R370 IonicContact OD2-CZ 3.3Å; D347-R370 PolarHBondContact OD2-N 2.87Å; D347-R370 IonicContact OD2-NE 3.64Å; D347-R370 PolarHBondContact OD2-NE 2.97Å; D347-R370 IonicContact OD2-NH2 2.9Å; R370-Y378 HydrophobicContact CB-CD1 4.22Å; R370-Y378 HydrophobicContact CB-CD2 3.73Å; R370-Y378 HydrophobicContact CB-CE2 4.37Å; R370-Y378 HydrophobicContact CB-CG 3.69Å; R370-Y378 HydrophobicContact CG-CD1 4.24Å; R370-Y378 HydrophobicContact CG-CD2 3.44Å; R370-Y378 VanDerWaalsContact CG-CD2 3.44Å; R370-Y378 HydrophobicContact CG-CE1 4.31Å; R370-Y378 HydrophobicContact CG-CE2 3.59Å; R370-Y378 HydrophobicContact CG-CG 3.84Å; R370-L379 WeakPolarHBondContact CA-O 3.49Å; R370-W380 HydrophobicContact CG-CD2 3.96Å; R370-W380 HydrophobicContact CG-CE3 3.93Å; R370-W380 HydrophobicContact CG-CH2 3.82Å; R370-W380 HydrophobicContact CG-CZ2 3.84Å; R370-W380 HydrophobicContact CG-CZ3 3.86Å
371	W	97.7	Very high	95.5	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	116.5	174.3	-169.4	-72.7	0	0	0	110.4	F308 M327 V334 C339 F342 Y369 Q373 Y378 L379 I381	F308-W371 HydrophobicContact CD2-CH2 4.49Å; F308-W371 AromaticContact CE2-CH2 3.41Å; F308-W371 HydrophobicContact CE2-CH2 3.41Å; F308-W371 VanDerWaalsContact CE2-CH2 3.41Å; F308-W371 HydrophobicContact CE2-CZ2 4.04Å; F308-W371 AromaticContact CE2-CZ3 3.77Å; F308-W371 HydrophobicContact CE2-CZ3 3.77Å; F308-W371 AromaticContact CZ-CH2 3.63Å; F308-W371 HydrophobicContact CZ-CH2 3.63Å; F308-W371 AromaticContact CZ-CZ2 3.78Å; F308-W371 HydrophobicContact CZ-CZ2 3.78Å; F308-W371 HydrophobicContact CZ-CZ3 4.33Å; M327-W371 HydrophobicContact CE-CB 4.32Å; M327-W371 HydrophobicContact CE-CD2 4.16Å; M327-W371 HydrophobicContact CE-CG 3.78Å; M327-W371 HydrophobicContact SD-CG 4.32Å; V334-W371 HydrophobicContact CG1-CZ2 4.39Å; C339-W371 HydrophobicContact CB-CH2 4.43Å; C339-W371 HydrophobicContact CB-CZ3 4.44Å; F342-W371 HydrophobicContact CB-CD2 3.82Å; F342-W371 HydrophobicContact CB-CE3 4.36Å; F342-W371 HydrophobicContact CB-CG 4.33Å; F342-W371 HydrophobicContact CB-CH2 3.97Å; F342-W371 HydrophobicContact CB-CZ2 3.41Å; F342-W371 VanDerWaalsContact CB-CZ2 3.41Å; F342-W371 HydrophobicContact CB-CZ3 4.42Å; F342-W371 HydrophobicContact CD1-CZ2 4.4Å; F342-W371 AromaticContact CD2-CH2 3.87Å; F342-W371 HydrophobicContact CD2-CH2 3.87Å; F342-W371 AromaticContact CD2-CZ2 3.43Å; F342-W371 HydrophobicContact CD2-CZ2 3.43Å; F342-W371 VanDerWaalsContact CD2-CZ2 3.43Å; F342-W371 HydrophobicContact CE2-CZ2 4.3Å; F342-W371 AromaticContact CG-CE2 3.77Å; F342-W371 HydrophobicContact CG-CH2 4.23Å; F342-W371 AromaticContact CG-CZ2 3.49Å; F342-W371 HydrophobicContact CG-CZ2 3.49Å; F342-W371 VanDerWaalsContact CG-CZ2 3.49Å; F342-W371 AromaticContact CG-NE1 3.94Å; F342-W371 CarbonylContact O-C 3.56Å; F342-W371 WeakPolarHBondContact O-CA 3.27Å; Y369-W371 AromaticContact CE2-CE3 3.8Å; Y369-W371 HydrophobicContact CE2-CE3 3.8Å; Y369-W371 HydrophobicContact CE2-CZ3 4.41Å; W371-Q373 PolarHBondContact O-NE2 3.22Å; W371-Y378 CarbonylContact O-C 3.51Å; W371-Y378 WeakPolarHBondContact O-CA 3.19Å; W371-Y378 WeakPolarHBondContact O-CB 3.46Å; W371-L379 HydrophobicContact CB-CD1 4.47Å; W371-L379 PolarHBondContact N-O 2.96Å; W371-L379 PolarHBondContact O-N 3.18Å; W371-I381 HydrophobicContact CB-CD1 3.45Å; W371-I381 VanDerWaalsContact CB-CD1 3.45Å; W371-I381 HydrophobicContact CB-CG1 3.97Å; W371-I381 HydrophobicContact CD2-CD1 4Å; W371-I381 HydrophobicContact CE3-CD1 3.97Å; W371-I381 HydrophobicContact CG-CD1 3.81Å
372	L	97.7	Very high	95.6	Very high	11 Å²	11	34.7 Å²	34.7	6%	0.058	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	139.4	-176.7	-63.9	174.7	0	0	0	111.7	F342 L416 D417	F342-L372 PolarHBondContact O-N 2.77Å; L372-L416 HydrophobicContact CD2-CB 4.14Å; L372-L416 HydrophobicContact CD2-CD1 4.03Å; L372-D417 HydrophobicContact CD1-CB 3.72Å
373	Q	95.9	Very high	95.9	Very high	3 Å²	3	33.7 Å²	33.7	1%	0.014	15%	0.149	C	C	.	.	P	Polyproline II helix	trans	-94.2	161.2	175.2	-61.4	-53.5	-69.9	0	0	110.9	D328 W371 R375 G376 G377 T409 Q420	D328-Q373 WeakPolarHBondContact OD1-CA 3.3Å; D328-Q373 VanDerWaalsContact OD1-CB 3.31Å; D328-Q373 WeakPolarHBondContact OD1-CB 3.31Å; D328-Q373 PolarHBondContact OD1-OE1 3Å; W371-Q373 PolarHBondContact O-NE2 3.22Å; Q373-R375 PolarHBondContact O-N 3.22Å; Q373-G376 WeakPolarHBondContact CB-O 3.42Å; Q373-G377 PolarHBondContact N-O 3.5Å; Q373-G377 VanDerWaalsContact N-O 3.16Å; Q373-T409 HydrophobicContact CB-CG2 4.49Å; Q373-T409 HydrophobicContact CG-CG2 3.77Å; Q373-Q420 VanDerWaalsContact O-CG 3.25Å; Q373-Q420 WeakPolarHBondContact O-CG 3.34Å; Q373-Q420 PolarHBondContact O-NE2 3.41Å
374	R	92.6	Very high	95.9	Very high	93 Å²	93	33.3 Å²	33.3	35%	0.351	15%	0.148	S	C	.	.	S	Bend	trans	-65.1	-37.3	-179.9	-176.2	171.9	51.1	82	1.8	113.3	D328 L329 E333 Q420	D328-R374 VanDerWaalsContact CG-N 3.26Å; D328-R374 PolarHBondContact O-NE 3.28Å; D328-R374 PolarHBondContact O-NH2 3.29Å; D328-R374 VanDerWaalsContact O-NH2 3.13Å; D328-R374 WeakPolarHBondContact OD1-CB 3.24Å; D328-R374 PolarHBondContact OD1-N 3.34Å; D328-R374 WeakPolarHBondContact OD2-CB 3.16Å; D328-R374 PolarHBondContact OD2-N 2.89Å; D328-R374 VanDerWaalsContact OD2-N 3.13Å; L329-R374 HydrophobicContact CD2-CB 3.83Å; L329-R374 HydrophobicContact CD2-CG 4.46Å; L329-R374 HydrophobicContact CG-CB 4.33Å; E333-R374 WeakPolarHBondContact OE1-CD 3.27Å; E333-R374 IonicContact OE1-NE 2.89Å; R374-Q420 WeakPolarHBondContact O-CA 3.4Å
375	R	89.2	Confident	95.8	Very high	180 Å²	180	33.3 Å²	33.3	68%	0.679	15%	0.148	S	C	*	.	S	Bend	trans	-93.8	-7.7	-174.1	-64.7	-178.5	-177.5	-130.4	3.5	115	D328 Q373	D328-R375 PolarHBondContact OD2-N 3.39Å; Q373-R375 PolarHBondContact O-N 3.22Å
376	G	93.6	Very high	95.7	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.01	15%	0.146	C	C	.	.	S	Bend	trans	133	159.9	-175.8	0	0	0	0	0	111.9	Q373 P412	Q373-G376 WeakPolarHBondContact CB-O 3.42Å; G376-P412 CarbonylContact C-O 3.47Å; G376-P412 VanDerWaalsContact CA-O 3.31Å; G376-P412 WeakPolarHBondContact CA-O 3.48Å
377	G	96.9	Very high	95.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	15%	0.151	C	C	.	.			trans	70.5	-160.6	-179.4	0	0	0	0	0	114.3	Q373 E410 M411 T414 Q420	Q373-G377 PolarHBondContact N-O 3.5Å; Q373-G377 VanDerWaalsContact N-O 3.16Å; G377-E410 WeakPolarHBondContact CA-O 3.39Å; G377-M411 WeakPolarHBondContact CA-O 3.39Å; G377-M411 PolarHBondContact N-O 3.35Å; G377-M411 VanDerWaalsContact N-O 3.15Å; G377-T414 PolarHBondContact N-O 3.39Å; G377-Q420 PolarHBondContact O-NE2 2.83Å
378	Y	97.7	Very high	94.9	Very high	19 Å²	19	32.8 Å²	32.8	8%	0.075	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	172.9	-176.3	59.3	-105.2	0	0	0	111.8	R370 W371 W380 T409 E410 M411 L416	R370-Y378 HydrophobicContact CB-CD1 4.22Å; R370-Y378 HydrophobicContact CB-CD2 3.73Å; R370-Y378 HydrophobicContact CB-CE2 4.37Å; R370-Y378 HydrophobicContact CB-CG 3.69Å; R370-Y378 HydrophobicContact CG-CD1 4.24Å; R370-Y378 HydrophobicContact CG-CD2 3.44Å; R370-Y378 VanDerWaalsContact CG-CD2 3.44Å; R370-Y378 HydrophobicContact CG-CE1 4.31Å; R370-Y378 HydrophobicContact CG-CE2 3.59Å; R370-Y378 HydrophobicContact CG-CG 3.84Å; W371-Y378 CarbonylContact O-C 3.51Å; W371-Y378 WeakPolarHBondContact O-CA 3.19Å; W371-Y378 WeakPolarHBondContact O-CB 3.46Å; Y378-W380 AromaticContact CE2-NE1 3.6Å; Y378-T409 CarbonylContact O-C 3.56Å; Y378-T409 WeakPolarHBondContact O-CA 3.24Å; Y378-E410 HydrophobicContact CD2-CB 4.31Å; Y378-E410 HydrophobicContact CE2-CB 3.79Å; Y378-E410 HydrophobicContact CE2-CG 4.28Å; Y378-E410 WeakPolarHBondContact CE2-OE2 3.35Å; Y378-E410 PolarHBondContact N-O 3.41Å; Y378-E410 VanDerWaalsContact N-O 3.08Å; Y378-E410 PolarHBondContact O-N 3.17Å; Y378-E410 PolarHBondContact OH-OE2 3.1Å; Y378-M411 HydrophobicContact CD1-CE 4.15Å; Y378-M411 HydrophobicContact CE1-CE 3.26Å; Y378-L416 HydrophobicContact CD1-CD1 3.78Å; Y378-L416 HydrophobicContact CE1-CD1 4.36Å
379	L	97.2	Very high	93.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	157.3	162	67.3	83.7	0	0	0	110.7	M327 R370 W371 I381 V405	M327-L379 HydrophobicContact CE-CD1 4.17Å; M327-L379 HydrophobicContact CE-CD2 4.07Å; M327-L379 HydrophobicContact CE-CG 4.41Å; M327-L379 HydrophobicContact CG-CD2 3.71Å; R370-L379 WeakPolarHBondContact CA-O 3.49Å; W371-L379 HydrophobicContact CB-CD1 4.47Å; W371-L379 PolarHBondContact N-O 2.96Å; W371-L379 PolarHBondContact O-N 3.18Å; L379-I381 HydrophobicContact CD1-CD1 3.71Å; L379-I381 HydrophobicContact CD1-CG1 3.24Å; L379-V405 HydrophobicContact CD1-CG1 4.23Å
380	W	98.2	Very high	92.5	Very high	75 Å²	75	32.7 Å²	32.7	28%	0.284	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	130.4	176.9	-72.4	97.3	0	0	0	111.6	R370 Y378 L406 S407 E410	R370-W380 HydrophobicContact CG-CD2 3.96Å; R370-W380 HydrophobicContact CG-CE3 3.93Å; R370-W380 HydrophobicContact CG-CH2 3.82Å; R370-W380 HydrophobicContact CG-CZ2 3.84Å; R370-W380 HydrophobicContact CG-CZ3 3.86Å; Y378-W380 AromaticContact CE2-NE1 3.6Å; W380-L406 HydrophobicContact CB-CB 3.92Å; W380-L406 HydrophobicContact CB-CD1 4.4Å; W380-L406 WeakPolarHBondContact O-CB 3.48Å; W380-L406 PolarHBondContact O-N 3.35Å; W380-S407 PolarHBondContact N-OG 2.85Å; W380-E410 PolarHBondContact NE1-OE1 3.47Å; W380-E410 PolarHBondContact NE1-OE2 2.88Å
381	I	97.8	Very high	91.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.9	176.4	-55.8	-169.6	0	0	0	109.8	F306 M327 Y368 Y369 W371 L379 S383 N403 Y404	F306-I381 HydrophobicContact CZ-CD1 4.42Å; M327-I381 HydrophobicContact CE-CD1 3.43Å; M327-I381 VanDerWaalsContact CE-CD1 3.43Å; Y368-I381 WeakPolarHBondContact CA-O 3.4Å; Y369-I381 HydrophobicContact CD1-CB 4.32Å; Y369-I381 VanDerWaalsContact CD1-O 3.23Å; Y369-I381 WeakPolarHBondContact CD1-O 3.25Å; Y369-I381 HydrophobicContact CE1-CB 3.84Å; Y369-I381 HydrophobicContact CE1-CG2 3.73Å; Y369-I381 HydrophobicContact CE2-CB 4.36Å; Y369-I381 PolarHBondContact N-O 3.35Å; Y369-I381 PolarHBondContact O-N 2.9Å; W371-I381 HydrophobicContact CB-CD1 3.45Å; W371-I381 VanDerWaalsContact CB-CD1 3.45Å; W371-I381 HydrophobicContact CB-CG1 3.97Å; W371-I381 HydrophobicContact CD2-CD1 4Å; W371-I381 HydrophobicContact CE3-CD1 3.97Å; W371-I381 HydrophobicContact CG-CD1 3.81Å; L379-I381 HydrophobicContact CD1-CD1 3.71Å; L379-I381 HydrophobicContact CD1-CG1 3.24Å; I381-S383 WeakPolarHBondContact CG2-OG 3.48Å; I381-N403 HydrophobicContact CG2-CB 3.94Å; I381-Y404 WeakPolarHBondContact CA-O 3.5Å
382	Q	96.4	Very high	89.8	Confident	52 Å²	52	47 Å²	47	24%	0.243	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	143.7	152	-173.4	168.4	47.8	0	0	108.5	V365 T366 Y368 Y404 L406	V365-Q382 HydrophobicContact CG1-CG 4.01Å; T366-Q382 PolarHBondContact O-NE2 3.32Å; T366-Q382 VanDerWaalsContact O-NE2 3.1Å; Y368-Q382 HydrophobicContact CD1-CB 3.97Å; Y368-Q382 HydrophobicContact CD1-CG 4.31Å; Y368-Q382 HydrophobicContact CE1-CB 4.24Å; Y368-Q382 HydrophobicContact CE1-CG 4.4Å; Q382-Y404 PolarHBondContact N-O 2.91Å; Q382-Y404 VanDerWaalsContact N-O 3.09Å; Q382-Y404 WeakPolarHBondContact O-CB 3.4Å; Q382-Y404 WeakPolarHBondContact O-CD2 3.47Å; Q382-Y404 PolarHBondContact O-N 2.71Å; Q382-L406 HydrophobicContact CB-CD1 4.14Å
383	S	95.7	Very high	88.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	144.1	176.8	-54.1	0	0	0	0	112.2	V365 T366 Y369 I381 W401 V402 N403	V365-S383 WeakPolarHBondContact CA-O 3.2Å; T366-S383 PolarHBondContact N-O 3.41Å; T366-S383 PolarHBondContact OG1-N 2.94Å; T366-S383 PolarHBondContact OG1-O 3.46Å; Y369-S383 WeakPolarHBondContact CE1-OG 3.34Å; Y369-S383 PolarHBondContact OH-OG 3.35Å; I381-S383 WeakPolarHBondContact CG2-OG 3.48Å; S383-W401 PolarHBondContact OG-NE1 2.96Å; S383-V402 CarbonylContact C-O 3.56Å; S383-V402 WeakPolarHBondContact CA-O 3.03Å; S383-V402 WeakPolarHBondContact CB-O 3.24Å; S383-N403 PolarHBondContact OG-OD1 3.43Å
384	T	93.8	Very high	87.2	Confident	17 Å²	17	50.6 Å²	50.6	10%	0.104	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.3	165	64.9	0	0	0	0	108.3	V364 V365 V402 Y404	V364-T384 WeakPolarHBondContact O-CA 3.3Å; V365-T384 HydrophobicContact CB-CG2 4.5Å; V365-T384 HydrophobicContact CG1-CG2 4.16Å; V365-T384 HydrophobicContact CG2-CG2 3.94Å; T384-V402 PolarHBondContact N-O 3.43Å; T384-V402 PolarHBondContact O-N 2.88Å; T384-Y404 HydrophobicContact CG2-CE2 3.72Å
385	A	93.4	Very high	86.2	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.7	-177.3	0	0	0	0	0	110.6	L358 Q363 V364 V399 I400 W401	L358-A385 HydrophobicContact CD1-CB 4.1Å; L358-A385 HydrophobicContact CD2-CB 3.97Å; Q363-A385 CarbonylContact C-O 3.55Å; Q363-A385 VanDerWaalsContact CA-O 3.26Å; Q363-A385 WeakPolarHBondContact CA-O 3.25Å; V364-A385 HydrophobicContact CG1-CB 3.97Å; V364-A385 PolarHBondContact N-O 3.04Å; V364-A385 PolarHBondContact O-N 3.12Å; A385-V399 HydrophobicContact CB-CG1 3.96Å; A385-I400 VanDerWaalsContact CA-O 3.29Å; A385-I400 WeakPolarHBondContact CA-O 3.43Å; A385-W401 HydrophobicContact CB-CD2 3.88Å; A385-W401 HydrophobicContact CB-CE3 3.32Å; A385-W401 HydrophobicContact CB-CG 4.48Å; A385-W401 HydrophobicContact CB-CH2 4.41Å; A385-W401 HydrophobicContact CB-CZ3 3.62Å
386	T	91.7	Very high	85.5	Confident	11 Å²	11	49.9 Å²	49.9	7%	0.067	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	130.4	178.3	-63.7	0	0	0	0	110.4	S294 Q363 S388 V399 I400	S294-T386 VanDerWaalsContact CA-CG2 3.43Å; Q363-T386 HydrophobicContact CG-CG2 3.73Å; Q363-T386 PolarHBondContact NE2-OG1 3.49Å; T386-S388 PolarHBondContact O-N 3.4Å; T386-V399 WeakPolarHBondContact O-CA 3.47Å; T386-I400 PolarHBondContact N-O 3.31Å; T386-I400 PolarHBondContact O-N 3.39Å
387	V	89.6	Confident	84.9	Confident	22 Å²	22	56.7 Å²	56.7	13%	0.133	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	118.9	169.7	-178.9	0	0	0	0	108.5	M312 L358 G362 I389 V399	M312-V387 HydrophobicContact CE-CG1 4.36Å; M312-V387 HydrophobicContact CE-CG2 4.11Å; M312-V387 HydrophobicContact SD-CG1 4.25Å; M312-V387 HydrophobicContact SD-CG2 4.47Å; L358-V387 HydrophobicContact CD1-CG2 3.91Å; L358-V387 HydrophobicContact CG-CG2 4.18Å; G362-V387 PolarHBondContact O-N 3.26Å; V387-I389 HydrophobicContact CG1-CG1 4.27Å; V387-V399 HydrophobicContact CG2-CG2 4.22Å
388	S	83.9	Confident	84.5	Confident	22 Å²	22	58.1 Å²	58.1	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.8	171.3	-152.4	0	0	0	0	109.4	S294 T386 N398	S294-S388 PolarHBondContact O-OG 2.96Å; T386-S388 PolarHBondContact O-N 3.4Å; S388-N398 VanDerWaalsContact CB-OD1 3.24Å; S388-N398 WeakPolarHBondContact CB-OD1 3.32Å; S388-N398 PolarHBondContact N-O 2.89Å; S388-N398 PolarHBondContact O-N 3.16Å
389	I	75.3	Confident	84.2	Confident	85 Å²	85	57.3 Å²	57.3	44%	0.436	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	117.3	177.6	-57.1	174.4	0	0	0	107.4	V387 H391 P394	V387-I389 HydrophobicContact CG1-CG1 4.27Å; I389-H391 PolarHBondContact O-N 3.05Å; I389-P394 HydrophobicContact CG2-CB 4.47Å
390	N	70.1	Confident	84	Confident	65 Å²	65	58.2 Å²	58.2	35%	0.348	28%	0.279	S	S	.	.			trans	-72.4	110.9	170.5	-175	-10.7	0	0	0	109	K392 A393 P394	N390-K392 PolarHBondContact O-N 3.46Å; N390-K392 WeakPolarHBondContact OD1-CB 3.48Å; N390-K392 PolarHBondContact OD1-N 3.06Å; N390-A393 HydrophobicContact CB-CB 4.48Å; N390-A393 CarbonylContact O-C 3.57Å; N390-A393 PolarHBondContact O-N 3.32Å; N390-P394 WeakPolarHBondContact O-CA 3.35Å; N390-P394 VanDerWaalsContact O-N 3.09Å
391	H	68	Low	83.7	Confident	130 Å²	130	54.8 Å²	54.8	60%	0.602	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.7	179.8	-68.3	-68.5	0	0	0	113.6	I389	I389-H391 PolarHBondContact O-N 3.05Å
392	K	71.6	Confident	83.5	Confident	202 Å²	202	55 Å²	55	88%	0.878	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-24.8	176.4	-62.4	-177.1	179.1	-179.4	0	112.4	N390	N390-K392 PolarHBondContact O-N 3.46Å; N390-K392 WeakPolarHBondContact OD1-CB 3.48Å; N390-K392 PolarHBondContact OD1-N 3.06Å
393	A	69.5	Low	83.5	Confident	13 Å²	13	52.6 Å²	52.6	11%	0.107	26%	0.256	C	S	.	.			trans	-139.5	75	179.4	0	0	0	0	0	109.3	N390 H395 E396	N390-A393 HydrophobicContact CB-CB 4.48Å; N390-A393 CarbonylContact O-C 3.57Å; N390-A393 PolarHBondContact O-N 3.32Å; A393-H395 PolarHBondContact O-N 3.13Å; A393-E396 HydrophobicContact CB-CB 4.16Å; A393-E396 HydrophobicContact CB-CG 3.99Å; A393-E396 WeakPolarHBondContact O-CB 3.3Å; A393-E396 PolarHBondContact O-N 3.29Å
394	P	68.5	Low	83.5	Confident	75 Å²	75	55.3 Å²	55.3	49%	0.487	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.5	-171.8	23.4	-33.2	0	0	0	114.4	I389 N390	I389-P394 HydrophobicContact CG2-CB 4.47Å; N390-P394 WeakPolarHBondContact O-CA 3.35Å; N390-P394 VanDerWaalsContact O-N 3.09Å
395	H	71.6	Confident	83.6	Confident	151 Å²	151	55.3 Å²	55.3	70%	0.699	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-24.2	171.3	52.7	-84.1	0	0	0	112.3	A393 R397	A393-H395 PolarHBondContact O-N 3.13Å; H395-R397 PolarHBondContact O-N 2.88Å
396	E	74.4	Confident	83.7	Confident	108 Å²	108	59.2 Å²	59.2	51%	0.505	29%	0.287	S	S	.	.			trans	-83.5	91.6	172.2	-65.1	-177.2	171.3	0	0	109.3	A393	A393-E396 HydrophobicContact CB-CB 4.16Å; A393-E396 HydrophobicContact CB-CG 3.99Å; A393-E396 WeakPolarHBondContact O-CB 3.3Å; A393-E396 PolarHBondContact O-N 3.29Å
397	R	81.5	Confident	83.9	Confident	144 Å²	144	60.1 Å²	60.1	54%	0.543	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.3	171.7	-60.3	-178.1	-173	178.9	2.1	108.9	M312 H395	M312-R397 HydrophobicContact CG-CB 4.02Å; M312-R397 HydrophobicContact SD-CB 3.83Å; H395-R397 PolarHBondContact O-N 2.88Å
398	N	88.1	Confident	84.2	Confident	30 Å²	30	69.9 Å²	69.9	16%	0.16	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	167.6	168.6	62.5	58.2	0	0	0	109	R309 S388	R309-N398 HydrophobicContact CG-CB 4Å; S388-N398 VanDerWaalsContact CB-OD1 3.24Å; S388-N398 WeakPolarHBondContact CB-OD1 3.32Å; S388-N398 PolarHBondContact N-O 2.89Å; S388-N398 PolarHBondContact O-N 3.16Å
399	V	92	Very high	84.8	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.7	177.2	174.1	0	0	0	0	107.5	R309 V310 M312 L358 A385 T386 V387 W401	R309-V399 WeakPolarHBondContact CA-O 3.49Å; V310-V399 HydrophobicContact CG2-CB 3.57Å; V310-V399 HydrophobicContact CG2-CG1 3.84Å; V310-V399 HydrophobicContact CG2-CG2 4.45Å; V310-V399 PolarHBondContact N-O 2.74Å; V310-V399 PolarHBondContact O-N 3.4Å; M312-V399 HydrophobicContact SD-CG2 3.83Å; L358-V399 HydrophobicContact CD2-CG1 3.74Å; L358-V399 HydrophobicContact CD2-CG2 4.04Å; A385-V399 HydrophobicContact CB-CG1 3.96Å; T386-V399 WeakPolarHBondContact O-CA 3.47Å; V387-V399 HydrophobicContact CG2-CG2 4.22Å; V399-W401 HydrophobicContact CG1-CE3 4.1Å
400	I	91.9	Very high	85.8	Confident	20 Å²	20	71 Å²	71	10%	0.103	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	120.2	166.9	-53	-159.1	0	0	0	106.8	L296 V307 A385 T386 V402	L296-I400 HydrophobicContact CB-CD1 3.79Å; L296-I400 HydrophobicContact CD1-CG2 4.09Å; V307-I400 HydrophobicContact CG1-CG2 4Å; A385-I400 VanDerWaalsContact CA-O 3.29Å; A385-I400 WeakPolarHBondContact CA-O 3.43Å; T386-I400 PolarHBondContact N-O 3.31Å; T386-I400 PolarHBondContact O-N 3.39Å; I400-V402 HydrophobicContact CG2-CG2 4.19Å
401	W	93.8	Very high	87	Confident	2 Å²	2	72.1 Å²	72.1	1%	0.008	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	104.4	-175.1	-168.1	-74.2	0	0	0	108.6	F308 V310 L314 L358 T366 S383 A385 V399 N403	F308-W401 HydrophobicContact CB-CB 4.18Å; F308-W401 AromaticContact CD2-CD1 3.9Å; F308-W401 HydrophobicContact CD2-CG 4.44Å; F308-W401 PolarHBondContact N-O 2.95Å; F308-W401 PolarHBondContact O-N 2.93Å; V310-W401 HydrophobicContact CG1-CB 4.38Å; V310-W401 HydrophobicContact CG2-CB 4.41Å; V310-W401 HydrophobicContact CG2-CE3 4.31Å; L314-W401 HydrophobicContact CD1-CH2 4.2Å; L314-W401 HydrophobicContact CD1-CZ3 4.12Å; L314-W401 HydrophobicContact CD2-CE3 3.87Å; L314-W401 HydrophobicContact CD2-CH2 4.4Å; L314-W401 HydrophobicContact CD2-CZ3 3.53Å; L314-W401 HydrophobicContact CG-CZ3 4.49Å; L358-W401 HydrophobicContact CD2-CZ3 4.07Å; T366-W401 HydrophobicContact CG2-CH2 4.08Å; T366-W401 HydrophobicContact CG2-CZ2 3.84Å; S383-W401 PolarHBondContact OG-NE1 2.96Å; A385-W401 HydrophobicContact CB-CD2 3.88Å; A385-W401 HydrophobicContact CB-CE3 3.32Å; A385-W401 HydrophobicContact CB-CG 4.48Å; A385-W401 HydrophobicContact CB-CH2 4.41Å; A385-W401 HydrophobicContact CB-CZ3 3.62Å; V399-W401 HydrophobicContact CG1-CE3 4.1Å; W401-N403 PolarHBondContact NE1-OD1 3.42Å; W401-N403 VanDerWaalsContact NE1-OD1 3.1Å
402	V	93.6	Very high	88.3	Confident	6 Å²	6	69 Å²	69	4%	0.036	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.9	-176.3	-174.2	0	0	0	0	108.2	V299 M301 M305 V307 S383 T384 I400 Y404	V299-V402 HydrophobicContact CG1-CG1 4.32Å; V299-V402 HydrophobicContact CG1-CG2 4.25Å; V299-V402 HydrophobicContact CG2-CG2 4.48Å; M301-V402 HydrophobicContact CE-CG1 4.45Å; M305-V402 HydrophobicContact CE-CG1 3.27Å; V307-V402 HydrophobicContact CG2-CG1 4.46Å; V307-V402 HydrophobicContact CG2-CG2 4.34Å; S383-V402 CarbonylContact C-O 3.56Å; S383-V402 WeakPolarHBondContact CA-O 3.03Å; S383-V402 WeakPolarHBondContact CB-O 3.24Å; T384-V402 PolarHBondContact N-O 3.43Å; T384-V402 PolarHBondContact O-N 2.88Å; I400-V402 HydrophobicContact CG2-CG2 4.19Å; V402-Y404 HydrophobicContact CB-CE2 4.37Å; V402-Y404 HydrophobicContact CG1-CE2 3.95Å
403	N	95.4	Very high	89.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.4	-176.7	-56.8	-74.6	0	0	0	110.5	M305 F306 F308 Y369 I381 S383 W401	M305-N403 VanDerWaalsContact CA-O 3.24Å; M305-N403 WeakPolarHBondContact CA-O 3.24Å; F306-N403 HydrophobicContact CD1-CB 4Å; F306-N403 HydrophobicContact CD2-CB 4.44Å; F306-N403 HydrophobicContact CE1-CB 3.51Å; F306-N403 HydrophobicContact CE2-CB 4.01Å; F306-N403 VanDerWaalsContact CE2-ND2 3.33Å; F306-N403 WeakPolarHBondContact CE2-ND2 3.39Å; F306-N403 HydrophobicContact CG-CB 4.43Å; F306-N403 HydrophobicContact CZ-CB 3.5Å; F306-N403 PolarHBondContact N-O 2.88Å; F306-N403 PolarHBondContact O-N 3.38Å; F306-N403 PolarHBondContact O-ND2 3.4Å; F308-N403 WeakPolarHBondContact CD2-ND2 3.32Å; F308-N403 WeakPolarHBondContact CE2-ND2 3.11Å; Y369-N403 PolarHBondContact OH-OD1 3.46Å; I381-N403 HydrophobicContact CG2-CB 3.94Å; S383-N403 PolarHBondContact OG-OD1 3.43Å; W401-N403 PolarHBondContact NE1-OD1 3.42Å; W401-N403 VanDerWaalsContact NE1-OD1 3.1Å
404	Y	94.9	Very high	90.5	Very high	57 Å²	57	69 Å²	69	22%	0.224	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114	174.9	-60	-105.1	0	0	0	107.8	M305 I381 Q382 T384 V402	M305-Y404 HydrophobicContact CE-CD1 4.01Å; M305-Y404 HydrophobicContact CE-CE1 3.36Å; M305-Y404 HydrophobicContact CE-CE2 4.07Å; M305-Y404 HydrophobicContact CG-CD1 3.81Å; M305-Y404 HydrophobicContact CG-CE1 4.08Å; M305-Y404 HydrophobicContact CG-CG 4.38Å; M305-Y404 HydrophobicContact SD-CD1 3.9Å; M305-Y404 HydrophobicContact SD-CE1 3.55Å; M305-Y404 VanDerWaalsContact SD-CE1 3.55Å; I381-Y404 WeakPolarHBondContact CA-O 3.5Å; Q382-Y404 PolarHBondContact N-O 2.91Å; Q382-Y404 VanDerWaalsContact N-O 3.09Å; Q382-Y404 WeakPolarHBondContact O-CB 3.4Å; Q382-Y404 WeakPolarHBondContact O-CD2 3.47Å; Q382-Y404 PolarHBondContact O-N 2.71Å; T384-Y404 HydrophobicContact CG2-CE2 3.72Å; V402-Y404 HydrophobicContact CB-CE2 4.37Å; V402-Y404 HydrophobicContact CG1-CE2 3.95Å
405	V	96.1	Very high	91.8	Very high	17 Å²	17	68.5 Å²	68.5	10%	0.103	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	121.8	179	178.7	0	0	0	0	108.8	N304 F306 Y326 L379 S407	N304-V405 PolarHBondContact ND2-O 2.87Å; N304-V405 PolarHBondContact O-N 3.35Å; F306-V405 HydrophobicContact CD1-CG2 3.98Å; F306-V405 HydrophobicContact CE1-CG2 3.71Å; Y326-V405 HydrophobicContact CD1-CB 4.5Å; Y326-V405 HydrophobicContact CD1-CG1 4.4Å; Y326-V405 HydrophobicContact CD1-CG2 4.26Å; Y326-V405 HydrophobicContact CD2-CG2 4.1Å; Y326-V405 HydrophobicContact CG-CG2 3.86Å; L379-V405 HydrophobicContact CD1-CG1 4.23Å; V405-S407 WeakPolarHBondContact CG1-O 3.33Å
406	L	96.2	Very high	92.8	Very high	83 Å²	83	64.6 Å²	64.6	44%	0.435	32%	0.32	S	S	.	.			trans	-105.4	-25.2	-172.9	-54	178.5	0	0	0	113.2	Y368 W380 Q382	Y368-L406 HydrophobicContact CD1-CD1 3.53Å; Y368-L406 HydrophobicContact CE1-CD1 3.98Å; Y368-L406 HydrophobicContact CG-CD1 4.05Å; W380-L406 HydrophobicContact CB-CB 3.92Å; W380-L406 HydrophobicContact CB-CD1 4.4Å; W380-L406 WeakPolarHBondContact O-CB 3.48Å; W380-L406 PolarHBondContact O-N 3.35Å; Q382-L406 HydrophobicContact CB-CD1 4.14Å
407	S	96.4	Very high	93.7	Very high	29 Å²	29	62.5 Å²	62.5	20%	0.203	31%	0.312	C	S	.	.	S	Bend	trans	-139.2	166.1	-178.1	78.4	0	0	0	0	112.1	W380 V405	W380-S407 PolarHBondContact N-OG 2.85Å; V405-S407 WeakPolarHBondContact CG1-O 3.33Å
408	R	94.9	Very high	94.1	Very high	227 Å²	227	58.8 Å²	58.8	86%	0.857	30%	0.303	S	S	*	.	P	Polyproline II helix	trans	-76.3	172.8	159.2	-64.1	-179.2	-179.2	-90.8	-0.6	109.5	E410	R408-E410 PolarHBondContact O-N 2.88Å
409	T	96.1	Very high	93.9	Very high	59 Å²	59	59.5 Å²	59.5	36%	0.362	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-58.6	126.1	175	-51.2	0	0	0	0	111.7	Q373 Y378 P412	Q373-T409 HydrophobicContact CB-CG2 4.49Å; Q373-T409 HydrophobicContact CG-CG2 3.77Å; Y378-T409 CarbonylContact O-C 3.56Å; Y378-T409 WeakPolarHBondContact O-CA 3.24Å; T409-P412 HydrophobicContact CG2-CB 4.01Å
410	E	97.3	Very high	93.9	Very high	72 Å²	72	60.1 Å²	60.1	34%	0.336	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-103.2	140.3	171.9	-67.1	179.9	-164.2	0	0	109.5	G377 Y378 W380 R408	G377-E410 WeakPolarHBondContact CA-O 3.39Å; Y378-E410 HydrophobicContact CD2-CB 4.31Å; Y378-E410 HydrophobicContact CE2-CB 3.79Å; Y378-E410 HydrophobicContact CE2-CG 4.28Å; Y378-E410 WeakPolarHBondContact CE2-OE2 3.35Å; Y378-E410 PolarHBondContact N-O 3.41Å; Y378-E410 VanDerWaalsContact N-O 3.08Å; Y378-E410 PolarHBondContact O-N 3.17Å; Y378-E410 PolarHBondContact OH-OE2 3.1Å; W380-E410 PolarHBondContact NE1-OE1 3.47Å; W380-E410 PolarHBondContact NE1-OE2 2.88Å; R408-E410 PolarHBondContact O-N 2.88Å
411	M	95.9	Very high	93.9	Very high	89 Å²	89	60.8 Å²	60.8	44%	0.438	31%	0.313	S	S	.	.	S	Bend	trans	53.6	49.8	179.9	-56.8	-172.5	-70.3	0	0	115.1	G377 Y378 D413 T414	G377-M411 WeakPolarHBondContact CA-O 3.39Å; G377-M411 PolarHBondContact N-O 3.35Å; G377-M411 VanDerWaalsContact N-O 3.15Å; Y378-M411 HydrophobicContact CD1-CE 4.15Å; Y378-M411 HydrophobicContact CE1-CE 3.26Å; M411-D413 PolarHBondContact O-N 2.89Å; M411-D413 VanDerWaalsContact O-N 3.09Å; M411-T414 PolarHBondContact O-N 3.22Å
412	P	94.4	Very high	93.5	Very high	63 Å²	63	64.3 Å²	64.3	41%	0.409	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.5	-173.3	26.2	-36	0	0	0	114.3	G376 T409	G376-P412 CarbonylContact C-O 3.47Å; G376-P412 VanDerWaalsContact CA-O 3.31Å; G376-P412 WeakPolarHBondContact CA-O 3.48Å; T409-P412 HydrophobicContact CG2-CB 4.01Å
413	D	93.9	Very high	93	Very high	150 Å²	150	70.6 Å²	70.6	80%	0.802	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	2.8	-177.4	-55	-54.3	0	0	0	113.4	M411 P415	M411-D413 PolarHBondContact O-N 2.89Å; M411-D413 VanDerWaalsContact O-N 3.09Å; D413-P415 WeakPolarHBondContact O-CD 3.43Å
414	T	94.6	Very high	92.4	Very high	65 Å²	65	74.8 Å²	74.8	40%	0.399	39%	0.394	S	S	.	.			trans	-110.8	104.7	-176.7	-53.4	0	0	0	0	110.6	G377 M411 L416	G377-T414 PolarHBondContact N-O 3.39Å; M411-T414 PolarHBondContact O-N 3.22Å; T414-L416 HydrophobicContact CG2-CD2 3.89Å; T414-L416 PolarHBondContact O-N 3.26Å
415	P	94.1	Very high	91.9	Very high	66 Å²	66	75.5 Å²	75.5	43%	0.429	40%	0.401	S	S	.	.			trans	-72.1	127.5	172.5	29.4	-32.5	0	0	0	110.1	D413 Q420 L421	D413-P415 WeakPolarHBondContact O-CD 3.43Å; P415-Q420 HydrophobicContact CB-CB 4.11Å; P415-L421 HydrophobicContact CB-CD2 3.78Å; P415-L421 HydrophobicContact CG-CD2 3.88Å
416	L	94.3	Very high	91.2	Very high	68 Å²	68	77.7 Å²	77.7	36%	0.356	41%	0.407	S	S	.	.			trans	-108.7	-25.9	-177.7	-55.5	175.1	0	0	0	111.9	L372 Y378 T414	L372-L416 HydrophobicContact CD2-CB 4.14Å; L372-L416 HydrophobicContact CD2-CD1 4.03Å; Y378-L416 HydrophobicContact CD1-CD1 3.78Å; Y378-L416 HydrophobicContact CE1-CD1 4.36Å; T414-L416 HydrophobicContact CG2-CD2 3.89Å; T414-L416 PolarHBondContact O-N 3.26Å
417	D	91.9	Very high	90.4	Very high	65 Å²	65	75.7 Å²	75.7	35%	0.348	40%	0.403	S	S	.	.	S	Bend	trans	-127.5	156	177.4	-168	-83.4	0	0	0	111.9	L372 L419 Q420	L372-D417 HydrophobicContact CD1-CB 3.72Å; D417-L419 PolarHBondContact O-N 2.93Å; D417-L419 VanDerWaalsContact O-N 3.16Å; D417-L419 WeakPolarHBondContact OD1-CB 3.46Å; D417-L419 WeakPolarHBondContact OD1-CD1 3.27Å; D417-L419 WeakPolarHBondContact OD1-CG 3.44Å; D417-L419 PolarHBondContact OD1-N 3.43Å; D417-Q420 HydrophobicContact CB-CG 4.49Å; D417-Q420 VanDerWaalsContact N-OE1 3.11Å; D417-Q420 PolarHBondContact O-N 3.02Å
418	L	89.6	Confident	89.7	Confident	65 Å²	65	80.6 Å²	80.6	34%	0.34	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-56	-28.7	175.7	-70	176.8	0	0	0	113	Q420 L421 R426 R429	L418-Q420 PolarHBondContact O-N 2.96Å; L418-L421 HydrophobicContact CD2-CD1 4.04Å; L418-L421 WeakPolarHBondContact O-CB 3.46Å; L418-L421 PolarHBondContact O-N 3.39Å; L418-R426 WeakPolarHBondContact O-CD 3.46Å; L418-R429 HydrophobicContact CD2-CB 4.31Å
419	L	85.7	Confident	88.8	Confident	46 Å²	46	76.9 Å²	76.9	24%	0.241	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-68.8	-20.8	179.1	-61	163.2	0	0	0	113.9	H341 D417 L421	H341-L419 WeakPolarHBondContact CD2-CD1 3.32Å; H341-L419 WeakPolarHBondContact CE1-CD1 3.33Å; H341-L419 VanDerWaalsContact CE1-CD2 3.4Å; H341-L419 WeakPolarHBondContact CE1-CD2 3.41Å; H341-L419 WeakPolarHBondContact NE2-CD1 3.42Å; H341-L419 WeakPolarHBondContact NE2-CD2 3.34Å; H341-L419 WeakPolarHBondContact O-CD1 3.37Å; D417-L419 PolarHBondContact O-N 2.93Å; D417-L419 VanDerWaalsContact O-N 3.16Å; D417-L419 WeakPolarHBondContact OD1-CB 3.46Å; D417-L419 WeakPolarHBondContact OD1-CD1 3.27Å; D417-L419 WeakPolarHBondContact OD1-CG 3.44Å; D417-L419 PolarHBondContact OD1-N 3.43Å; L419-L421 VanDerWaalsContact C-N 3.3Å
420	Q	92.1	Very high	87.8	Confident	14 Å²	14	78.3 Å²	78.3	7%	0.065	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-88.1	-6.4	178.5	-52	-177.2	-63.3	0	0	111.7	Q373 R374 G377 P415 D417 L418	Q373-Q420 VanDerWaalsContact O-CG 3.25Å; Q373-Q420 WeakPolarHBondContact O-CG 3.34Å; Q373-Q420 PolarHBondContact O-NE2 3.41Å; R374-Q420 WeakPolarHBondContact O-CA 3.4Å; G377-Q420 PolarHBondContact O-NE2 2.83Å; P415-Q420 HydrophobicContact CB-CB 4.11Å; D417-Q420 HydrophobicContact CB-CG 4.49Å; D417-Q420 VanDerWaalsContact N-OE1 3.11Å; D417-Q420 PolarHBondContact O-N 3.02Å; L418-Q420 PolarHBondContact O-N 2.96Å
421	L	90.3	Very high	86.6	Confident	33 Å²	33	84.1 Å²	84.1	17%	0.173	43%	0.433	C	S	.	.	S	Bend	trans	-85.3	149.7	175.3	-61.6	178.3	0	0	0	110.9	P415 L418 L419 I425	P415-L421 HydrophobicContact CB-CD2 3.78Å; P415-L421 HydrophobicContact CG-CD2 3.88Å; L418-L421 HydrophobicContact CD2-CD1 4.04Å; L418-L421 WeakPolarHBondContact O-CB 3.46Å; L418-L421 PolarHBondContact O-N 3.39Å; L419-L421 VanDerWaalsContact C-N 3.3Å; L421-I425 HydrophobicContact CB-CG2 4.5Å; L421-I425 HydrophobicContact CD1-CG2 4.06Å
422	P	86.3	Confident	85.2	Confident	76 Å²	76	84.7 Å²	84.7	49%	0.494	44%	0.441	S	S	.	.			trans	-52.1	143.6	170.4	-25.9	33.6	0	0	0	112.5	S424 I425 R426	P422-S424 PolarHBondContact O-N 3.44Å; P422-S424 VanDerWaalsContact O-N 3.08Å; P422-I425 HydrophobicContact CG-CD1 4.24Å; P422-I425 PolarHBondContact O-N 3.49Å; P422-R426 PolarHBondContact O-N 2.9Å
423	E	82.1	Confident	83.6	Confident	138 Å²	138	86.2 Å²	86.2	65%	0.645	45%	0.453	S	S	*	.	H	α-helix	trans	-47.3	-41.7	-178	-162.9	91.9	-131.8	0	0	113.2	R426 A427	E423-R426 PolarHBondContact O-N 3.31Å; E423-R426 IonicContact OE1-CZ 3.72Å; E423-R426 IonicContact OE1-NE 3.99Å; E423-R426 IonicContact OE1-NH2 2.69Å; E423-R426 PolarHBondContact OE1-NH2 2.94Å; E423-R426 IonicContact OE2-NH2 3.58Å; E423-A427 VanDerWaalsContact O-CB 3.31Å; E423-A427 WeakPolarHBondContact O-CB 3.34Å; E423-A427 PolarHBondContact O-N 3.15Å
424	S	83.6	Confident	81.9	Confident	88 Å²	88	83.1 Å²	83.1	62%	0.615	44%	0.443	S	S	*	.	H	α-helix	trans	-61.8	-47.5	179.5	50.6	0	0	0	0	112.7	P422 E428	P422-S424 PolarHBondContact O-N 3.44Å; P422-S424 VanDerWaalsContact O-N 3.08Å; S424-E428 PolarHBondContact O-N 3.36Å
425	I	83.9	Confident	79.5	Confident	72 Å²	72	83.9 Å²	83.9	37%	0.369	45%	0.451	S	S	.	.	H	α-helix	trans	-70.7	-38.8	179.9	-60.2	178.1	0	0	0	110.1	L421 P422 E428 R429	L421-I425 HydrophobicContact CB-CG2 4.5Å; L421-I425 HydrophobicContact CD1-CG2 4.06Å; P422-I425 HydrophobicContact CG-CD1 4.24Å; P422-I425 PolarHBondContact O-N 3.49Å; I425-E428 PolarHBondContact O-N 3.33Å; I425-R429 PolarHBondContact O-N 2.77Å; I425-R429 VanDerWaalsContact O-N 3.07Å
426	R	82.8	Confident	77.4	Confident	63 Å²	63	86.2 Å²	86.2	24%	0.238	47%	0.466	C	S	.	.	H	α-helix	trans	-61.8	-47.2	176.7	-173.4	173.1	70.4	173.6	0.2	111.6	L418 P422 E423 E428 R429 L430	L418-R426 WeakPolarHBondContact O-CD 3.46Å; P422-R426 PolarHBondContact O-N 2.9Å; E423-R426 PolarHBondContact O-N 3.31Å; E423-R426 IonicContact OE1-CZ 3.72Å; E423-R426 IonicContact OE1-NE 3.99Å; E423-R426 IonicContact OE1-NH2 2.69Å; E423-R426 PolarHBondContact OE1-NH2 2.94Å; E423-R426 IonicContact OE2-NH2 3.58Å; R426-E428 VanDerWaalsContact C-N 3.32Å; R426-E428 PolarHBondContact O-N 2.7Å; R426-R429 PolarHBondContact O-N 3.13Å; R426-L430 HydrophobicContact CG-CD1 4.16Å; R426-L430 WeakPolarHBondContact O-CG 3.39Å; R426-L430 PolarHBondContact O-N 3.4Å; R426-L430 VanDerWaalsContact O-N 3.09Å
427	A	78.9	Confident	75.3	Confident	42 Å²	42	90 Å²	90	35%	0.347	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-36.5	178.8	0	0	0	0	0	112.5	E423 R431	E423-A427 VanDerWaalsContact O-CB 3.31Å; E423-A427 WeakPolarHBondContact O-CB 3.34Å; E423-A427 PolarHBondContact O-N 3.15Å; A427-R431 WeakPolarHBondContact O-CG 3.46Å; A427-R431 PolarHBondContact O-N 2.81Å
428	E	80.5	Confident	73.2	Confident	131 Å²	131	94.3 Å²	94.3	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-65.2	-48.1	175	-172.4	175.4	-173.7	0	0	111.8	S424 I425 R426 L430 R431 V432	S424-E428 PolarHBondContact O-N 3.36Å; I425-E428 PolarHBondContact O-N 3.33Å; R426-E428 VanDerWaalsContact C-N 3.32Å; R426-E428 PolarHBondContact O-N 2.7Å; E428-L430 PolarHBondContact O-N 3.27Å; E428-R431 PolarHBondContact O-N 2.97Å; E428-V432 PolarHBondContact O-N 3.2Å
429	R	77.1	Confident	71	Confident	150 Å²	150	94.2 Å²	94.2	57%	0.566	53%	0.53	S	S	*	.	H	α-helix	trans	-64.2	-37	179.9	-75.6	-163	176.7	-170.2	2.3	113.6	L418 I425 R426 R431 V432 S433	L418-R429 HydrophobicContact CD2-CB 4.31Å; I425-R429 PolarHBondContact O-N 2.77Å; I425-R429 VanDerWaalsContact O-N 3.07Å; R426-R429 PolarHBondContact O-N 3.13Å; R429-R431 VanDerWaalsContact C-N 3.32Å; R429-R431 PolarHBondContact O-N 3.02Å; R429-V432 PolarHBondContact O-N 3.21Å; R429-S433 PolarHBondContact O-N 3.19Å; R429-S433 PolarHBondContact O-OG 2.94Å
430	L	75.3	Confident	68.7	Low	89 Å²	89	96.6 Å²	96.6	47%	0.466	55%	0.551	S	S	.	*	H	α-helix	trans	-68.9	-28.7	176.9	-72.9	169.4	0	0	0	113	R426 E428 S433 S434	R426-L430 HydrophobicContact CG-CD1 4.16Å; R426-L430 WeakPolarHBondContact O-CG 3.39Å; R426-L430 PolarHBondContact O-N 3.4Å; R426-L430 VanDerWaalsContact O-N 3.09Å; E428-L430 PolarHBondContact O-N 3.27Å; L430-S433 PolarHBondContact O-OG 3.36Å; L430-S434 WeakPolarHBondContact O-CB 3.34Å; L430-S434 PolarHBondContact O-N 3.31Å; L430-S434 PolarHBondContact O-OG 3.25Å
431	R	70.6	Confident	66.4	Low	194 Å²	194	101.9 Å²	101.9	73%	0.732	59%	0.586	S	S	*	*	H	α-helix	trans	-71.2	-36.3	173.2	-76	176.7	178.8	166	1.1	112.3	A427 E428 R429 S434	A427-R431 WeakPolarHBondContact O-CG 3.46Å; A427-R431 PolarHBondContact O-N 2.81Å; E428-R431 PolarHBondContact O-N 2.97Å; R429-R431 VanDerWaalsContact C-N 3.32Å; R429-R431 PolarHBondContact O-N 3.02Å; R431-S434 PolarHBondContact O-OG 3.42Å
432	V	66.8	Low	64	Low	101 Å²	101	109.2 Å²	109.2	61%	0.612	62%	0.62	S	S	*	*	H	α-helix	trans	-68.9	-41.1	178.2	177.5	0	0	0	0	111.1	E428 R429 S434 S435	E428-V432 PolarHBondContact O-N 3.2Å; R429-V432 PolarHBondContact O-N 3.21Å; V432-S434 VanDerWaalsContact C-N 3.33Å; V432-S434 PolarHBondContact O-N 3.3Å; V432-S435 PolarHBondContact O-OG 3.33Å
433	S	60.6	Low	61.9	Low	94 Å²	94	110.3 Å²	110.3	66%	0.657	64%	0.635	S	S	*	*	H	α-helix	trans	-73	-19.4	-179.3	63.7	0	0	0	0	115	R429 L430	R429-S433 PolarHBondContact O-N 3.19Å; R429-S433 PolarHBondContact O-OG 2.94Å; L430-S433 PolarHBondContact O-OG 3.36Å
434	S	57.9	Low	60	Low	85 Å²	85	115.7 Å²	115.7	59%	0.594	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-0.7	-178.7	50.3	0	0	0	0	114.2	L430 R431 V432 P436	L430-S434 WeakPolarHBondContact O-CB 3.34Å; L430-S434 PolarHBondContact O-N 3.31Å; L430-S434 PolarHBondContact O-OG 3.25Å; R431-S434 PolarHBondContact O-OG 3.42Å; V432-S434 VanDerWaalsContact C-N 3.33Å; V432-S434 PolarHBondContact O-N 3.3Å; S434-P436 WeakPolarHBondContact O-CD 3.44Å
435	S	45.2	Very low	58	Low	82 Å²	82	115.2 Å²	115.2	57%	0.573	66%	0.659	S	S	*	*			trans	-73.7	118.6	174	62.3	0	0	0	0	110.5	V432 T437	V432-S435 PolarHBondContact O-OG 3.33Å; S435-T437 PolarHBondContact O-N 3.37Å
436	P	50.8	Low	56.2	Low	115 Å²	115	115.4 Å²	115.4	75%	0.747	68%	0.679	S	S	*	*			trans	-70.1	132.2	174.6	28.9	-29.7	0	0	0	108.1	S434 D438	S434-P436 WeakPolarHBondContact O-CD 3.44Å; P436-D438 VanDerWaalsContact C-N 3.28Å; P436-D438 PolarHBondContact O-N 3.18Å
437	T	49.8	Very low	54.1	Low	147 Å²	147	121.1 Å²	121.1	90%	0.902	74%	0.739	S	S	*	*			trans	-63.9	94.3	166.4	22.9	0	0	0	0	107.8	S435 G439	S435-T437 PolarHBondContact O-N 3.37Å; T437-G439 VanDerWaalsContact C-N 3.33Å; T437-G439 PolarHBondContact O-N 3.33Å
438	D	46.6	Very low	52.9	Low	155 Å²	155	125.1 Å²	125.1	83%	0.829	76%	0.758	S	S	*	*			trans	-70.9	93	172.2	-153.2	3.8	0	0	0	107.8	P436	P436-D438 VanDerWaalsContact C-N 3.28Å; P436-D438 PolarHBondContact O-N 3.18Å
439	G	43.4	Very low	51.4	Low	64 Å²	64	124.7 Å²	124.7	66%	0.66	77%	0.766	S	S	*	*			trans	-137.4	55.2	-177.7	0	0	0	0	0	110.3	T437 P441	T437-G439 VanDerWaalsContact C-N 3.33Å; T437-G439 PolarHBondContact O-N 3.33Å; G439-P441 WeakPolarHBondContact O-CD 3.23Å
440	S	38.4	Very low	50	Low	95 Å²	95	123.3 Å²	123.3	66%	0.664	78%	0.777	S	S	*	*			trans	-66	122.7	165.4	42	0	0	0	0	108.8	Q442	S440-Q442 PolarHBondContact O-N 3.25Å; S440-Q442 VanDerWaalsContact O-N 3.14Å
441	P	43.5	Very low	48.5	Very low	126 Å²	126	125.4 Å²	125.4	82%	0.818	80%	0.796	S	S	*	*			trans	-71.9	113.8	177	27.1	-29.3	0	0	0	108.3	G439 A443	G439-P441 WeakPolarHBondContact O-CD 3.23Å; P441-A443 PolarHBondContact O-N 3.23Å
442	Q	39.8	Very low	47.1	Very low	186 Å²	186	121.1 Å²	121.1	87%	0.869	80%	0.799	S	S	*	*			trans	-52.8	115.5	168	-82.2	178.9	-8.3	0	0	109.3	S440 R444	S440-Q442 PolarHBondContact O-N 3.25Å; S440-Q442 VanDerWaalsContact O-N 3.14Å; Q442-R444 PolarHBondContact O-N 3.08Å
443	A	43.4	Very low	45.8	Very low	100 Å²	100	122.4 Å²	122.4	83%	0.826	81%	0.812	S	S	*	*			trans	-59.7	106.7	164.8	0	0	0	0	0	108.1	P441 G445	P441-A443 PolarHBondContact O-N 3.23Å; A443-G445 PolarHBondContact O-N 3.18Å
444	R	40.8	Very low	44.7	Very low	251 Å²	251	124.4 Å²	124.4	95%	0.947	82%	0.823	S	S	*	*			trans	-66	102.2	164.9	-84.5	-174.3	173	-174.7	-1.7	107.9	Q442	Q442-R444 PolarHBondContact O-N 3.08Å
445	G	42.1	Very low	43.7	Very low	78 Å²	78	127.5 Å²	127.5	80%	0.804	84%	0.841	S	S	*	*			trans	-67.7	140.5	155	0	0	0	0	0	109.7	A443	A443-G445 PolarHBondContact O-N 3.18Å
446	G	46.3	Very low	43.6	Very low	76 Å²	76	131.3 Å²	131.3	78%	0.784	86%	0.863	S	S	*	*			trans	170.9	96	172.3	0	0	0	0	0	113.8
447	A	38.3	Very low	42.9	Very low	182 Å²	182	132.7 Å²	132.7	100%	1.504	87%	0.873	S	S	*	*			trans	66.9	0	155.2	0	0	0	0	0	119.3

Retrieved 447 of 447 residues in 225 ms (Link to these results)

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