A0A096NLA4_PAPAN Loading...

Matrix metalloproteinase-25

May activate progelatinase A.

AlphaFold DB , UniProt , Accession A0A096NLA4, Species PAPAN (Papio anubis, Olive baboon), Gene MMP25, Length 562 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.7	Very low	42.3	Very low	251 Å²	251	181.9 Å²	181.9	100%	1.236	87%	0.874	S	S	*	*				0	145	0	-124.2	157.2	79.5	0	0	108.5
2	R	39.5	Very low	42.4	Very low	234 Å²	234	179.1 Å²	179.1	88%	0.883	87%	0.866	S	S	*	*			trans	-64.8	173.4	-164.8	-65.4	168.8	172.9	-175.6	-2.2	114.6
3	L	37.8	Very low	42.4	Very low	138 Å²	138	173.8 Å²	173.8	72%	0.723	85%	0.854	S	S	*	*			trans	89.8	126.4	162.5	-95.2	66.6	0	0	0	115.4
4	R	40.6	Very low	42.7	Very low	220 Å²	220	173.4 Å²	173.4	83%	0.83	86%	0.856	S	S	*	*			cis	-150.8	133.3	5.2	-78.9	178.6	176.8	176.4	-1.6	109.7
5	L	43.6	Very low	42.9	Very low	170 Å²	170	171.7 Å²	171.7	89%	0.89	85%	0.851	S	S	*	*			trans	-83.4	124.9	157.8	-154.1	85.8	0	0	0	107.3
6	R	45.3	Very low	43.1	Very low	234 Å²	234	167.5 Å²	167.5	88%	0.883	84%	0.84	S	S	*	*			trans	178.5	137.8	147.6	-102.8	169.2	-166.5	-146.4	3.3	112.1
7	L	41.7	Very low	43.1	Very low	153 Å²	153	164.2 Å²	164.2	80%	0.801	83%	0.833	S	S	*	*			trans	79.9	80.7	170.1	-80.2	83	0	0	0	117.6
8	L	42.3	Very low	43.3	Very low	188 Å²	188	161.8 Å²	161.8	98%	0.984	83%	0.831	S	S	*	*			trans	-113.9	74.7	144.1	-147.9	93.2	0	0	0	107.8
9	A	48.4	Very low	43.2	Very low	73 Å²	73	158.4 Å²	158.4	60%	0.603	83%	0.829	S	S	*	*			trans	-148.3	131.2	169.5	0	0	0	0	0	108.3
10	L	48.9	Very low	43.3	Very low	163 Å²	163	162.1 Å²	162.1	85%	0.853	83%	0.831	S	S	*	*			trans	77.7	80	176.5	-65.6	119.4	0	0	0	117.4
11	L	41.2	Very low	43.6	Very low	177 Å²	177	157.8 Å²	157.8	93%	0.927	82%	0.82	S	S	*	*			trans	-128.3	65.5	141.6	-83.8	161.6	0	0	0	108.3
12	L	43.5	Very low	44.1	Very low	148 Å²	148	151.2 Å²	151.2	78%	0.775	80%	0.796	S	S	*	*			trans	-68.9	130	147.7	-110.7	85.6	0	0	0	105.3	L14	L12-L14 PolarHBondContact O-N 2.74Å
13	P	43.3	Very low	44.4	Very low	110 Å²	110	148.7 Å²	148.7	71%	0.714	79%	0.792	S	S	*	*			trans	-61.8	117.2	164	28.3	-28.3	0	0	0	105.1	L15	P13-L15 PolarHBondContact O-N 3.19Å
14	L	46.8	Very low	44.9	Very low	168 Å²	168	144.9 Å²	144.9	88%	0.88	78%	0.775	S	S	*	*			trans	-58.3	93.5	164.1	-80.1	156.7	0	0	0	105.5	L12	L12-L14 PolarHBondContact O-N 2.74Å
15	L	45.5	Very low	45.7	Very low	149 Å²	149	136.7 Å²	136.7	78%	0.78	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-49.7	125	162.8	-88.3	156.8	0	0	0	105.3	P13	P13-L15 PolarHBondContact O-N 3.19Å
16	P	45.2	Very low	46	Very low	104 Å²	104	132.8 Å²	132.8	68%	0.675	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-52.7	138.6	173.7	21.9	-30.7	0	0	0	107.2
17	P	44.4	Very low	46.2	Very low	111 Å²	111	129.1 Å²	129.1	72%	0.721	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-50.6	140.9	173.8	23.2	-32.4	0	0	0	107.7	A19	P17-A19 PolarHBondContact O-N 3.16Å
18	P	46.3	Very low	46.7	Very low	122 Å²	122	124 Å²	124	79%	0.792	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-48.4	122.8	179.7	20.4	-31.9	0	0	0	107.4	R20	P18-R20 PolarHBondContact O-N 3.25Å
19	A	40.8	Very low	47.6	Very low	97 Å²	97	117.7 Å²	117.7	80%	0.802	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-46.6	118	-177.2	0	0	0	0	0	107.1	P17 A21	P17-A19 PolarHBondContact O-N 3.16Å; A19-A21 PolarHBondContact O-N 3.16Å
20	R	45	Very low	48.1	Very low	232 Å²	232	117.5 Å²	117.5	88%	0.875	67%	0.673	S	S	*	*			trans	-57.1	111.9	-178.7	-127.3	177.6	-176.6	177	2.3	105.5	P18	P18-R20 PolarHBondContact O-N 3.25Å
21	A	49.3	Very low	48.9	Very low	72 Å²	72	113.9 Å²	113.9	60%	0.595	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-49.2	134.5	175.5	0	0	0	0	0	107.9	A19 K23	A19-A21 PolarHBondContact O-N 3.16Å; A21-K23 PolarHBondContact O-N 3.16Å
22	P	46.6	Very low	50.3	Low	113 Å²	113	105.5 Å²	105.5	73%	0.734	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-51.8	132.4	-178.8	19	-29.3	0	0	0	108.6
23	K	46.2	Very low	51.7	Low	181 Å²	181	100.5 Å²	100.5	79%	0.787	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-60	131.4	176	-74.2	-179.2	177.6	179.2	0	107.3	A21 S25	A21-K23 PolarHBondContact O-N 3.16Å; K23-S25 PolarHBondContact O-N 3.01Å
24	P	48.6	Very low	52.9	Low	57 Å²	57	99.9 Å²	99.9	37%	0.37	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-54.5	136.2	176.2	19.2	-28.6	0	0	0	108.9	D28 V29 M77	P24-D28 HydrophobicContact CB-CB 4Å; P24-V29 HydrophobicContact CB-CG2 4.48Å; P24-M77 HydrophobicContact CB-CB 4.22Å; P24-M77 HydrophobicContact CG-CB 4.46Å
25	S	56.2	Low	54.6	Low	48 Å²	48	93.2 Å²	93.2	34%	0.336	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-64.8	160.6	179.4	71	0	0	0	0	109.8	K23 Q27 D28 V29	K23-S25 PolarHBondContact O-N 3.01Å; S25-Q27 PolarHBondContact O-N 3.45Å; S25-Q27 VanDerWaalsContact O-N 3.16Å; S25-Q27 PolarHBondContact OG-N 2.96Å; S25-D28 WeakPolarHBondContact CB-OD2 3.34Å; S25-D28 PolarHBondContact N-OD2 2.86Å; S25-D28 PolarHBondContact O-N 3Å; S25-D28 PolarHBondContact OG-N 3.22Å; S25-D28 VanDerWaalsContact OG-N 3.15Å; S25-D28 PolarHBondContact OG-OD2 2.77Å; S25-V29 PolarHBondContact O-N 2.65Å; S25-V29 VanDerWaalsContact O-N 3.16Å
26	A	49.6	Very low	56.3	Low	88 Å²	88	86.1 Å²	86.1	73%	0.727	50%	0.503	S	S	*	.	H	α-helix	trans	-58.3	-27.5	173.8	0	0	0	0	0	112.2	V29 S30	A26-V29 PolarHBondContact O-N 2.84Å; A26-S30 PolarHBondContact O-N 3.49Å
27	Q	50.3	Low	57.6	Low	157 Å²	157	83.1 Å²	83.1	73%	0.734	48%	0.483	S	S	*	.	H	α-helix	trans	-68.8	-40.7	174.3	-68.8	174.4	-13.5	0	0	112.1	S25 V29 S30 L31	S25-Q27 PolarHBondContact O-N 3.45Å; S25-Q27 VanDerWaalsContact O-N 3.16Å; S25-Q27 PolarHBondContact OG-N 2.96Å; Q27-V29 VanDerWaalsContact C-N 3.29Å; Q27-V29 PolarHBondContact O-N 3.28Å; Q27-S30 PolarHBondContact O-N 2.77Å; Q27-L31 VanDerWaalsContact O-CB 3.3Å; Q27-L31 WeakPolarHBondContact O-CB 3.41Å; Q27-L31 PolarHBondContact O-N 3.32Å
28	D	53.3	Low	58.9	Low	45 Å²	45	85.2 Å²	85.2	24%	0.241	48%	0.476	C	S	.	.	H	α-helix	trans	-65.9	-34.8	176.2	-59.1	-48.8	0	0	0	111.6	P24 S25 G32	P24-D28 HydrophobicContact CB-CB 4Å; S25-D28 WeakPolarHBondContact CB-OD2 3.34Å; S25-D28 PolarHBondContact N-OD2 2.86Å; S25-D28 PolarHBondContact O-N 3Å; S25-D28 PolarHBondContact OG-N 3.22Å; S25-D28 VanDerWaalsContact OG-N 3.15Å; S25-D28 PolarHBondContact OG-OD2 2.77Å; D28-G32 PolarHBondContact O-N 2.72Å
29	V	59.6	Low	60.5	Low	57 Å²	57	79.8 Å²	79.8	35%	0.345	44%	0.44	S	S	.	.	H	α-helix	trans	-70.1	-42	176.7	178.2	0	0	0	0	111.1	P24 S25 A26 Q27 G32 V33 L58	P24-V29 HydrophobicContact CB-CG2 4.48Å; S25-V29 PolarHBondContact O-N 2.65Å; S25-V29 VanDerWaalsContact O-N 3.16Å; A26-V29 PolarHBondContact O-N 2.84Å; Q27-V29 VanDerWaalsContact C-N 3.29Å; Q27-V29 PolarHBondContact O-N 3.28Å; V29-G32 PolarHBondContact O-N 3.45Å; V29-V33 WeakPolarHBondContact O-CG2 3.4Å; V29-V33 PolarHBondContact O-N 2.8Å; V29-V33 VanDerWaalsContact O-N 3.07Å; V29-L58 HydrophobicContact CG1-CD2 3.98Å
30	S	60.4	Low	62	Low	68 Å²	68	76.2 Å²	76.2	48%	0.476	41%	0.413	S	S	.	.	H	α-helix	trans	-66.6	-47.8	176.9	-164.8	0	0	0	0	112	A26 Q27 G32 V33 D34	A26-S30 PolarHBondContact O-N 3.49Å; Q27-S30 PolarHBondContact O-N 2.77Å; S30-G32 PolarHBondContact O-N 2.96Å; S30-V33 PolarHBondContact O-N 2.98Å; S30-V33 VanDerWaalsContact O-N 3.1Å; S30-D34 PolarHBondContact O-N 3.43Å; S30-D34 VanDerWaalsContact O-N 3.16Å
31	L	66	Low	63.5	Low	88 Å²	88	65.6 Å²	65.6	46%	0.461	37%	0.373	S	S	.	.	H	α-helix	trans	-56.8	-40.5	174.9	-177.9	69.2	0	0	0	111.1	Q27 W35	Q27-L31 VanDerWaalsContact O-CB 3.3Å; Q27-L31 WeakPolarHBondContact O-CB 3.41Å; Q27-L31 PolarHBondContact O-N 3.32Å; L31-W35 WeakPolarHBondContact O-CB 3.45Å; L31-W35 PolarHBondContact O-N 3.45Å
32	G	69.9	Low	64.6	Low	1 Å²	1	62.6 Å²	62.6	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-63.5	-40.8	175.8	0	0	0	0	0	113.5	D28 V29 S30 L36	D28-G32 PolarHBondContact O-N 2.72Å; V29-G32 PolarHBondContact O-N 3.45Å; S30-G32 PolarHBondContact O-N 2.96Å; G32-L36 WeakPolarHBondContact O-CB 3.47Å; G32-L36 VanDerWaalsContact O-CD1 3.27Å; G32-L36 WeakPolarHBondContact O-CD1 3.43Å; G32-L36 WeakPolarHBondContact O-CG 3.21Å; G32-L36 PolarHBondContact O-N 3.02Å
33	V	71.6	Confident	65.2	Low	42 Å²	42	60.7 Å²	60.7	26%	0.255	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-45.2	179.1	171.2	0	0	0	0	111.3	V29 S30 L36 T37 L42 L58	V29-V33 WeakPolarHBondContact O-CG2 3.4Å; V29-V33 PolarHBondContact O-N 2.8Å; V29-V33 VanDerWaalsContact O-N 3.07Å; S30-V33 PolarHBondContact O-N 2.98Å; S30-V33 VanDerWaalsContact O-N 3.1Å; V33-L36 PolarHBondContact O-N 2.92Å; V33-T37 WeakPolarHBondContact O-CB 3.45Å; V33-T37 PolarHBondContact O-N 2.83Å; V33-T37 PolarHBondContact O-OG1 3.06Å; V33-L42 HydrophobicContact CG1-CD1 4.18Å; V33-L58 HydrophobicContact CG2-CD1 3.73Å; V33-L58 HydrophobicContact CG2-CD2 3.9Å; V33-L58 HydrophobicContact CG2-CG 4.46Å
34	D	69.5	Low	65.7	Low	97 Å²	97	56.9 Å²	56.9	52%	0.519	33%	0.328	S	S	.	.	H	α-helix	trans	-66.1	-44.5	179.8	-65.7	-25	0	0	0	111.1	S30 T37 R38	S30-D34 PolarHBondContact O-N 3.43Å; S30-D34 VanDerWaalsContact O-N 3.16Å; D34-T37 PolarHBondContact O-N 3.27Å; D34-R38 WeakPolarHBondContact O-CB 3.48Å; D34-R38 PolarHBondContact O-N 2.77Å
35	W	81.9	Confident	65.7	Low	28 Å²	28	59.1 Å²	59.1	11%	0.106	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-48.1	175.7	-169	104.8	0	0	0	111	L31 T37 R38 Y39 Y41 M65 M85 F254	L31-W35 WeakPolarHBondContact O-CB 3.45Å; L31-W35 PolarHBondContact O-N 3.45Å; W35-T37 VanDerWaalsContact C-N 3.28Å; W35-T37 PolarHBondContact O-N 2.84Å; W35-R38 PolarHBondContact O-N 3.4Å; W35-Y39 AromaticContact CD1-CE2 3.79Å; W35-Y39 AromaticContact CD2-CD2 3.5Å; W35-Y39 HydrophobicContact CD2-CD2 3.5Å; W35-Y39 AromaticContact CD2-CE2 3.83Å; W35-Y39 HydrophobicContact CD2-CE2 3.83Å; W35-Y39 AromaticContact CE2-CD2 3.42Å; W35-Y39 VanDerWaalsContact CE2-CD2 3.42Å; W35-Y39 AromaticContact CE2-CE2 3.44Å; W35-Y39 VanDerWaalsContact CE2-CE2 3.44Å; W35-Y39 AromaticContact CE3-CD2 3.77Å; W35-Y39 HydrophobicContact CE3-CD2 3.77Å; W35-Y39 HydrophobicContact CG-CD2 4.03Å; W35-Y39 HydrophobicContact CG-CE2 4.03Å; W35-Y39 AromaticContact CH2-CD2 3.84Å; W35-Y39 HydrophobicContact CH2-CD2 3.84Å; W35-Y39 HydrophobicContact CH2-CG 4.4Å; W35-Y39 AromaticContact CZ2-CD2 3.63Å; W35-Y39 HydrophobicContact CZ2-CD2 3.63Å; W35-Y39 AromaticContact CZ2-CE2 3.85Å; W35-Y39 HydrophobicContact CZ2-CE2 3.85Å; W35-Y39 HydrophobicContact CZ2-CG 4.49Å; W35-Y39 AromaticContact CZ3-CD2 3.89Å; W35-Y39 HydrophobicContact CZ3-CD2 3.89Å; W35-Y39 HydrophobicContact CZ3-CG 4.47Å; W35-Y39 AromaticContact NE1-CD2 3.94Å; W35-Y39 AromaticContact NE1-CE2 3.46Å; W35-Y39 WeakPolarHBondContact O-CD2 3.33Å; W35-Y39 PolarHBondContact O-N 2.86Å; W35-Y39 VanDerWaalsContact O-N 3.09Å; W35-Y41 HydrophobicContact CH2-CE2 4.07Å; W35-Y41 AromaticContact CZ3-CD2 3.8Å; W35-Y41 HydrophobicContact CZ3-CD2 3.8Å; W35-Y41 AromaticContact CZ3-CE2 3.61Å; W35-Y41 HydrophobicContact CZ3-CE2 3.61Å; W35-M65 HydrophobicContact CE3-CG 4.45Å; W35-M65 HydrophobicContact CH2-CG 3.85Å; W35-M65 HydrophobicContact CH2-SD 4.31Å; W35-M65 HydrophobicContact CZ3-CG 3.45Å; W35-M65 VanDerWaalsContact CZ3-CG 3.45Å; W35-M65 HydrophobicContact CZ3-SD 4.29Å; W35-M85 HydrophobicContact CB-SD 4.27Å; W35-M85 HydrophobicContact CD2-CB 4.2Å; W35-M85 HydrophobicContact CD2-CE 4.05Å; W35-M85 HydrophobicContact CD2-CG 3.72Å; W35-M85 HydrophobicContact CD2-SD 3.84Å; W35-M85 HydrophobicContact CE3-CE 3.65Å; W35-M85 HydrophobicContact CE3-CG 4.06Å; W35-M85 HydrophobicContact CE3-SD 4.09Å; W35-M85 HydrophobicContact CG-CB 4.36Å; W35-M85 HydrophobicContact CG-CG 4.21Å; W35-M85 HydrophobicContact CG-SD 3.93Å; W35-M85 HydrophobicContact CH2-CG 4.35Å; W35-M85 HydrophobicContact CZ2-CB 4.27Å; W35-M85 HydrophobicContact CZ2-CG 3.97Å; W35-M85 HydrophobicContact CZ3-CE 4.22Å; W35-M85 HydrophobicContact CZ3-CG 4.4Å; W35-M85 PolarHBondContact NE1-O 2.75Å; W35-F254 HydrophobicContact CH2-CE1 4.42Å; W35-F254 HydrophobicContact CH2-CZ 4.17Å; W35-F254 HydrophobicContact CZ2-CE1 4.01Å; W35-F254 HydrophobicContact CZ2-CZ 4.22Å
36	L	82	Confident	65.2	Low	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-32.7	179.2	-71.6	166.2	0	0	0	112	G32 V33 G40 Y41 L42 L58 A61 I62 M65 M85	G32-L36 WeakPolarHBondContact O-CB 3.47Å; G32-L36 VanDerWaalsContact O-CD1 3.27Å; G32-L36 WeakPolarHBondContact O-CD1 3.43Å; G32-L36 WeakPolarHBondContact O-CG 3.21Å; G32-L36 PolarHBondContact O-N 3.02Å; V33-L36 PolarHBondContact O-N 2.92Å; L36-G40 PolarHBondContact O-N 3.21Å; L36-Y41 HydrophobicContact CD2-CD2 3.91Å; L36-Y41 HydrophobicContact CD2-CG 3.94Å; L36-Y41 WeakPolarHBondContact O-CA 3.48Å; L36-Y41 WeakPolarHBondContact O-CB 3.45Å; L36-Y41 PolarHBondContact O-N 3.04Å; L36-L42 HydrophobicContact CB-CB 4.37Å; L36-L42 HydrophobicContact CB-CD1 3.69Å; L36-L42 HydrophobicContact CB-CG 3.89Å; L36-L42 HydrophobicContact CD1-CD1 4.09Å; L36-L42 PolarHBondContact O-N 3.08Å; L36-L58 HydrophobicContact CD1-CD1 3.66Å; L36-A61 HydrophobicContact CD1-CB 4.43Å; L36-I62 HydrophobicContact CD1-CG1 3.64Å; L36-M65 HydrophobicContact CD2-CB 3.65Å; L36-M65 HydrophobicContact CD2-CG 4.01Å; L36-M85 HydrophobicContact CD2-CE 4.09Å; L36-M85 HydrophobicContact CG-CE 4.07Å
37	T	71.4	Confident	64.7	Low	42 Å²	42	62.7 Å²	62.7	26%	0.258	35%	0.353	S	S	.	.	H	α-helix	trans	-72.4	-47	176.2	-54.6	0	0	0	0	110.9	V33 D34 W35 Y39 G40	V33-T37 WeakPolarHBondContact O-CB 3.45Å; V33-T37 PolarHBondContact O-N 2.83Å; V33-T37 PolarHBondContact O-OG1 3.06Å; D34-T37 PolarHBondContact O-N 3.27Å; W35-T37 VanDerWaalsContact C-N 3.28Å; W35-T37 PolarHBondContact O-N 2.84Å; T37-Y39 VanDerWaalsContact C-N 3.29Å; T37-Y39 PolarHBondContact O-N 3.15Å; T37-G40 PolarHBondContact O-N 3.14Å; T37-G40 VanDerWaalsContact O-N 3.13Å
38	R	72.7	Confident	64.2	Low	155 Å²	155	59.5 Å²	59.5	59%	0.585	35%	0.353	S	S	*	.	H	α-helix	trans	-54.2	-45.3	177.4	179.5	-179.8	-70.3	-167.8	-2.6	111.7	D34 W35 G40	D34-R38 WeakPolarHBondContact O-CB 3.48Å; D34-R38 PolarHBondContact O-N 2.77Å; W35-R38 PolarHBondContact O-N 3.4Å; R38-G40 VanDerWaalsContact C-N 3.34Å; R38-G40 PolarHBondContact O-N 3.1Å
39	Y	79.1	Confident	63.7	Low	8 Å²	8	63.5 Å²	63.5	3%	0.031	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	12.3	-177.1	-59.2	-65	0	0	0	114.4	W35 T37 Y41 R89 D94 V95	W35-Y39 AromaticContact CD1-CE2 3.79Å; W35-Y39 AromaticContact CD2-CD2 3.5Å; W35-Y39 HydrophobicContact CD2-CD2 3.5Å; W35-Y39 AromaticContact CD2-CE2 3.83Å; W35-Y39 HydrophobicContact CD2-CE2 3.83Å; W35-Y39 AromaticContact CE2-CD2 3.42Å; W35-Y39 VanDerWaalsContact CE2-CD2 3.42Å; W35-Y39 AromaticContact CE2-CE2 3.44Å; W35-Y39 VanDerWaalsContact CE2-CE2 3.44Å; W35-Y39 AromaticContact CE3-CD2 3.77Å; W35-Y39 HydrophobicContact CE3-CD2 3.77Å; W35-Y39 HydrophobicContact CG-CD2 4.03Å; W35-Y39 HydrophobicContact CG-CE2 4.03Å; W35-Y39 AromaticContact CH2-CD2 3.84Å; W35-Y39 HydrophobicContact CH2-CD2 3.84Å; W35-Y39 HydrophobicContact CH2-CG 4.4Å; W35-Y39 AromaticContact CZ2-CD2 3.63Å; W35-Y39 HydrophobicContact CZ2-CD2 3.63Å; W35-Y39 AromaticContact CZ2-CE2 3.85Å; W35-Y39 HydrophobicContact CZ2-CE2 3.85Å; W35-Y39 HydrophobicContact CZ2-CG 4.49Å; W35-Y39 AromaticContact CZ3-CD2 3.89Å; W35-Y39 HydrophobicContact CZ3-CD2 3.89Å; W35-Y39 HydrophobicContact CZ3-CG 4.47Å; W35-Y39 AromaticContact NE1-CD2 3.94Å; W35-Y39 AromaticContact NE1-CE2 3.46Å; W35-Y39 WeakPolarHBondContact O-CD2 3.33Å; W35-Y39 PolarHBondContact O-N 2.86Å; W35-Y39 VanDerWaalsContact O-N 3.09Å; T37-Y39 VanDerWaalsContact C-N 3.29Å; T37-Y39 PolarHBondContact O-N 3.15Å; Y39-Y41 PolarHBondContact O-N 3.02Å; Y39-R89 VanDerWaalsContact CD1-NH2 3.27Å; Y39-R89 VanDerWaalsContact CZ-CD 3.46Å; Y39-R89 VanDerWaalsContact CZ-NE 3.33Å; Y39-R89 WeakPolarHBondContact OH-CD 3.34Å; Y39-D94 PolarHBondContact O-N 2.6Å; Y39-V95 PolarHBondContact O-N 2.88Å
40	G	72.8	Confident	62.8	Low	22 Å²	22	65.6 Å²	65.6	23%	0.227	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	3.8	168.5	0	0	0	0	0	116.2	L36 T37 R38 L42 V95	L36-G40 PolarHBondContact O-N 3.21Å; T37-G40 PolarHBondContact O-N 3.14Å; T37-G40 VanDerWaalsContact O-N 3.13Å; R38-G40 VanDerWaalsContact C-N 3.34Å; R38-G40 PolarHBondContact O-N 3.1Å; G40-L42 VanDerWaalsContact C-N 3.33Å; G40-V95 WeakPolarHBondContact O-CB 3.35Å
41	Y	77.6	Confident	61.7	Low	9 Å²	9	69.9 Å²	69.9	4%	0.035	41%	0.406	C	S	.	.	S	Bend	trans	-74.3	-24.4	175.9	-62.4	-72.5	0	0	0	113.3	W35 L36 Y39 A61 V64 M65 F68 D94 V95	W35-Y41 HydrophobicContact CH2-CE2 4.07Å; W35-Y41 AromaticContact CZ3-CD2 3.8Å; W35-Y41 HydrophobicContact CZ3-CD2 3.8Å; W35-Y41 AromaticContact CZ3-CE2 3.61Å; W35-Y41 HydrophobicContact CZ3-CE2 3.61Å; L36-Y41 HydrophobicContact CD2-CD2 3.91Å; L36-Y41 HydrophobicContact CD2-CG 3.94Å; L36-Y41 WeakPolarHBondContact O-CA 3.48Å; L36-Y41 WeakPolarHBondContact O-CB 3.45Å; L36-Y41 PolarHBondContact O-N 3.04Å; Y39-Y41 PolarHBondContact O-N 3.02Å; Y41-A61 WeakPolarHBondContact O-CB 3.44Å; Y41-V64 HydrophobicContact CD1-CB 4.17Å; Y41-V64 HydrophobicContact CD1-CG1 3.74Å; Y41-V64 HydrophobicContact CE1-CG1 3.96Å; Y41-M65 HydrophobicContact CD1-CB 3.92Å; Y41-M65 HydrophobicContact CD2-CB 3.96Å; Y41-M65 HydrophobicContact CD2-CG 3.99Å; Y41-M65 VanDerWaalsContact CE1-CA 3.45Å; Y41-M65 HydrophobicContact CE1-CB 3.88Å; Y41-M65 HydrophobicContact CE1-CG 4.35Å; Y41-M65 HydrophobicContact CE2-CB 3.88Å; Y41-M65 HydrophobicContact CE2-CG 3.59Å; Y41-M65 HydrophobicContact CG-CB 3.95Å; Y41-M65 HydrophobicContact CG-CG 4.48Å; Y41-F68 HydrophobicContact CE1-CB 4.21Å; Y41-F68 WeakPolarHBondContact OH-CB 3.26Å; Y41-F68 VanDerWaalsContact OH-CD1 3.27Å; Y41-F68 WeakPolarHBondContact OH-CD1 3.46Å; Y41-F68 WeakPolarHBondContact OH-CG 3.12Å; Y41-D94 HydrophobicContact CE1-CB 4.27Å; Y41-D94 HydrophobicContact CE2-CB 3.84Å; Y41-D94 WeakPolarHBondContact CE2-OD2 3.39Å; Y41-D94 WeakPolarHBondContact OH-CB 2.9Å; Y41-D94 VanDerWaalsContact OH-CG 3.31Å; Y41-D94 PolarHBondContact OH-OD2 3.49Å; Y41-V95 HydrophobicContact CD1-CG2 3.82Å; Y41-V95 HydrophobicContact CE1-CG2 3.81Å
42	L	71.4	Confident	60.7	Low	8 Å²	8	73.2 Å²	73.2	4%	0.042	42%	0.424	C	S	.	.	S	Bend	trans	-119	138.8	171	-74.5	172.4	0	0	0	110.4	V33 L36 G40 L58 A61	V33-L42 HydrophobicContact CG1-CD1 4.18Å; L36-L42 HydrophobicContact CB-CB 4.37Å; L36-L42 HydrophobicContact CB-CD1 3.69Å; L36-L42 HydrophobicContact CB-CG 3.89Å; L36-L42 HydrophobicContact CD1-CD1 4.09Å; L36-L42 PolarHBondContact O-N 3.08Å; G40-L42 VanDerWaalsContact C-N 3.33Å; L42-L58 HydrophobicContact CD1-CD1 3.84Å; L42-A61 HydrophobicContact CD2-CB 3.42Å; L42-A61 VanDerWaalsContact CD2-CB 3.42Å; L42-A61 HydrophobicContact CG-CB 3.68Å
43	P	59.9	Low	59.9	Low	73 Å²	73	76.4 Å²	76.4	47%	0.474	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-66.6	147.3	172.1	29.5	-33.6	0	0	0	109.8
44	P	55.3	Low	59.6	Low	101 Å²	101	76.5 Å²	76.5	66%	0.656	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-58	142.5	173.5	25.1	-32.8	0	0	0	109.8	N46	P44-N46 PolarHBondContact O-N 3.32Å
45	P	48.9	Very low	59.6	Low	105 Å²	105	77.1 Å²	77.1	68%	0.682	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-60.2	122.5	-178.6	21.1	-29.5	0	0	0	110.5
46	N	46	Very low	59.1	Low	84 Å²	84	77.5 Å²	77.5	45%	0.449	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-82.5	122.2	-178.9	-175.4	-9.7	0	0	0	110.1	P44 A48 Q49	P44-N46 PolarHBondContact O-N 3.32Å; N46-A48 PolarHBondContact O-N 2.95Å; N46-A48 PolarHBondContact OD1-N 3.41Å; N46-A48 VanDerWaalsContact OD1-N 3.16Å; N46-Q49 HydrophobicContact CB-CB 4.44Å; N46-Q49 CarbonylContact O-C 3.51Å; N46-Q49 VanDerWaalsContact O-C 3.24Å; N46-Q49 PolarHBondContact O-N 3.05Å
47	P	40.2	Very low	58.7	Low	126 Å²	126	83.5 Å²	83.5	82%	0.818	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-26.1	-178.3	20.7	-30.9	0	0	0	114.2	Q49	P47-Q49 VanDerWaalsContact C-N 3.34Å
48	A	38.3	Very low	59	Low	90 Å²	90	82.9 Å²	82.9	74%	0.744	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-14.1	177.5	0	0	0	0	0	113.7	N46	N46-A48 PolarHBondContact O-N 2.95Å; N46-A48 PolarHBondContact OD1-N 3.41Å; N46-A48 VanDerWaalsContact OD1-N 3.16Å
49	Q	44.2	Very low	59.5	Low	129 Å²	129	80.4 Å²	80.4	60%	0.603	47%	0.471	S	S	*	.			trans	-128.4	70.7	178.8	-68.3	178.4	-12.4	0	0	107.6	N46 P47 Q51	N46-Q49 HydrophobicContact CB-CB 4.44Å; N46-Q49 CarbonylContact O-C 3.51Å; N46-Q49 VanDerWaalsContact O-C 3.24Å; N46-Q49 PolarHBondContact O-N 3.05Å; P47-Q49 VanDerWaalsContact C-N 3.34Å; Q49-Q51 PolarHBondContact O-N 3.26Å
50	A	38.7	Very low	59.6	Low	102 Å²	102	83.6 Å²	83.6	84%	0.843	49%	0.489	S	S	*	.			trans	-65.6	48.7	163	0	0	0	0	0	110.9
51	Q	38.1	Very low	60.1	Low	158 Å²	158	82.9 Å²	82.9	74%	0.738	48%	0.481	S	S	*	.			trans	-105.6	97.3	177.3	-151.2	145.8	24.5	0	0	105.2	Q49 Q53	Q49-Q51 PolarHBondContact O-N 3.26Å; Q51-Q53 PolarHBondContact O-N 2.97Å
52	L	44.8	Very low	60.5	Low	158 Å²	158	82.7 Å²	82.7	83%	0.827	48%	0.48	S	S	*	.			trans	3.6	106.6	157.3	-76.5	137.4	0	0	0	111.9	S54	L52-S54 PolarHBondContact O-N 2.9Å
53	Q	54.4	Low	61.1	Low	67 Å²	67	85.5 Å²	85.5	31%	0.313	49%	0.492	S	S	.	.			trans	-49.9	109.2	165.8	-71.3	-67.4	-7.8	0	0	106.2	Q51	Q51-Q53 PolarHBondContact O-N 2.97Å
54	S	63.4	Low	62.2	Low	44 Å²	44	84.4 Å²	84.4	31%	0.308	48%	0.484	S	S	.	.			trans	-62.3	143.9	-168.5	69.6	0	0	0	0	107.8	L52 A56 K57 L58	L52-S54 PolarHBondContact O-N 2.9Å; S54-A56 CarbonylContact O-C 3.58Å; S54-A56 PolarHBondContact O-N 3.25Å; S54-K57 PolarHBondContact O-N 3.27Å; S54-K57 WeakPolarHBondContact OG-CG 3.37Å; S54-K57 PolarHBondContact OG-N 2.94Å; S54-K57 VanDerWaalsContact OG-N 3.14Å; S54-L58 PolarHBondContact O-N 3.35Å; S54-L58 VanDerWaalsContact O-N 3.1Å
55	P	69.9	Low	63.8	Low	110 Å²	110	79.6 Å²	79.6	71%	0.714	45%	0.453	S	S	*	.	H	α-helix	trans	-52	-24.7	174.7	-28.8	35	0	0	0	112.7	R59	P55-R59 VanDerWaalsContact O-CB 3.27Å; P55-R59 WeakPolarHBondContact O-CB 3.22Å; P55-R59 PolarHBondContact O-N 3.32Å; P55-R59 VanDerWaalsContact O-N 3.14Å
56	A	72.9	Confident	65.8	Low	37 Å²	37	74.6 Å²	74.6	31%	0.306	42%	0.42	S	S	.	.	H	α-helix	trans	-67.9	-49.1	170.6	0	0	0	0	0	113.4	S54 L58 R59 D60	S54-A56 CarbonylContact O-C 3.58Å; S54-A56 PolarHBondContact O-N 3.25Å; A56-L58 PolarHBondContact O-N 3.22Å; A56-R59 PolarHBondContact O-N 2.94Å; A56-D60 WeakPolarHBondContact O-CB 3.34Å; A56-D60 PolarHBondContact O-N 3.29Å
57	K	71.8	Confident	67.6	Low	125 Å²	125	77.4 Å²	77.4	54%	0.543	43%	0.425	S	S	.	.	H	α-helix	trans	-60.2	-42.9	177	-77.3	-179.6	178.6	-176.5	0	112.3	S54 D60 A61	S54-K57 PolarHBondContact O-N 3.27Å; S54-K57 WeakPolarHBondContact OG-CG 3.37Å; S54-K57 PolarHBondContact OG-N 2.94Å; S54-K57 VanDerWaalsContact OG-N 3.14Å; K57-D60 PolarHBondContact O-N 3.39Å; K57-A61 WeakPolarHBondContact O-CB 3.29Å; K57-A61 PolarHBondContact O-N 3.37Å
58	L	77.8	Confident	69.6	Low	29 Å²	29	73 Å²	73	15%	0.152	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-47.8	176.4	177.3	57.7	0	0	0	111.7	V29 V33 L36 L42 S54 A56 D60 A61 I62	V29-L58 HydrophobicContact CG1-CD2 3.98Å; V33-L58 HydrophobicContact CG2-CD1 3.73Å; V33-L58 HydrophobicContact CG2-CD2 3.9Å; V33-L58 HydrophobicContact CG2-CG 4.46Å; L36-L58 HydrophobicContact CD1-CD1 3.66Å; L42-L58 HydrophobicContact CD1-CD1 3.84Å; S54-L58 PolarHBondContact O-N 3.35Å; S54-L58 VanDerWaalsContact O-N 3.1Å; A56-L58 PolarHBondContact O-N 3.22Å; L58-D60 VanDerWaalsContact C-N 3.26Å; L58-D60 PolarHBondContact O-N 2.92Å; L58-A61 PolarHBondContact O-N 2.65Å; L58-I62 HydrophobicContact CD1-CD1 4.16Å; L58-I62 HydrophobicContact CD1-CG1 4.33Å; L58-I62 HydrophobicContact CG-CD1 4.02Å; L58-I62 VanDerWaalsContact O-CG1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.31Å; L58-I62 PolarHBondContact O-N 3.04Å
59	R	83.7	Confident	71.9	Confident	104 Å²	104	69.2 Å²	69.2	39%	0.392	36%	0.361	S	S	.	.	H	α-helix	trans	-58	-41.4	176.4	-178.2	-163.3	64.2	-121.1	-8	111.5	P55 A56 I62 K63 G75	P55-R59 VanDerWaalsContact O-CB 3.27Å; P55-R59 WeakPolarHBondContact O-CB 3.22Å; P55-R59 PolarHBondContact O-N 3.32Å; P55-R59 VanDerWaalsContact O-N 3.14Å; A56-R59 PolarHBondContact O-N 2.94Å; R59-I62 PolarHBondContact O-N 3.01Å; R59-K63 WeakPolarHBondContact O-CG 3.49Å; R59-K63 PolarHBondContact O-N 2.84Å; R59-K63 VanDerWaalsContact O-N 3.07Å; R59-G75 VanDerWaalsContact CG-O 3.27Å; R59-G75 WeakPolarHBondContact CG-O 2.97Å; R59-G75 WeakPolarHBondContact O-CA 3.27Å
60	D	81.7	Confident	73.8	Confident	74 Å²	74	65.9 Å²	65.9	40%	0.396	36%	0.361	S	S	.	.	H	α-helix	trans	-70.7	-38.5	-179.4	-62.3	-15.3	0	0	0	111.1	A56 K57 L58 I62 K63 V64	A56-D60 WeakPolarHBondContact O-CB 3.34Å; A56-D60 PolarHBondContact O-N 3.29Å; K57-D60 PolarHBondContact O-N 3.39Å; L58-D60 VanDerWaalsContact C-N 3.26Å; L58-D60 PolarHBondContact O-N 2.92Å; D60-I62 PolarHBondContact O-N 3.42Å; D60-K63 WeakPolarHBondContact O-CB 3.45Å; D60-K63 PolarHBondContact O-N 2.8Å; D60-V64 WeakPolarHBondContact O-CG2 3.32Å; D60-V64 PolarHBondContact O-N 2.9Å
61	A	82.1	Confident	76.2	Confident	7 Å²	7	62 Å²	62	6%	0.058	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-41.9	171.7	0	0	0	0	0	112.7	L36 Y41 L42 K57 L58 K63 V64 M65	L36-A61 HydrophobicContact CD1-CB 4.43Å; Y41-A61 WeakPolarHBondContact O-CB 3.44Å; L42-A61 HydrophobicContact CD2-CB 3.42Å; L42-A61 VanDerWaalsContact CD2-CB 3.42Å; L42-A61 HydrophobicContact CG-CB 3.68Å; K57-A61 WeakPolarHBondContact O-CB 3.29Å; K57-A61 PolarHBondContact O-N 3.37Å; L58-A61 PolarHBondContact O-N 2.65Å; A61-K63 VanDerWaalsContact C-N 3.3Å; A61-K63 PolarHBondContact O-N 3.36Å; A61-V64 PolarHBondContact O-N 2.66Å; A61-M65 PolarHBondContact O-N 3.35Å
62	I	87.6	Confident	78.6	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-42	174	-66.5	162.9	0	0	0	110.5	L36 L58 R59 D60 V64 M65 Q66 M77 T81	L36-I62 HydrophobicContact CD1-CG1 3.64Å; L58-I62 HydrophobicContact CD1-CD1 4.16Å; L58-I62 HydrophobicContact CD1-CG1 4.33Å; L58-I62 HydrophobicContact CG-CD1 4.02Å; L58-I62 VanDerWaalsContact O-CG1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.31Å; L58-I62 PolarHBondContact O-N 3.04Å; R59-I62 PolarHBondContact O-N 3.01Å; D60-I62 PolarHBondContact O-N 3.42Å; I62-V64 VanDerWaalsContact C-N 3.34Å; I62-V64 PolarHBondContact O-N 3.42Å; I62-M65 PolarHBondContact O-N 2.89Å; I62-Q66 HydrophobicContact CG2-CG 4.12Å; I62-Q66 WeakPolarHBondContact O-CB 3.37Å; I62-Q66 VanDerWaalsContact O-CG 3.24Å; I62-Q66 WeakPolarHBondContact O-CG 3.41Å; I62-Q66 PolarHBondContact O-N 3.17Å; I62-M77 HydrophobicContact CD1-CG 3.92Å; I62-M77 HydrophobicContact CD1-SD 3.99Å; I62-M77 HydrophobicContact CG1-SD 4.07Å; I62-T81 HydrophobicContact CG2-CG2 4.44Å
63	K	84.4	Confident	80.9	Confident	67 Å²	67	54.8 Å²	54.8	29%	0.291	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-39.7	176	-71	-179.3	176.5	-177.4	0	112.6	R59 D60 A61 Q66 R67 E73 G75	R59-K63 WeakPolarHBondContact O-CG 3.49Å; R59-K63 PolarHBondContact O-N 2.84Å; R59-K63 VanDerWaalsContact O-N 3.07Å; D60-K63 WeakPolarHBondContact O-CB 3.45Å; D60-K63 PolarHBondContact O-N 2.8Å; A61-K63 VanDerWaalsContact C-N 3.3Å; A61-K63 PolarHBondContact O-N 3.36Å; K63-Q66 PolarHBondContact O-N 2.65Å; K63-R67 VanDerWaalsContact O-CB 3.31Å; K63-R67 WeakPolarHBondContact O-CB 3.39Å; K63-R67 PolarHBondContact O-N 3.18Å; K63-E73 HydrophobicContact CB-CB 4.3Å; K63-E73 HydrophobicContact CG-CB 4.18Å; K63-G75 VanDerWaalsContact CG-CA 3.46Å
64	V	81.8	Confident	82.6	Confident	49 Å²	49	54.4 Å²	54.4	30%	0.297	30%	0.298	S	S	.	.	H	α-helix	trans	-63.5	-45.1	176.9	178.1	0	0	0	0	110.1	Y41 D60 A61 I62 R67 F68	Y41-V64 HydrophobicContact CD1-CB 4.17Å; Y41-V64 HydrophobicContact CD1-CG1 3.74Å; Y41-V64 HydrophobicContact CE1-CG1 3.96Å; D60-V64 WeakPolarHBondContact O-CG2 3.32Å; D60-V64 PolarHBondContact O-N 2.9Å; A61-V64 PolarHBondContact O-N 2.66Å; I62-V64 VanDerWaalsContact C-N 3.34Å; I62-V64 PolarHBondContact O-N 3.42Å; V64-R67 PolarHBondContact O-N 3.1Å; V64-F68 WeakPolarHBondContact O-CB 3.44Å; V64-F68 PolarHBondContact O-N 3.06Å
65	M	90.1	Very high	83.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-48.6	175.5	-174.8	-79.3	-71	0	0	112.2	W35 L36 Y41 A61 I62 R67 F68 A69 T81 M85	W35-M65 HydrophobicContact CE3-CG 4.45Å; W35-M65 HydrophobicContact CH2-CG 3.85Å; W35-M65 HydrophobicContact CH2-SD 4.31Å; W35-M65 HydrophobicContact CZ3-CG 3.45Å; W35-M65 VanDerWaalsContact CZ3-CG 3.45Å; W35-M65 HydrophobicContact CZ3-SD 4.29Å; L36-M65 HydrophobicContact CD2-CB 3.65Å; L36-M65 HydrophobicContact CD2-CG 4.01Å; Y41-M65 HydrophobicContact CD1-CB 3.92Å; Y41-M65 HydrophobicContact CD2-CB 3.96Å; Y41-M65 HydrophobicContact CD2-CG 3.99Å; Y41-M65 VanDerWaalsContact CE1-CA 3.45Å; Y41-M65 HydrophobicContact CE1-CB 3.88Å; Y41-M65 HydrophobicContact CE1-CG 4.35Å; Y41-M65 HydrophobicContact CE2-CB 3.88Å; Y41-M65 HydrophobicContact CE2-CG 3.59Å; Y41-M65 HydrophobicContact CG-CB 3.95Å; Y41-M65 HydrophobicContact CG-CG 4.48Å; A61-M65 PolarHBondContact O-N 3.35Å; I62-M65 PolarHBondContact O-N 2.89Å; M65-R67 VanDerWaalsContact C-N 3.34Å; M65-R67 PolarHBondContact O-N 2.96Å; M65-F68 WeakPolarHBondContact O-CB 3.46Å; M65-F68 PolarHBondContact O-N 2.94Å; M65-A69 WeakPolarHBondContact O-CB 3.34Å; M65-A69 PolarHBondContact O-N 3.37Å; M65-A69 HydrophobicContact SD-CB 4.18Å; M65-T81 HydrophobicContact CE-CG2 3.28Å; M65-M85 HydrophobicContact CE-CE 3.22Å; M65-M85 HydrophobicContact CE-CG 4.07Å; M65-M85 HydrophobicContact CE-SD 4.41Å
66	Q	91.1	Very high	84.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56.2	-48.6	177.3	-76.7	171.2	-27.6	0	0	111.2	I62 K63 F68 A69 G70 L71 P72 T74 R76 T81	I62-Q66 HydrophobicContact CG2-CG 4.12Å; I62-Q66 WeakPolarHBondContact O-CB 3.37Å; I62-Q66 VanDerWaalsContact O-CG 3.24Å; I62-Q66 WeakPolarHBondContact O-CG 3.41Å; I62-Q66 PolarHBondContact O-N 3.17Å; K63-Q66 PolarHBondContact O-N 2.65Å; Q66-F68 VanDerWaalsContact C-N 3.3Å; Q66-F68 PolarHBondContact O-N 3.06Å; Q66-A69 CarbonylContact O-C 3.54Å; Q66-A69 PolarHBondContact O-N 2.95Å; Q66-G70 PolarHBondContact O-N 3.46Å; Q66-L71 HydrophobicContact CB-CB 3.99Å; Q66-L71 HydrophobicContact CG-CB 4.21Å; Q66-L71 HydrophobicContact CG-CD1 4.4Å; Q66-L71 PolarHBondContact O-N 3.26Å; Q66-P72 VanDerWaalsContact CD-O 3.28Å; Q66-P72 PolarHBondContact OE1-O 2.81Å; Q66-T74 PolarHBondContact NE2-OG1 3.32Å; Q66-R76 PolarHBondContact NE2-O 3.48Å; Q66-T81 HydrophobicContact CG-CG2 4.32Å; Q66-T81 PolarHBondContact NE2-OG1 2.97Å
67	R	83.6	Confident	85	Confident	144 Å²	144	55.1 Å²	55.1	54%	0.543	27%	0.274	S	S	.	.	H	α-helix	trans	-56.9	-45	175.3	-177	-172.2	-66.2	151.2	4	111.6	K63 V64 M65 G70 E73	K63-R67 VanDerWaalsContact O-CB 3.31Å; K63-R67 WeakPolarHBondContact O-CB 3.39Å; K63-R67 PolarHBondContact O-N 3.18Å; V64-R67 PolarHBondContact O-N 3.1Å; M65-R67 VanDerWaalsContact C-N 3.34Å; M65-R67 PolarHBondContact O-N 2.96Å; R67-G70 PolarHBondContact O-N 3.18Å; R67-E73 HydrophobicContact CB-CG 4.06Å; R67-E73 IonicContact CZ-OE1 3.3Å; R67-E73 VanDerWaalsContact CZ-OE1 3.3Å; R67-E73 IonicContact CZ-OE2 3.5Å; R67-E73 IonicContact NE-OE1 2.71Å; R67-E73 PolarHBondContact NE-OE1 3.21Å; R67-E73 IonicContact NE-OE2 3.63Å; R67-E73 IonicContact NH2-OE1 3.06Å; R67-E73 PolarHBondContact NH2-OE1 2.9Å; R67-E73 IonicContact NH2-OE2 2.7Å; R67-E73 PolarHBondContact NH2-OE2 3.48Å
68	F	81.9	Confident	85.7	Confident	33 Å²	33	50.9 Å²	50.9	15%	0.145	26%	0.258	C	S	.	.	H	α-helix	trans	-65.1	-41.3	-179.5	-162.5	-88.4	0	0	0	111.9	Y41 V64 M65 Q66 G70 D94 H243 S245 P253	Y41-F68 HydrophobicContact CE1-CB 4.21Å; Y41-F68 WeakPolarHBondContact OH-CB 3.26Å; Y41-F68 VanDerWaalsContact OH-CD1 3.27Å; Y41-F68 WeakPolarHBondContact OH-CD1 3.46Å; Y41-F68 WeakPolarHBondContact OH-CG 3.12Å; V64-F68 WeakPolarHBondContact O-CB 3.44Å; V64-F68 PolarHBondContact O-N 3.06Å; M65-F68 WeakPolarHBondContact O-CB 3.46Å; M65-F68 PolarHBondContact O-N 2.94Å; Q66-F68 VanDerWaalsContact C-N 3.3Å; Q66-F68 PolarHBondContact O-N 3.06Å; F68-G70 PolarHBondContact O-N 3.2Å; F68-D94 HydrophobicContact CD1-CB 4.26Å; F68-D94 HydrophobicContact CE1-CB 3.99Å; F68-D94 HydrophobicContact CZ-CB 4.24Å; F68-H243 HydrophobicContact CE1-CB 4.03Å; F68-H243 HydrophobicContact CZ-CB 3.73Å; F68-S245 WeakPolarHBondContact O-CB 3.12Å; F68-P253 HydrophobicContact CD1-CG 4.29Å; F68-P253 HydrophobicContact CE1-CG 3.85Å
69	A	85.7	Confident	86.2	Confident	10 Å²	10	54 Å²	54	8%	0.083	28%	0.279	C	S	.	.	H	α-helix	trans	-73.1	-10.3	175.6	0	0	0	0	0	113.8	M65 Q66 L71 T84 R252 F254	M65-A69 WeakPolarHBondContact O-CB 3.34Å; M65-A69 PolarHBondContact O-N 3.37Å; M65-A69 HydrophobicContact SD-CB 4.18Å; Q66-A69 CarbonylContact O-C 3.54Å; Q66-A69 PolarHBondContact O-N 2.95Å; A69-L71 HydrophobicContact CB-CD1 4.22Å; A69-L71 HydrophobicContact CB-CG 4.03Å; A69-T84 HydrophobicContact CB-CG2 4.02Å; A69-R252 VanDerWaalsContact C-NH2 3.33Å; A69-R252 PolarHBondContact O-NH2 2.8Å; A69-F254 HydrophobicContact CB-CE2 3.78Å; A69-F254 HydrophobicContact CB-CZ 4.3Å
70	G	84.5	Confident	86.4	Confident	59 Å²	59	54.4 Å²	54.4	61%	0.608	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	20.5	-176.7	0	0	0	0	0	114.3	Q66 R67 F68	Q66-G70 PolarHBondContact O-N 3.46Å; R67-G70 PolarHBondContact O-N 3.18Å; F68-G70 PolarHBondContact O-N 3.2Å
71	L	89.1	Confident	86.7	Confident	22 Å²	22	50.9 Å²	50.9	12%	0.115	27%	0.267	C	S	.	.			trans	-91	158.1	177.2	-57.6	179.2	0	0	0	111.7	Q66 A69 E73 E80 T84	Q66-L71 HydrophobicContact CB-CB 3.99Å; Q66-L71 HydrophobicContact CG-CB 4.21Å; Q66-L71 HydrophobicContact CG-CD1 4.4Å; Q66-L71 PolarHBondContact O-N 3.26Å; A69-L71 HydrophobicContact CB-CD1 4.22Å; A69-L71 HydrophobicContact CB-CG 4.03Å; L71-E73 PolarHBondContact O-N 2.94Å; L71-E80 HydrophobicContact CD2-CG 3.85Å; L71-T84 HydrophobicContact CD1-CG2 4.26Å
72	P	89.1	Confident	87	Confident	81 Å²	81	51.6 Å²	51.6	53%	0.526	27%	0.27	S	S	.	.			trans	-57.9	134.5	169.6	-22.7	33.9	0	0	0	112	Q66 T74	Q66-P72 VanDerWaalsContact CD-O 3.28Å; Q66-P72 PolarHBondContact OE1-O 2.81Å; P72-T74 HydrophobicContact CB-CG2 4.22Å; P72-T74 PolarHBondContact O-N 3.23Å
73	E	91.8	Very high	87.1	Confident	82 Å²	82	53.9 Å²	53.9	38%	0.383	29%	0.29	S	S	.	.			trans	-77.2	64.1	-177.3	-63.3	-177.4	-142	0	0	113	K63 R67 L71 G75	K63-E73 HydrophobicContact CB-CB 4.3Å; K63-E73 HydrophobicContact CG-CB 4.18Å; R67-E73 HydrophobicContact CB-CG 4.06Å; R67-E73 IonicContact CZ-OE1 3.3Å; R67-E73 VanDerWaalsContact CZ-OE1 3.3Å; R67-E73 IonicContact CZ-OE2 3.5Å; R67-E73 IonicContact NE-OE1 2.71Å; R67-E73 PolarHBondContact NE-OE1 3.21Å; R67-E73 IonicContact NE-OE2 3.63Å; R67-E73 IonicContact NH2-OE1 3.06Å; R67-E73 PolarHBondContact NH2-OE1 2.9Å; R67-E73 IonicContact NH2-OE2 2.7Å; R67-E73 PolarHBondContact NH2-OE2 3.48Å; L71-E73 PolarHBondContact O-N 2.94Å; E73-G75 VanDerWaalsContact C-N 3.3Å
74	T	90.1	Very high	87.2	Confident	60 Å²	60	51.1 Å²	51.1	37%	0.368	28%	0.279	S	S	.	.			trans	-72	-26	179.4	73.8	0	0	0	0	112.3	Q66 P72 R76 D78	Q66-T74 PolarHBondContact NE2-OG1 3.32Å; P72-T74 HydrophobicContact CB-CG2 4.22Å; P72-T74 PolarHBondContact O-N 3.23Å; T74-R76 PolarHBondContact O-N 2.98Å; T74-R76 PolarHBondContact OG1-N 2.84Å; T74-R76 PolarHBondContact OG1-O 2.75Å; T74-D78 WeakPolarHBondContact CB-OD2 3.4Å; T74-D78 WeakPolarHBondContact CG2-OD2 3.49Å; T74-D78 PolarHBondContact OG1-OD2 2.63Å
75	G	85.3	Confident	87.5	Confident	5 Å²	5	49.6 Å²	49.6	5%	0.052	27%	0.269	C	S	.	.			trans	66.9	18.8	-172.7	0	0	0	0	0	113.6	R59 K63 E73	R59-G75 VanDerWaalsContact CG-O 3.27Å; R59-G75 WeakPolarHBondContact CG-O 2.97Å; R59-G75 WeakPolarHBondContact O-CA 3.27Å; K63-G75 VanDerWaalsContact CG-CA 3.46Å; E73-G75 VanDerWaalsContact C-N 3.3Å
76	R	87.8	Confident	87.4	Confident	184 Å²	184	57.5 Å²	57.5	69%	0.694	30%	0.299	S	S	*	.	S	Bend	trans	-122.8	149.9	-178.7	-63	-179.6	178.2	-179.4	1.4	109.5	Q66 T74 D78 T81	Q66-R76 PolarHBondContact NE2-O 3.48Å; T74-R76 PolarHBondContact O-N 2.98Å; T74-R76 PolarHBondContact OG1-N 2.84Å; T74-R76 PolarHBondContact OG1-O 2.75Å; R76-D78 PolarHBondContact O-N 2.79Å; R76-T81 PolarHBondContact O-OG1 2.78Å
77	M	83.9	Confident	87.3	Confident	16 Å²	16	62.4 Å²	62.4	8%	0.079	32%	0.32	C	S	.	.			trans	-75.1	64.1	168	-60.7	-65.8	-71.3	0	0	109.3	P24 I62 T81 V82 M85	P24-M77 HydrophobicContact CB-CB 4.22Å; P24-M77 HydrophobicContact CG-CB 4.46Å; I62-M77 HydrophobicContact CD1-CG 3.92Å; I62-M77 HydrophobicContact CD1-SD 3.99Å; I62-M77 HydrophobicContact CG1-SD 4.07Å; M77-T81 HydrophobicContact SD-CG2 4.21Å; M77-V82 HydrophobicContact CB-CG2 4.25Å; M77-V82 HydrophobicContact CE-CG2 4.09Å; M77-M85 HydrophobicContact CE-CE 3.62Å; M77-M85 HydrophobicContact CE-SD 3.41Å; M77-M85 WeakPolarHBondContact CE-SD 3.17Å; M77-M85 HydrophobicContact SD-CE 3.69Å; M77-M85 HydrophobicContact SD-SD 4.28Å
78	D	85.9	Confident	87.8	Confident	37 Å²	37	57.6 Å²	57.6	20%	0.198	31%	0.308	C	S	.	.			trans	-71.3	162.9	174.1	54.5	48.4	0	0	0	111	T74 R76 E80 T81 V82	T74-D78 WeakPolarHBondContact CB-OD2 3.4Å; T74-D78 WeakPolarHBondContact CG2-OD2 3.49Å; T74-D78 PolarHBondContact OG1-OD2 2.63Å; R76-D78 PolarHBondContact O-N 2.79Å; D78-E80 PolarHBondContact O-N 3.04Å; D78-T81 VanDerWaalsContact CG-OG1 3.3Å; D78-T81 WeakPolarHBondContact O-CB 3.35Å; D78-T81 PolarHBondContact O-N 2.95Å; D78-T81 WeakPolarHBondContact OD1-CB 3.42Å; D78-T81 PolarHBondContact OD1-N 2.78Å; D78-T81 PolarHBondContact OD1-OG1 3.21Å; D78-V82 PolarHBondContact O-N 3Å
79	P	88.7	Confident	88.3	Confident	94 Å²	94	56.2 Å²	56.2	61%	0.61	30%	0.302	S	S	*	.	H	α-helix	trans	-56	-34.8	-175.2	-28.8	36.7	0	0	0	114	V82 A83	P79-V82 PolarHBondContact O-N 3.03Å; P79-A83 VanDerWaalsContact O-CB 3.24Å; P79-A83 WeakPolarHBondContact O-CB 3.49Å; P79-A83 PolarHBondContact O-N 3.04Å
80	E	88.8	Confident	88.7	Confident	112 Å²	112	56 Å²	56	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-68.8	-40	177.5	-169.9	177.2	-166.8	0	0	111.7	L71 D78 A83 T84	L71-E80 HydrophobicContact CD2-CG 3.85Å; D78-E80 PolarHBondContact O-N 3.04Å; E80-A83 PolarHBondContact O-N 2.71Å; E80-T84 WeakPolarHBondContact O-CB 3.32Å; E80-T84 PolarHBondContact O-N 2.91Å; E80-T84 PolarHBondContact O-OG1 3.47Å
81	T	88.2	Confident	88.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.2	-48.8	173.2	-60.4	0	0	0	0	111.3	I62 M65 Q66 R76 M77 D78 T84 M85	I62-T81 HydrophobicContact CG2-CG2 4.44Å; M65-T81 HydrophobicContact CE-CG2 3.28Å; Q66-T81 HydrophobicContact CG-CG2 4.32Å; Q66-T81 PolarHBondContact NE2-OG1 2.97Å; R76-T81 PolarHBondContact O-OG1 2.78Å; M77-T81 HydrophobicContact SD-CG2 4.21Å; D78-T81 VanDerWaalsContact CG-OG1 3.3Å; D78-T81 WeakPolarHBondContact O-CB 3.35Å; D78-T81 PolarHBondContact O-N 2.95Å; D78-T81 WeakPolarHBondContact OD1-CB 3.42Å; D78-T81 PolarHBondContact OD1-N 2.78Å; D78-T81 PolarHBondContact OD1-OG1 3.21Å; T81-T84 PolarHBondContact O-N 3.31Å; T81-M85 HydrophobicContact CG2-CE 4.33Å; T81-M85 WeakPolarHBondContact O-CG 3.4Å; T81-M85 PolarHBondContact O-N 2.9Å
82	V	87.9	Confident	88.2	Confident	22 Å²	22	53 Å²	53	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-41.4	179.3	175	0	0	0	0	111.3	M77 D78 P79 T84 M85 R86	M77-V82 HydrophobicContact CB-CG2 4.25Å; M77-V82 HydrophobicContact CE-CG2 4.09Å; D78-V82 PolarHBondContact O-N 3Å; P79-V82 PolarHBondContact O-N 3.03Å; V82-T84 VanDerWaalsContact C-N 3.29Å; V82-T84 PolarHBondContact O-N 2.68Å; V82-M85 PolarHBondContact O-N 3.41Å; V82-R86 WeakPolarHBondContact O-CG 3.26Å; V82-R86 PolarHBondContact O-N 3.06Å
83	A	88.6	Confident	87.6	Confident	54 Å²	54	50.4 Å²	50.4	45%	0.446	25%	0.253	S	S	.	.	H	α-helix	trans	-62	-39.4	176.1	0	0	0	0	0	111.5	P79 E80 R86	P79-A83 VanDerWaalsContact O-CB 3.24Å; P79-A83 WeakPolarHBondContact O-CB 3.49Å; P79-A83 PolarHBondContact O-N 3.04Å; E80-A83 PolarHBondContact O-N 2.71Å; A83-R86 PolarHBondContact O-N 2.71Å
84	T	88.4	Confident	87	Confident	10 Å²	10	46.6 Å²	46.6	6%	0.061	24%	0.236	C	C	.	.	H	α-helix	trans	-66.1	-41.6	176.3	-59.7	0	0	0	0	111.9	A69 L71 E80 T81 V82 R86 K87 F254	A69-T84 HydrophobicContact CB-CG2 4.02Å; L71-T84 HydrophobicContact CD1-CG2 4.26Å; E80-T84 WeakPolarHBondContact O-CB 3.32Å; E80-T84 PolarHBondContact O-N 2.91Å; E80-T84 PolarHBondContact O-OG1 3.47Å; T81-T84 PolarHBondContact O-N 3.31Å; V82-T84 VanDerWaalsContact C-N 3.29Å; V82-T84 PolarHBondContact O-N 2.68Å; T84-R86 PolarHBondContact O-N 2.75Å; T84-K87 WeakPolarHBondContact O-CB 3.32Å; T84-K87 PolarHBondContact O-N 2.8Å; T84-K87 VanDerWaalsContact O-N 3.12Å; T84-F254 HydrophobicContact CG2-CD1 4.43Å; T84-F254 HydrophobicContact CG2-CD2 4.44Å; T84-F254 HydrophobicContact CG2-CE1 3.98Å; T84-F254 HydrophobicContact CG2-CE2 4.02Å; T84-F254 HydrophobicContact CG2-CZ 3.76Å; T84-F254 WeakPolarHBondContact O-CE1 3.24Å
85	M	87.6	Confident	85.9	Confident	17 Å²	17	44.8 Å²	44.8	8%	0.084	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-21.7	175.9	-73.1	-173.8	172.8	0	0	114.2	W35 L36 M65 M77 T81 V82	W35-M85 HydrophobicContact CB-SD 4.27Å; W35-M85 HydrophobicContact CD2-CB 4.2Å; W35-M85 HydrophobicContact CD2-CE 4.05Å; W35-M85 HydrophobicContact CD2-CG 3.72Å; W35-M85 HydrophobicContact CD2-SD 3.84Å; W35-M85 HydrophobicContact CE3-CE 3.65Å; W35-M85 HydrophobicContact CE3-CG 4.06Å; W35-M85 HydrophobicContact CE3-SD 4.09Å; W35-M85 HydrophobicContact CG-CB 4.36Å; W35-M85 HydrophobicContact CG-CG 4.21Å; W35-M85 HydrophobicContact CG-SD 3.93Å; W35-M85 HydrophobicContact CH2-CG 4.35Å; W35-M85 HydrophobicContact CZ2-CB 4.27Å; W35-M85 HydrophobicContact CZ2-CG 3.97Å; W35-M85 HydrophobicContact CZ3-CE 4.22Å; W35-M85 HydrophobicContact CZ3-CG 4.4Å; W35-M85 PolarHBondContact NE1-O 2.75Å; L36-M85 HydrophobicContact CD2-CE 4.09Å; L36-M85 HydrophobicContact CG-CE 4.07Å; M65-M85 HydrophobicContact CE-CE 3.22Å; M65-M85 HydrophobicContact CE-CG 4.07Å; M65-M85 HydrophobicContact CE-SD 4.41Å; M77-M85 HydrophobicContact CE-CE 3.62Å; M77-M85 HydrophobicContact CE-SD 3.41Å; M77-M85 WeakPolarHBondContact CE-SD 3.17Å; M77-M85 HydrophobicContact SD-CE 3.69Å; M77-M85 HydrophobicContact SD-SD 4.28Å; T81-M85 HydrophobicContact CG2-CE 4.33Å; T81-M85 WeakPolarHBondContact O-CG 3.4Å; T81-M85 PolarHBondContact O-N 2.9Å; V82-M85 PolarHBondContact O-N 3.41Å
86	R	87.3	Confident	84.6	Confident	165 Å²	165	47.5 Å²	47.5	62%	0.623	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.9	178	-69.7	172.8	-176.8	-90.8	0.4	113.6	V82 A83 T84	V82-R86 WeakPolarHBondContact O-CG 3.26Å; V82-R86 PolarHBondContact O-N 3.06Å; A83-R86 PolarHBondContact O-N 2.71Å; T84-R86 PolarHBondContact O-N 2.75Å
87	K	89.6	Confident	82.4	Confident	104 Å²	104	41 Å²	41	45%	0.452	23%	0.227	S	C	.	.	S	Bend	trans	-67.2	141.7	178.1	-69.8	-177.5	177.3	-178.7	0	109.9	T84 F254	T84-K87 WeakPolarHBondContact O-CB 3.32Å; T84-K87 PolarHBondContact O-N 2.8Å; T84-K87 VanDerWaalsContact O-N 3.12Å; K87-F254 HydrophobicContact CB-CD1 4.11Å
88	P	92.7	Very high	79.9	Confident	43 Å²	43	46.3 Å²	46.3	28%	0.279	26%	0.261	S	S	.	.			trans	-54.6	141.4	169.6	-21.7	31.9	0	0	0	111.1	G190 L192 Y255	P88-G190 CarbonylContact C-O 2.77Å; P88-G190 VanDerWaalsContact CA-O 3.23Å; P88-G190 WeakPolarHBondContact CA-O 3.28Å; P88-L192 HydrophobicContact CB-CD1 3.91Å; P88-L192 HydrophobicContact CB-CD2 3.71Å; P88-L192 HydrophobicContact CB-CG 3.84Å; P88-Y255 WeakPolarHBondContact O-CB 3.35Å; P88-Y255 PolarHBondContact O-N 2.89Å
89	R	93.4	Very high	77.3	Confident	4 Å²	4	48 Å²	48	2%	0.015	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-156.5	169	-172	62.2	165.4	-70.3	153.4	9.4	113	Y39 L92 D94 G190 T191 L192 P253 F254	Y39-R89 VanDerWaalsContact CD1-NH2 3.27Å; Y39-R89 VanDerWaalsContact CZ-CD 3.46Å; Y39-R89 VanDerWaalsContact CZ-NE 3.33Å; Y39-R89 WeakPolarHBondContact OH-CD 3.34Å; R89-L92 PolarHBondContact NH2-O 2.74Å; R89-D94 IonicContact CZ-OD1 3.18Å; R89-D94 IonicContact CZ-OD2 2.65Å; R89-D94 IonicContact NH1-OD1 2.78Å; R89-D94 IonicContact NH1-OD2 2.75Å; R89-D94 PolarHBondContact NH1-OD2 3.23Å; R89-D94 VanDerWaalsContact NH2-CG 3.33Å; R89-D94 IonicContact NH2-OD1 2.74Å; R89-D94 PolarHBondContact NH2-OD1 2.68Å; R89-D94 IonicContact NH2-OD2 3.48Å; R89-D94 PolarHBondContact NH2-OD2 3.27Å; R89-G190 PolarHBondContact N-O 3.3Å; R89-T191 WeakPolarHBondContact O-CA 3.35Å; R89-L192 PolarHBondContact O-N 3.08Å; R89-P253 CarbonylContact C-O 3.47Å; R89-P253 WeakPolarHBondContact CA-O 3.32Å; R89-P253 WeakPolarHBondContact CB-O 3.48Å; R89-P253 VanDerWaalsContact NH2-CB 3.27Å; R89-F254 HydrophobicContact CB-CD1 4.15Å
90	C	93.1	Very high	74.9	Confident	4 Å²	4	45.6 Å²	45.6	3%	0.027	27%	0.272	C	S	.	.			trans	-68.6	145.6	167.1	169	0	0	0	0	111.5	L92 H233 H243 P253	C90-L92 VanDerWaalsContact C-N 3.32Å; C90-L92 PolarHBondContact O-N 3.44Å; C90-L92 PolarHBondContact SG-N 3.08Å; C90-L92 VanDerWaalsContact SG-N 3.43Å; C90-H233 WeakPolarHBondContact CB-NE2 3.39Å; C90-H243 WeakPolarHBondContact CB-NE2 3.26Å; C90-H243 PolarHBondContact SG-NE2 3.29Å; C90-H243 VanDerWaalsContact SG-NE2 3.43Å; C90-P253 PolarHBondContact N-O 2.82Å
91	S	85.2	Confident	72.3	Confident	13 Å²	13	45.3 Å²	45.3	9%	0.091	27%	0.274	C	S	.	.	S	Bend	trans	-72.2	-21.8	-176.8	101	0	0	0	0	113.9	A193 H194	S91-A193 PolarHBondContact N-O 3.35Å; S91-A193 VanDerWaalsContact N-O 3.11Å; S91-H194 WeakPolarHBondContact OG-CB 3.33Å; S91-H194 PolarHBondContact OG-ND1 3.02Å; S91-H194 VanDerWaalsContact OG-ND1 3.15Å
92	L	79	Confident	69.6	Low	6 Å²	6	51.2 Å²	51.2	3%	0.031	31%	0.31	C	S	.	.	S	Bend	trans	-70.6	150.9	-173.8	-67	-177.3	0	0	0	113	R89 C90 Y183 H194 A195 F197 H237 H243	R89-L92 PolarHBondContact NH2-O 2.74Å; C90-L92 VanDerWaalsContact C-N 3.32Å; C90-L92 PolarHBondContact O-N 3.44Å; C90-L92 PolarHBondContact SG-N 3.08Å; C90-L92 VanDerWaalsContact SG-N 3.43Å; L92-Y183 HydrophobicContact CD2-CE1 4.21Å; L92-Y183 HydrophobicContact CD2-CE2 4.46Å; L92-H194 HydrophobicContact CD2-CB 4.43Å; L92-H194 HydrophobicContact CG-CB 4.27Å; L92-A195 WeakPolarHBondContact CD1-O 3.35Å; L92-F197 HydrophobicContact CD1-CE2 4.27Å; L92-F197 HydrophobicContact CD1-CZ 4.01Å; L92-H237 HydrophobicContact CD1-CB 4.1Å; L92-H243 PolarHBondContact O-CE1 3.05Å
93	P	75.3	Confident	66.9	Low	26 Å²	26	59.1 Å²	59.1	17%	0.169	34%	0.337	C	S	.	.			trans	-63.9	141.1	174.7	-20.9	32.5	0	0	0	113.3	V95 L96	P93-V95 VanDerWaalsContact C-N 3.33Å; P93-L96 HydrophobicContact CB-CD2 4.45Å
94	D	79.7	Confident	64.3	Low	3 Å²	3	67.7 Å²	67.7	2%	0.016	36%	0.358	C	S	.	.	S	Bend	trans	-73.2	-29.9	175.6	-62.3	-35.7	0	0	0	111.9	Y39 Y41 F68 R89 H243 P253	Y39-D94 PolarHBondContact O-N 2.6Å; Y41-D94 HydrophobicContact CE1-CB 4.27Å; Y41-D94 HydrophobicContact CE2-CB 3.84Å; Y41-D94 WeakPolarHBondContact CE2-OD2 3.39Å; Y41-D94 WeakPolarHBondContact OH-CB 2.9Å; Y41-D94 VanDerWaalsContact OH-CG 3.31Å; Y41-D94 PolarHBondContact OH-OD2 3.49Å; F68-D94 HydrophobicContact CD1-CB 4.26Å; F68-D94 HydrophobicContact CE1-CB 3.99Å; F68-D94 HydrophobicContact CZ-CB 4.24Å; R89-D94 IonicContact CZ-OD1 3.18Å; R89-D94 IonicContact CZ-OD2 2.65Å; R89-D94 IonicContact NH1-OD1 2.78Å; R89-D94 IonicContact NH1-OD2 2.75Å; R89-D94 PolarHBondContact NH1-OD2 3.23Å; R89-D94 VanDerWaalsContact NH2-CG 3.33Å; R89-D94 IonicContact NH2-OD1 2.74Å; R89-D94 PolarHBondContact NH2-OD1 2.68Å; R89-D94 IonicContact NH2-OD2 3.48Å; R89-D94 PolarHBondContact NH2-OD2 3.27Å; D94-H243 IonicContact OD1-CE1 3.01Å; D94-H243 PolarHBondContact OD1-CE1 3Å; D94-H243 IonicContact OD1-CG 2.6Å; D94-H243 IonicContact OD1-ND1 2.74Å; D94-H243 PolarHBondContact OD1-ND1 2.86Å; D94-P253 VanDerWaalsContact OD1-CB 3.25Å; D94-P253 WeakPolarHBondContact OD1-CB 3.36Å; D94-P253 WeakPolarHBondContact OD1-CG 3.42Å
95	V	67.8	Low	61.8	Low	21 Å²	21	79 Å²	79	13%	0.127	40%	0.399	C	S	.	.	S	Bend	trans	-116.5	102.2	179.6	-174.6	0	0	0	0	109.4	Y39 G40 Y41 P93 G97	Y39-V95 PolarHBondContact O-N 2.88Å; G40-V95 WeakPolarHBondContact O-CB 3.35Å; Y41-V95 HydrophobicContact CD1-CG2 3.82Å; Y41-V95 HydrophobicContact CE1-CG2 3.81Å; P93-V95 VanDerWaalsContact C-N 3.33Å; V95-G97 PolarHBondContact O-N 3.29Å
96	L	56.8	Low	59.6	Low	62 Å²	62	85.9 Å²	85.9	33%	0.325	43%	0.425	S	S	.	.			trans	-77.8	82	177.9	-57.5	175.2	0	0	0	110.7	P93 F197	P93-L96 HydrophobicContact CB-CD2 4.45Å; L96-F197 HydrophobicContact CD1-CE2 4.14Å; L96-F197 HydrophobicContact CD1-CZ 3.88Å; L96-F197 HydrophobicContact CD2-CE2 4.27Å; L96-F197 HydrophobicContact CD2-CZ 4.49Å
97	G	43.3	Very low	57.5	Low	47 Å²	47	85.9 Å²	85.9	49%	0.485	43%	0.425	S	S	.	.	S	Bend	trans	77.5	174.3	168.4	0	0	0	0	0	117.4	V95 A99 G100	V95-G97 PolarHBondContact O-N 3.29Å; G97-A99 PolarHBondContact O-N 2.82Å; G97-G100 PolarHBondContact O-N 2.53Å
98	V	31.1	Very low	55.1	Low	128 Å²	128	81.9 Å²	81.9	78%	0.776	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-19.7	-173	-131.4	0	0	0	0	114.1	G100	V98-G100 VanDerWaalsContact C-N 3.34Å
99	A	31.6	Very low	53	Low	73 Å²	73	81.3 Å²	81.3	60%	0.603	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-23.1	174.8	0	0	0	0	0	113.5	G97 L101	G97-A99 PolarHBondContact O-N 2.82Å; A99-L101 VanDerWaalsContact C-N 3.34Å
100	G	37	Very low	51	Low	44 Å²	44	83.9 Å²	83.9	45%	0.454	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-24.1	176.3	0	0	0	0	0	113.8	G97 V98	G97-G100 PolarHBondContact O-N 2.53Å; V98-G100 VanDerWaalsContact C-N 3.34Å
101	L	35.3	Very low	49.2	Very low	106 Å²	106	85.6 Å²	85.6	56%	0.555	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-12.6	179.8	-65.5	171.8	0	0	0	113.4	A99	A99-L101 VanDerWaalsContact C-N 3.34Å
102	V	30.7	Very low	48	Very low	124 Å²	124	88.2 Å²	88.2	75%	0.752	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-14.8	-172.8	-174.9	0	0	0	0	113.4	R104	V102-R104 PolarHBondContact O-N 2.9Å
103	R	31.8	Very low	47.5	Very low	188 Å²	188	89.6 Å²	89.6	71%	0.709	47%	0.47	S	S	*	.			trans	-93.6	104.2	178.6	-85.1	-178.1	143.8	163.5	-4.1	112.4	R105	R103-R105 PolarHBondContact O-N 2.83Å
104	R	32.9	Very low	47.9	Very low	234 Å²	234	91.3 Å²	91.3	88%	0.883	48%	0.48	S	S	*	.			trans	-46.1	132.3	166.4	-78.7	-177.4	-179.4	-178.6	0.8	111.7	V102	V102-R104 PolarHBondContact O-N 2.9Å
105	R	37.8	Very low	48.3	Very low	247 Å²	247	92.5 Å²	92.5	93%	0.932	49%	0.485	S	S	*	.			trans	55.6	62.7	153.9	-66.6	-175.7	172.9	-174.9	-2.2	117.1	R103	R103-R105 PolarHBondContact O-N 2.83Å
106	R	41.3	Very low	49.2	Very low	162 Å²	162	100 Å²	100	61%	0.611	52%	0.515	S	S	*	.			trans	-120.3	132.8	154.9	-66.8	-171.6	179.6	-170.8	-2.6	108.9
107	R	43.3	Very low	50.8	Low	165 Å²	165	101 Å²	101	62%	0.623	52%	0.517	S	S	*	.	S	Bend	trans	-76.4	-16.5	178.9	-69.2	-178	-63.9	-167.2	-2.9	112.5	S244 S245 D270	R107-S244 WeakPolarHBondContact O-CA 3.34Å; R107-S244 PolarHBondContact O-OG 3.16Å; R107-S245 PolarHBondContact O-N 3.36Å; R107-S245 PolarHBondContact O-OG 3.32Å; R107-D270 IonicContact CZ-OD1 3.91Å; R107-D270 IonicContact NE-OD1 3.52Å; R107-D270 IonicContact NH2-OD1 3.9Å
108	Y	39.2	Very low	53.1	Low	20 Å²	20	104 Å²	104	8%	0.078	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.6	-174	-149.5	-91.7	0	0	0	110.3	L110 L241 M251 D270 D271	Y108-L110 HydrophobicContact CD1-CD2 4.01Å; Y108-L110 HydrophobicContact CE1-CD2 4.3Å; Y108-L241 HydrophobicContact CD1-CD2 4.42Å; Y108-L241 HydrophobicContact CE1-CB 3.65Å; Y108-L241 HydrophobicContact CE1-CD2 3.47Å; Y108-L241 VanDerWaalsContact CE1-CD2 3.47Å; Y108-L241 HydrophobicContact CE1-CG 4.05Å; Y108-L241 WeakPolarHBondContact OH-CB 3.26Å; Y108-L241 WeakPolarHBondContact OH-CD1 3.09Å; Y108-M251 HydrophobicContact CE2-CB 3.88Å; Y108-M251 HydrophobicContact CE2-CG 4.09Å; Y108-M251 WeakPolarHBondContact OH-CG 3.45Å; Y108-D270 VanDerWaalsContact CD2-OD2 3.24Å; Y108-D270 WeakPolarHBondContact CD2-OD2 3.43Å; Y108-D271 WeakPolarHBondContact CE2-OD1 3.49Å; Y108-D271 PolarHBondContact OH-OD1 2.8Å
109	A	47.3	Very low	56.1	Low	31 Å²	31	101.3 Å²	101.3	26%	0.256	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	133.2	173.2	0	0	0	0	0	109.7	G242 H243	A109-G242 CarbonylContact O-C 3.24Å; A109-G242 WeakPolarHBondContact O-CA 3.44Å; A109-G242 PolarHBondContact O-N 2.94Å; A109-H243 PolarHBondContact N-O 3.3Å
110	L	51	Low	59.1	Low	57 Å²	57	97.9 Å²	97.9	30%	0.298	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.3	169.5	-62.7	177.3	0	0	0	107.9	Y108 G112 L241 Q277 L278	Y108-L110 HydrophobicContact CD1-CD2 4.01Å; Y108-L110 HydrophobicContact CE1-CD2 4.3Å; L110-G112 PolarHBondContact O-N 2.91Å; L110-L241 HydrophobicContact CD2-CD2 3.92Å; L110-Q277 HydrophobicContact CD1-CB 4.42Å; L110-L278 HydrophobicContact CD1-CD2 4.02Å; L110-L278 HydrophobicContact CD2-CD1 4.23Å; L110-L278 HydrophobicContact CD2-CD2 4.05Å; L110-L278 HydrophobicContact CD2-CG 4.13Å; L110-L278 HydrophobicContact CG-CD2 4.44Å
111	S	56.2	Low	61.9	Low	41 Å²	41	96.6 Å²	96.6	29%	0.287	45%	0.452	S	S	.	.			trans	-65.8	-31.6	177.7	-178	0	0	0	0	111.9	F197 G240	S111-F197 WeakPolarHBondContact OG-CD1 3.21Å; S111-F197 VanDerWaalsContact OG-CD2 3.24Å; S111-F197 WeakPolarHBondContact OG-CD2 3.49Å; S111-F197 WeakPolarHBondContact OG-CG 3.35Å; S111-G240 WeakPolarHBondContact CB-O 3.41Å; S111-G240 PolarHBondContact N-O 3.19Å
112	G	59.1	Low	64.8	Low	67 Å²	67	91.7 Å²	91.7	69%	0.691	43%	0.426	S	S	*	.	S	Bend	trans	93.9	-5.7	-179.5	0	0	0	0	0	114.1	L110	L110-G112 PolarHBondContact O-N 2.91Å
113	S	69.5	Low	67.9	Low	35 Å²	35	87.9 Å²	87.9	25%	0.245	40%	0.399	C	S	.	.			trans	-100.5	145.2	168.4	64.2	0	0	0	0	111.6	P198	S113-P198 WeakPolarHBondContact CB-O 3.23Å; S113-P198 PolarHBondContact OG-O 3.11Å
114	V	83.6	Confident	70.9	Confident	62 Å²	62	79.6 Å²	79.6	38%	0.376	37%	0.369	S	S	.	.			trans	-141.2	149.9	-178.4	-65.5	0	0	0	0	110.4	K116 L278 Y279	V114-K116 PolarHBondContact O-N 2.9Å; V114-L278 HydrophobicContact CG1-CB 3.85Å; V114-L278 HydrophobicContact CG1-CD1 4.39Å; V114-L278 HydrophobicContact CG1-CD2 3.65Å; V114-L278 HydrophobicContact CG1-CG 4.16Å; V114-Y279 HydrophobicContact CB-CE1 4.26Å
115	W	86.9	Confident	73.8	Confident	29 Å²	29	74.1 Å²	74.1	11%	0.11	35%	0.348	C	S	.	.			trans	-67.6	130	167.9	-67.8	108.9	0	0	0	110.5	K117 L120 D169 P198 S204 A238 Y279	W115-K117 VanDerWaalsContact C-N 3.27Å; W115-L120 HydrophobicContact CB-CD2 3.96Å; W115-L120 HydrophobicContact CD2-CD2 3.83Å; W115-L120 HydrophobicContact CE3-CD2 4.28Å; W115-L120 HydrophobicContact CG-CD1 4.06Å; W115-L120 HydrophobicContact CG-CD2 3.67Å; W115-D169 HydrophobicContact CH2-CB 4.26Å; W115-D169 HydrophobicContact CZ2-CB 4.46Å; W115-P198 HydrophobicContact CD2-CB 3.92Å; W115-P198 HydrophobicContact CG-CB 3.99Å; W115-P198 HydrophobicContact CG-CG 4.3Å; W115-P198 HydrophobicContact CZ2-CB 4.33Å; W115-S204 WeakPolarHBondContact CH2-O 3.3Å; W115-A238 PolarHBondContact NE1-O 3.45Å; W115-Y279 HydrophobicContact CB-CE1 4.17Å; W115-Y279 PolarHBondContact N-OH 3.22Å
116	K	88.4	Confident	76.4	Confident	177 Å²	177	63.8 Å²	63.8	77%	0.77	31%	0.314	S	S	*	.	S	Bend	trans	-75.5	-20	176.3	-65.4	173.5	-175.7	162.3	0	112.2	V114 E200	V114-K116 PolarHBondContact O-N 2.9Å; K116-E200 IonicContact NZ-OE1 3.55Å; K116-E200 PolarHBondContact NZ-OE1 3.28Å
117	K	89.9	Confident	79	Confident	85 Å²	85	58.2 Å²	58.2	37%	0.37	29%	0.294	S	S	.	.			trans	-103.1	156.9	178.9	63.8	-177.4	-177.9	173.9	0	111.4	W115 T119 L120 D169	W115-K117 VanDerWaalsContact C-N 3.27Å; K117-T119 WeakPolarHBondContact CD-O 3.4Å; K117-L120 HydrophobicContact CD-CD2 4.34Å; K117-L120 HydrophobicContact CG-CD2 3.8Å; K117-D169 WeakPolarHBondContact CE-OD1 3.43Å; K117-D169 WeakPolarHBondContact CE-OD2 3.5Å; K117-D169 IonicContact NZ-OD1 3.51Å; K117-D169 PolarHBondContact NZ-OD1 3.3Å; K117-D169 IonicContact NZ-OD2 3.93Å; K117-D169 PolarHBondContact NZ-OD2 3.42Å
118	R	90.5	Very high	81.4	Confident	110 Å²	110	50.8 Å²	50.8	42%	0.415	27%	0.268	S	S	.	.	S	Bend	trans	-98.7	-25.5	-178.9	-62.1	-62.4	178.5	104.2	-14.3	113.2	D154 L155 T156 Y279	R118-D154 IonicContact NH1-OD2 3.25Å; R118-D154 PolarHBondContact NH1-OD2 2.85Å; R118-L155 CarbonylContact O-C 3.48Å; R118-L155 VanDerWaalsContact O-CA 3.31Å; R118-L155 WeakPolarHBondContact O-CA 3.14Å; R118-T156 PolarHBondContact O-N 3.22Å; R118-Y279 VanDerWaalsContact CZ-O 3.31Å; R118-Y279 PolarHBondContact NH1-O 3.47Å; R118-Y279 PolarHBondContact NH2-O 3.18Å
119	T	94.2	Very high	83.7	Confident	71 Å²	71	57.2 Å²	57.2	44%	0.436	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	113.3	175	-53.9	0	0	0	0	108.8	K117 T156 H158	K117-T119 WeakPolarHBondContact CD-O 3.4Å; T119-T156 CarbonylContact C-O 3.59Å; T119-T156 WeakPolarHBondContact CA-O 3.3Å; T119-T156 PolarHBondContact OG1-OG1 3.17Å; T119-T156 VanDerWaalsContact OG1-OG1 3.06Å; T119-H158 WeakPolarHBondContact CG2-CD2 3.2Å
120	L	95.4	Very high	84.9	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.9	178.9	-60.4	178.1	0	0	0	109.7	W115 K117 T156 F157 H158 D169 L239	W115-L120 HydrophobicContact CB-CD2 3.96Å; W115-L120 HydrophobicContact CD2-CD2 3.83Å; W115-L120 HydrophobicContact CE3-CD2 4.28Å; W115-L120 HydrophobicContact CG-CD1 4.06Å; W115-L120 HydrophobicContact CG-CD2 3.67Å; K117-L120 HydrophobicContact CD-CD2 4.34Å; K117-L120 HydrophobicContact CG-CD2 3.8Å; L120-T156 PolarHBondContact N-O 3.36Å; L120-F157 HydrophobicContact CB-CD1 3.94Å; L120-F157 HydrophobicContact CB-CE1 4.09Å; L120-F157 HydrophobicContact CD1-CD1 4.43Å; L120-F157 HydrophobicContact CD1-CE1 3.72Å; L120-F157 HydrophobicContact CD1-CZ 4.4Å; L120-F157 HydrophobicContact CG-CE1 4.42Å; L120-F157 VanDerWaalsContact O-CA 3.32Å; L120-F157 WeakPolarHBondContact O-CA 3.48Å; L120-H158 PolarHBondContact O-N 2.76Å; L120-D169 WeakPolarHBondContact CA-OD2 3.36Å; L120-D169 HydrophobicContact CD2-CB 4.32Å; L120-L239 HydrophobicContact CD1-CD2 3.57Å
121	T	95.4	Very high	86.4	Confident	17 Å²	17	57.1 Å²	57.1	10%	0.104	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	143.2	174.6	52.8	0	0	0	0	110.5	H158 V160 P168 D169 I170	T121-H158 CarbonylContact C-O 3.57Å; T121-H158 VanDerWaalsContact CA-O 3.24Å; T121-H158 WeakPolarHBondContact CA-O 3.42Å; T121-V160 HydrophobicContact CG2-CG1 3.63Å; T121-P168 WeakPolarHBondContact OG1-CA 3.31Å; T121-D169 PolarHBondContact N-OD2 2.96Å; T121-D169 WeakPolarHBondContact O-CA 3.24Å; T121-D169 WeakPolarHBondContact O-CB 3.2Å; T121-D169 PolarHBondContact O-N 2.96Å; T121-D169 PolarHBondContact OG1-N 2.87Å; T121-D169 PolarHBondContact OG1-OD2 3.25Å; T121-I170 PolarHBondContact O-N 3.36Å
122	W	96.4	Very high	87.7	Confident	3 Å²	3	64.8 Å²	64.8	1%	0.011	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	157.6	179.4	66.1	-84.8	0	0	0	111.6	V124 M142 N143 L146 H158 E159 V160 I170 I172	W122-V124 HydrophobicContact CE3-CG2 4.46Å; W122-V124 HydrophobicContact CZ3-CG2 3.94Å; W122-M142 HydrophobicContact CH2-CB 4.31Å; W122-M142 HydrophobicContact CZ3-CB 3.93Å; W122-N143 HydrophobicContact CH2-CB 4.01Å; W122-N143 HydrophobicContact CZ2-CB 3.78Å; W122-L146 HydrophobicContact CB-CD1 3.98Å; W122-L146 VanDerWaalsContact CD1-CD1 3.49Å; W122-L146 HydrophobicContact CD2-CD1 3.57Å; W122-L146 HydrophobicContact CE3-CD1 4.27Å; W122-L146 HydrophobicContact CG-CD1 3.41Å; W122-L146 VanDerWaalsContact CG-CD1 3.41Å; W122-H158 VanDerWaalsContact CD1-C 3.46Å; W122-H158 PolarHBondContact N-O 3.3Å; W122-E159 HydrophobicContact CD2-CB 4.19Å; W122-E159 HydrophobicContact CD2-CG 4.12Å; W122-E159 HydrophobicContact CE3-CG 4.05Å; W122-E159 HydrophobicContact CH2-CB 4.09Å; W122-E159 VanDerWaalsContact CH2-CD 3.48Å; W122-E159 HydrophobicContact CH2-CG 3.81Å; W122-E159 HydrophobicContact CZ2-CB 3.62Å; W122-E159 HydrophobicContact CZ2-CG 3.86Å; W122-E159 HydrophobicContact CZ3-CG 3.91Å; W122-E159 VanDerWaalsContact O-CA 3.32Å; W122-E159 WeakPolarHBondContact O-CA 2.99Å; W122-V160 PolarHBondContact O-N 3.21Å; W122-I170 VanDerWaalsContact CA-O 3.26Å; W122-I170 WeakPolarHBondContact CA-O 3.19Å; W122-I170 HydrophobicContact CB-CB 4.06Å; W122-I172 HydrophobicContact CE3-CD1 3.82Å; W122-I172 HydrophobicContact CZ3-CD1 4.36Å
123	R	94.8	Very high	89.2	Confident	45 Å²	45	63 Å²	63	17%	0.17	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	141.5	176.2	-176.8	172.8	58.5	96.1	-6.1	111	V160 E167 P168 I170 L171 I172	R123-V160 HydrophobicContact CB-CG2 4.26Å; R123-V160 WeakPolarHBondContact CD-O 3.4Å; R123-E167 IonicContact NH2-OE2 3.03Å; R123-P168 HydrophobicContact CB-CB 4.18Å; R123-P168 HydrophobicContact CB-CG 3.97Å; R123-I170 PolarHBondContact N-O 2.62Å; R123-I170 VanDerWaalsContact N-O 3.1Å; R123-L171 HydrophobicContact CB-CD1 4.43Å; R123-I172 PolarHBondContact O-N 2.71Å
124	V	95.5	Very high	90.3	Very high	14 Å²	14	64.1 Å²	64.1	9%	0.085	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	117.8	168.2	-172.7	0	0	0	0	109.3	W122 S126 F127 R139 M142 I172	W122-V124 HydrophobicContact CE3-CG2 4.46Å; W122-V124 HydrophobicContact CZ3-CG2 3.94Å; V124-S126 WeakPolarHBondContact CG1-O 3.48Å; V124-F127 HydrophobicContact CB-CE1 4.11Å; V124-F127 HydrophobicContact CB-CZ 3.88Å; V124-F127 HydrophobicContact CG1-CD1 3.91Å; V124-F127 HydrophobicContact CG1-CD2 4.37Å; V124-F127 HydrophobicContact CG1-CE1 3.52Å; V124-F127 HydrophobicContact CG1-CE2 4.02Å; V124-F127 HydrophobicContact CG1-CG 4.32Å; V124-F127 HydrophobicContact CG1-CZ 3.58Å; V124-R139 HydrophobicContact CG2-CG 4.22Å; V124-M142 HydrophobicContact CG2-CG 4.24Å; V124-I172 HydrophobicContact CG1-CG2 4.48Å; V124-I172 HydrophobicContact CG2-CB 4.39Å; V124-I172 HydrophobicContact CG2-CD1 4.17Å
125	R	93.1	Very high	90.7	Very high	118 Å²	118	67 Å²	67	45%	0.445	32%	0.323	S	S	.	.			trans	-84.1	-45.6	178.5	179.5	170.4	68.5	-166	4.4	111.7	L171 I172 D173	R125-L171 HydrophobicContact CB-CD1 3.95Å; R125-L171 HydrophobicContact CB-CG 4.14Å; R125-L171 VanDerWaalsContact NH1-CD2 3.29Å; R125-I172 PolarHBondContact N-O 2.71Å; R125-D173 IonicContact CZ-OD1 2.67Å; R125-D173 IonicContact CZ-OD2 3.8Å; R125-D173 VanDerWaalsContact NE-CG 3.26Å; R125-D173 IonicContact NE-OD1 3.79Å; R125-D173 PolarHBondContact NE-OD1 3.04Å; R125-D173 IonicContact NE-OD2 3.52Å; R125-D173 PolarHBondContact NE-OD2 2.86Å; R125-D173 IonicContact NH2-OD1 3.09Å; R125-D173 IonicContact NH2-OD2 3.44Å; R125-D173 PolarHBondContact NH2-OD2 2.92Å
126	S	94.1	Very high	90.8	Very high	31 Å²	31	71.5 Å²	71.5	22%	0.217	35%	0.346	C	S	.	.			trans	-133.7	166.3	179.8	63.3	0	0	0	0	110.5	V124 D173 F174	V124-S126 WeakPolarHBondContact CG1-O 3.48Å; S126-D173 VanDerWaalsContact CB-OD1 3.27Å; S126-D173 WeakPolarHBondContact CB-OD1 3.44Å; S126-D173 VanDerWaalsContact OG-CG 3.25Å; S126-D173 PolarHBondContact OG-OD1 2.96Å; S126-F174 WeakPolarHBondContact O-CD2 3.2Å; S126-F174 PolarHBondContact OG-N 3.06Å; S126-F174 PolarHBondContact OG-O 2.92Å
127	F	95.1	Very high	91	Very high	44 Å²	44	65.4 Å²	65.4	19%	0.193	32%	0.323	C	S	.	.			trans	-128.7	151.6	-174.6	-69.2	-85.4	0	0	0	109.3	V124 Q129 Q135 V138 R139	V124-F127 HydrophobicContact CB-CE1 4.11Å; V124-F127 HydrophobicContact CB-CZ 3.88Å; V124-F127 HydrophobicContact CG1-CD1 3.91Å; V124-F127 HydrophobicContact CG1-CD2 4.37Å; V124-F127 HydrophobicContact CG1-CE1 3.52Å; V124-F127 HydrophobicContact CG1-CE2 4.02Å; V124-F127 HydrophobicContact CG1-CG 4.32Å; V124-F127 HydrophobicContact CG1-CZ 3.58Å; F127-Q129 PolarHBondContact O-N 3.06Å; F127-Q135 HydrophobicContact CB-CG 4.14Å; F127-Q135 HydrophobicContact CD1-CB 3.78Å; F127-Q135 HydrophobicContact CD1-CG 3.79Å; F127-Q135 HydrophobicContact CD2-CB 4.41Å; F127-Q135 HydrophobicContact CD2-CG 3.87Å; F127-Q135 HydrophobicContact CE1-CB 3.68Å; F127-Q135 HydrophobicContact CE1-CG 4.13Å; F127-Q135 WeakPolarHBondContact CE1-O 3.4Å; F127-Q135 HydrophobicContact CE2-CB 4.33Å; F127-Q135 HydrophobicContact CE2-CG 4.21Å; F127-Q135 HydrophobicContact CG-CB 4.15Å; F127-Q135 HydrophobicContact CG-CG 3.65Å; F127-Q135 HydrophobicContact CZ-CB 3.97Å; F127-Q135 HydrophobicContact CZ-CG 4.33Å; F127-V138 HydrophobicContact CD1-CB 3.89Å; F127-V138 HydrophobicContact CD1-CG1 3.86Å; F127-V138 HydrophobicContact CD1-CG2 4.33Å; F127-V138 HydrophobicContact CE1-CB 4.09Å; F127-V138 HydrophobicContact CE1-CG1 4.05Å; F127-R139 HydrophobicContact CE1-CG 3.93Å; F127-R139 HydrophobicContact CZ-CG 4.06Å
128	P	93	Very high	91.3	Very high	10 Å²	10	61.3 Å²	61.3	7%	0.065	31%	0.306	C	S	.	.			trans	-63.6	123.4	-176.8	26.2	-32.7	0	0	0	110	V138 F174 D211 W215	P128-V138 HydrophobicContact CG-CG2 3.96Å; P128-F174 HydrophobicContact CB-CD1 3.61Å; P128-F174 HydrophobicContact CB-CE1 3.82Å; P128-F174 HydrophobicContact CB-CG 4.21Å; P128-F174 HydrophobicContact CG-CD1 4.06Å; P128-F174 HydrophobicContact CG-CE1 3.83Å; P128-F174 HydrophobicContact CG-CZ 4.15Å; P128-D211 WeakPolarHBondContact CA-OD1 3.22Å; P128-W215 HydrophobicContact CB-CB 4.5Å; P128-W215 HydrophobicContact CB-CG 4.4Å
129	Q	87.3	Confident	91.4	Very high	155 Å²	155	60.9 Å²	60.9	72%	0.724	30%	0.304	S	S	*	.	S	Bend	trans	-86.2	-26.9	-174.2	-61.6	-169.4	-10.5	0	0	112.7	F127 D211	F127-Q129 PolarHBondContact O-N 3.06Å; Q129-D211 PolarHBondContact N-OD1 3.23Å
130	S	73.3	Confident	91.3	Very high	65 Å²	65	60.1 Å²	60.1	46%	0.455	30%	0.299	S	S	.	.	S	Bend	trans	-92.6	-5.6	-177	56.9	0	0	0	0	112.7	D211	S130-D211 PolarHBondContact OG-O 2.83Å
131	S	81.9	Confident	91.3	Very high	21 Å²	21	60.2 Å²	60.2	15%	0.147	30%	0.3	C	S	.	.	S	Bend	trans	-94.8	154.2	-174.8	178.8	0	0	0	0	112.9	L133 W215	S131-L133 VanDerWaalsContact C-N 3.25Å; S131-L133 WeakPolarHBondContact OG-CB 3.48Å; S131-L133 VanDerWaalsContact OG-CG 3.26Å; S131-L133 WeakPolarHBondContact OG-CG 3.37Å; S131-L133 PolarHBondContact OG-N 2.87Å; S131-W215 PolarHBondContact OG-O 3.35Å
132	Q	84.6	Confident	91.4	Very high	202 Å²	202	59.4 Å²	59.4	94%	0.944	30%	0.295	S	S	*	.	S	Bend	trans	-81.9	-2.8	170	-59.9	-176.5	23.5	0	0	112.9
133	L	90.1	Very high	91.2	Very high	30 Å²	30	61.4 Å²	61.4	16%	0.157	31%	0.306	C	S	.	.			trans	-72.2	129.4	-179.5	-63.2	176.1	0	0	0	110.8	S131 T137 V138 W215 F217 L227	S131-L133 VanDerWaalsContact C-N 3.25Å; S131-L133 WeakPolarHBondContact OG-CB 3.48Å; S131-L133 VanDerWaalsContact OG-CG 3.26Å; S131-L133 WeakPolarHBondContact OG-CG 3.37Å; S131-L133 PolarHBondContact OG-N 2.87Å; L133-T137 HydrophobicContact CD2-CG2 3.99Å; L133-V138 HydrophobicContact CB-CG2 3.98Å; L133-W215 HydrophobicContact CD1-CB 4.1Å; L133-F217 HydrophobicContact CD2-CB 3.88Å; L133-L227 HydrophobicContact CD1-CB 4.07Å; L133-L227 HydrophobicContact CD1-CD2 3.71Å
134	S	92.6	Very high	91.2	Very high	58 Å²	58	62.5 Å²	62.5	41%	0.406	31%	0.31	S	S	.	.			trans	-69.9	154.3	172.8	80.1	0	0	0	0	110.9	E136 T137 V138	S134-E136 PolarHBondContact O-N 3.31Å; S134-T137 WeakPolarHBondContact O-CB 3.49Å; S134-T137 PolarHBondContact O-N 3.41Å; S134-T137 WeakPolarHBondContact OG-CB 3.26Å; S134-T137 PolarHBondContact OG-N 2.95Å; S134-T137 PolarHBondContact OG-OG1 2.9Å; S134-V138 PolarHBondContact O-N 3.33Å
135	Q	92.5	Very high	91.3	Very high	122 Å²	122	61.9 Å²	61.9	57%	0.57	31%	0.306	S	S	*	.	H	α-helix	trans	-56.2	-39	176	-62.4	-174.1	5.8	0	0	112	F127 V138 R139	F127-Q135 HydrophobicContact CB-CG 4.14Å; F127-Q135 HydrophobicContact CD1-CB 3.78Å; F127-Q135 HydrophobicContact CD1-CG 3.79Å; F127-Q135 HydrophobicContact CD2-CB 4.41Å; F127-Q135 HydrophobicContact CD2-CG 3.87Å; F127-Q135 HydrophobicContact CE1-CB 3.68Å; F127-Q135 HydrophobicContact CE1-CG 4.13Å; F127-Q135 WeakPolarHBondContact CE1-O 3.4Å; F127-Q135 HydrophobicContact CE2-CB 4.33Å; F127-Q135 HydrophobicContact CE2-CG 4.21Å; F127-Q135 HydrophobicContact CG-CB 4.15Å; F127-Q135 HydrophobicContact CG-CG 3.65Å; F127-Q135 HydrophobicContact CZ-CB 3.97Å; F127-Q135 HydrophobicContact CZ-CG 4.33Å; Q135-V138 PolarHBondContact O-N 3.03Å; Q135-R139 WeakPolarHBondContact O-CG 3.36Å; Q135-R139 PolarHBondContact O-N 2.89Å
136	E	88.6	Confident	91.5	Very high	123 Å²	123	56.2 Å²	56.2	58%	0.575	29%	0.285	S	S	*	.	H	α-helix	trans	-62.9	-45.5	175.7	-175	61.5	-164.5	0	0	111.3	S134 V138 R139 V140	S134-E136 PolarHBondContact O-N 3.31Å; E136-V138 VanDerWaalsContact C-N 3.32Å; E136-V138 PolarHBondContact O-N 3.28Å; E136-R139 PolarHBondContact O-N 3.5Å; E136-V140 HydrophobicContact CG-CG2 4.5Å; E136-V140 WeakPolarHBondContact O-CB 3.34Å; E136-V140 VanDerWaalsContact O-CG2 3.26Å; E136-V140 WeakPolarHBondContact O-CG2 3.36Å; E136-V140 PolarHBondContact O-N 3.36Å
137	T	92.4	Very high	91.3	Very high	49 Å²	49	58.9 Å²	58.9	30%	0.301	30%	0.295	S	S	.	.	H	α-helix	trans	-58	-46.7	175.4	-53.3	0	0	0	0	110.9	L133 S134 R139 V140 L141	L133-T137 HydrophobicContact CD2-CG2 3.99Å; S134-T137 WeakPolarHBondContact O-CB 3.49Å; S134-T137 PolarHBondContact O-N 3.41Å; S134-T137 WeakPolarHBondContact OG-CB 3.26Å; S134-T137 PolarHBondContact OG-N 2.95Å; S134-T137 PolarHBondContact OG-OG1 2.9Å; T137-R139 PolarHBondContact O-N 3.01Å; T137-V140 PolarHBondContact O-N 3.26Å; T137-L141 HydrophobicContact CG2-CD1 4.09Å; T137-L141 HydrophobicContact CG2-CG 4.32Å; T137-L141 VanDerWaalsContact O-CG 3.25Å; T137-L141 WeakPolarHBondContact O-CG 3.42Å; T137-L141 PolarHBondContact O-N 3.05Å
138	V	96	Very high	91.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-58.4	-49.8	177.5	173	0	0	0	0	110.9	F127 P128 L133 S134 Q135 E136 V140 L141 M142 F174 L227	F127-V138 HydrophobicContact CD1-CB 3.89Å; F127-V138 HydrophobicContact CD1-CG1 3.86Å; F127-V138 HydrophobicContact CD1-CG2 4.33Å; F127-V138 HydrophobicContact CE1-CB 4.09Å; F127-V138 HydrophobicContact CE1-CG1 4.05Å; P128-V138 HydrophobicContact CG-CG2 3.96Å; L133-V138 HydrophobicContact CB-CG2 3.98Å; S134-V138 PolarHBondContact O-N 3.33Å; Q135-V138 PolarHBondContact O-N 3.03Å; E136-V138 VanDerWaalsContact C-N 3.32Å; E136-V138 PolarHBondContact O-N 3.28Å; V138-V140 VanDerWaalsContact C-N 3.33Å; V138-V140 PolarHBondContact O-N 2.82Å; V138-L141 PolarHBondContact O-N 2.91Å; V138-M142 HydrophobicContact CG1-CE 4.1Å; V138-M142 HydrophobicContact CG1-CG 4.3Å; V138-M142 VanDerWaalsContact O-CG 3.27Å; V138-M142 WeakPolarHBondContact O-CG 3.44Å; V138-M142 PolarHBondContact O-N 3.39Å; V138-F174 HydrophobicContact CG1-CE2 3.89Å; V138-F174 HydrophobicContact CG1-CZ 3.96Å; V138-L227 HydrophobicContact CB-CD2 4.46Å; V138-L227 HydrophobicContact CG1-CD2 4.21Å; V138-L227 HydrophobicContact CG2-CD2 3.94Å
139	R	93.3	Very high	91.3	Very high	100 Å²	100	56.6 Å²	56.6	38%	0.377	29%	0.285	S	S	.	.	H	α-helix	trans	-58.5	-44.2	178.3	-69.9	175.3	73.9	160.3	-5.2	112.2	V124 F127 Q135 E136 T137 M142 N143 E159	V124-R139 HydrophobicContact CG2-CG 4.22Å; F127-R139 HydrophobicContact CE1-CG 3.93Å; F127-R139 HydrophobicContact CZ-CG 4.06Å; Q135-R139 WeakPolarHBondContact O-CG 3.36Å; Q135-R139 PolarHBondContact O-N 2.89Å; E136-R139 PolarHBondContact O-N 3.5Å; T137-R139 PolarHBondContact O-N 3.01Å; R139-M142 PolarHBondContact O-N 2.59Å; R139-N143 WeakPolarHBondContact O-CB 3.09Å; R139-N143 PolarHBondContact O-N 2.83Å; R139-E159 IonicContact CZ-OE1 2.77Å; R139-E159 IonicContact CZ-OE2 3Å; R139-E159 IonicContact NE-OE1 2.72Å; R139-E159 PolarHBondContact NE-OE1 2.86Å; R139-E159 IonicContact NE-OE2 3.02Å; R139-E159 PolarHBondContact NE-OE2 3.01Å; R139-E159 IonicContact NH2-OE1 2.86Å; R139-E159 PolarHBondContact NH2-OE1 3.03Å; R139-E159 IonicContact NH2-OE2 3.01Å; R139-E159 PolarHBondContact NH2-OE2 3Å
140	V	91.3	Very high	91.5	Very high	55 Å²	55	49.8 Å²	49.8	33%	0.333	26%	0.257	S	S	.	.	H	α-helix	trans	-60.6	-45.9	176.7	169.6	0	0	0	0	111	E136 T137 V138 N143 Y144	E136-V140 HydrophobicContact CG-CG2 4.5Å; E136-V140 WeakPolarHBondContact O-CB 3.34Å; E136-V140 VanDerWaalsContact O-CG2 3.26Å; E136-V140 WeakPolarHBondContact O-CG2 3.36Å; E136-V140 PolarHBondContact O-N 3.36Å; T137-V140 PolarHBondContact O-N 3.26Å; V138-V140 VanDerWaalsContact C-N 3.33Å; V138-V140 PolarHBondContact O-N 2.82Å; V140-N143 PolarHBondContact O-N 2.81Å; V140-Y144 HydrophobicContact CG1-CD2 3.62Å; V140-Y144 HydrophobicContact CG1-CE2 3.51Å; V140-Y144 WeakPolarHBondContact O-CD2 3.25Å; V140-Y144 PolarHBondContact O-N 2.66Å
141	L	96.4	Very high	92.2	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-41.7	178.1	-65.1	177.7	0	0	0	112.2	T137 V138 Y144 A145 F217 L227 F228 P262	T137-L141 HydrophobicContact CG2-CD1 4.09Å; T137-L141 HydrophobicContact CG2-CG 4.32Å; T137-L141 VanDerWaalsContact O-CG 3.25Å; T137-L141 WeakPolarHBondContact O-CG 3.42Å; T137-L141 PolarHBondContact O-N 3.05Å; V138-L141 PolarHBondContact O-N 2.91Å; L141-Y144 PolarHBondContact O-N 3.03Å; L141-A145 WeakPolarHBondContact O-CB 3.4Å; L141-A145 PolarHBondContact O-N 3.03Å; L141-F217 HydrophobicContact CD1-CB 3.73Å; L141-F217 HydrophobicContact CD1-CD1 4.46Å; L141-F217 HydrophobicContact CD1-CD2 4.04Å; L141-F217 HydrophobicContact CD1-CG 3.81Å; L141-F217 HydrophobicContact CD2-CD1 4.13Å; L141-F217 HydrophobicContact CD2-CD2 3.61Å; L141-F217 HydrophobicContact CD2-CE1 4.13Å; L141-F217 HydrophobicContact CD2-CE2 3.62Å; L141-F217 HydrophobicContact CD2-CG 3.87Å; L141-F217 HydrophobicContact CD2-CZ 3.88Å; L141-F217 HydrophobicContact CG-CD2 4.48Å; L141-F217 HydrophobicContact CG-CG 4.46Å; L141-L227 HydrophobicContact CD1-CB 4.37Å; L141-L227 HydrophobicContact CD1-CD2 4.32Å; L141-F228 HydrophobicContact CD2-CB 4.18Å; L141-F228 HydrophobicContact CD2-CD2 4.42Å; L141-P262 HydrophobicContact CD2-CG 3.97Å
142	M	97.7	Very high	92.5	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62	-44.5	175.6	-64.7	-56.5	159.3	0	0	111.4	W122 V124 V138 R139 Y144 A145 L146 I172 F174 F209 L227 A231 F235	W122-M142 HydrophobicContact CH2-CB 4.31Å; W122-M142 HydrophobicContact CZ3-CB 3.93Å; V124-M142 HydrophobicContact CG2-CG 4.24Å; V138-M142 HydrophobicContact CG1-CE 4.1Å; V138-M142 HydrophobicContact CG1-CG 4.3Å; V138-M142 VanDerWaalsContact O-CG 3.27Å; V138-M142 WeakPolarHBondContact O-CG 3.44Å; V138-M142 PolarHBondContact O-N 3.39Å; R139-M142 PolarHBondContact O-N 2.59Å; M142-Y144 PolarHBondContact O-N 3.24Å; M142-A145 PolarHBondContact O-N 3.3Å; M142-L146 WeakPolarHBondContact O-CG 3.17Å; M142-L146 PolarHBondContact O-N 2.94Å; M142-I172 HydrophobicContact CB-CD1 4.05Å; M142-I172 HydrophobicContact CE-CG2 4.33Å; M142-I172 HydrophobicContact CG-CD1 3.98Å; M142-I172 HydrophobicContact SD-CD1 4.17Å; M142-I172 HydrophobicContact SD-CG2 4.24Å; M142-F174 HydrophobicContact CE-CE2 4.25Å; M142-F174 HydrophobicContact CE-CZ 3.82Å; M142-F209 HydrophobicContact CE-CD2 4.43Å; M142-F209 HydrophobicContact CE-CE1 4.35Å; M142-F209 HydrophobicContact CE-CE2 3.83Å; M142-F209 HydrophobicContact CE-CZ 3.79Å; M142-F209 HydrophobicContact SD-CE2 4.15Å; M142-F209 HydrophobicContact SD-CZ 4.04Å; M142-L227 HydrophobicContact CE-CD1 3.7Å; M142-L227 HydrophobicContact CE-CD2 3.89Å; M142-L227 HydrophobicContact CE-CG 3.83Å; M142-A231 HydrophobicContact CE-CB 4.18Å; M142-A231 HydrophobicContact SD-CB 3.75Å; M142-F235 HydrophobicContact CB-CE2 4.42Å; M142-F235 HydrophobicContact CB-CZ 4.42Å; M142-F235 HydrophobicContact SD-CE2 3.9Å; M142-F235 HydrophobicContact SD-CZ 3.64Å
143	N	92.8	Very high	92.6	Very high	45 Å²	45	42.7 Å²	42.7	24%	0.241	22%	0.216	C	C	.	.	H	α-helix	trans	-58.7	-49.2	175.4	175.2	72.8	0	0	0	111.6	W122 R139 V140 A145 L146 M147	W122-N143 HydrophobicContact CH2-CB 4.01Å; W122-N143 HydrophobicContact CZ2-CB 3.78Å; R139-N143 WeakPolarHBondContact O-CB 3.09Å; R139-N143 PolarHBondContact O-N 2.83Å; V140-N143 PolarHBondContact O-N 2.81Å; N143-A145 VanDerWaalsContact C-N 3.31Å; N143-A145 PolarHBondContact O-N 2.88Å; N143-L146 PolarHBondContact O-N 2.9Å; N143-M147 WeakPolarHBondContact ND2-CE 3.36Å; N143-M147 PolarHBondContact ND2-SD 3.13Å; N143-M147 VanDerWaalsContact ND2-SD 3.42Å; N143-M147 WeakPolarHBondContact O-CB 3.47Å; N143-M147 VanDerWaalsContact O-CG 3.3Å; N143-M147 WeakPolarHBondContact O-CG 3.34Å; N143-M147 PolarHBondContact O-N 3.03Å; N143-M147 WeakPolarHBondContact OD1-CE 3.31Å
144	Y	94.1	Very high	92.4	Very high	68 Å²	68	44 Å²	44	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-62.9	-37.6	177.6	-83.3	-66.4	0	0	0	112.9	V140 L141 M142 M147 A148 P262 D263	V140-Y144 HydrophobicContact CG1-CD2 3.62Å; V140-Y144 HydrophobicContact CG1-CE2 3.51Å; V140-Y144 WeakPolarHBondContact O-CD2 3.25Å; V140-Y144 PolarHBondContact O-N 2.66Å; L141-Y144 PolarHBondContact O-N 3.03Å; M142-Y144 PolarHBondContact O-N 3.24Å; Y144-M147 PolarHBondContact O-N 2.86Å; Y144-A148 PolarHBondContact O-N 3.29Å; Y144-P262 HydrophobicContact CD1-CB 4.11Å; Y144-P262 HydrophobicContact CD2-CB 3.97Å; Y144-P262 HydrophobicContact CG-CB 3.67Å; Y144-D263 WeakPolarHBondContact CE1-OD1 3.27Å; Y144-D263 PolarHBondContact OH-OD1 3.1Å
145	A	97.7	Very high	92.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-41.8	179.4	0	0	0	0	0	111.2	L141 M142 N143 A148 W149 F228 A231 V232 F235	L141-A145 WeakPolarHBondContact O-CB 3.4Å; L141-A145 PolarHBondContact O-N 3.03Å; M142-A145 PolarHBondContact O-N 3.3Å; N143-A145 VanDerWaalsContact C-N 3.31Å; N143-A145 PolarHBondContact O-N 2.88Å; A145-A148 WeakPolarHBondContact O-CB 3.33Å; A145-A148 PolarHBondContact O-N 3.09Å; A145-W149 VanDerWaalsContact O-CD1 3.29Å; A145-F228 HydrophobicContact CB-CD2 4.2Å; A145-F228 HydrophobicContact CB-CE2 4.05Å; A145-A231 HydrophobicContact CB-CB 3.84Å; A145-V232 HydrophobicContact CB-CG2 3.7Å; A145-F235 HydrophobicContact CB-CD2 3.71Å; A145-F235 HydrophobicContact CB-CE2 3.8Å
146	L	96.1	Very high	92.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-41.9	172.3	-69	168.2	0	0	0	112	W122 M142 N143 A148 W149 G150 F157 I170 F235	W122-L146 HydrophobicContact CB-CD1 3.98Å; W122-L146 VanDerWaalsContact CD1-CD1 3.49Å; W122-L146 HydrophobicContact CD2-CD1 3.57Å; W122-L146 HydrophobicContact CE3-CD1 4.27Å; W122-L146 HydrophobicContact CG-CD1 3.41Å; W122-L146 VanDerWaalsContact CG-CD1 3.41Å; M142-L146 WeakPolarHBondContact O-CG 3.17Å; M142-L146 PolarHBondContact O-N 2.94Å; N143-L146 PolarHBondContact O-N 2.9Å; L146-A148 VanDerWaalsContact C-N 3.26Å; L146-A148 PolarHBondContact O-N 3.4Å; L146-W149 PolarHBondContact O-N 3.41Å; L146-W149 VanDerWaalsContact O-N 3.11Å; L146-G150 PolarHBondContact O-N 2.84Å; L146-F157 HydrophobicContact CB-CB 4.15Å; L146-F157 HydrophobicContact CB-CD1 4.08Å; L146-F157 HydrophobicContact CB-CD2 3.97Å; L146-F157 HydrophobicContact CB-CE1 4.47Å; L146-F157 HydrophobicContact CB-CE2 4.39Å; L146-F157 HydrophobicContact CB-CG 3.8Å; L146-F157 HydrophobicContact CD1-CB 4.37Å; L146-F157 HydrophobicContact CD1-CD1 4.26Å; L146-F157 HydrophobicContact CD1-CG 4.44Å; L146-F157 HydrophobicContact CD2-CD1 3.75Å; L146-F157 HydrophobicContact CD2-CE1 3.71Å; L146-F157 HydrophobicContact CD2-CG 4.36Å; L146-F157 HydrophobicContact CD2-CZ 4.31Å; L146-F157 HydrophobicContact CG-CD1 4.25Å; L146-F157 HydrophobicContact CG-CG 4.42Å; L146-F157 VanDerWaalsContact O-CE2 3.25Å; L146-F157 WeakPolarHBondContact O-CE2 3.25Å; L146-I170 HydrophobicContact CD2-CD1 4.14Å; L146-F235 HydrophobicContact CD1-CE2 4.34Å; L146-F235 HydrophobicContact CD2-CB 3.97Å; L146-F235 HydrophobicContact CD2-CD1 3.89Å; L146-F235 HydrophobicContact CD2-CD2 3.54Å; L146-F235 HydrophobicContact CD2-CE1 4.27Å; L146-F235 HydrophobicContact CD2-CE2 3.94Å; L146-F235 HydrophobicContact CD2-CG 3.52Å; L146-F235 HydrophobicContact CD2-CZ 4.3Å; L146-F235 HydrophobicContact CG-CD2 3.63Å; L146-F235 HydrophobicContact CG-CE2 3.66Å; L146-F235 HydrophobicContact CG-CG 4.16Å; L146-F235 HydrophobicContact CG-CZ 4.21Å
147	M	90	Very high	92.8	Very high	87 Å²	87	34 Å²	34	43%	0.429	17%	0.174	S	C	.	.	H	α-helix	trans	-60.1	-33.6	176.3	-76.8	-176.9	172.8	0	0	112.8	N143 Y144 W149 G150 M151	N143-M147 WeakPolarHBondContact ND2-CE 3.36Å; N143-M147 PolarHBondContact ND2-SD 3.13Å; N143-M147 VanDerWaalsContact ND2-SD 3.42Å; N143-M147 WeakPolarHBondContact O-CB 3.47Å; N143-M147 VanDerWaalsContact O-CG 3.3Å; N143-M147 WeakPolarHBondContact O-CG 3.34Å; N143-M147 PolarHBondContact O-N 3.03Å; N143-M147 WeakPolarHBondContact OD1-CE 3.31Å; Y144-M147 PolarHBondContact O-N 2.86Å; M147-W149 PolarHBondContact O-N 2.95Å; M147-G150 PolarHBondContact O-N 2.95Å; M147-G150 VanDerWaalsContact O-N 3.14Å; M147-M151 WeakPolarHBondContact O-CG 2.88Å; M147-M151 PolarHBondContact O-N 2.93Å
148	A	93.8	Very high	92.8	Very high	5 Å²	5	36.5 Å²	36.5	4%	0.041	18%	0.182	C	C	.	.	H	α-helix	trans	-57.5	-36.5	175.9	0	0	0	0	0	112.4	Y144 A145 L146 Y265 L267	Y144-A148 PolarHBondContact O-N 3.29Å; A145-A148 WeakPolarHBondContact O-CB 3.33Å; A145-A148 PolarHBondContact O-N 3.09Å; L146-A148 VanDerWaalsContact C-N 3.26Å; L146-A148 PolarHBondContact O-N 3.4Å; A148-Y265 HydrophobicContact CB-CD1 3.86Å; A148-Y265 HydrophobicContact CB-CE1 4.06Å; A148-L267 WeakPolarHBondContact O-CD1 3.43Å
149	W	95.5	Very high	92.7	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-79.9	-39.2	173.3	-61.6	106.6	0	0	0	112.3	A145 L146 M147 M151 E152 S153 V232 L239 L241 I250 M251 L267 D271 L275	A145-W149 VanDerWaalsContact O-CD1 3.29Å; L146-W149 PolarHBondContact O-N 3.41Å; L146-W149 VanDerWaalsContact O-N 3.11Å; M147-W149 PolarHBondContact O-N 2.95Å; W149-M151 PolarHBondContact O-N 2.8Å; W149-E152 PolarHBondContact O-N 2.82Å; W149-S153 PolarHBondContact O-N 2.82Å; W149-S153 PolarHBondContact O-OG 3.27Å; W149-V232 HydrophobicContact CZ2-CG1 4.25Å; W149-V232 VanDerWaalsContact CZ2-O 3.3Å; W149-V232 WeakPolarHBondContact CZ2-O 2.83Å; W149-V232 PolarHBondContact NE1-O 3.44Å; W149-L239 HydrophobicContact CB-CD1 3.49Å; W149-L239 VanDerWaalsContact CB-CD1 3.49Å; W149-L239 HydrophobicContact CD2-CD1 4.11Å; W149-L239 HydrophobicContact CG-CD1 3.61Å; W149-L241 HydrophobicContact CE3-CD1 3.84Å; W149-L241 HydrophobicContact CH2-CD1 3.45Å; W149-L241 VanDerWaalsContact CH2-CD1 3.45Å; W149-L241 HydrophobicContact CZ2-CD1 4.3Å; W149-L241 HydrophobicContact CZ3-CD1 3.17Å; W149-I250 HydrophobicContact CH2-CG2 4.04Å; W149-I250 HydrophobicContact CZ2-CG2 3.9Å; W149-M251 HydrophobicContact CH2-CG 4.08Å; W149-M251 HydrophobicContact CH2-SD 4.1Å; W149-M251 HydrophobicContact CZ2-CG 4.5Å; W149-M251 HydrophobicContact CZ2-SD 3.94Å; W149-L267 HydrophobicContact CD2-CD1 3.91Å; W149-L267 HydrophobicContact CD2-CD2 4.22Å; W149-L267 HydrophobicContact CE3-CD1 3.29Å; W149-L267 HydrophobicContact CE3-CD2 4.12Å; W149-L267 HydrophobicContact CE3-CG 4.37Å; W149-L267 HydrophobicContact CH2-CD1 4.33Å; W149-L267 HydrophobicContact CH2-CD2 3.91Å; W149-L267 HydrophobicContact CZ2-CD2 4.02Å; W149-L267 HydrophobicContact CZ3-CD1 3.52Å; W149-L267 HydrophobicContact CZ3-CD2 3.95Å; W149-L267 HydrophobicContact CZ3-CG 4.39Å; W149-D271 HydrophobicContact CH2-CB 4.02Å; W149-D271 HydrophobicContact CZ3-CB 4.12Å; W149-L275 HydrophobicContact CB-CD2 4.47Å; W149-L275 HydrophobicContact CE3-CB 4.24Å; W149-L275 HydrophobicContact CE3-CD1 3.84Å; W149-L275 HydrophobicContact CE3-CD2 3.85Å; W149-L275 HydrophobicContact CE3-CG 4.18Å; W149-L275 HydrophobicContact CZ3-CB 4.25Å; W149-L275 HydrophobicContact CZ3-CD1 4.46Å; W149-L275 VanDerWaalsContact O-CD2 3.32Å; W149-L275 WeakPolarHBondContact O-CD2 3.25Å
150	G	91.9	Very high	92.6	Very high	13 Å²	13	36.2 Å²	36.2	13%	0.134	19%	0.187	C	C	.	.	H	α-helix	trans	-60.3	-42.2	178.1	0	0	0	0	0	113.2	L146 M147 E152 S153 L155	L146-G150 PolarHBondContact O-N 2.84Å; M147-G150 PolarHBondContact O-N 2.95Å; M147-G150 VanDerWaalsContact O-N 3.14Å; G150-E152 PolarHBondContact O-N 3.08Å; G150-S153 CarbonylContact O-C 3.44Å; G150-S153 PolarHBondContact O-N 3.23Å; G150-L155 WeakPolarHBondContact CA-O 3.4Å
151	M	87.4	Confident	92	Very high	99 Å²	99	37.9 Å²	37.9	49%	0.488	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.7	-179.9	-74.1	-173.1	-68.1	0	0	114.1	M147 W149	M147-M151 WeakPolarHBondContact O-CG 2.88Å; M147-M151 PolarHBondContact O-N 2.93Å; W149-M151 PolarHBondContact O-N 2.8Å
152	E	86.9	Confident	90.7	Very high	33 Å²	33	41.5 Å²	41.5	15%	0.154	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	2.7	-175.7	-62.7	-71.1	-179.6	0	0	112.6	W149 G150 L267 R272 L275 Q276	W149-E152 PolarHBondContact O-N 2.82Å; G150-E152 PolarHBondContact O-N 3.08Å; E152-L267 HydrophobicContact CB-CD1 4.14Å; E152-L267 HydrophobicContact CG-CB 4.46Å; E152-L267 HydrophobicContact CG-CD1 4.01Å; E152-L267 HydrophobicContact CG-CG 4.44Å; E152-R272 HydrophobicContact CB-CG 4.26Å; E152-R272 IonicContact OE1-NH1 3.91Å; E152-R272 WeakPolarHBondContact OE2-CD 3.39Å; E152-R272 IonicContact OE2-NH1 3.54Å; E152-L275 HydrophobicContact CB-CD2 4.14Å; E152-Q276 WeakPolarHBondContact O-CG 3.23Å; E152-Q276 PolarHBondContact O-NE2 3.14Å
153	S	87.6	Confident	89	Confident	6 Å²	6	45.9 Å²	45.9	4%	0.042	25%	0.249	C	C	.	.	S	Bend	trans	-142.9	-174.7	-178.6	66.9	0	0	0	0	112.2	W149 G150 L155 A282	W149-S153 PolarHBondContact O-N 2.82Å; W149-S153 PolarHBondContact O-OG 3.27Å; G150-S153 CarbonylContact O-C 3.44Å; G150-S153 PolarHBondContact O-N 3.23Å; S153-L155 VanDerWaalsContact C-N 3.31Å; S153-L155 PolarHBondContact OG-N 2.91Å; S153-A282 WeakPolarHBondContact O-CB 3.47Å
154	D	85.9	Confident	87.7	Confident	57 Å²	57	50.6 Å²	50.6	31%	0.305	27%	0.27	S	S	.	.	S	Bend	trans	-92.8	12.9	172.9	-82.4	-27.9	0	0	0	113	R118 A282 P283	R118-D154 IonicContact NH1-OD2 3.25Å; R118-D154 PolarHBondContact NH1-OD2 2.85Å; D154-A282 WeakPolarHBondContact OD1-CA 3.3Å; D154-P283 WeakPolarHBondContact OD1-CD 3.45Å
155	L	92.6	Very high	86.4	Confident	6 Å²	6	50.9 Å²	50.9	3%	0.031	29%	0.293	C	S	.	.			trans	-81.7	134.5	-178.9	-63.7	178.1	0	0	0	110.6	R118 G150 S153 F157 L239 Y279	R118-L155 CarbonylContact O-C 3.48Å; R118-L155 VanDerWaalsContact O-CA 3.31Å; R118-L155 WeakPolarHBondContact O-CA 3.14Å; G150-L155 WeakPolarHBondContact CA-O 3.4Å; S153-L155 VanDerWaalsContact C-N 3.31Å; S153-L155 PolarHBondContact OG-N 2.91Å; L155-F157 HydrophobicContact CB-CE2 3.93Å; L155-F157 HydrophobicContact CB-CZ 3.97Å; L155-F157 HydrophobicContact CD1-CZ 4.25Å; L155-L239 HydrophobicContact CD1-CD1 4.17Å; L155-L239 HydrophobicContact CD1-CD2 3.6Å; L155-L239 HydrophobicContact CD1-CG 4.43Å; L155-Y279 HydrophobicContact CD1-CD1 4.14Å; L155-Y279 HydrophobicContact CD1-CD2 3.79Å; L155-Y279 HydrophobicContact CD1-CE1 4.24Å; L155-Y279 HydrophobicContact CD1-CE2 3.91Å; L155-Y279 HydrophobicContact CD1-CG 3.92Å; L155-Y279 HydrophobicContact CD2-CD1 3.8Å; L155-Y279 HydrophobicContact CD2-CE1 4.09Å; L155-Y279 HydrophobicContact CD2-CG 4.21Å; L155-Y279 HydrophobicContact CG-CD1 4.22Å; L155-Y279 HydrophobicContact CG-CD2 4.47Å; L155-Y279 HydrophobicContact CG-CG 4.12Å
156	T	93.3	Very high	85.4	Confident	62 Å²	62	55.6 Å²	55.6	38%	0.38	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.8	171.9	61.5	0	0	0	0	110.2	R118 T119 L120	R118-T156 PolarHBondContact O-N 3.22Å; T119-T156 CarbonylContact C-O 3.59Å; T119-T156 WeakPolarHBondContact CA-O 3.3Å; T119-T156 PolarHBondContact OG1-OG1 3.17Å; T119-T156 VanDerWaalsContact OG1-OG1 3.06Å; L120-T156 PolarHBondContact N-O 3.36Å
157	F	95.4	Very high	84.9	Confident	25 Å²	25	62.2 Å²	62.2	11%	0.11	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.1	-175.6	-60.6	-84.9	0	0	0	109.8	L120 L146 L155 I170 L239	L120-F157 HydrophobicContact CB-CD1 3.94Å; L120-F157 HydrophobicContact CB-CE1 4.09Å; L120-F157 HydrophobicContact CD1-CD1 4.43Å; L120-F157 HydrophobicContact CD1-CE1 3.72Å; L120-F157 HydrophobicContact CD1-CZ 4.4Å; L120-F157 HydrophobicContact CG-CE1 4.42Å; L120-F157 VanDerWaalsContact O-CA 3.32Å; L120-F157 WeakPolarHBondContact O-CA 3.48Å; L146-F157 HydrophobicContact CB-CB 4.15Å; L146-F157 HydrophobicContact CB-CD1 4.08Å; L146-F157 HydrophobicContact CB-CD2 3.97Å; L146-F157 HydrophobicContact CB-CE1 4.47Å; L146-F157 HydrophobicContact CB-CE2 4.39Å; L146-F157 HydrophobicContact CB-CG 3.8Å; L146-F157 HydrophobicContact CD1-CB 4.37Å; L146-F157 HydrophobicContact CD1-CD1 4.26Å; L146-F157 HydrophobicContact CD1-CG 4.44Å; L146-F157 HydrophobicContact CD2-CD1 3.75Å; L146-F157 HydrophobicContact CD2-CE1 3.71Å; L146-F157 HydrophobicContact CD2-CG 4.36Å; L146-F157 HydrophobicContact CD2-CZ 4.31Å; L146-F157 HydrophobicContact CG-CD1 4.25Å; L146-F157 HydrophobicContact CG-CG 4.42Å; L146-F157 VanDerWaalsContact O-CE2 3.25Å; L146-F157 WeakPolarHBondContact O-CE2 3.25Å; L155-F157 HydrophobicContact CB-CE2 3.93Å; L155-F157 HydrophobicContact CB-CZ 3.97Å; L155-F157 HydrophobicContact CD1-CZ 4.25Å; F157-I170 HydrophobicContact CE1-CD1 4.37Å; F157-L239 HydrophobicContact CE1-CD2 4.1Å; F157-L239 HydrophobicContact CZ-CD1 4.06Å; F157-L239 HydrophobicContact CZ-CD2 4.01Å
158	H	93.4	Very high	85	Confident	102 Å²	102	58.8 Å²	58.8	47%	0.472	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	124.8	179	-66.3	-85.5	0	0	0	110.6	T119 L120 T121 W122	T119-H158 WeakPolarHBondContact CG2-CD2 3.2Å; L120-H158 PolarHBondContact O-N 2.76Å; T121-H158 CarbonylContact C-O 3.57Å; T121-H158 VanDerWaalsContact CA-O 3.24Å; T121-H158 WeakPolarHBondContact CA-O 3.42Å; W122-H158 VanDerWaalsContact CD1-C 3.46Å; W122-H158 PolarHBondContact N-O 3.3Å
159	E	93.3	Very high	85	Confident	73 Å²	73	59.7 Å²	59.7	34%	0.341	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	133.7	172.7	-161.8	177.7	-163.8	0	0	109.5	W122 R139	W122-E159 HydrophobicContact CD2-CB 4.19Å; W122-E159 HydrophobicContact CD2-CG 4.12Å; W122-E159 HydrophobicContact CE3-CG 4.05Å; W122-E159 HydrophobicContact CH2-CB 4.09Å; W122-E159 VanDerWaalsContact CH2-CD 3.48Å; W122-E159 HydrophobicContact CH2-CG 3.81Å; W122-E159 HydrophobicContact CZ2-CB 3.62Å; W122-E159 HydrophobicContact CZ2-CG 3.86Å; W122-E159 HydrophobicContact CZ3-CG 3.91Å; W122-E159 VanDerWaalsContact O-CA 3.32Å; W122-E159 WeakPolarHBondContact O-CA 2.99Å; R139-E159 IonicContact CZ-OE1 2.77Å; R139-E159 IonicContact CZ-OE2 3Å; R139-E159 IonicContact NE-OE1 2.72Å; R139-E159 PolarHBondContact NE-OE1 2.86Å; R139-E159 IonicContact NE-OE2 3.02Å; R139-E159 PolarHBondContact NE-OE2 3.01Å; R139-E159 IonicContact NH2-OE1 2.86Å; R139-E159 PolarHBondContact NH2-OE1 3.03Å; R139-E159 IonicContact NH2-OE2 3.01Å; R139-E159 PolarHBondContact NH2-OE2 3Å
160	V	91.8	Very high	85	Confident	22 Å²	22	59.7 Å²	59.7	13%	0.133	34%	0.335	C	S	.	.			trans	-113.8	144.1	176.9	-65.7	0	0	0	0	111.1	T121 W122 R123 P168	T121-V160 HydrophobicContact CG2-CG1 3.63Å; W122-V160 PolarHBondContact O-N 3.21Å; R123-V160 HydrophobicContact CB-CG2 4.26Å; R123-V160 WeakPolarHBondContact CD-O 3.4Å; V160-P168 HydrophobicContact CG2-CB 3.89Å
161	D	78.9	Confident	85.2	Confident	90 Å²	90	59.6 Å²	59.6	48%	0.481	33%	0.331	S	S	.	.			trans	-86.9	139.5	176.8	-172.2	-0.1	0	0	0	111.1	S163 Q164	D161-S163 PolarHBondContact O-N 2.8Å; D161-S163 VanDerWaalsContact O-N 3.16Å; D161-S163 PolarHBondContact OD1-N 3.48Å; D161-S163 PolarHBondContact OD2-OG 3.28Å; D161-Q164 PolarHBondContact O-N 2.79Å; D161-Q164 VanDerWaalsContact O-N 3.16Å
162	S	67.9	Low	85.7	Confident	79 Å²	79	54.9 Å²	54.9	55%	0.552	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-48.9	-31.8	169	61.1	0	0	0	0	114.1	Q164 G165	S162-Q164 PolarHBondContact O-N 3.36Å; S162-Q164 VanDerWaalsContact O-N 3.16Å; S162-G165 PolarHBondContact O-N 2.94Å
163	S	63.7	Low	86.1	Confident	91 Å²	91	54.1 Å²	54.1	64%	0.636	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-63.7	-18.5	-179	63.9	0	0	0	0	114	D161	D161-S163 PolarHBondContact O-N 2.8Å; D161-S163 VanDerWaalsContact O-N 3.16Å; D161-S163 PolarHBondContact OD1-N 3.48Å; D161-S163 PolarHBondContact OD2-OG 3.28Å
164	Q	64	Low	86.5	Confident	145 Å²	145	54.4 Å²	54.4	68%	0.678	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-90.9	-2.3	-178.4	-58.5	-149.5	-17	0	0	114.1	D161 S162 Q166	D161-Q164 PolarHBondContact O-N 2.79Å; D161-Q164 VanDerWaalsContact O-N 3.16Å; S162-Q164 PolarHBondContact O-N 3.36Å; S162-Q164 VanDerWaalsContact O-N 3.16Å; Q164-Q166 PolarHBondContact O-N 2.93Å
165	G	67.1	Low	86.7	Confident	73 Å²	73	52.1 Å²	52.1	75%	0.753	30%	0.295	S	S	*	.			trans	62.7	9.7	176.6	0	0	0	0	0	115	S162	S162-G165 PolarHBondContact O-N 2.94Å
166	Q	77.4	Confident	86.4	Confident	100 Å²	100	57 Å²	57	47%	0.467	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-91	125.4	177.4	-178.6	178.5	-12	0	0	109.6	Q164	Q164-Q166 PolarHBondContact O-N 2.93Å
167	E	84.9	Confident	85.8	Confident	139 Å²	139	55.5 Å²	55.5	65%	0.65	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-71	132.5	170.4	-68.7	-64.2	173.8	0	0	110.4	R123	R123-E167 IonicContact NH2-OE2 3.03Å
168	P	92.4	Very high	84.5	Confident	15 Å²	15	60.6 Å²	60.6	10%	0.097	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-73.5	166.3	176.8	35.2	-37.9	0	0	0	111.2	T121 R123 V160 L171	T121-P168 WeakPolarHBondContact OG1-CA 3.31Å; R123-P168 HydrophobicContact CB-CB 4.18Å; R123-P168 HydrophobicContact CB-CG 3.97Å; V160-P168 HydrophobicContact CG2-CB 3.89Å; P168-L171 HydrophobicContact CG-CB 4.14Å; P168-L171 HydrophobicContact CG-CD1 3.68Å
169	D	93.2	Very high	83.6	Confident	23 Å²	23	56.8 Å²	56.8	12%	0.123	31%	0.311	C	S	.	.	S	Bend	trans	-75.9	-28.1	169.2	-59.5	-57.5	0	0	0	113.4	W115 K117 L120 T121 S204	W115-D169 HydrophobicContact CH2-CB 4.26Å; W115-D169 HydrophobicContact CZ2-CB 4.46Å; K117-D169 WeakPolarHBondContact CE-OD1 3.43Å; K117-D169 WeakPolarHBondContact CE-OD2 3.5Å; K117-D169 IonicContact NZ-OD1 3.51Å; K117-D169 PolarHBondContact NZ-OD1 3.3Å; K117-D169 IonicContact NZ-OD2 3.93Å; K117-D169 PolarHBondContact NZ-OD2 3.42Å; L120-D169 WeakPolarHBondContact CA-OD2 3.36Å; L120-D169 HydrophobicContact CD2-CB 4.32Å; T121-D169 PolarHBondContact N-OD2 2.96Å; T121-D169 WeakPolarHBondContact O-CA 3.24Å; T121-D169 WeakPolarHBondContact O-CB 3.2Å; T121-D169 PolarHBondContact O-N 2.96Å; T121-D169 PolarHBondContact OG1-N 2.87Å; T121-D169 PolarHBondContact OG1-OD2 3.25Å; D169-S204 VanDerWaalsContact O-O 3.1Å
170	I	96.3	Very high	82.4	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	102.3	-179.2	-61.1	175	0	0	0	107	T121 W122 R123 L146 F157 I172 G205 F235 A238	T121-I170 PolarHBondContact O-N 3.36Å; W122-I170 VanDerWaalsContact CA-O 3.26Å; W122-I170 WeakPolarHBondContact CA-O 3.19Å; W122-I170 HydrophobicContact CB-CB 4.06Å; R123-I170 PolarHBondContact N-O 2.62Å; R123-I170 VanDerWaalsContact N-O 3.1Å; L146-I170 HydrophobicContact CD2-CD1 4.14Å; F157-I170 HydrophobicContact CE1-CD1 4.37Å; I170-I172 HydrophobicContact CG2-CG1 4.18Å; I170-G205 WeakPolarHBondContact CG2-O 3.31Å; I170-F235 HydrophobicContact CG2-CD1 4.27Å; I170-F235 HydrophobicContact CG2-CE1 3.93Å; I170-A238 HydrophobicContact CD1-CB 4.26Å
171	L	95.3	Very high	81.1	Confident	11 Å²	11	61.6 Å²	61.6	6%	0.058	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.6	170.6	-163.8	64.2	0	0	0	109.6	R123 R125 P168 D206 T207	R123-L171 HydrophobicContact CB-CD1 4.43Å; R125-L171 HydrophobicContact CB-CD1 3.95Å; R125-L171 HydrophobicContact CB-CG 4.14Å; R125-L171 VanDerWaalsContact NH1-CD2 3.29Å; P168-L171 HydrophobicContact CG-CB 4.14Å; P168-L171 HydrophobicContact CG-CD1 3.68Å; L171-D206 HydrophobicContact CB-CB 4.48Å; L171-D206 WeakPolarHBondContact CB-OD1 3.11Å; L171-D206 PolarHBondContact N-OD1 3.46Å; L171-D206 WeakPolarHBondContact O-CA 3.47Å; L171-T207 PolarHBondContact O-N 3.29Å
172	I	97.9	Very high	80.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124.3	-179.4	-63.3	155.6	0	0	0	109	W122 R123 V124 R125 M142 I170 F174 T207 F209 F235	W122-I172 HydrophobicContact CE3-CD1 3.82Å; W122-I172 HydrophobicContact CZ3-CD1 4.36Å; R123-I172 PolarHBondContact O-N 2.71Å; V124-I172 HydrophobicContact CG1-CG2 4.48Å; V124-I172 HydrophobicContact CG2-CB 4.39Å; V124-I172 HydrophobicContact CG2-CD1 4.17Å; R125-I172 PolarHBondContact N-O 2.71Å; M142-I172 HydrophobicContact CB-CD1 4.05Å; M142-I172 HydrophobicContact CE-CG2 4.33Å; M142-I172 HydrophobicContact CG-CD1 3.98Å; M142-I172 HydrophobicContact SD-CD1 4.17Å; M142-I172 HydrophobicContact SD-CG2 4.24Å; I170-I172 HydrophobicContact CG2-CG1 4.18Å; I172-F174 HydrophobicContact CG2-CE2 4.29Å; I172-T207 WeakPolarHBondContact CA-O 3.28Å; I172-F209 HydrophobicContact CG2-CD2 3.99Å; I172-F209 HydrophobicContact CG2-CE2 3.69Å; I172-F235 HydrophobicContact CD1-CE1 3.93Å; I172-F235 HydrophobicContact CD1-CZ 3.51Å; I172-F235 HydrophobicContact CG1-CE1 3.85Å; I172-F235 HydrophobicContact CG1-CZ 3.89Å
173	D	95.7	Very high	79.7	Confident	18 Å²	18	61.5 Å²	61.5	10%	0.096	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140.3	-179	-152.4	48.1	0	0	0	112.3	R125 S126 T207 H208 F209	R125-D173 IonicContact CZ-OD1 2.67Å; R125-D173 IonicContact CZ-OD2 3.8Å; R125-D173 VanDerWaalsContact NE-CG 3.26Å; R125-D173 IonicContact NE-OD1 3.79Å; R125-D173 PolarHBondContact NE-OD1 3.04Å; R125-D173 IonicContact NE-OD2 3.52Å; R125-D173 PolarHBondContact NE-OD2 2.86Å; R125-D173 IonicContact NH2-OD1 3.09Å; R125-D173 IonicContact NH2-OD2 3.44Å; R125-D173 PolarHBondContact NH2-OD2 2.92Å; S126-D173 VanDerWaalsContact CB-OD1 3.27Å; S126-D173 WeakPolarHBondContact CB-OD1 3.44Å; S126-D173 VanDerWaalsContact OG-CG 3.25Å; S126-D173 PolarHBondContact OG-OD1 2.96Å; D173-T207 PolarHBondContact N-O 3.24Å; D173-H208 CarbonylContact O-C 3.59Å; D173-H208 VanDerWaalsContact O-CA 3.31Å; D173-H208 WeakPolarHBondContact O-CA 3.44Å; D173-F209 PolarHBondContact O-N 2.98Å
174	F	96.1	Very high	79.8	Confident	12 Å²	12	60.6 Å²	60.6	5%	0.053	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	105.3	168.4	-70.8	-98.5	0	0	0	107.2	S126 P128 V138 M142 I172 F209 D211 W215 L227	S126-F174 WeakPolarHBondContact O-CD2 3.2Å; S126-F174 PolarHBondContact OG-N 3.06Å; S126-F174 PolarHBondContact OG-O 2.92Å; P128-F174 HydrophobicContact CB-CD1 3.61Å; P128-F174 HydrophobicContact CB-CE1 3.82Å; P128-F174 HydrophobicContact CB-CG 4.21Å; P128-F174 HydrophobicContact CG-CD1 4.06Å; P128-F174 HydrophobicContact CG-CE1 3.83Å; P128-F174 HydrophobicContact CG-CZ 4.15Å; V138-F174 HydrophobicContact CG1-CE2 3.89Å; V138-F174 HydrophobicContact CG1-CZ 3.96Å; M142-F174 HydrophobicContact CE-CE2 4.25Å; M142-F174 HydrophobicContact CE-CZ 3.82Å; I172-F174 HydrophobicContact CG2-CE2 4.29Å; F174-F209 CarbonylContact C-O 3.54Å; F174-F209 WeakPolarHBondContact CA-O 3.49Å; F174-F209 HydrophobicContact CD1-CB 3.69Å; F174-F209 HydrophobicContact CD1-CG 4.47Å; F174-F209 HydrophobicContact CE1-CB 3.75Å; F174-F209 HydrophobicContact CE1-CG 4.1Å; F174-F209 HydrophobicContact CE2-CD2 4.45Å; F174-F209 HydrophobicContact CG-CB 4.26Å; F174-F209 HydrophobicContact CZ-CB 4.37Å; F174-F209 HydrophobicContact CZ-CD2 4.29Å; F174-F209 HydrophobicContact CZ-CG 4.3Å; F174-D211 HydrophobicContact CB-CB 4.03Å; F174-W215 AromaticContact CD1-CD1 3.99Å; F174-W215 AromaticContact CD1-NE1 3.78Å; F174-W215 AromaticContact CE1-CD1 3.9Å; F174-W215 HydrophobicContact CE1-CD2 4.4Å; F174-W215 HydrophobicContact CE1-CG 4.22Å; F174-W215 AromaticContact CE1-NE1 3.85Å; F174-L227 HydrophobicContact CE1-CD1 3.82Å; F174-L227 HydrophobicContact CE1-CD2 4.36Å; F174-L227 HydrophobicContact CZ-CD1 3.83Å; F174-L227 HydrophobicContact CZ-CD2 3.97Å
175	A	89.3	Confident	80.6	Confident	9 Å²	9	54.2 Å²	54.2	7%	0.074	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	159.2	-170.2	0	0	0	0	0	110.4	H179 F185 F209 D210 D211	A175-H179 HydrophobicContact CB-CB 3.42Å; A175-H179 VanDerWaalsContact CB-CB 3.42Å; A175-F185 HydrophobicContact CB-CE2 4.35Å; A175-F185 WeakPolarHBondContact O-CD2 3.45Å; A175-F209 PolarHBondContact N-O 3.45Å; A175-D210 CarbonylContact O-C 3.53Å; A175-D210 WeakPolarHBondContact O-CA 3.48Å; A175-D211 PolarHBondContact O-N 3.11Å
176	R	87	Confident	81.1	Confident	108 Å²	108	54.8 Å²	54.8	41%	0.408	28%	0.276	S	S	.	.			trans	-119.1	143.8	-178.1	-60.4	-172.2	-176.6	178	2.6	110.5	F178 D211 E212	R176-F178 CarbonylContact O-C 3.48Å; R176-F178 PolarHBondContact O-N 3.38Å; R176-D211 HydrophobicContact CG-CB 3.72Å; R176-D211 IonicContact CZ-OD2 3.55Å; R176-D211 IonicContact NE-OD2 3.49Å; R176-D211 PolarHBondContact NE-OD2 3.31Å; R176-D211 IonicContact NH2-OD2 2.8Å; R176-D211 PolarHBondContact NH2-OD2 2.87Å; R176-E212 HydrophobicContact CB-CG 4.1Å; R176-E212 HydrophobicContact CG-CG 3.8Å
177	A	80.3	Confident	81.1	Confident	31 Å²	31	50.4 Å²	50.4	26%	0.256	26%	0.257	S	S	.	.	S	Bend	trans	44.6	-124.9	174.5	0	0	0	0	0	112.1	H179 P184 F185	A177-H179 PolarHBondContact O-ND1 3.08Å; A177-P184 CarbonylContact O-C 3.58Å; A177-P184 WeakPolarHBondContact O-CA 3.32Å; A177-F185 WeakPolarHBondContact CA-O 3.33Å; A177-F185 PolarHBondContact O-N 3.24Å
178	F	68.4	Low	81.1	Confident	132 Å²	132	49.9 Å²	49.9	58%	0.579	26%	0.258	S	S	*	.			trans	-78.2	122.1	172.5	179.1	-98.4	0	0	0	111.3	R176 D181 P184	R176-F178 CarbonylContact O-C 3.48Å; R176-F178 PolarHBondContact O-N 3.38Å; F178-D181 WeakPolarHBondContact CE2-O 3.36Å; F178-P184 HydrophobicContact CB-CB 4.29Å; F178-P184 HydrophobicContact CD2-CB 4.5Å
179	H	74.8	Confident	80.6	Confident	22 Å²	22	50.4 Å²	50.4	10%	0.102	27%	0.266	C	S	.	.			trans	-131.5	45.9	-174.4	52.2	-84.2	0	0	0	112.3	A175 A177 D181 Y183 F185 H194 H208	A175-H179 HydrophobicContact CB-CB 3.42Å; A175-H179 VanDerWaalsContact CB-CB 3.42Å; A177-H179 PolarHBondContact O-ND1 3.08Å; H179-D181 VanDerWaalsContact C-N 3.29Å; H179-D181 IonicContact CD2-OD1 3.32Å; H179-D181 IonicContact CD2-OD2 3.62Å; H179-D181 PolarHBondContact CD2-OD2 3.22Å; H179-D181 IonicContact CE1-OD1 3.53Å; H179-D181 IonicContact NE2-OD1 2.65Å; H179-D181 IonicContact NE2-OD2 3.49Å; H179-D181 PolarHBondContact NE2-OD2 3.39Å; H179-D181 VanDerWaalsContact NE2-OD2 3.08Å; H179-D181 PolarHBondContact O-N 3.43Å; H179-Y183 PolarHBondContact CE1-O 3.12Å; H179-Y183 VanDerWaalsContact CE1-O 3.28Å; H179-F185 AromaticContact CE1-CD2 3.35Å; H179-F185 WeakPolarHBondContact CE1-CD2 3.36Å; H179-F185 AromaticContact CE1-CE2 3.21Å; H179-F185 WeakPolarHBondContact CE1-CE2 3.44Å; H179-F185 AromaticContact CE1-CG 3.88Å; H179-F185 AromaticContact CE1-CZ 3.62Å; H179-F185 AromaticContact ND1-CD2 3.62Å; H179-F185 AromaticContact ND1-CE2 3.78Å; H179-F185 AromaticContact NE2-CE2 3.67Å; H179-F185 AromaticContact NE2-CZ 3.87Å; H179-H194 AromaticContact CE1-CE1 3.5Å; H179-H194 AromaticContact NE2-CE1 3.22Å; H179-H194 PolarHBondContact NE2-CE1 3.39Å; H179-H194 AromaticContact NE2-NE2 3.39Å; H179-H194 PolarHBondContact NE2-NE2 3.08Å; H179-H208 AromaticContact CD2-CE1 3.75Å; H179-H208 AromaticContact CD2-CG 3.72Å; H179-H208 AromaticContact CD2-ND1 3.12Å; H179-H208 PolarHBondContact CD2-ND1 3.23Å; H179-H208 AromaticContact NE2-CG 3.61Å; H179-H208 AromaticContact NE2-ND1 3.08Å; H179-H208 PolarHBondContact NE2-ND1 2.81Å
180	Q	68.6	Low	80.3	Confident	181 Å²	181	50.4 Å²	50.4	85%	0.846	27%	0.271	S	S	*	.	S	Bend	trans	68.6	22.2	171.6	-49.3	178.4	26.3	0	0	114.9
181	D	64.4	Low	79.9	Confident	15 Å²	15	50.5 Å²	50.5	8%	0.08	27%	0.272	C	S	.	.	S	Bend	trans	-128.9	-178.6	169.4	72.5	20	0	0	0	112.3	F178 H179 Y183 H194 F196 I203 H208	F178-D181 WeakPolarHBondContact CE2-O 3.36Å; H179-D181 VanDerWaalsContact C-N 3.29Å; H179-D181 IonicContact CD2-OD1 3.32Å; H179-D181 IonicContact CD2-OD2 3.62Å; H179-D181 PolarHBondContact CD2-OD2 3.22Å; H179-D181 IonicContact CE1-OD1 3.53Å; H179-D181 IonicContact NE2-OD1 2.65Å; H179-D181 IonicContact NE2-OD2 3.49Å; H179-D181 PolarHBondContact NE2-OD2 3.39Å; H179-D181 VanDerWaalsContact NE2-OD2 3.08Å; H179-D181 PolarHBondContact O-N 3.43Å; D181-Y183 VanDerWaalsContact C-N 3.27Å; D181-Y183 PolarHBondContact O-N 2.8Å; D181-Y183 WeakPolarHBondContact OD1-CA 3.24Å; D181-Y183 PolarHBondContact OD1-N 3.46Å; D181-H194 IonicContact OD2-CD2 2.69Å; D181-H194 IonicContact OD2-CE1 2.78Å; D181-H194 IonicContact OD2-NE2 3.64Å; D181-H194 PolarHBondContact OD2-NE2 2.82Å; D181-F196 HydrophobicContact CB-CE2 4.28Å; D181-F196 HydrophobicContact CB-CZ 3.7Å; D181-F196 WeakPolarHBondContact OD2-CE2 3.39Å; D181-F196 WeakPolarHBondContact OD2-CZ 3.4Å; D181-I203 HydrophobicContact CB-CD1 4.02Å; D181-H208 IonicContact OD2-CE1 3.22Å; D181-H208 PolarHBondContact OD2-CE1 2.93Å; D181-H208 VanDerWaalsContact OD2-CE1 3.31Å; D181-H208 IonicContact OD2-ND1 3.34Å; D181-H208 PolarHBondContact OD2-ND1 3.15Å
182	S	57.5	Low	79.9	Confident	91 Å²	91	50.2 Å²	50.2	64%	0.636	27%	0.271	S	S	*	.	S	Bend	trans	-81.6	2.2	-178.7	56.3	0	0	0	0	114.7
183	Y	60.5	Low	79.8	Confident	76 Å²	76	50.2 Å²	50.2	30%	0.298	27%	0.271	S	S	.	.			trans	-126.8	74.3	-171.1	-67.5	-81.8	0	0	0	110.8	L92 H179 D181 H194 F196	L92-Y183 HydrophobicContact CD2-CE1 4.21Å; L92-Y183 HydrophobicContact CD2-CE2 4.46Å; H179-Y183 PolarHBondContact CE1-O 3.12Å; H179-Y183 VanDerWaalsContact CE1-O 3.28Å; D181-Y183 VanDerWaalsContact C-N 3.27Å; D181-Y183 PolarHBondContact O-N 2.8Å; D181-Y183 WeakPolarHBondContact OD1-CA 3.24Å; D181-Y183 PolarHBondContact OD1-N 3.46Å; Y183-H194 VanDerWaalsContact CB-CE1 3.41Å; Y183-H194 WeakPolarHBondContact CB-CE1 3.41Å; Y183-H194 PolarHBondContact O-CE1 3.48Å; Y183-F196 HydrophobicContact CD2-CE1 4Å; Y183-F196 HydrophobicContact CD2-CZ 4.15Å; Y183-F196 HydrophobicContact CE2-CE1 4.14Å
184	P	64.9	Low	79.6	Confident	71 Å²	71	49.4 Å²	49.4	46%	0.461	27%	0.266	S	S	.	.			trans	-66.8	143.9	179.5	29.4	-35.3	0	0	0	111.8	A177 F178	A177-P184 CarbonylContact O-C 3.58Å; A177-P184 WeakPolarHBondContact O-CA 3.32Å; F178-P184 HydrophobicContact CB-CB 4.29Å; F178-P184 HydrophobicContact CD2-CB 4.5Å
185	F	80.3	Confident	79.4	Confident	11 Å²	11	48.8 Å²	48.8	5%	0.048	26%	0.264	C	S	.	.			trans	-75.4	157	169.4	-61.4	-47.7	0	0	0	112.3	A175 A177 H179 T191 H194 H208 F209 D210	A175-F185 HydrophobicContact CB-CE2 4.35Å; A175-F185 WeakPolarHBondContact O-CD2 3.45Å; A177-F185 WeakPolarHBondContact CA-O 3.33Å; A177-F185 PolarHBondContact O-N 3.24Å; H179-F185 AromaticContact CE1-CD2 3.35Å; H179-F185 WeakPolarHBondContact CE1-CD2 3.36Å; H179-F185 AromaticContact CE1-CE2 3.21Å; H179-F185 WeakPolarHBondContact CE1-CE2 3.44Å; H179-F185 AromaticContact CE1-CG 3.88Å; H179-F185 AromaticContact CE1-CZ 3.62Å; H179-F185 AromaticContact ND1-CD2 3.62Å; H179-F185 AromaticContact ND1-CE2 3.78Å; H179-F185 AromaticContact NE2-CE2 3.67Å; H179-F185 AromaticContact NE2-CZ 3.87Å; F185-T191 HydrophobicContact CD1-CG2 3.78Å; F185-T191 HydrophobicContact CE1-CG2 4.18Å; F185-H194 AromaticContact CE1-CE1 3.63Å; F185-H194 AromaticContact CE1-ND1 3.36Å; F185-H194 WeakPolarHBondContact CE1-ND1 3.14Å; F185-H194 AromaticContact CZ-CE1 3.69Å; F185-H194 AromaticContact CZ-ND1 3.79Å; F185-H208 HydrophobicContact CE2-CB 4.06Å; F185-H208 HydrophobicContact CZ-CB 3.72Å; F185-H208 WeakPolarHBondContact CZ-O 3.45Å; F185-F209 VanDerWaalsContact CE2-C 3.48Å; F185-F209 WeakPolarHBondContact CE2-O 3.27Å; F185-D210 HydrophobicContact CB-CB 3.94Å; F185-D210 VanDerWaalsContact CB-CG 3.48Å; F185-D210 WeakPolarHBondContact CB-OD2 3.29Å; F185-D210 HydrophobicContact CD1-CB 3.93Å; F185-D210 HydrophobicContact CD2-CB 3.63Å; F185-D210 HydrophobicContact CE1-CB 4.36Å; F185-D210 HydrophobicContact CE2-CB 4.07Å; F185-D210 HydrophobicContact CG-CB 3.56Å; F185-D210 HydrophobicContact CZ-CB 4.43Å
186	D	77.7	Confident	79	Confident	86 Å²	86	49.9 Å²	49.9	46%	0.46	27%	0.267	S	S	.	.			trans	-109.2	5.6	-175.2	52.2	-0.6	0	0	0	114.2	T191	D186-T191 VanDerWaalsContact CG-OG1 3.28Å; D186-T191 WeakPolarHBondContact OD1-CA 3.44Å; D186-T191 WeakPolarHBondContact OD1-CB 3.33Å; D186-T191 PolarHBondContact OD1-N 2.96Å; D186-T191 PolarHBondContact OD1-OG1 3.32Å; D186-T191 VanDerWaalsContact OD1-OG1 3.05Å; D186-T191 PolarHBondContact OD2-OG1 3.41Å; D186-T191 VanDerWaalsContact OD2-OG1 3.06Å
187	G	78.4	Confident	78.8	Confident	7 Å²	7	46.6 Å²	46.6	7%	0.072	26%	0.255	C	S	.	.	S	Bend	trans	91.5	-157.7	177.2	0	0	0	0	0	111.6	G189 D210	G187-G189 PolarHBondContact O-N 3.43Å; G187-G189 VanDerWaalsContact O-N 3.12Å; G187-D210 WeakPolarHBondContact CA-OD2 3.24Å; G187-D210 PolarHBondContact N-OD2 3.41Å
188	L	83.8	Confident	79	Confident	129 Å²	129	45.4 Å²	45.4	68%	0.675	25%	0.245	S	C	*	.	S	Bend	trans	-58.3	118.8	-175.5	-172.9	74.1	0	0	0	112.9	E212	L188-E212 WeakPolarHBondContact CD1-O 3.27Å
189	G	81.8	Confident	79.5	Confident	25 Å²	25	40.6 Å²	40.6	26%	0.258	23%	0.232	S	C	.	.	S	Bend	trans	73.3	170.4	-175.3	0	0	0	0	0	112.7	G187 T191 E213	G187-G189 PolarHBondContact O-N 3.43Å; G187-G189 VanDerWaalsContact O-N 3.12Å; G189-T191 PolarHBondContact O-N 2.89Å; G189-E213 WeakPolarHBondContact CA-OE1 3.38Å; G189-E213 PolarHBondContact N-OE1 2.96Å
190	G	87.3	Confident	79.2	Confident	23 Å²	23	47.8 Å²	47.8	24%	0.237	27%	0.266	C	S	.	.	S	Bend	trans	87.4	-97	-176.5	0	0	0	0	0	110.4	P88 R89	P88-G190 CarbonylContact C-O 2.77Å; P88-G190 VanDerWaalsContact CA-O 3.23Å; P88-G190 WeakPolarHBondContact CA-O 3.28Å; R89-G190 PolarHBondContact N-O 3.3Å
191	T	87.8	Confident	79.4	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.018	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-96.6	111.1	-178.1	-51.4	0	0	0	0	111	R89 F185 D186 G189	R89-T191 WeakPolarHBondContact O-CA 3.35Å; F185-T191 HydrophobicContact CD1-CG2 3.78Å; F185-T191 HydrophobicContact CE1-CG2 4.18Å; D186-T191 VanDerWaalsContact CG-OG1 3.28Å; D186-T191 WeakPolarHBondContact OD1-CA 3.44Å; D186-T191 WeakPolarHBondContact OD1-CB 3.33Å; D186-T191 PolarHBondContact OD1-N 2.96Å; D186-T191 PolarHBondContact OD1-OG1 3.32Å; D186-T191 VanDerWaalsContact OD1-OG1 3.05Å; D186-T191 PolarHBondContact OD2-OG1 3.41Å; D186-T191 VanDerWaalsContact OD2-OG1 3.06Å; G189-T191 PolarHBondContact O-N 2.89Å
192	L	95.1	Very high	79.9	Confident	5 Å²	5	50.1 Å²	50.1	3%	0.026	29%	0.287	C	S	.	.			trans	-82.7	-41.2	-175.4	-60.4	-177.8	0	0	0	113.2	P88 R89 D210 E213 W215 T225 V230 Y255	P88-L192 HydrophobicContact CB-CD1 3.91Å; P88-L192 HydrophobicContact CB-CD2 3.71Å; P88-L192 HydrophobicContact CB-CG 3.84Å; R89-L192 PolarHBondContact O-N 3.08Å; L192-D210 WeakPolarHBondContact O-CB 3.43Å; L192-D210 PolarHBondContact O-N 3.33Å; L192-E213 HydrophobicContact CD2-CG 3.86Å; L192-E213 VanDerWaalsContact CD2-OE1 3.26Å; L192-E213 WeakPolarHBondContact CD2-OE1 3.39Å; L192-W215 HydrophobicContact CB-CH2 4.37Å; L192-W215 WeakPolarHBondContact O-CZ2 3.32Å; L192-T225 HydrophobicContact CD1-CG2 3.78Å; L192-T225 HydrophobicContact CD2-CG2 3.9Å; L192-T225 HydrophobicContact CG-CG2 4.36Å; L192-V230 HydrophobicContact CB-CG1 4.38Å; L192-V230 HydrophobicContact CD1-CG2 3.91Å; L192-Y255 HydrophobicContact CD1-CD1 4.41Å; L192-Y255 HydrophobicContact CD1-CD2 3.92Å; L192-Y255 HydrophobicContact CD1-CG 3.72Å
193	A	96.1	Very high	80.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	171.7	-172	0	0	0	0	0	110.6	S91 H208 F209 V230 E234	S91-A193 PolarHBondContact N-O 3.35Å; S91-A193 VanDerWaalsContact N-O 3.11Å; A193-H208 CarbonylContact C-O 3.58Å; A193-H208 VanDerWaalsContact CA-O 3.23Å; A193-H208 WeakPolarHBondContact CA-O 3.39Å; A193-H208 WeakPolarHBondContact CB-O 3.14Å; A193-F209 HydrophobicContact CB-CD1 3.93Å; A193-F209 HydrophobicContact CB-CE1 4.42Å; A193-F209 HydrophobicContact CB-CG 4.42Å; A193-V230 HydrophobicContact CB-CG1 3.62Å; A193-E234 HydrophobicContact CB-CG 3.53Å
194	H	91.4	Very high	81.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	160.6	161.5	57.8	-104.9	0	0	0	111.8	S91 L92 H179 D181 Y183 F185 F196 H208 E234	S91-H194 WeakPolarHBondContact OG-CB 3.33Å; S91-H194 PolarHBondContact OG-ND1 3.02Å; S91-H194 VanDerWaalsContact OG-ND1 3.15Å; L92-H194 HydrophobicContact CD2-CB 4.43Å; L92-H194 HydrophobicContact CG-CB 4.27Å; H179-H194 AromaticContact CE1-CE1 3.5Å; H179-H194 AromaticContact NE2-CE1 3.22Å; H179-H194 PolarHBondContact NE2-CE1 3.39Å; H179-H194 AromaticContact NE2-NE2 3.39Å; H179-H194 PolarHBondContact NE2-NE2 3.08Å; D181-H194 IonicContact OD2-CD2 2.69Å; D181-H194 IonicContact OD2-CE1 2.78Å; D181-H194 IonicContact OD2-NE2 3.64Å; D181-H194 PolarHBondContact OD2-NE2 2.82Å; Y183-H194 VanDerWaalsContact CB-CE1 3.41Å; Y183-H194 WeakPolarHBondContact CB-CE1 3.41Å; Y183-H194 PolarHBondContact O-CE1 3.48Å; F185-H194 AromaticContact CE1-CE1 3.63Å; F185-H194 AromaticContact CE1-ND1 3.36Å; F185-H194 WeakPolarHBondContact CE1-ND1 3.14Å; F185-H194 AromaticContact CZ-CE1 3.69Å; F185-H194 AromaticContact CZ-ND1 3.79Å; H194-F196 AromaticContact CD2-CE2 3.97Å; H194-F196 AromaticContact NE2-CE2 3.98Å; H194-H208 PolarHBondContact N-O 3.32Å; H194-H208 AromaticContact NE2-CG 3.93Å; H194-H208 AromaticContact NE2-ND1 3.39Å; H194-H208 PolarHBondContact NE2-ND1 3.46Å; H194-H208 PolarHBondContact O-N 3.2Å; H194-H208 VanDerWaalsContact O-O 3.13Å; H194-E234 WeakPolarHBondContact CA-OE2 3.37Å
195	A	91.5	Very high	82.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	152.6	166.3	0	0	0	0	0	112.9	L92 D206 T207 E234 H237 A238	L92-A195 WeakPolarHBondContact CD1-O 3.35Å; A195-D206 CarbonylContact C-O 3.54Å; A195-D206 VanDerWaalsContact CA-O 3.29Å; A195-D206 WeakPolarHBondContact CA-O 3.4Å; A195-T207 HydrophobicContact CB-CG2 4.01Å; A195-T207 WeakPolarHBondContact CB-OG1 3.35Å; A195-E234 HydrophobicContact CB-CB 4.17Å; A195-E234 VanDerWaalsContact CB-O 3.27Å; A195-E234 WeakPolarHBondContact CB-O 3.46Å; A195-E234 PolarHBondContact N-OE2 3Å; A195-E234 VanDerWaalsContact N-OE2 3.15Å; A195-H237 HydrophobicContact CB-CB 3.96Å; A195-A238 HydrophobicContact CB-CB 4.21Å
196	F	82	Confident	83.1	Confident	31 Å²	31	41.6 Å²	41.6	14%	0.136	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-85.2	137.1	174.1	-66.6	-82.9	0	0	0	110.8	D181 Y183 H194 I203 G205 D206 H208	D181-F196 HydrophobicContact CB-CE2 4.28Å; D181-F196 HydrophobicContact CB-CZ 3.7Å; D181-F196 WeakPolarHBondContact OD2-CE2 3.39Å; D181-F196 WeakPolarHBondContact OD2-CZ 3.4Å; Y183-F196 HydrophobicContact CD2-CE1 4Å; Y183-F196 HydrophobicContact CD2-CZ 4.15Å; Y183-F196 HydrophobicContact CE2-CE1 4.14Å; H194-F196 AromaticContact CD2-CE2 3.97Å; H194-F196 AromaticContact NE2-CE2 3.98Å; F196-I203 VanDerWaalsContact CB-O 3.22Å; F196-I203 WeakPolarHBondContact CB-O 3.22Å; F196-I203 HydrophobicContact CD1-CG2 4.14Å; F196-I203 HydrophobicContact CD2-CD1 3.89Å; F196-I203 HydrophobicContact CD2-CG1 3.69Å; F196-I203 HydrophobicContact CD2-CG2 4.36Å; F196-I203 HydrophobicContact CE1-CD1 4.32Å; F196-I203 HydrophobicContact CE2-CD1 3.44Å; F196-I203 VanDerWaalsContact CE2-CD1 3.44Å; F196-I203 HydrophobicContact CE2-CG1 3.79Å; F196-I203 HydrophobicContact CG-CG1 4.26Å; F196-I203 HydrophobicContact CG-CG2 4.07Å; F196-I203 HydrophobicContact CZ-CD1 3.7Å; F196-I203 HydrophobicContact CZ-CG1 4.41Å; F196-G205 VanDerWaalsContact O-CA 3.27Å; F196-G205 WeakPolarHBondContact O-CA 3.4Å; F196-G205 PolarHBondContact O-N 3.36Å; F196-D206 HydrophobicContact CD2-CB 4.29Å; F196-D206 PolarHBondContact N-O 3.43Å; F196-H208 AromaticContact CE2-CE1 3.89Å; F196-H208 AromaticContact CE2-ND1 3.98Å
197	F	82.5	Confident	84	Confident	40 Å²	40	37.5 Å²	37.5	18%	0.175	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-61.1	158.8	176	-65.1	-65.1	0	0	0	112.6	L92 L96 S111 H237 L241	L92-F197 HydrophobicContact CD1-CE2 4.27Å; L92-F197 HydrophobicContact CD1-CZ 4.01Å; L96-F197 HydrophobicContact CD1-CE2 4.14Å; L96-F197 HydrophobicContact CD1-CZ 3.88Å; L96-F197 HydrophobicContact CD2-CE2 4.27Å; L96-F197 HydrophobicContact CD2-CZ 4.49Å; S111-F197 WeakPolarHBondContact OG-CD1 3.21Å; S111-F197 VanDerWaalsContact OG-CD2 3.24Å; S111-F197 WeakPolarHBondContact OG-CD2 3.49Å; S111-F197 WeakPolarHBondContact OG-CG 3.35Å; F197-H237 VanDerWaalsContact CD1-O 3.23Å; F197-H237 WeakPolarHBondContact CD1-O 3.36Å; F197-H237 HydrophobicContact CE1-CB 4.25Å; F197-H237 AromaticContact CE1-ND1 3.76Å; F197-L241 WeakPolarHBondContact CE1-O 3.49Å
198	P	85.1	Confident	84.9	Confident	5 Å²	5	37.4 Å²	37.4	3%	0.032	21%	0.212	C	C	.	.	S	Bend	trans	-52.2	145.2	172.6	-22.6	28.6	0	0	0	111.9	S113 W115 A238 G240	S113-P198 WeakPolarHBondContact CB-O 3.23Å; S113-P198 PolarHBondContact OG-O 3.11Å; W115-P198 HydrophobicContact CD2-CB 3.92Å; W115-P198 HydrophobicContact CG-CB 3.99Å; W115-P198 HydrophobicContact CG-CG 4.3Å; W115-P198 HydrophobicContact CZ2-CB 4.33Å; P198-A238 WeakPolarHBondContact CD-O 3.19Å; P198-A238 WeakPolarHBondContact CG-O 3.32Å; P198-G240 VanDerWaalsContact CD-CA 3.45Å; P198-G240 VanDerWaalsContact CD-N 3.32Å
199	G	77.7	Confident	85.5	Confident	31 Å²	31	31.3 Å²	31.3	32%	0.32	18%	0.18	S	C	.	.	S	Bend	trans	177.5	-174.1	-178	0	0	0	0	0	112.7	S204	G199-S204 VanDerWaalsContact CA-OG 3.26Å; G199-S204 WeakPolarHBondContact CA-OG 3.41Å; G199-S204 PolarHBondContact N-OG 3.14Å
200	E	69.9	Low	86.2	Confident	173 Å²	173	30.1 Å²	30.1	81%	0.808	17%	0.168	S	C	*	.	S	Bend	trans	-101.8	-0.3	-179.8	-60	-175.5	169.8	0	0	111.9	K116	K116-E200 IonicContact NZ-OE1 3.55Å; K116-E200 PolarHBondContact NZ-OE1 3.28Å
201	H	71.8	Confident	86.5	Confident	126 Å²	126	29.2 Å²	29.2	58%	0.583	16%	0.158	S	C	*	.	S	Bend	trans	-79.1	146.5	176.2	-167.8	-92.1	0	0	0	109.9	I203 S204	H201-I203 WeakPolarHBondContact ND1-CG2 3.18Å; H201-I203 PolarHBondContact ND1-N 3.46Å; H201-I203 PolarHBondContact O-N 3.2Å; H201-S204 WeakPolarHBondContact O-CB 3.42Å; H201-S204 PolarHBondContact O-N 2.97Å; H201-S204 PolarHBondContact O-OG 3.31Å
202	P	74.3	Confident	86.5	Confident	119 Å²	119	32.9 Å²	32.9	77%	0.773	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-22.9	-179.3	-29.8	36.4	0	0	0	116.2
203	I	75.6	Confident	86.4	Confident	40 Å²	40	32.9 Å²	32.9	21%	0.205	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-5.3	178.6	-152.6	173.7	0	0	0	112.8	D181 F196 H201 G205 D206	D181-I203 HydrophobicContact CB-CD1 4.02Å; F196-I203 VanDerWaalsContact CB-O 3.22Å; F196-I203 WeakPolarHBondContact CB-O 3.22Å; F196-I203 HydrophobicContact CD1-CG2 4.14Å; F196-I203 HydrophobicContact CD2-CD1 3.89Å; F196-I203 HydrophobicContact CD2-CG1 3.69Å; F196-I203 HydrophobicContact CD2-CG2 4.36Å; F196-I203 HydrophobicContact CE1-CD1 4.32Å; F196-I203 HydrophobicContact CE2-CD1 3.44Å; F196-I203 VanDerWaalsContact CE2-CD1 3.44Å; F196-I203 HydrophobicContact CE2-CG1 3.79Å; F196-I203 HydrophobicContact CG-CG1 4.26Å; F196-I203 HydrophobicContact CG-CG2 4.07Å; F196-I203 HydrophobicContact CZ-CD1 3.7Å; F196-I203 HydrophobicContact CZ-CG1 4.41Å; H201-I203 WeakPolarHBondContact ND1-CG2 3.18Å; H201-I203 PolarHBondContact ND1-N 3.46Å; H201-I203 PolarHBondContact O-N 3.2Å; I203-G205 PolarHBondContact O-N 2.87Å; I203-D206 HydrophobicContact CG1-CB 3.99Å; I203-D206 VanDerWaalsContact O-CB 3.3Å; I203-D206 WeakPolarHBondContact O-CB 3.39Å; I203-D206 PolarHBondContact O-N 2.88Å; I203-D206 VanDerWaalsContact O-N 3.08Å
204	S	80.9	Confident	86.2	Confident	16 Å²	16	36.3 Å²	36.3	11%	0.112	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	128.1	-176.6	-74.3	0	0	0	0	110.5	W115 D169 G199 H201 D206	W115-S204 WeakPolarHBondContact CH2-O 3.3Å; D169-S204 VanDerWaalsContact O-O 3.1Å; G199-S204 VanDerWaalsContact CA-OG 3.26Å; G199-S204 WeakPolarHBondContact CA-OG 3.41Å; G199-S204 PolarHBondContact N-OG 3.14Å; H201-S204 WeakPolarHBondContact O-CB 3.42Å; H201-S204 PolarHBondContact O-N 2.97Å; H201-S204 PolarHBondContact O-OG 3.31Å; S204-D206 VanDerWaalsContact C-N 3.27Å
205	G	82.7	Confident	86.3	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.8	-21.2	-173.7	0	0	0	0	0	114.3	I170 F196 I203 T207 A238	I170-G205 WeakPolarHBondContact CG2-O 3.31Å; F196-G205 VanDerWaalsContact O-CA 3.27Å; F196-G205 WeakPolarHBondContact O-CA 3.4Å; F196-G205 PolarHBondContact O-N 3.36Å; I203-G205 PolarHBondContact O-N 2.87Å; G205-T207 PolarHBondContact O-N 2.84Å; G205-T207 PolarHBondContact O-OG1 2.61Å; G205-A238 WeakPolarHBondContact O-CB 3.35Å
206	D	92.1	Very high	86.4	Confident	14 Å²	14	37.8 Å²	37.8	8%	0.075	21%	0.205	C	C	.	.			trans	-60.2	139.9	-178.6	-70.5	-4.7	0	0	0	110.7	L171 A195 F196 I203 S204	L171-D206 HydrophobicContact CB-CB 4.48Å; L171-D206 WeakPolarHBondContact CB-OD1 3.11Å; L171-D206 PolarHBondContact N-OD1 3.46Å; L171-D206 WeakPolarHBondContact O-CA 3.47Å; A195-D206 CarbonylContact C-O 3.54Å; A195-D206 VanDerWaalsContact CA-O 3.29Å; A195-D206 WeakPolarHBondContact CA-O 3.4Å; F196-D206 HydrophobicContact CD2-CB 4.29Å; F196-D206 PolarHBondContact N-O 3.43Å; I203-D206 HydrophobicContact CG1-CB 3.99Å; I203-D206 VanDerWaalsContact O-CB 3.3Å; I203-D206 WeakPolarHBondContact O-CB 3.39Å; I203-D206 PolarHBondContact O-N 2.88Å; I203-D206 VanDerWaalsContact O-N 3.08Å; S204-D206 VanDerWaalsContact C-N 3.27Å
207	T	97	Very high	86.7	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	121	-173.3	-58	0	0	0	0	109.1	L171 I172 D173 A195 G205 F209 E234 F235	L171-T207 PolarHBondContact O-N 3.29Å; I172-T207 WeakPolarHBondContact CA-O 3.28Å; D173-T207 PolarHBondContact N-O 3.24Å; A195-T207 HydrophobicContact CB-CG2 4.01Å; A195-T207 WeakPolarHBondContact CB-OG1 3.35Å; G205-T207 PolarHBondContact O-N 2.84Å; G205-T207 PolarHBondContact O-OG1 2.61Å; T207-F209 HydrophobicContact CG2-CD2 4.23Å; T207-F209 HydrophobicContact CG2-CE2 3.5Å; T207-F209 HydrophobicContact CG2-CZ 3.8Å; T207-E234 HydrophobicContact CG2-CB 3.49Å; T207-E234 VanDerWaalsContact CG2-CB 3.49Å; T207-E234 HydrophobicContact CG2-CG 4.21Å; T207-F235 HydrophobicContact CG2-CD1 4.39Å; T207-F235 HydrophobicContact CG2-CE1 4.1Å
208	H	96.4	Very high	86.3	Confident	6 Å²	6	40.7 Å²	40.7	3%	0.028	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132	-177.8	-58.8	159.4	0	0	0	109.9	D173 H179 D181 F185 A193 H194 F196	D173-H208 CarbonylContact O-C 3.59Å; D173-H208 VanDerWaalsContact O-CA 3.31Å; D173-H208 WeakPolarHBondContact O-CA 3.44Å; H179-H208 AromaticContact CD2-CE1 3.75Å; H179-H208 AromaticContact CD2-CG 3.72Å; H179-H208 AromaticContact CD2-ND1 3.12Å; H179-H208 PolarHBondContact CD2-ND1 3.23Å; H179-H208 AromaticContact NE2-CG 3.61Å; H179-H208 AromaticContact NE2-ND1 3.08Å; H179-H208 PolarHBondContact NE2-ND1 2.81Å; D181-H208 IonicContact OD2-CE1 3.22Å; D181-H208 PolarHBondContact OD2-CE1 2.93Å; D181-H208 VanDerWaalsContact OD2-CE1 3.31Å; D181-H208 IonicContact OD2-ND1 3.34Å; D181-H208 PolarHBondContact OD2-ND1 3.15Å; F185-H208 HydrophobicContact CE2-CB 4.06Å; F185-H208 HydrophobicContact CZ-CB 3.72Å; F185-H208 WeakPolarHBondContact CZ-O 3.45Å; A193-H208 CarbonylContact C-O 3.58Å; A193-H208 VanDerWaalsContact CA-O 3.23Å; A193-H208 WeakPolarHBondContact CA-O 3.39Å; A193-H208 WeakPolarHBondContact CB-O 3.14Å; H194-H208 PolarHBondContact N-O 3.32Å; H194-H208 AromaticContact NE2-CG 3.93Å; H194-H208 AromaticContact NE2-ND1 3.39Å; H194-H208 PolarHBondContact NE2-ND1 3.46Å; H194-H208 PolarHBondContact O-N 3.2Å; H194-H208 VanDerWaalsContact O-O 3.13Å; F196-H208 AromaticContact CE2-CE1 3.89Å; F196-H208 AromaticContact CE2-ND1 3.98Å
209	F	97.6	Very high	85.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.9	174.8	-64.8	-92.7	0	0	0	108.7	M142 I172 D173 F174 A175 F185 A193 T207 D211 W215 L227 V230 A231 E234	M142-F209 HydrophobicContact CE-CD2 4.43Å; M142-F209 HydrophobicContact CE-CE1 4.35Å; M142-F209 HydrophobicContact CE-CE2 3.83Å; M142-F209 HydrophobicContact CE-CZ 3.79Å; M142-F209 HydrophobicContact SD-CE2 4.15Å; M142-F209 HydrophobicContact SD-CZ 4.04Å; I172-F209 HydrophobicContact CG2-CD2 3.99Å; I172-F209 HydrophobicContact CG2-CE2 3.69Å; D173-F209 PolarHBondContact O-N 2.98Å; F174-F209 CarbonylContact C-O 3.54Å; F174-F209 WeakPolarHBondContact CA-O 3.49Å; F174-F209 HydrophobicContact CD1-CB 3.69Å; F174-F209 HydrophobicContact CD1-CG 4.47Å; F174-F209 HydrophobicContact CE1-CB 3.75Å; F174-F209 HydrophobicContact CE1-CG 4.1Å; F174-F209 HydrophobicContact CE2-CD2 4.45Å; F174-F209 HydrophobicContact CG-CB 4.26Å; F174-F209 HydrophobicContact CZ-CB 4.37Å; F174-F209 HydrophobicContact CZ-CD2 4.29Å; F174-F209 HydrophobicContact CZ-CG 4.3Å; A175-F209 PolarHBondContact N-O 3.45Å; F185-F209 VanDerWaalsContact CE2-C 3.48Å; F185-F209 WeakPolarHBondContact CE2-O 3.27Å; A193-F209 HydrophobicContact CB-CD1 3.93Å; A193-F209 HydrophobicContact CB-CE1 4.42Å; A193-F209 HydrophobicContact CB-CG 4.42Å; T207-F209 HydrophobicContact CG2-CD2 4.23Å; T207-F209 HydrophobicContact CG2-CE2 3.5Å; T207-F209 HydrophobicContact CG2-CZ 3.8Å; F209-D211 PolarHBondContact O-N 3.03Å; F209-D211 VanDerWaalsContact O-N 3.17Å; F209-W215 HydrophobicContact CB-CH2 4.43Å; F209-W215 HydrophobicContact CB-CZ2 3.74Å; F209-W215 AromaticContact CD1-CH2 3.78Å; F209-W215 HydrophobicContact CD1-CH2 3.78Å; F209-W215 AromaticContact CD1-CZ2 3.95Å; F209-W215 HydrophobicContact CD1-CZ2 3.95Å; F209-W215 HydrophobicContact CD1-CZ3 4.34Å; F209-W215 HydrophobicContact CG-CZ2 4.35Å; F209-L227 HydrophobicContact CD1-CD1 3.8Å; F209-L227 HydrophobicContact CE1-CD1 3.9Å; F209-L227 HydrophobicContact CG-CD1 4.41Å; F209-V230 HydrophobicContact CD1-CG1 4.15Å; F209-V230 HydrophobicContact CE1-CB 4.41Å; F209-V230 HydrophobicContact CE1-CG1 3.97Å; F209-A231 HydrophobicContact CE1-CB 4Å; F209-A231 HydrophobicContact CZ-CB 3.76Å; F209-E234 HydrophobicContact CE1-CG 4.41Å
210	D	95.1	Very high	84.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	111.1	176.1	-171.6	-0.7	0	0	0	110.3	A175 F185 G187 L192 E212 E213 W215	A175-D210 CarbonylContact O-C 3.53Å; A175-D210 WeakPolarHBondContact O-CA 3.48Å; F185-D210 HydrophobicContact CB-CB 3.94Å; F185-D210 VanDerWaalsContact CB-CG 3.48Å; F185-D210 WeakPolarHBondContact CB-OD2 3.29Å; F185-D210 HydrophobicContact CD1-CB 3.93Å; F185-D210 HydrophobicContact CD2-CB 3.63Å; F185-D210 HydrophobicContact CE1-CB 4.36Å; F185-D210 HydrophobicContact CE2-CB 4.07Å; F185-D210 HydrophobicContact CG-CB 3.56Å; F185-D210 HydrophobicContact CZ-CB 4.43Å; G187-D210 WeakPolarHBondContact CA-OD2 3.24Å; G187-D210 PolarHBondContact N-OD2 3.41Å; L192-D210 WeakPolarHBondContact O-CB 3.43Å; L192-D210 PolarHBondContact O-N 3.33Å; D210-E212 PolarHBondContact O-N 2.73Å; D210-E212 WeakPolarHBondContact OD1-CB 3.41Å; D210-E212 PolarHBondContact OD1-N 3Å; D210-E213 HydrophobicContact CB-CG 4Å; D210-E213 WeakPolarHBondContact O-CB 3.45Å; D210-E213 PolarHBondContact O-N 3.1Å; D210-E213 VanDerWaalsContact O-N 3.09Å; D210-W215 PolarHBondContact O-NE1 3.03Å
211	D	93.6	Very high	83.9	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.027	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-6.8	178.3	-174.5	46.9	0	0	0	113	P128 Q129 S130 F174 A175 R176 F209 E213	P128-D211 WeakPolarHBondContact CA-OD1 3.22Å; Q129-D211 PolarHBondContact N-OD1 3.23Å; S130-D211 PolarHBondContact OG-O 2.83Å; F174-D211 HydrophobicContact CB-CB 4.03Å; A175-D211 PolarHBondContact O-N 3.11Å; R176-D211 HydrophobicContact CG-CB 3.72Å; R176-D211 IonicContact CZ-OD2 3.55Å; R176-D211 IonicContact NE-OD2 3.49Å; R176-D211 PolarHBondContact NE-OD2 3.31Å; R176-D211 IonicContact NH2-OD2 2.8Å; R176-D211 PolarHBondContact NH2-OD2 2.87Å; F209-D211 PolarHBondContact O-N 3.03Å; F209-D211 VanDerWaalsContact O-N 3.17Å; D211-E213 VanDerWaalsContact C-N 3.3Å
212	E	88.6	Confident	83.2	Confident	80 Å²	80	42.2 Å²	42.2	37%	0.374	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.5	169.9	-58.4	-169.7	94.6	0	0	112.8	R176 L188 D210	R176-E212 HydrophobicContact CB-CG 4.1Å; R176-E212 HydrophobicContact CG-CG 3.8Å; L188-E212 WeakPolarHBondContact CD1-O 3.27Å; D210-E212 PolarHBondContact O-N 2.73Å; D210-E212 WeakPolarHBondContact OD1-CB 3.41Å; D210-E212 PolarHBondContact OD1-N 3Å
213	E	91.9	Very high	83	Confident	5 Å²	5	43.6 Å²	43.6	2%	0.023	26%	0.263	C	S	.	.	S	Bend	trans	-75	148	171	-68.9	-64.5	160.8	0	0	112.4	G189 L192 D210 D211 W215 T225	G189-E213 WeakPolarHBondContact CA-OE1 3.38Å; G189-E213 PolarHBondContact N-OE1 2.96Å; L192-E213 HydrophobicContact CD2-CG 3.86Å; L192-E213 VanDerWaalsContact CD2-OE1 3.26Å; L192-E213 WeakPolarHBondContact CD2-OE1 3.39Å; D210-E213 HydrophobicContact CB-CG 4Å; D210-E213 WeakPolarHBondContact O-CB 3.45Å; D210-E213 PolarHBondContact O-N 3.1Å; D210-E213 VanDerWaalsContact O-N 3.09Å; D211-E213 VanDerWaalsContact C-N 3.3Å; E213-W215 VanDerWaalsContact C-N 3.31Å; E213-W215 HydrophobicContact CB-CD2 4.21Å; E213-W215 HydrophobicContact CB-CZ2 3.84Å; E213-W215 HydrophobicContact CG-CZ2 4.09Å; E213-W215 PolarHBondContact O-N 3.22Å; E213-T225 PolarHBondContact OE2-OG1 3.21Å
214	T	91.8	Very high	83.4	Confident	71 Å²	71	43 Å²	43	44%	0.436	27%	0.267	S	S	.	.			trans	-82.7	81.3	171.2	-54.7	0	0	0	0	109.3	T216 G224 T225	T214-T216 HydrophobicContact CG2-CG2 4.32Å; T214-T216 PolarHBondContact O-N 2.87Å; T214-G224 WeakPolarHBondContact O-CA 3.14Å; T214-T225 PolarHBondContact O-N 3.18Å
215	W	94.5	Very high	84	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.008	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	127.2	178.8	-63.8	106.4	0	0	0	111.6	P128 S131 L133 F174 L192 F209 D210 E213 T225 L227 V230	P128-W215 HydrophobicContact CB-CB 4.5Å; P128-W215 HydrophobicContact CB-CG 4.4Å; S131-W215 PolarHBondContact OG-O 3.35Å; L133-W215 HydrophobicContact CD1-CB 4.1Å; F174-W215 AromaticContact CD1-CD1 3.99Å; F174-W215 AromaticContact CD1-NE1 3.78Å; F174-W215 AromaticContact CE1-CD1 3.9Å; F174-W215 HydrophobicContact CE1-CD2 4.4Å; F174-W215 HydrophobicContact CE1-CG 4.22Å; F174-W215 AromaticContact CE1-NE1 3.85Å; L192-W215 HydrophobicContact CB-CH2 4.37Å; L192-W215 WeakPolarHBondContact O-CZ2 3.32Å; F209-W215 HydrophobicContact CB-CH2 4.43Å; F209-W215 HydrophobicContact CB-CZ2 3.74Å; F209-W215 AromaticContact CD1-CH2 3.78Å; F209-W215 HydrophobicContact CD1-CH2 3.78Å; F209-W215 AromaticContact CD1-CZ2 3.95Å; F209-W215 HydrophobicContact CD1-CZ2 3.95Å; F209-W215 HydrophobicContact CD1-CZ3 4.34Å; F209-W215 HydrophobicContact CG-CZ2 4.35Å; D210-W215 PolarHBondContact O-NE1 3.03Å; E213-W215 VanDerWaalsContact C-N 3.31Å; E213-W215 HydrophobicContact CB-CD2 4.21Å; E213-W215 HydrophobicContact CB-CZ2 3.84Å; E213-W215 HydrophobicContact CG-CZ2 4.09Å; E213-W215 PolarHBondContact O-N 3.22Å; W215-T225 CarbonylContact C-O 3.5Å; W215-T225 WeakPolarHBondContact CA-O 3.39Å; W215-T225 HydrophobicContact CE3-CG2 4.01Å; W215-T225 HydrophobicContact CH2-CG2 4.1Å; W215-T225 HydrophobicContact CZ3-CG2 3.5Å; W215-L227 HydrophobicContact CD2-CB 4.49Å; W215-L227 HydrophobicContact CD2-CD1 3.78Å; W215-L227 HydrophobicContact CE3-CB 3.83Å; W215-L227 HydrophobicContact CE3-CD1 3.51Å; W215-L227 HydrophobicContact CE3-CG 4.28Å; W215-L227 HydrophobicContact CG-CD1 4.35Å; W215-L227 HydrophobicContact CH2-CD1 4.5Å; W215-L227 HydrophobicContact CZ3-CD1 3.88Å; W215-V230 HydrophobicContact CH2-CB 4.11Å; W215-V230 HydrophobicContact CH2-CG1 3.91Å; W215-V230 HydrophobicContact CH2-CG2 4.18Å; W215-V230 HydrophobicContact CZ3-CB 3.83Å; W215-V230 HydrophobicContact CZ3-CG1 4.16Å; W215-V230 HydrophobicContact CZ3-CG2 3.78Å
216	T	92.5	Very high	84.5	Confident	30 Å²	30	43 Å²	43	18%	0.184	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	168.5	179.3	64	0	0	0	0	110.6	T214 T225 D226 L227	T214-T216 HydrophobicContact CG2-CG2 4.32Å; T214-T216 PolarHBondContact O-N 2.87Å; T216-T225 PolarHBondContact N-O 2.83Å; T216-T225 PolarHBondContact OG1-O 2.98Å; T216-D226 WeakPolarHBondContact O-CA 3.47Å; T216-L227 PolarHBondContact O-N 2.87Å
217	F	89.2	Confident	84.7	Confident	77 Å²	77	42.3 Å²	42.3	34%	0.338	26%	0.262	S	S	.	.	S	Bend	trans	-149.1	133.7	168.9	172	-107.3	0	0	0	108.9	L133 L141 S219 F228 P262	L133-F217 HydrophobicContact CD2-CB 3.88Å; L141-F217 HydrophobicContact CD1-CB 3.73Å; L141-F217 HydrophobicContact CD1-CD1 4.46Å; L141-F217 HydrophobicContact CD1-CD2 4.04Å; L141-F217 HydrophobicContact CD1-CG 3.81Å; L141-F217 HydrophobicContact CD2-CD1 4.13Å; L141-F217 HydrophobicContact CD2-CD2 3.61Å; L141-F217 HydrophobicContact CD2-CE1 4.13Å; L141-F217 HydrophobicContact CD2-CE2 3.62Å; L141-F217 HydrophobicContact CD2-CG 3.87Å; L141-F217 HydrophobicContact CD2-CZ 3.88Å; L141-F217 HydrophobicContact CG-CD2 4.48Å; L141-F217 HydrophobicContact CG-CG 4.46Å; F217-S219 PolarHBondContact O-N 2.73Å; F217-F228 HydrophobicContact CD2-CB 4.13Å; F217-F228 HydrophobicContact CE2-CB 4.3Å; F217-P262 HydrophobicContact CE2-CG 3.58Å; F217-P262 VanDerWaalsContact CZ-CD 3.49Å; F217-P262 HydrophobicContact CZ-CG 3.64Å
218	G	73.3	Confident	84.7	Confident	55 Å²	55	42.3 Å²	42.3	57%	0.567	26%	0.262	S	S	*	.	S	Bend	trans	68.6	16	178.6	0	0	0	0	0	114.8	T220	G218-T220 PolarHBondContact O-N 3.19Å
219	S	68.8	Low	84.7	Confident	42 Å²	42	42.2 Å²	42.2	29%	0.294	26%	0.263	S	S	.	.			trans	-62.8	120.1	174.7	-178.2	0	0	0	0	110	F217 D221 E223	F217-S219 PolarHBondContact O-N 2.73Å; S219-D221 VanDerWaalsContact C-N 3.34Å; S219-E223 PolarHBondContact OG-O 2.82Å
220	T	57.2	Low	84.8	Confident	132 Å²	132	42.5 Å²	42.5	81%	0.81	26%	0.264	S	S	*	.	S	Bend	trans	-82.2	-15.5	177.6	50.9	0	0	0	0	113.4	G218	G218-T220 PolarHBondContact O-N 3.19Å
221	D	57.3	Low	84.9	Confident	128 Å²	128	42.5 Å²	42.5	68%	0.684	26%	0.264	S	S	*	.	S	Bend	trans	-93.4	-3.7	-168.6	-55.9	-11.7	0	0	0	111.5	S219 E223	S219-D221 VanDerWaalsContact C-N 3.34Å; D221-E223 PolarHBondContact O-N 3.32Å
222	G	57.5	Low	85.1	Confident	64 Å²	64	42.3 Å²	42.3	66%	0.66	26%	0.263	S	S	*	.			trans	72.8	0.7	-179.1	0	0	0	0	0	114.3
223	E	69.4	Low	85.6	Confident	149 Å²	149	39 Å²	39	70%	0.696	25%	0.248	S	C	*	.			trans	-79.8	130.9	176	-66.8	-67.2	147.9	0	0	110.5	S219 D221	S219-E223 PolarHBondContact OG-O 2.82Å; D221-E223 PolarHBondContact O-N 3.32Å
224	G	84	Confident	85.9	Confident	28 Å²	28	38.9 Å²	38.9	29%	0.289	25%	0.247	S	C	.	.	S	Bend	trans	93.1	179.7	179	0	0	0	0	0	115.4	T214	T214-G224 WeakPolarHBondContact O-CA 3.14Å
225	T	92.8	Very high	86.2	Confident	11 Å²	11	35.5 Å²	35.5	7%	0.067	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123	-176.7	-57.4	0	0	0	0	109.2	L192 E213 T214 W215 T216 L227 V230 Y255	L192-T225 HydrophobicContact CD1-CG2 3.78Å; L192-T225 HydrophobicContact CD2-CG2 3.9Å; L192-T225 HydrophobicContact CG-CG2 4.36Å; E213-T225 PolarHBondContact OE2-OG1 3.21Å; T214-T225 PolarHBondContact O-N 3.18Å; W215-T225 CarbonylContact C-O 3.5Å; W215-T225 WeakPolarHBondContact CA-O 3.39Å; W215-T225 HydrophobicContact CE3-CG2 4.01Å; W215-T225 HydrophobicContact CH2-CG2 4.1Å; W215-T225 HydrophobicContact CZ3-CG2 3.5Å; T216-T225 PolarHBondContact N-O 2.83Å; T216-T225 PolarHBondContact OG1-O 2.98Å; T225-L227 PolarHBondContact O-N 3.24Å; T225-V230 HydrophobicContact CG2-CG2 3.79Å; T225-Y255 HydrophobicContact CG2-CE2 4.24Å
226	D	94.6	Very high	86.3	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.016	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	109.7	-176.9	-174.8	-103.1	0	0	0	109.9	T216 F228 A229 V230 Y255 P258	T216-D226 WeakPolarHBondContact O-CA 3.47Å; D226-F228 PolarHBondContact O-N 2.98Å; D226-A229 HydrophobicContact CB-CB 4.16Å; D226-A229 PolarHBondContact O-N 3.05Å; D226-A229 WeakPolarHBondContact OD1-CB 3.37Å; D226-A229 PolarHBondContact OD1-N 2.68Å; D226-V230 PolarHBondContact O-N 2.89Å; D226-Y255 HydrophobicContact CB-CE2 4.48Å; D226-Y255 VanDerWaalsContact CB-OH 3.28Å; D226-Y255 WeakPolarHBondContact CB-OH 3.23Å; D226-Y255 PolarHBondContact N-OH 2.87Å; D226-P258 HydrophobicContact CB-CB 3.94Å; D226-P258 HydrophobicContact CB-CG 3.93Å
227	L	96.8	Very high	86.2	Confident	0 Å²	0	34 Å²	34	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-35.5	-174.7	-179.2	60.9	0	0	0	111.7	L133 V138 L141 M142 F174 F209 W215 T216 T225 A231	L133-L227 HydrophobicContact CD1-CB 4.07Å; L133-L227 HydrophobicContact CD1-CD2 3.71Å; V138-L227 HydrophobicContact CB-CD2 4.46Å; V138-L227 HydrophobicContact CG1-CD2 4.21Å; V138-L227 HydrophobicContact CG2-CD2 3.94Å; L141-L227 HydrophobicContact CD1-CB 4.37Å; L141-L227 HydrophobicContact CD1-CD2 4.32Å; M142-L227 HydrophobicContact CE-CD1 3.7Å; M142-L227 HydrophobicContact CE-CD2 3.89Å; M142-L227 HydrophobicContact CE-CG 3.83Å; F174-L227 HydrophobicContact CE1-CD1 3.82Å; F174-L227 HydrophobicContact CE1-CD2 4.36Å; F174-L227 HydrophobicContact CZ-CD1 3.83Å; F174-L227 HydrophobicContact CZ-CD2 3.97Å; F209-L227 HydrophobicContact CD1-CD1 3.8Å; F209-L227 HydrophobicContact CE1-CD1 3.9Å; F209-L227 HydrophobicContact CG-CD1 4.41Å; W215-L227 HydrophobicContact CD2-CB 4.49Å; W215-L227 HydrophobicContact CD2-CD1 3.78Å; W215-L227 HydrophobicContact CE3-CB 3.83Å; W215-L227 HydrophobicContact CE3-CD1 3.51Å; W215-L227 HydrophobicContact CE3-CG 4.28Å; W215-L227 HydrophobicContact CG-CD1 4.35Å; W215-L227 HydrophobicContact CH2-CD1 4.5Å; W215-L227 HydrophobicContact CZ3-CD1 3.88Å; T216-L227 PolarHBondContact O-N 2.87Å; T225-L227 PolarHBondContact O-N 3.24Å; L227-A231 WeakPolarHBondContact O-CB 3.47Å; L227-A231 PolarHBondContact O-N 2.77Å
228	F	96.8	Very high	86.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.2	-49	179.6	178.7	-110.8	0	0	0	111.7	L141 A145 F217 D226 V230 A231 V232 V259 P262 Y265	L141-F228 HydrophobicContact CD2-CB 4.18Å; L141-F228 HydrophobicContact CD2-CD2 4.42Å; A145-F228 HydrophobicContact CB-CD2 4.2Å; A145-F228 HydrophobicContact CB-CE2 4.05Å; F217-F228 HydrophobicContact CD2-CB 4.13Å; F217-F228 HydrophobicContact CE2-CB 4.3Å; D226-F228 PolarHBondContact O-N 2.98Å; F228-V230 VanDerWaalsContact C-N 3.34Å; F228-V230 PolarHBondContact O-N 3.3Å; F228-A231 PolarHBondContact O-N 3.07Å; F228-V232 HydrophobicContact CD2-CG2 4.26Å; F228-V232 HydrophobicContact CE1-CG2 4.11Å; F228-V232 HydrophobicContact CE2-CG2 3.82Å; F228-V232 HydrophobicContact CZ-CG2 3.73Å; F228-V232 VanDerWaalsContact O-CG2 3.3Å; F228-V232 WeakPolarHBondContact O-CG2 3.23Å; F228-V232 PolarHBondContact O-N 2.86Å; F228-V259 HydrophobicContact CD1-CG2 3.52Å; F228-V259 HydrophobicContact CE1-CG2 3.56Å; F228-P262 HydrophobicContact CD1-CB 4.46Å; F228-P262 HydrophobicContact CD1-CG 4.03Å; F228-P262 HydrophobicContact CD2-CB 4.08Å; F228-P262 HydrophobicContact CD2-CG 3.94Å; F228-P262 HydrophobicContact CE1-CB 4.09Å; F228-P262 HydrophobicContact CE1-CG 4.12Å; F228-P262 HydrophobicContact CE2-CB 3.66Å; F228-P262 HydrophobicContact CE2-CG 4.03Å; F228-P262 HydrophobicContact CG-CB 4.47Å; F228-P262 HydrophobicContact CG-CG 3.94Å; F228-P262 HydrophobicContact CZ-CB 3.68Å; F228-P262 HydrophobicContact CZ-CG 4.13Å; F228-Y265 HydrophobicContact CE1-CD1 4.21Å; F228-Y265 HydrophobicContact CE1-CD2 4.32Å; F228-Y265 AromaticContact CE1-CG 3.83Å; F228-Y265 HydrophobicContact CE1-CG 3.83Å; F228-Y265 HydrophobicContact CZ-CD1 4.07Å; F228-Y265 HydrophobicContact CZ-CG 4.07Å
229	A	96.4	Very high	87.5	Confident	5 Å²	5	27.8 Å²	27.8	4%	0.041	17%	0.174	C	C	.	.	H	α-helix	trans	-58.4	-45.1	178	0	0	0	0	0	112.2	D226 H233 Y255 V259	D226-A229 HydrophobicContact CB-CB 4.16Å; D226-A229 PolarHBondContact O-N 3.05Å; D226-A229 WeakPolarHBondContact OD1-CB 3.37Å; D226-A229 PolarHBondContact OD1-N 2.68Å; A229-H233 PolarHBondContact O-N 3.21Å; A229-Y255 HydrophobicContact CB-CE2 4.28Å; A229-V259 HydrophobicContact CB-CG1 3.96Å; A229-V259 HydrophobicContact CB-CG2 4.1Å
230	V	97.9	Very high	88.1	Confident	6 Å²	6	25.8 Å²	25.8	4%	0.036	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-43.2	178.1	-178.2	0	0	0	0	110.8	L192 A193 F209 W215 T225 D226 F228 V232 H233 E234 Y255	L192-V230 HydrophobicContact CB-CG1 4.38Å; L192-V230 HydrophobicContact CD1-CG2 3.91Å; A193-V230 HydrophobicContact CB-CG1 3.62Å; F209-V230 HydrophobicContact CD1-CG1 4.15Å; F209-V230 HydrophobicContact CE1-CB 4.41Å; F209-V230 HydrophobicContact CE1-CG1 3.97Å; W215-V230 HydrophobicContact CH2-CB 4.11Å; W215-V230 HydrophobicContact CH2-CG1 3.91Å; W215-V230 HydrophobicContact CH2-CG2 4.18Å; W215-V230 HydrophobicContact CZ3-CB 3.83Å; W215-V230 HydrophobicContact CZ3-CG1 4.16Å; W215-V230 HydrophobicContact CZ3-CG2 3.78Å; T225-V230 HydrophobicContact CG2-CG2 3.79Å; D226-V230 PolarHBondContact O-N 2.89Å; F228-V230 VanDerWaalsContact C-N 3.34Å; F228-V230 PolarHBondContact O-N 3.3Å; V230-V232 VanDerWaalsContact C-N 3.34Å; V230-V232 PolarHBondContact O-N 3.34Å; V230-H233 WeakPolarHBondContact O-CA 3.26Å; V230-H233 VanDerWaalsContact O-CB 3.32Å; V230-H233 WeakPolarHBondContact O-CB 3.34Å; V230-H233 PolarHBondContact O-N 2.86Å; V230-E234 HydrophobicContact CG1-CG 4.02Å; V230-E234 WeakPolarHBondContact O-CG 3.44Å; V230-E234 PolarHBondContact O-N 2.88Å; V230-Y255 HydrophobicContact CG2-CD2 4Å; V230-Y255 HydrophobicContact CG2-CE2 4.06Å
231	A	98.5	Very high	89.5	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.3	-40.3	178.4	0	0	0	0	0	112.9	M142 A145 F209 L227 F228 H233 E234 F235	M142-A231 HydrophobicContact CE-CB 4.18Å; M142-A231 HydrophobicContact SD-CB 3.75Å; A145-A231 HydrophobicContact CB-CB 3.84Å; F209-A231 HydrophobicContact CE1-CB 4Å; F209-A231 HydrophobicContact CZ-CB 3.76Å; L227-A231 WeakPolarHBondContact O-CB 3.47Å; L227-A231 PolarHBondContact O-N 2.77Å; F228-A231 PolarHBondContact O-N 3.07Å; A231-H233 VanDerWaalsContact C-N 3.29Å; A231-H233 PolarHBondContact O-N 3.25Å; A231-E234 PolarHBondContact O-N 2.79Å; A231-F235 HydrophobicContact CB-CD2 4.46Å; A231-F235 HydrophobicContact CB-CE2 4.08Å; A231-F235 WeakPolarHBondContact O-CB 3.44Å; A231-F235 WeakPolarHBondContact O-CD2 3.39Å; A231-F235 VanDerWaalsContact O-CG 3.27Å; A231-F235 WeakPolarHBondContact O-CG 3.2Å; A231-F235 PolarHBondContact O-N 3.07Å
232	V	98.4	Very high	90.6	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.9	-43.2	174.3	177.3	0	0	0	0	110.4	A145 W149 F228 V230 G236 I250 Y265 L267	A145-V232 HydrophobicContact CB-CG2 3.7Å; W149-V232 HydrophobicContact CZ2-CG1 4.25Å; W149-V232 VanDerWaalsContact CZ2-O 3.3Å; W149-V232 WeakPolarHBondContact CZ2-O 2.83Å; W149-V232 PolarHBondContact NE1-O 3.44Å; F228-V232 HydrophobicContact CD2-CG2 4.26Å; F228-V232 HydrophobicContact CE1-CG2 4.11Å; F228-V232 HydrophobicContact CE2-CG2 3.82Å; F228-V232 HydrophobicContact CZ-CG2 3.73Å; F228-V232 VanDerWaalsContact O-CG2 3.3Å; F228-V232 WeakPolarHBondContact O-CG2 3.23Å; F228-V232 PolarHBondContact O-N 2.86Å; V230-V232 VanDerWaalsContact C-N 3.34Å; V230-V232 PolarHBondContact O-N 3.34Å; V232-G236 PolarHBondContact O-N 2.67Å; V232-I250 HydrophobicContact CB-CG1 4.04Å; V232-I250 HydrophobicContact CG1-CB 4.36Å; V232-I250 HydrophobicContact CG1-CG1 3.71Å; V232-I250 HydrophobicContact CG1-CG2 3.96Å; V232-Y265 HydrophobicContact CG1-CE1 3.69Å; V232-Y265 HydrophobicContact CG2-CD1 4.47Å; V232-Y265 HydrophobicContact CG2-CE1 4.2Å; V232-L267 HydrophobicContact CG1-CD2 4.21Å
233	H	98.3	Very high	91.9	Very high	11 Å²	11	10.5 Å²	10.5	5%	0.051	6%	0.059	C	C	.	.	H	α-helix	trans	-60.5	-55.3	176.2	-179.5	107.1	0	0	0	111.5	C90 A229 V230 A231 F235 G236 H237 H243 I250 M251 R252	C90-H233 WeakPolarHBondContact CB-NE2 3.39Å; A229-H233 PolarHBondContact O-N 3.21Å; V230-H233 WeakPolarHBondContact O-CA 3.26Å; V230-H233 VanDerWaalsContact O-CB 3.32Å; V230-H233 WeakPolarHBondContact O-CB 3.34Å; V230-H233 PolarHBondContact O-N 2.86Å; A231-H233 VanDerWaalsContact C-N 3.29Å; A231-H233 PolarHBondContact O-N 3.25Å; H233-F235 VanDerWaalsContact C-N 3.32Å; H233-F235 PolarHBondContact O-N 3.36Å; H233-G236 WeakPolarHBondContact O-CA 3.35Å; H233-G236 PolarHBondContact O-N 2.82Å; H233-H237 AromaticContact CD2-CD2 3.73Å; H233-H237 AromaticContact CD2-NE2 3.67Å; H233-H237 AromaticContact NE2-CD2 3.64Å; H233-H237 AromaticContact NE2-NE2 3.07Å; H233-H237 PolarHBondContact NE2-NE2 3.15Å; H233-H237 PolarHBondContact O-N 2.88Å; H233-H243 AromaticContact CE1-CD2 3.61Å; H233-H243 AromaticContact CE1-NE2 3.72Å; H233-H243 AromaticContact NE2-CD2 3.6Å; H233-H243 AromaticContact NE2-NE2 3.37Å; H233-H243 PolarHBondContact NE2-NE2 2.96Å; H233-I250 HydrophobicContact CB-CG1 4.35Å; H233-I250 PolarHBondContact ND1-O 2.8Å; H233-M251 WeakPolarHBondContact ND1-CA 3.16Å; H233-M251 VanDerWaalsContact O-CE 3.23Å; H233-M251 WeakPolarHBondContact O-CE 3.47Å; H233-R252 PolarHBondContact CE1-O 2.79Å; H233-R252 PolarHBondContact ND1-O 3.34Å
234	E	98.2	Very high	92.6	Very high	3 Å²	3	3.4 Å²	3.4	1%	0.014	3%	0.026	C	C	.	.	H	α-helix	trans	-64.8	-35.7	-174.6	-59.7	-48.9	145.5	0	0	112.8	A193 H194 A195 T207 F209 V230 A231 G236 H237 A238	A193-E234 HydrophobicContact CB-CG 3.53Å; H194-E234 WeakPolarHBondContact CA-OE2 3.37Å; A195-E234 HydrophobicContact CB-CB 4.17Å; A195-E234 VanDerWaalsContact CB-O 3.27Å; A195-E234 WeakPolarHBondContact CB-O 3.46Å; A195-E234 PolarHBondContact N-OE2 3Å; A195-E234 VanDerWaalsContact N-OE2 3.15Å; T207-E234 HydrophobicContact CG2-CB 3.49Å; T207-E234 VanDerWaalsContact CG2-CB 3.49Å; T207-E234 HydrophobicContact CG2-CG 4.21Å; F209-E234 HydrophobicContact CE1-CG 4.41Å; V230-E234 HydrophobicContact CG1-CG 4.02Å; V230-E234 WeakPolarHBondContact O-CG 3.44Å; V230-E234 PolarHBondContact O-N 2.88Å; A231-E234 PolarHBondContact O-N 2.79Å; E234-G236 PolarHBondContact O-N 3.11Å; E234-H237 WeakPolarHBondContact O-CA 3.33Å; E234-H237 VanDerWaalsContact O-CB 3.32Å; E234-H237 WeakPolarHBondContact O-CB 3.23Å; E234-H237 PolarHBondContact O-N 2.9Å; E234-H237 IonicContact OE2-CD2 3.29Å; E234-A238 PolarHBondContact O-N 3.15Å
235	F	98.4	Very high	92.5	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-66.6	-24.5	173.3	-64.5	-33.5	0	0	0	113.1	M142 A145 L146 I170 I172 T207 A231 H233 H237 A238 L239	M142-F235 HydrophobicContact CB-CE2 4.42Å; M142-F235 HydrophobicContact CB-CZ 4.42Å; M142-F235 HydrophobicContact SD-CE2 3.9Å; M142-F235 HydrophobicContact SD-CZ 3.64Å; A145-F235 HydrophobicContact CB-CD2 3.71Å; A145-F235 HydrophobicContact CB-CE2 3.8Å; L146-F235 HydrophobicContact CD1-CE2 4.34Å; L146-F235 HydrophobicContact CD2-CB 3.97Å; L146-F235 HydrophobicContact CD2-CD1 3.89Å; L146-F235 HydrophobicContact CD2-CD2 3.54Å; L146-F235 HydrophobicContact CD2-CE1 4.27Å; L146-F235 HydrophobicContact CD2-CE2 3.94Å; L146-F235 HydrophobicContact CD2-CG 3.52Å; L146-F235 HydrophobicContact CD2-CZ 4.3Å; L146-F235 HydrophobicContact CG-CD2 3.63Å; L146-F235 HydrophobicContact CG-CE2 3.66Å; L146-F235 HydrophobicContact CG-CG 4.16Å; L146-F235 HydrophobicContact CG-CZ 4.21Å; I170-F235 HydrophobicContact CG2-CD1 4.27Å; I170-F235 HydrophobicContact CG2-CE1 3.93Å; I172-F235 HydrophobicContact CD1-CE1 3.93Å; I172-F235 HydrophobicContact CD1-CZ 3.51Å; I172-F235 HydrophobicContact CG1-CE1 3.85Å; I172-F235 HydrophobicContact CG1-CZ 3.89Å; T207-F235 HydrophobicContact CG2-CD1 4.39Å; T207-F235 HydrophobicContact CG2-CE1 4.1Å; A231-F235 HydrophobicContact CB-CD2 4.46Å; A231-F235 HydrophobicContact CB-CE2 4.08Å; A231-F235 WeakPolarHBondContact O-CB 3.44Å; A231-F235 WeakPolarHBondContact O-CD2 3.39Å; A231-F235 VanDerWaalsContact O-CG 3.27Å; A231-F235 WeakPolarHBondContact O-CG 3.2Å; A231-F235 PolarHBondContact O-N 3.07Å; H233-F235 VanDerWaalsContact C-N 3.32Å; H233-F235 PolarHBondContact O-N 3.36Å; F235-H237 VanDerWaalsContact C-N 3.31Å; F235-H237 PolarHBondContact O-N 3.26Å; F235-A238 PolarHBondContact O-N 3.39Å; F235-L239 WeakPolarHBondContact O-CB 3.5Å; F235-L239 WeakPolarHBondContact O-CG 3.49Å; F235-L239 PolarHBondContact O-N 3.38Å
236	G	95.7	Very high	91.8	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-59.8	-44.1	167.7	0	0	0	0	0	111.7	V232 H233 E234 L239 G240 L241	V232-G236 PolarHBondContact O-N 2.67Å; H233-G236 WeakPolarHBondContact O-CA 3.35Å; H233-G236 PolarHBondContact O-N 2.82Å; E234-G236 PolarHBondContact O-N 3.11Å; G236-L239 CarbonylContact O-C 3.58Å; G236-L239 PolarHBondContact O-N 3.24Å; G236-L239 VanDerWaalsContact O-N 3.16Å; G236-G240 PolarHBondContact O-N 2.88Å; G236-L241 VanDerWaalsContact O-CB 3.23Å; G236-L241 WeakPolarHBondContact O-CB 3.48Å; G236-L241 PolarHBondContact O-N 3.47Å
237	H	91.3	Very high	91	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.005	5%	0.051	C	C	.	.	H	α-helix	trans	-63.5	-46	173.8	-69.3	-46.2	0	0	0	112.4	L92 A195 F197 H233 E234 F235 L239 G240 L241 H243 M251	L92-H237 HydrophobicContact CD1-CB 4.1Å; A195-H237 HydrophobicContact CB-CB 3.96Å; F197-H237 VanDerWaalsContact CD1-O 3.23Å; F197-H237 WeakPolarHBondContact CD1-O 3.36Å; F197-H237 HydrophobicContact CE1-CB 4.25Å; F197-H237 AromaticContact CE1-ND1 3.76Å; H233-H237 AromaticContact CD2-CD2 3.73Å; H233-H237 AromaticContact CD2-NE2 3.67Å; H233-H237 AromaticContact NE2-CD2 3.64Å; H233-H237 AromaticContact NE2-NE2 3.07Å; H233-H237 PolarHBondContact NE2-NE2 3.15Å; H233-H237 PolarHBondContact O-N 2.88Å; E234-H237 WeakPolarHBondContact O-CA 3.33Å; E234-H237 VanDerWaalsContact O-CB 3.32Å; E234-H237 WeakPolarHBondContact O-CB 3.23Å; E234-H237 PolarHBondContact O-N 2.9Å; E234-H237 IonicContact OE2-CD2 3.29Å; F235-H237 VanDerWaalsContact C-N 3.31Å; F235-H237 PolarHBondContact O-N 3.26Å; H237-L239 PolarHBondContact O-N 3.43Å; H237-G240 PolarHBondContact O-N 2.98Å; H237-L241 WeakPolarHBondContact CA-O 3.46Å; H237-L241 PolarHBondContact ND1-O 2.87Å; H237-H243 AromaticContact CE1-CD2 3.42Å; H237-H243 PolarHBondContact CE1-CD2 2.85Å; H237-H243 VanDerWaalsContact CE1-CD2 3.42Å; H237-H243 AromaticContact CE1-NE2 3.68Å; H237-H243 AromaticContact NE2-CD2 3.37Å; H237-H243 PolarHBondContact NE2-CD2 2.95Å; H237-H243 AromaticContact NE2-NE2 3.23Å; H237-H243 PolarHBondContact NE2-NE2 3.17Å; H237-M251 WeakPolarHBondContact CE1-CE 3.35Å; H237-M251 WeakPolarHBondContact ND1-CE 3.45Å
238	A	94.8	Very high	90.4	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-58	-22.3	174.4	0	0	0	0	0	112.9	W115 I170 A195 P198 G205 E234 F235	W115-A238 PolarHBondContact NE1-O 3.45Å; I170-A238 HydrophobicContact CD1-CB 4.26Å; A195-A238 HydrophobicContact CB-CB 4.21Å; P198-A238 WeakPolarHBondContact CD-O 3.19Å; P198-A238 WeakPolarHBondContact CG-O 3.32Å; G205-A238 WeakPolarHBondContact O-CB 3.35Å; E234-A238 PolarHBondContact O-N 3.15Å; F235-A238 PolarHBondContact O-N 3.39Å
239	L	94.7	Very high	90	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-1.7	174.9	-65.3	177	0	0	0	114.3	L120 W149 L155 F157 F235 G236 H237 L275 Y279	L120-L239 HydrophobicContact CD1-CD2 3.57Å; W149-L239 HydrophobicContact CB-CD1 3.49Å; W149-L239 VanDerWaalsContact CB-CD1 3.49Å; W149-L239 HydrophobicContact CD2-CD1 4.11Å; W149-L239 HydrophobicContact CG-CD1 3.61Å; L155-L239 HydrophobicContact CD1-CD1 4.17Å; L155-L239 HydrophobicContact CD1-CD2 3.6Å; L155-L239 HydrophobicContact CD1-CG 4.43Å; F157-L239 HydrophobicContact CE1-CD2 4.1Å; F157-L239 HydrophobicContact CZ-CD1 4.06Å; F157-L239 HydrophobicContact CZ-CD2 4.01Å; F235-L239 WeakPolarHBondContact O-CB 3.5Å; F235-L239 WeakPolarHBondContact O-CG 3.49Å; F235-L239 PolarHBondContact O-N 3.38Å; G236-L239 CarbonylContact O-C 3.58Å; G236-L239 PolarHBondContact O-N 3.24Å; G236-L239 VanDerWaalsContact O-N 3.16Å; H237-L239 PolarHBondContact O-N 3.43Å; L239-L275 HydrophobicContact CD1-CD1 4.08Å; L239-Y279 HydrophobicContact CB-CE2 4.2Å; L239-Y279 WeakPolarHBondContact O-CE2 2.89Å; L239-Y279 VanDerWaalsContact O-CZ 3.3Å; L239-Y279 PolarHBondContact O-OH 2.91Å
240	G	81.8	Confident	90	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.2	3.9	173.6	0	0	0	0	0	115.5	S111 P198 G236 H237	S111-G240 WeakPolarHBondContact CB-O 3.41Å; S111-G240 PolarHBondContact N-O 3.19Å; P198-G240 VanDerWaalsContact CD-CA 3.45Å; P198-G240 VanDerWaalsContact CD-N 3.32Å; G236-G240 PolarHBondContact O-N 2.88Å; H237-G240 PolarHBondContact O-N 2.98Å
241	L	85.3	Confident	89.8	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.5	179.3	-60.4	169.1	0	0	0	109.8	Y108 L110 W149 F197 G236 H237 M251 L275 L278	Y108-L241 HydrophobicContact CD1-CD2 4.42Å; Y108-L241 HydrophobicContact CE1-CB 3.65Å; Y108-L241 HydrophobicContact CE1-CD2 3.47Å; Y108-L241 VanDerWaalsContact CE1-CD2 3.47Å; Y108-L241 HydrophobicContact CE1-CG 4.05Å; Y108-L241 WeakPolarHBondContact OH-CB 3.26Å; Y108-L241 WeakPolarHBondContact OH-CD1 3.09Å; L110-L241 HydrophobicContact CD2-CD2 3.92Å; W149-L241 HydrophobicContact CE3-CD1 3.84Å; W149-L241 HydrophobicContact CH2-CD1 3.45Å; W149-L241 VanDerWaalsContact CH2-CD1 3.45Å; W149-L241 HydrophobicContact CZ2-CD1 4.3Å; W149-L241 HydrophobicContact CZ3-CD1 3.17Å; F197-L241 WeakPolarHBondContact CE1-O 3.49Å; G236-L241 VanDerWaalsContact O-CB 3.23Å; G236-L241 WeakPolarHBondContact O-CB 3.48Å; G236-L241 PolarHBondContact O-N 3.47Å; H237-L241 WeakPolarHBondContact CA-O 3.46Å; H237-L241 PolarHBondContact ND1-O 2.87Å; L241-M251 HydrophobicContact CB-CE 4.35Å; L241-M251 HydrophobicContact CB-CG 4.5Å; L241-L275 HydrophobicContact CD1-CB 4.26Å; L241-L275 HydrophobicContact CD1-CD1 4.15Å; L241-L278 HydrophobicContact CD2-CD1 3.65Å; L241-L278 HydrophobicContact CD2-CG 4.37Å; L241-L278 HydrophobicContact CG-CD1 4.14Å
242	G	81.8	Confident	89.5	Confident	1 Å²	1	16.3 Å²	16.3	1%	0.01	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-177.3	170.9	0	0	0	0	0	111.9	A109	A109-G242 CarbonylContact O-C 3.24Å; A109-G242 WeakPolarHBondContact O-CA 3.44Å; A109-G242 PolarHBondContact O-N 2.94Å
243	H	84.9	Confident	89.1	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.009	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	146.7	178.9	-70.6	151.4	0	0	0	113.2	F68 C90 L92 D94 A109 H233 H237 M251	F68-H243 HydrophobicContact CE1-CB 4.03Å; F68-H243 HydrophobicContact CZ-CB 3.73Å; C90-H243 WeakPolarHBondContact CB-NE2 3.26Å; C90-H243 PolarHBondContact SG-NE2 3.29Å; C90-H243 VanDerWaalsContact SG-NE2 3.43Å; L92-H243 PolarHBondContact O-CE1 3.05Å; D94-H243 IonicContact OD1-CE1 3.01Å; D94-H243 PolarHBondContact OD1-CE1 3Å; D94-H243 IonicContact OD1-CG 2.6Å; D94-H243 IonicContact OD1-ND1 2.74Å; D94-H243 PolarHBondContact OD1-ND1 2.86Å; A109-H243 PolarHBondContact N-O 3.3Å; H233-H243 AromaticContact CE1-CD2 3.61Å; H233-H243 AromaticContact CE1-NE2 3.72Å; H233-H243 AromaticContact NE2-CD2 3.6Å; H233-H243 AromaticContact NE2-NE2 3.37Å; H233-H243 PolarHBondContact NE2-NE2 2.96Å; H237-H243 AromaticContact CE1-CD2 3.42Å; H237-H243 PolarHBondContact CE1-CD2 2.85Å; H237-H243 VanDerWaalsContact CE1-CD2 3.42Å; H237-H243 AromaticContact CE1-NE2 3.68Å; H237-H243 AromaticContact NE2-CD2 3.37Å; H237-H243 PolarHBondContact NE2-CD2 2.95Å; H237-H243 AromaticContact NE2-NE2 3.23Å; H237-H243 PolarHBondContact NE2-NE2 3.17Å; H243-M251 CarbonylContact C-O 3.58Å; H243-M251 VanDerWaalsContact CA-O 3.24Å; H243-M251 WeakPolarHBondContact CA-O 3.32Å
244	S	84.1	Confident	88.8	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.7	173	-174.4	0	0	0	0	112	R107 A246 S249 M251 R252 D270	R107-S244 WeakPolarHBondContact O-CA 3.34Å; R107-S244 PolarHBondContact O-OG 3.16Å; S244-A246 WeakPolarHBondContact OG-CB 3.49Å; S244-A246 PolarHBondContact OG-N 2.96Å; S244-S249 WeakPolarHBondContact CB-OG 3.33Å; S244-M251 PolarHBondContact N-O 2.8Å; S244-R252 WeakPolarHBondContact O-CG 3.41Å; S244-D270 PolarHBondContact OG-OD2 2.89Å
245	S	80.8	Confident	88.5	Confident	32 Å²	32	18.8 Å²	18.8	22%	0.224	10%	0.103	C	C	.	.			trans	-85.7	-7.4	167.2	65.9	0	0	0	0	113.1	F68 R107	F68-S245 WeakPolarHBondContact O-CB 3.12Å; R107-S245 PolarHBondContact O-N 3.36Å; R107-S245 PolarHBondContact O-OG 3.32Å
246	A	79	Confident	88	Confident	11 Å²	11	23.5 Å²	23.5	9%	0.091	12%	0.124	C	C	.	.			trans	-67.4	134.3	-173.6	0	0	0	0	0	111.7	S244 N248 S249 R252 D270	S244-A246 WeakPolarHBondContact OG-CB 3.49Å; S244-A246 PolarHBondContact OG-N 2.96Å; A246-N248 VanDerWaalsContact C-N 3.26Å; A246-N248 PolarHBondContact O-N 2.97Å; A246-N248 VanDerWaalsContact O-N 3.13Å; A246-S249 PolarHBondContact O-N 2.87Å; A246-R252 WeakPolarHBondContact O-CD 3.36Å; A246-R252 VanDerWaalsContact O-CG 3.3Å; A246-R252 WeakPolarHBondContact O-CG 3.23Å; A246-R252 PolarHBondContact O-NE 2.68Å; A246-D270 HydrophobicContact CB-CB 4.04Å; A246-D270 VanDerWaalsContact CB-OD2 3.23Å; A246-D270 WeakPolarHBondContact CB-OD2 3.42Å
247	P	77.3	Confident	87.8	Confident	90 Å²	90	24.2 Å²	24.2	58%	0.584	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-32	-170.7	-25.5	32.8	0	0	0	115.4	Q256	P247-Q256 PolarHBondContact O-OE1 2.7Å; P247-Q256 VanDerWaalsContact O-OE1 3.11Å
248	N	83.3	Confident	87.7	Confident	135 Å²	135	27.6 Å²	27.6	72%	0.722	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.6	12.4	-174.6	-56.4	-13.9	0	0	0	112.1	A246 S268	A246-N248 VanDerWaalsContact C-N 3.26Å; A246-N248 PolarHBondContact O-N 2.97Å; A246-N248 VanDerWaalsContact O-N 3.13Å; N248-S268 VanDerWaalsContact O-CB 3.28Å; N248-S268 WeakPolarHBondContact O-CB 3.1Å
249	S	89.9	Confident	87.4	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.007	17%	0.167	C	C	.	.			trans	-77.8	138.5	177.6	161.7	0	0	0	0	109.6	S244 A246 M251 R252 Q256 D271	S244-S249 WeakPolarHBondContact CB-OG 3.33Å; A246-S249 PolarHBondContact O-N 2.87Å; S249-M251 PolarHBondContact OG-N 2.77Å; S249-R252 PolarHBondContact O-N 2.69Å; S249-Q256 PolarHBondContact O-NE2 2.83Å; S249-D271 VanDerWaalsContact CA-OD2 3.29Å; S249-D271 WeakPolarHBondContact CA-OD2 3.29Å; S249-D271 WeakPolarHBondContact CB-OD1 3.28Å; S249-D271 PolarHBondContact OG-OD1 3Å
250	I	95.2	Very high	87	Confident	14 Å²	14	32 Å²	32	7%	0.072	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-29.8	172.3	-163.4	56.1	0	0	0	111	W149 V232 H233 R252 V259 Y265 L267 D271	W149-I250 HydrophobicContact CH2-CG2 4.04Å; W149-I250 HydrophobicContact CZ2-CG2 3.9Å; V232-I250 HydrophobicContact CB-CG1 4.04Å; V232-I250 HydrophobicContact CG1-CB 4.36Å; V232-I250 HydrophobicContact CG1-CG1 3.71Å; V232-I250 HydrophobicContact CG1-CG2 3.96Å; H233-I250 HydrophobicContact CB-CG1 4.35Å; H233-I250 PolarHBondContact ND1-O 2.8Å; I250-R252 PolarHBondContact O-N 2.89Å; I250-R252 VanDerWaalsContact O-N 3.1Å; I250-V259 HydrophobicContact CD1-CG1 3.86Å; I250-Y265 VanDerWaalsContact CB-OH 3.29Å; I250-Y265 WeakPolarHBondContact CB-OH 3.5Å; I250-Y265 WeakPolarHBondContact CG1-OH 3.16Å; I250-L267 HydrophobicContact CG2-CD2 4.17Å; I250-D271 PolarHBondContact N-OD2 2.77Å
251	M	93.9	Very high	87.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	14.3	175	-61.8	-46.6	-67.9	0	0	114.5	Y108 W149 H233 H237 L241 H243 S244 S249	Y108-M251 HydrophobicContact CE2-CB 3.88Å; Y108-M251 HydrophobicContact CE2-CG 4.09Å; Y108-M251 WeakPolarHBondContact OH-CG 3.45Å; W149-M251 HydrophobicContact CH2-CG 4.08Å; W149-M251 HydrophobicContact CH2-SD 4.1Å; W149-M251 HydrophobicContact CZ2-CG 4.5Å; W149-M251 HydrophobicContact CZ2-SD 3.94Å; H233-M251 WeakPolarHBondContact ND1-CA 3.16Å; H233-M251 VanDerWaalsContact O-CE 3.23Å; H233-M251 WeakPolarHBondContact O-CE 3.47Å; H237-M251 WeakPolarHBondContact CE1-CE 3.35Å; H237-M251 WeakPolarHBondContact ND1-CE 3.45Å; L241-M251 HydrophobicContact CB-CE 4.35Å; L241-M251 HydrophobicContact CB-CG 4.5Å; H243-M251 CarbonylContact C-O 3.58Å; H243-M251 VanDerWaalsContact CA-O 3.24Å; H243-M251 WeakPolarHBondContact CA-O 3.32Å; S244-M251 PolarHBondContact N-O 2.8Å; S249-M251 PolarHBondContact OG-N 2.77Å
252	R	92.9	Very high	87.4	Confident	41 Å²	41	36.2 Å²	36.2	16%	0.155	21%	0.213	C	C	.	.			trans	-66.5	138	166.2	-101.9	-177.6	149.9	-132.8	-12.5	109.6	A69 H233 S244 A246 S249 I250 F254 Q256	A69-R252 VanDerWaalsContact C-NH2 3.33Å; A69-R252 PolarHBondContact O-NH2 2.8Å; H233-R252 PolarHBondContact CE1-O 2.79Å; H233-R252 PolarHBondContact ND1-O 3.34Å; S244-R252 WeakPolarHBondContact O-CG 3.41Å; A246-R252 WeakPolarHBondContact O-CD 3.36Å; A246-R252 VanDerWaalsContact O-CG 3.3Å; A246-R252 WeakPolarHBondContact O-CG 3.23Å; A246-R252 PolarHBondContact O-NE 2.68Å; S249-R252 PolarHBondContact O-N 2.69Å; I250-R252 PolarHBondContact O-N 2.89Å; I250-R252 VanDerWaalsContact O-N 3.1Å; R252-F254 VanDerWaalsContact C-N 3.3Å; R252-F254 PolarHBondContact O-N 2.83Å; R252-Q256 VanDerWaalsContact CB-NE2 3.31Å
253	P	89.3	Confident	87.3	Confident	4 Å²	4	40.2 Å²	40.2	3%	0.026	23%	0.234	C	C	.	.	S	Bend	trans	-64.5	-36.7	-175.1	22.5	-32.7	0	0	0	112.6	F68 R89 C90 D94	F68-P253 HydrophobicContact CD1-CG 4.29Å; F68-P253 HydrophobicContact CE1-CG 3.85Å; R89-P253 CarbonylContact C-O 3.47Å; R89-P253 WeakPolarHBondContact CA-O 3.32Å; R89-P253 WeakPolarHBondContact CB-O 3.48Å; R89-P253 VanDerWaalsContact NH2-CB 3.27Å; C90-P253 PolarHBondContact N-O 2.82Å; D94-P253 VanDerWaalsContact OD1-CB 3.25Å; D94-P253 WeakPolarHBondContact OD1-CB 3.36Å; D94-P253 WeakPolarHBondContact OD1-CG 3.42Å
254	F	91.9	Very high	87.3	Confident	10 Å²	10	48.1 Å²	48.1	4%	0.044	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-82	135.4	-177.9	-50.5	-76.3	0	0	0	110.9	W35 A69 T84 K87 R89 R252 Q256	W35-F254 HydrophobicContact CH2-CE1 4.42Å; W35-F254 HydrophobicContact CH2-CZ 4.17Å; W35-F254 HydrophobicContact CZ2-CE1 4.01Å; W35-F254 HydrophobicContact CZ2-CZ 4.22Å; A69-F254 HydrophobicContact CB-CE2 3.78Å; A69-F254 HydrophobicContact CB-CZ 4.3Å; T84-F254 HydrophobicContact CG2-CD1 4.43Å; T84-F254 HydrophobicContact CG2-CD2 4.44Å; T84-F254 HydrophobicContact CG2-CE1 3.98Å; T84-F254 HydrophobicContact CG2-CE2 4.02Å; T84-F254 HydrophobicContact CG2-CZ 3.76Å; T84-F254 WeakPolarHBondContact O-CE1 3.24Å; K87-F254 HydrophobicContact CB-CD1 4.11Å; R89-F254 HydrophobicContact CB-CD1 4.15Å; R252-F254 VanDerWaalsContact C-N 3.3Å; R252-F254 PolarHBondContact O-N 2.83Å; F254-Q256 PolarHBondContact O-N 2.89Å
255	Y	93.2	Very high	87.6	Confident	53 Å²	53	49.2 Å²	49.2	21%	0.208	27%	0.273	C	S	.	.			trans	-61	132.1	174.7	179.3	-117.8	0	0	0	111.4	P88 L192 T225 D226 A229 V230 G257	P88-Y255 WeakPolarHBondContact O-CB 3.35Å; P88-Y255 PolarHBondContact O-N 2.89Å; L192-Y255 HydrophobicContact CD1-CD1 4.41Å; L192-Y255 HydrophobicContact CD1-CD2 3.92Å; L192-Y255 HydrophobicContact CD1-CG 3.72Å; T225-Y255 HydrophobicContact CG2-CE2 4.24Å; D226-Y255 HydrophobicContact CB-CE2 4.48Å; D226-Y255 VanDerWaalsContact CB-OH 3.28Å; D226-Y255 WeakPolarHBondContact CB-OH 3.23Å; D226-Y255 PolarHBondContact N-OH 2.87Å; A229-Y255 HydrophobicContact CB-CE2 4.28Å; V230-Y255 HydrophobicContact CG2-CD2 4Å; V230-Y255 HydrophobicContact CG2-CE2 4.06Å; Y255-G257 WeakPolarHBondContact OH-CA 3.41Å
256	Q	88.1	Confident	87.9	Confident	98 Å²	98	54.2 Å²	54.2	46%	0.458	29%	0.287	S	S	.	.			trans	-109.7	2.9	-174.5	-70.9	174.5	77.6	0	0	113.4	P247 S249 R252 F254	P247-Q256 PolarHBondContact O-OE1 2.7Å; P247-Q256 VanDerWaalsContact O-OE1 3.11Å; S249-Q256 PolarHBondContact O-NE2 2.83Å; R252-Q256 VanDerWaalsContact CB-NE2 3.31Å; F254-Q256 PolarHBondContact O-N 2.89Å
257	G	89.6	Confident	88.4	Confident	15 Å²	15	54.1 Å²	54.1	16%	0.155	29%	0.285	C	S	.	.			trans	90.6	-176.8	-173.4	0	0	0	0	0	113.4	Y255	Y255-G257 WeakPolarHBondContact OH-CA 3.41Å
258	P	90.5	Very high	88.9	Confident	73 Å²	73	50.5 Å²	50.5	47%	0.474	26%	0.262	S	S	.	.			trans	-60.4	141.9	177.2	-17.5	27.2	0	0	0	112.5	D226	D226-P258 HydrophobicContact CB-CB 3.94Å; D226-P258 HydrophobicContact CB-CG 3.93Å
259	V	88.3	Confident	88.9	Confident	46 Å²	46	47.7 Å²	47.7	28%	0.279	25%	0.251	S	S	.	.			trans	-100.7	13.6	-178.7	-63.9	0	0	0	0	113.9	F228 A229 I250 Y265	F228-V259 HydrophobicContact CD1-CG2 3.52Å; F228-V259 HydrophobicContact CE1-CG2 3.56Å; A229-V259 HydrophobicContact CB-CG1 3.96Å; A229-V259 HydrophobicContact CB-CG2 4.1Å; I250-V259 HydrophobicContact CD1-CG1 3.86Å; V259-Y265 HydrophobicContact CB-CD2 3.69Å; V259-Y265 HydrophobicContact CB-CE2 3.61Å; V259-Y265 HydrophobicContact CG1-CE2 4.08Å; V259-Y265 HydrophobicContact CG2-CD2 3.53Å; V259-Y265 HydrophobicContact CG2-CE2 3.64Å; V259-Y265 HydrophobicContact CG2-CG 4.28Å
260	G	86.5	Confident	88.5	Confident	46 Å²	46	48.6 Å²	48.6	47%	0.474	26%	0.256	S	S	.	.			trans	87.2	-152.7	178.9	0	0	0	0	0	113.2
261	N	85.1	Confident	88.2	Confident	79 Å²	79	48 Å²	48	42%	0.422	25%	0.252	S	S	.	.			trans	-76.4	126.4	-173.1	-177.5	-30.1	0	0	0	111.3	D263 K264 Y265	N261-D263 VanDerWaalsContact C-N 3.33Å; N261-D263 PolarHBondContact O-N 3.05Å; N261-D263 PolarHBondContact OD1-N 2.89Å; N261-K264 PolarHBondContact O-N 3.12Å; N261-Y265 PolarHBondContact O-N 2.83Å
262	P	89	Confident	88	Confident	9 Å²	9	51.9 Å²	51.9	6%	0.058	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-50.3	-42.3	178.8	-29.3	35.6	0	0	0	115.5	L141 Y144 F217 F228 K264 Y265	L141-P262 HydrophobicContact CD2-CG 3.97Å; Y144-P262 HydrophobicContact CD1-CB 4.11Å; Y144-P262 HydrophobicContact CD2-CB 3.97Å; Y144-P262 HydrophobicContact CG-CB 3.67Å; F217-P262 HydrophobicContact CE2-CG 3.58Å; F217-P262 VanDerWaalsContact CZ-CD 3.49Å; F217-P262 HydrophobicContact CZ-CG 3.64Å; F228-P262 HydrophobicContact CD1-CB 4.46Å; F228-P262 HydrophobicContact CD1-CG 4.03Å; F228-P262 HydrophobicContact CD2-CB 4.08Å; F228-P262 HydrophobicContact CD2-CG 3.94Å; F228-P262 HydrophobicContact CE1-CB 4.09Å; F228-P262 HydrophobicContact CE1-CG 4.12Å; F228-P262 HydrophobicContact CE2-CB 3.66Å; F228-P262 HydrophobicContact CE2-CG 4.03Å; F228-P262 HydrophobicContact CG-CB 4.47Å; F228-P262 HydrophobicContact CG-CG 3.94Å; F228-P262 HydrophobicContact CZ-CB 3.68Å; F228-P262 HydrophobicContact CZ-CG 4.13Å; P262-K264 PolarHBondContact O-N 2.86Å; P262-Y265 PolarHBondContact O-N 3.06Å
263	D	80.1	Confident	87.5	Confident	86 Å²	86	53.5 Å²	53.5	46%	0.46	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-62.7	-31.9	-179.6	-69.6	-55.4	0	0	0	113.1	Y144 N261 R266	Y144-D263 WeakPolarHBondContact CE1-OD1 3.27Å; Y144-D263 PolarHBondContact OH-OD1 3.1Å; N261-D263 VanDerWaalsContact C-N 3.33Å; N261-D263 PolarHBondContact O-N 3.05Å; N261-D263 PolarHBondContact OD1-N 2.89Å; D263-R266 PolarHBondContact O-NH1 2.76Å
264	K	86.2	Confident	87.1	Confident	167 Å²	167	53.4 Å²	53.4	73%	0.726	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-99.7	-9.4	-175.1	-62.5	-177.6	-177.7	177.1	0	112.4	N261 P262	N261-K264 PolarHBondContact O-N 3.12Å; P262-K264 PolarHBondContact O-N 2.86Å
265	Y	89.8	Confident	87	Confident	23 Å²	23	52.9 Å²	52.9	9%	0.09	28%	0.276	C	S	.	.			trans	-64.2	137.7	179.7	178.7	-98.6	0	0	0	110.3	A148 F228 V232 I250 V259 N261 P262 L267	A148-Y265 HydrophobicContact CB-CD1 3.86Å; A148-Y265 HydrophobicContact CB-CE1 4.06Å; F228-Y265 HydrophobicContact CE1-CD1 4.21Å; F228-Y265 HydrophobicContact CE1-CD2 4.32Å; F228-Y265 AromaticContact CE1-CG 3.83Å; F228-Y265 HydrophobicContact CE1-CG 3.83Å; F228-Y265 HydrophobicContact CZ-CD1 4.07Å; F228-Y265 HydrophobicContact CZ-CG 4.07Å; V232-Y265 HydrophobicContact CG1-CE1 3.69Å; V232-Y265 HydrophobicContact CG2-CD1 4.47Å; V232-Y265 HydrophobicContact CG2-CE1 4.2Å; I250-Y265 VanDerWaalsContact CB-OH 3.29Å; I250-Y265 WeakPolarHBondContact CB-OH 3.5Å; I250-Y265 WeakPolarHBondContact CG1-OH 3.16Å; V259-Y265 HydrophobicContact CB-CD2 3.69Å; V259-Y265 HydrophobicContact CB-CE2 3.61Å; V259-Y265 HydrophobicContact CG1-CE2 4.08Å; V259-Y265 HydrophobicContact CG2-CD2 3.53Å; V259-Y265 HydrophobicContact CG2-CE2 3.64Å; V259-Y265 HydrophobicContact CG2-CG 4.28Å; N261-Y265 PolarHBondContact O-N 2.83Å; P262-Y265 PolarHBondContact O-N 3.06Å; Y265-L267 HydrophobicContact CE1-CD2 3.96Å
266	R	86.9	Confident	86.8	Confident	137 Å²	137	52 Å²	52	52%	0.517	27%	0.274	S	S	.	.			trans	-137.7	140.3	178.5	-65.5	-64	-179.2	-88.5	3.4	109	D263	D263-R266 PolarHBondContact O-NH1 2.76Å
267	L	89.9	Confident	86.6	Confident	9 Å²	9	53.1 Å²	53.1	5%	0.047	28%	0.279	C	S	.	.			trans	-63.3	146.3	178.2	-66.5	178.2	0	0	0	111	A148 W149 E152 V232 I250 Y265 D271 L275	A148-L267 WeakPolarHBondContact O-CD1 3.43Å; W149-L267 HydrophobicContact CD2-CD1 3.91Å; W149-L267 HydrophobicContact CD2-CD2 4.22Å; W149-L267 HydrophobicContact CE3-CD1 3.29Å; W149-L267 HydrophobicContact CE3-CD2 4.12Å; W149-L267 HydrophobicContact CE3-CG 4.37Å; W149-L267 HydrophobicContact CH2-CD1 4.33Å; W149-L267 HydrophobicContact CH2-CD2 3.91Å; W149-L267 HydrophobicContact CZ2-CD2 4.02Å; W149-L267 HydrophobicContact CZ3-CD1 3.52Å; W149-L267 HydrophobicContact CZ3-CD2 3.95Å; W149-L267 HydrophobicContact CZ3-CG 4.39Å; E152-L267 HydrophobicContact CB-CD1 4.14Å; E152-L267 HydrophobicContact CG-CB 4.46Å; E152-L267 HydrophobicContact CG-CD1 4.01Å; E152-L267 HydrophobicContact CG-CG 4.44Å; V232-L267 HydrophobicContact CG1-CD2 4.21Å; I250-L267 HydrophobicContact CG2-CD2 4.17Å; Y265-L267 HydrophobicContact CE1-CD2 3.96Å; L267-D271 HydrophobicContact CB-CB 4.22Å; L267-D271 HydrophobicContact CD2-CB 4.35Å; L267-L275 HydrophobicContact CD1-CD2 4.42Å
268	S	88.1	Confident	86.3	Confident	15 Å²	15	54 Å²	54	11%	0.105	28%	0.28	C	S	.	.			trans	-64.9	156.5	171.9	85.1	0	0	0	0	109.9	N248 D270 D271 R272	N248-S268 VanDerWaalsContact O-CB 3.28Å; N248-S268 WeakPolarHBondContact O-CB 3.1Å; S268-D270 PolarHBondContact O-N 3.37Å; S268-D270 VanDerWaalsContact O-N 3.13Å; S268-D270 PolarHBondContact OG-N 2.75Å; S268-D271 VanDerWaalsContact CB-OD2 3.31Å; S268-D271 WeakPolarHBondContact CB-OD2 3.47Å; S268-D271 PolarHBondContact O-N 3.11Å; S268-D271 VanDerWaalsContact OG-CG 3.29Å; S268-D271 PolarHBondContact OG-N 3.46Å; S268-D271 PolarHBondContact OG-OD2 2.98Å; S268-R272 WeakPolarHBondContact O-CB 3.23Å; S268-R272 PolarHBondContact O-N 2.89Å
269	P	83.2	Confident	86.1	Confident	76 Å²	76	50.7 Å²	50.7	49%	0.494	26%	0.258	S	S	.	.	H	α-helix	trans	-54.4	-33.3	174.9	-27.1	35.3	0	0	0	113.4	D273	P269-D273 VanDerWaalsContact O-CB 3.23Å; P269-D273 WeakPolarHBondContact O-CB 3.23Å; P269-D273 PolarHBondContact O-N 3.45Å
270	D	81.8	Confident	85.9	Confident	20 Å²	20	50 Å²	50	11%	0.107	26%	0.26	C	S	.	.	H	α-helix	trans	-70.8	-42.2	-178.8	-162.8	70.2	0	0	0	111.5	R107 Y108 S244 A246 S268 G274	R107-D270 IonicContact CZ-OD1 3.91Å; R107-D270 IonicContact NE-OD1 3.52Å; R107-D270 IonicContact NH2-OD1 3.9Å; Y108-D270 VanDerWaalsContact CD2-OD2 3.24Å; Y108-D270 WeakPolarHBondContact CD2-OD2 3.43Å; S244-D270 PolarHBondContact OG-OD2 2.89Å; A246-D270 HydrophobicContact CB-CB 4.04Å; A246-D270 VanDerWaalsContact CB-OD2 3.23Å; A246-D270 WeakPolarHBondContact CB-OD2 3.42Å; S268-D270 PolarHBondContact O-N 3.37Å; S268-D270 VanDerWaalsContact O-N 3.13Å; S268-D270 PolarHBondContact OG-N 2.75Å; D270-G274 PolarHBondContact O-N 2.99Å
271	D	88.9	Confident	85.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67	-44.1	175.9	-58.3	-52.7	0	0	0	111.6	Y108 W149 S249 I250 L267 S268 G274 L275	Y108-D271 WeakPolarHBondContact CE2-OD1 3.49Å; Y108-D271 PolarHBondContact OH-OD1 2.8Å; W149-D271 HydrophobicContact CH2-CB 4.02Å; W149-D271 HydrophobicContact CZ3-CB 4.12Å; S249-D271 VanDerWaalsContact CA-OD2 3.29Å; S249-D271 WeakPolarHBondContact CA-OD2 3.29Å; S249-D271 WeakPolarHBondContact CB-OD1 3.28Å; S249-D271 PolarHBondContact OG-OD1 3Å; I250-D271 PolarHBondContact N-OD2 2.77Å; L267-D271 HydrophobicContact CB-CB 4.22Å; L267-D271 HydrophobicContact CD2-CB 4.35Å; S268-D271 VanDerWaalsContact CB-OD2 3.31Å; S268-D271 WeakPolarHBondContact CB-OD2 3.47Å; S268-D271 PolarHBondContact O-N 3.11Å; S268-D271 VanDerWaalsContact OG-CG 3.29Å; S268-D271 PolarHBondContact OG-N 3.46Å; S268-D271 PolarHBondContact OG-OD2 2.98Å; D271-G274 PolarHBondContact O-N 3.26Å; D271-L275 WeakPolarHBondContact O-CB 3.3Å; D271-L275 PolarHBondContact O-N 2.93Å
272	R	89.4	Confident	84.3	Confident	82 Å²	82	52.3 Å²	52.3	31%	0.309	26%	0.259	S	S	.	.	H	α-helix	trans	-62.1	-46.7	176.4	176.7	173.1	65.8	-154.8	-6.4	111.9	E152 S268 G274 L275 Q276	E152-R272 HydrophobicContact CB-CG 4.26Å; E152-R272 IonicContact OE1-NH1 3.91Å; E152-R272 WeakPolarHBondContact OE2-CD 3.39Å; E152-R272 IonicContact OE2-NH1 3.54Å; S268-R272 WeakPolarHBondContact O-CB 3.23Å; S268-R272 PolarHBondContact O-N 2.89Å; R272-G274 VanDerWaalsContact C-N 3.25Å; R272-G274 PolarHBondContact O-N 3.48Å; R272-L275 PolarHBondContact O-N 2.76Å; R272-Q276 HydrophobicContact CG-CG 4.21Å; R272-Q276 VanDerWaalsContact CG-NE2 3.32Å; R272-Q276 WeakPolarHBondContact O-CB 3.32Å; R272-Q276 VanDerWaalsContact O-CG 3.24Å; R272-Q276 WeakPolarHBondContact O-CG 3.42Å; R272-Q276 PolarHBondContact O-N 2.77Å
273	D	81.3	Confident	82.5	Confident	76 Å²	76	56.8 Å²	56.8	41%	0.406	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-34.6	178.6	-70.1	-11.7	0	0	0	110.8	P269 Q277	P269-D273 VanDerWaalsContact O-CB 3.23Å; P269-D273 WeakPolarHBondContact O-CB 3.23Å; P269-D273 PolarHBondContact O-N 3.45Å; D273-Q277 VanDerWaalsContact O-CG 3.25Å; D273-Q277 WeakPolarHBondContact O-CG 3.44Å; D273-Q277 PolarHBondContact O-N 2.87Å; D273-Q277 VanDerWaalsContact O-N 3.17Å; D273-Q277 PolarHBondContact O-NE2 2.96Å
274	G	81.7	Confident	80.9	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-63.4	-50.5	172.5	0	0	0	0	0	112.2	D270 D271 R272 Q277	D270-G274 PolarHBondContact O-N 2.99Å; D271-G274 PolarHBondContact O-N 3.26Å; R272-G274 VanDerWaalsContact C-N 3.25Å; R272-G274 PolarHBondContact O-N 3.48Å; G274-Q277 WeakPolarHBondContact O-CB 3.41Å; G274-Q277 PolarHBondContact O-N 2.93Å
275	L	90.4	Very high	78.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.5	-46.9	177.8	-176.2	74.4	0	0	0	112.1	W149 E152 L239 L241 L267 D271 R272 Q277 L278 Y279	W149-L275 HydrophobicContact CB-CD2 4.47Å; W149-L275 HydrophobicContact CE3-CB 4.24Å; W149-L275 HydrophobicContact CE3-CD1 3.84Å; W149-L275 HydrophobicContact CE3-CD2 3.85Å; W149-L275 HydrophobicContact CE3-CG 4.18Å; W149-L275 HydrophobicContact CZ3-CB 4.25Å; W149-L275 HydrophobicContact CZ3-CD1 4.46Å; W149-L275 VanDerWaalsContact O-CD2 3.32Å; W149-L275 WeakPolarHBondContact O-CD2 3.25Å; E152-L275 HydrophobicContact CB-CD2 4.14Å; L239-L275 HydrophobicContact CD1-CD1 4.08Å; L241-L275 HydrophobicContact CD1-CB 4.26Å; L241-L275 HydrophobicContact CD1-CD1 4.15Å; L267-L275 HydrophobicContact CD1-CD2 4.42Å; D271-L275 WeakPolarHBondContact O-CB 3.3Å; D271-L275 PolarHBondContact O-N 2.93Å; R272-L275 PolarHBondContact O-N 2.76Å; L275-Q277 PolarHBondContact O-N 2.87Å; L275-L278 WeakPolarHBondContact O-CB 3.27Å; L275-L278 PolarHBondContact O-N 3.38Å; L275-Y279 HydrophobicContact CD1-CD2 3.71Å; L275-Y279 HydrophobicContact CD1-CE2 4.06Å; L275-Y279 HydrophobicContact CG-CD2 4.33Å; L275-Y279 PolarHBondContact O-N 2.9Å
276	Q	88.4	Confident	76	Confident	34 Å²	34	62.3 Å²	62.3	16%	0.159	33%	0.333	C	S	.	.	H	α-helix	trans	-69.5	-22.5	-177.8	-69.8	176.9	-1.4	0	0	112.6	E152 R272 L278 G280 K281	E152-Q276 WeakPolarHBondContact O-CG 3.23Å; E152-Q276 PolarHBondContact O-NE2 3.14Å; R272-Q276 HydrophobicContact CG-CG 4.21Å; R272-Q276 VanDerWaalsContact CG-NE2 3.32Å; R272-Q276 WeakPolarHBondContact O-CB 3.32Å; R272-Q276 VanDerWaalsContact O-CG 3.24Å; R272-Q276 WeakPolarHBondContact O-CG 3.42Å; R272-Q276 PolarHBondContact O-N 2.77Å; Q276-L278 VanDerWaalsContact C-N 3.29Å; Q276-G280 WeakPolarHBondContact O-CA 3.24Å; Q276-G280 PolarHBondContact O-N 2.82Å; Q276-K281 HydrophobicContact CB-CG 4.37Å; Q276-K281 HydrophobicContact CG-CG 4.13Å; Q276-K281 VanDerWaalsContact OE1-CE 3.22Å
277	Q	84	Confident	73.8	Confident	122 Å²	122	65.5 Å²	65.5	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-67.9	-29.7	168.7	-81.1	168.7	71.9	0	0	112.6	L110 D273 G274 L275	L110-Q277 HydrophobicContact CD1-CB 4.42Å; D273-Q277 VanDerWaalsContact O-CG 3.25Å; D273-Q277 WeakPolarHBondContact O-CG 3.44Å; D273-Q277 PolarHBondContact O-N 2.87Å; D273-Q277 VanDerWaalsContact O-N 3.17Å; D273-Q277 PolarHBondContact O-NE2 2.96Å; G274-Q277 WeakPolarHBondContact O-CB 3.41Å; G274-Q277 PolarHBondContact O-N 2.93Å; L275-Q277 PolarHBondContact O-N 2.87Å
278	L	83.4	Confident	71.4	Confident	32 Å²	32	72.2 Å²	72.2	17%	0.168	38%	0.382	C	S	.	.	H	α-helix	trans	-85.6	-43.6	179	-60.9	-177.7	0	0	0	112	L110 V114 L241 L275 Q276	L110-L278 HydrophobicContact CD1-CD2 4.02Å; L110-L278 HydrophobicContact CD2-CD1 4.23Å; L110-L278 HydrophobicContact CD2-CD2 4.05Å; L110-L278 HydrophobicContact CD2-CG 4.13Å; L110-L278 HydrophobicContact CG-CD2 4.44Å; V114-L278 HydrophobicContact CG1-CB 3.85Å; V114-L278 HydrophobicContact CG1-CD1 4.39Å; V114-L278 HydrophobicContact CG1-CD2 3.65Å; V114-L278 HydrophobicContact CG1-CG 4.16Å; L241-L278 HydrophobicContact CD2-CD1 3.65Å; L241-L278 HydrophobicContact CD2-CG 4.37Å; L241-L278 HydrophobicContact CG-CD1 4.14Å; L275-L278 WeakPolarHBondContact O-CB 3.27Å; L275-L278 PolarHBondContact O-N 3.38Å; Q276-L278 VanDerWaalsContact C-N 3.29Å
279	Y	86.4	Confident	68.6	Low	4 Å²	4	80.9 Å²	80.9	2%	0.016	42%	0.418	C	S	.	.	H	α-helix	trans	-115.9	-7.6	-168.7	-60.5	-72.1	0	0	0	114.9	V114 W115 R118 L155 L239 L275	V114-Y279 HydrophobicContact CB-CE1 4.26Å; W115-Y279 HydrophobicContact CB-CE1 4.17Å; W115-Y279 PolarHBondContact N-OH 3.22Å; R118-Y279 VanDerWaalsContact CZ-O 3.31Å; R118-Y279 PolarHBondContact NH1-O 3.47Å; R118-Y279 PolarHBondContact NH2-O 3.18Å; L155-Y279 HydrophobicContact CD1-CD1 4.14Å; L155-Y279 HydrophobicContact CD1-CD2 3.79Å; L155-Y279 HydrophobicContact CD1-CE1 4.24Å; L155-Y279 HydrophobicContact CD1-CE2 3.91Å; L155-Y279 HydrophobicContact CD1-CG 3.92Å; L155-Y279 HydrophobicContact CD2-CD1 3.8Å; L155-Y279 HydrophobicContact CD2-CE1 4.09Å; L155-Y279 HydrophobicContact CD2-CG 4.21Å; L155-Y279 HydrophobicContact CG-CD1 4.22Å; L155-Y279 HydrophobicContact CG-CD2 4.47Å; L155-Y279 HydrophobicContact CG-CG 4.12Å; L239-Y279 HydrophobicContact CB-CE2 4.2Å; L239-Y279 WeakPolarHBondContact O-CE2 2.89Å; L239-Y279 VanDerWaalsContact O-CZ 3.3Å; L239-Y279 PolarHBondContact O-OH 2.91Å; L275-Y279 HydrophobicContact CD1-CD2 3.71Å; L275-Y279 HydrophobicContact CD1-CE2 4.06Å; L275-Y279 HydrophobicContact CG-CD2 4.33Å; L275-Y279 PolarHBondContact O-N 2.9Å
280	G	82.9	Confident	66.7	Low	31 Å²	31	83.3 Å²	83.3	32%	0.32	43%	0.434	S	S	.	.			trans	81.8	176.6	-172.6	0	0	0	0	0	113	Q276	Q276-G280 WeakPolarHBondContact O-CA 3.24Å; Q276-G280 PolarHBondContact O-N 2.82Å
281	K	75.9	Confident	64.6	Low	145 Å²	145	89.4 Å²	89.4	63%	0.63	47%	0.472	S	S	*	.			trans	-86.6	140.1	176.1	-75.1	-179.3	177.2	-176.7	0	110.3	Q276	Q276-K281 HydrophobicContact CB-CG 4.37Å; Q276-K281 HydrophobicContact CG-CG 4.13Å; Q276-K281 VanDerWaalsContact OE1-CE 3.22Å
282	A	62.5	Low	62.2	Low	30 Å²	30	100.6 Å²	100.6	25%	0.248	51%	0.514	C	S	.	.			trans	-54.6	135.8	166	0	0	0	0	0	110.9	S153 D154 Q284	S153-A282 WeakPolarHBondContact O-CB 3.47Å; D154-A282 WeakPolarHBondContact OD1-CA 3.3Å; A282-Q284 PolarHBondContact O-N 3.05Å
283	P	51.7	Low	59.3	Low	102 Å²	102	106 Å²	106	66%	0.662	54%	0.54	S	S	*	.			trans	-53.1	114.1	165.4	-22.8	30.5	0	0	0	108.7	D154 T285	D154-P283 WeakPolarHBondContact OD1-CD 3.45Å; P283-T285 PolarHBondContact O-N 2.85Å; P283-T285 VanDerWaalsContact O-N 3.15Å
284	Q	47	Very low	57.2	Low	158 Å²	158	108.3 Å²	108.3	74%	0.738	56%	0.559	S	S	*	*			trans	-56.1	118.3	-175.8	-65.3	-86.4	-49	0	0	110.4	A282	A282-Q284 PolarHBondContact O-N 3.05Å
285	T	37.5	Very low	54.9	Low	114 Å²	114	116.8 Å²	116.8	70%	0.699	60%	0.603	S	S	*	*			trans	-73	146	152.8	47.5	0	0	0	0	109.1	P283 Y287	P283-T285 PolarHBondContact O-N 2.85Å; P283-T285 VanDerWaalsContact O-N 3.15Å; T285-Y287 PolarHBondContact O-N 3.43Å
286	P	35.4	Very low	52	Low	121 Å²	121	120.9 Å²	120.9	79%	0.786	64%	0.637	S	S	*	*	S	Bend	trans	-71.7	21.2	-160.9	-19.7	34	0	0	0	118.2
287	Y	40.3	Very low	49.5	Very low	203 Å²	203	125.1 Å²	125.1	80%	0.796	67%	0.668	S	S	*	*			trans	-132.6	95.5	-179.7	-79	-89.2	0	0	0	110	T285	T285-Y287 PolarHBondContact O-N 3.43Å
288	D	38.5	Very low	47.1	Very low	151 Å²	151	125 Å²	125	81%	0.807	68%	0.678	S	S	*	*			trans	-172	108.7	133.3	-91.5	-23.6	0	0	0	110.9
289	K	30.2	Very low	44.7	Very low	197 Å²	197	129.6 Å²	129.6	86%	0.857	71%	0.709	S	S	*	*			trans	-87.7	133.4	164.1	-82.7	-177.8	177.5	177.7	0	108.5	T291	K289-T291 PolarHBondContact O-N 3.23Å
290	P	42.3	Very low	42.1	Very low	127 Å²	127	138.6 Å²	138.6	83%	0.825	75%	0.751	S	S	*	*			trans	-78.3	118.4	179.2	29.6	-30.6	0	0	0	110.8
291	T	38.3	Very low	39.7	Very low	147 Å²	147	142.7 Å²	142.7	90%	0.902	77%	0.773	S	S	*	*			trans	-100.7	99.2	160.7	12.1	0	0	0	0	108.8	K289	K289-T291 PolarHBondContact O-N 3.23Å
292	R	38.7	Very low	37.8	Very low	236 Å²	236	141.9 Å²	141.9	89%	0.891	78%	0.782	S	S	*	*			trans	-92.7	122.9	175	-161.1	179.1	-172.1	-166.4	2.5	109.1
293	K	27.6	Very low	36.5	Very low	194 Å²	194	147.5 Å²	147.5	84%	0.843	81%	0.813	S	S	*	*			trans	-122.9	140.4	153.1	-89.8	-173.1	177.7	-179.6	0	108.9
294	P	38.4	Very low	35.4	Very low	126 Å²	126	148 Å²	148	82%	0.818	82%	0.819	S	S	*	*			trans	-78.6	134.9	176.7	-5.2	23	0	0	0	111
295	L	32.7	Very low	34.8	Very low	178 Å²	178	146.4 Å²	146.4	93%	0.932	82%	0.822	S	S	*	*			trans	-106.6	146.8	166.2	-127.5	82.5	0	0	0	110.5
296	A	30.6	Very low	35.1	Very low	87 Å²	87	146.3 Å²	146.3	72%	0.719	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-67.6	166.9	-172.8	0	0	0	0	0	114.3
297	P	35.1	Very low	35.2	Very low	122 Å²	122	148 Å²	148	79%	0.792	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-78.7	149.7	-172.2	31	-31.6	0	0	0	113.5
298	P	33.7	Very low	34.7	Very low	120 Å²	120	143.9 Å²	143.9	78%	0.779	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-88.9	163.2	-177.5	34.3	-32.5	0	0	0	114.3
299	P	32.3	Very low	34.9	Very low	129 Å²	129	142.8 Å²	142.8	84%	0.838	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-89.1	166.2	-174	31	-22.4	0	0	0	114.5
300	Q	31.4	Very low	35.9	Very low	192 Å²	192	139 Å²	139	90%	0.897	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-79.9	149.9	-173.7	-71.9	-180	-23.5	0	0	114.8
301	P	32.9	Very low	36.4	Very low	118 Å²	118	138.5 Å²	138.5	77%	0.766	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-90.2	160.7	179	34.1	-32.8	0	0	0	115.1
302	P	36.7	Very low	37.9	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-94	170.8	-174.9	34.5	-25.8	0	0	0	114.9
303	V	34.5	Very low	39.7	Very low	148 Å²	148	130.5 Å²	130.5	90%	0.897	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-94.2	143.6	-168.1	178.7	0	0	0	0	113.2
304	S	29.6	Very low	42.3	Very low	112 Å²	112	122.8 Å²	122.8	78%	0.783	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-99.8	157.8	180	-7.4	0	0	0	0	115.3
305	P	33.7	Very low	44.5	Very low	125 Å²	125	120.6 Å²	120.6	81%	0.812	74%	0.737	S	S	*	*			trans	-108.7	174.5	178.5	33.4	-18	0	0	0	116.2
306	P	44	Very low	47.1	Very low	112 Å²	112	114.3 Å²	114.3	73%	0.727	70%	0.701	S	S	*	*			trans	-117.8	157	-157.1	40.1	-28.7	0	0	0	120.7
307	D	38.3	Very low	49.8	Very low	158 Å²	158	112.5 Å²	112.5	85%	0.845	68%	0.682	S	S	*	*			trans	76.5	143.3	137.6	-66.5	-23.8	0	0	0	128
308	S	28.3	Very low	52.1	Low	116 Å²	116	112.1 Å²	112.1	81%	0.811	67%	0.67	S	S	*	*			trans	-157.3	162.9	164.8	-86.5	0	0	0	0	112.6
309	P	43.3	Very low	54.2	Low	127 Å²	127	106.5 Å²	106.5	83%	0.825	63%	0.634	S	S	*	*	P	Polyproline II helix		-84.4	146.1	-127.1	32.7	-36.5	0	0	0	117.5
310	S	50.7	Low	56.7	Low	117 Å²	117	103.5 Å²	103.5	82%	0.818	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-98.3	131.2	-172.5	47.9	0	0	0	0	113.9
311	F	54.3	Low	59.7	Low	118 Å²	118	95.1 Å²	95.1	52%	0.518	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-73.1	144.2	159.5	-72.8	-92.1	0	0	0	109	I313 W338	F311-I313 PolarHBondContact O-N 3.37Å; F311-W338 HydrophobicContact CB-CZ2 4.32Å
312	P	69.5	Low	62.6	Low	117 Å²	117	91.6 Å²	91.6	76%	0.76	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-63.7	126.3	176.9	25.5	-31.5	0	0	0	109.8
313	I	75.8	Confident	65.4	Low	98 Å²	98	85.6 Å²	85.6	50%	0.503	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-86.4	120.7	178.3	-60.9	175	0	0	0	107	F311 W338 P353	F311-I313 PolarHBondContact O-N 3.37Å; I313-W338 HydrophobicContact CG1-CH2 4.35Å; I313-W338 HydrophobicContact CG1-CZ2 4.27Å; I313-P353 HydrophobicContact CG2-CG 3.54Å
314	P	83.3	Confident	68.3	Low	31 Å²	31	78.8 Å²	78.8	20%	0.201	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-66.5	149.1	179.3	25.1	-31.5	0	0	0	111.4	K335 W338 W340	P314-K335 HydrophobicContact CB-CG 4.16Å; P314-K335 HydrophobicContact CG-CG 4.31Å; P314-W338 HydrophobicContact CG-CB 4.01Å; P314-W338 VanDerWaalsContact CG-CD1 3.45Å; P314-W338 HydrophobicContact CG-CG 3.89Å; P314-W340 HydrophobicContact CB-CH2 4.08Å; P314-W340 HydrophobicContact CG-CH2 3.76Å; P314-W340 HydrophobicContact CG-CZ3 4.45Å; P314-W340 WeakPolarHBondContact O-CH2 3.48Å; P314-W340 VanDerWaalsContact O-CZ2 3.28Å; P314-W340 WeakPolarHBondContact O-CZ2 3.15Å
315	D	83.8	Confident	71.3	Confident	81 Å²	81	73.5 Å²	73.5	43%	0.433	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-89.1	123	174.8	-175.3	-0.8	0	0	0	110.3	C317 E318	D315-C317 PolarHBondContact O-N 3.43Å; D315-C317 VanDerWaalsContact O-N 3.15Å; D315-C317 PolarHBondContact OD1-N 3.37Å; D315-E318 HydrophobicContact CB-CG 4.19Å; D315-E318 WeakPolarHBondContact O-CB 3.24Å; D315-E318 PolarHBondContact O-N 3.49Å
316	R	86.6	Confident	73.8	Confident	45 Å²	45	68.9 Å²	68.9	17%	0.17	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-59.9	-24	177	69.9	-172.1	-172.8	-74.7	-7.1	113.1	E318 G319 F321 W340 P351 L506 D507	R316-E318 VanDerWaalsContact C-N 3.28Å; R316-E318 PolarHBondContact O-N 3.07Å; R316-G319 PolarHBondContact O-N 3.24Å; R316-F321 HydrophobicContact CB-CZ 4.43Å; R316-F321 WeakPolarHBondContact O-CZ 3.41Å; R316-W340 HydrophobicContact CB-CD2 4Å; R316-W340 HydrophobicContact CB-CE3 4.49Å; R316-W340 HydrophobicContact CB-CG 4.46Å; R316-W340 HydrophobicContact CB-CH2 4.16Å; R316-W340 HydrophobicContact CB-CZ2 3.66Å; R316-P351 PolarHBondContact NH1-O 3.4Å; R316-L506 WeakPolarHBondContact CD-O 3.44Å; R316-L506 HydrophobicContact CG-CB 4.41Å; R316-L506 PolarHBondContact NE-O 3.14Å; R316-D507 PolarHBondContact NH2-O 3.19Å
317	C	87.2	Confident	75.6	Confident	49 Å²	49	63.9 Å²	63.9	33%	0.331	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-81.4	-5.2	-177.1	-60.3	0	0	0	0	113.9	D315 G319 C508	D315-C317 PolarHBondContact O-N 3.43Å; D315-C317 VanDerWaalsContact O-N 3.15Å; D315-C317 PolarHBondContact OD1-N 3.37Å; C317-G319 PolarHBondContact O-N 2.72Å; C317-C508 WeakPolarHBondContact CA-SG 3.19Å; C317-C508 HydrophobicContact CB-CB 3.89Å; C317-C508 WeakPolarHBondContact CB-SG 3.46Å; C317-C508 WeakPolarHBondContact SG-CB 3.49Å; C317-C508 CovalentContact SG-SG 2.04Å; C317-C508 PolarHBondContact SG-SG 3.42Å
318	E	83.4	Confident	77.2	Confident	115 Å²	115	62.9 Å²	62.9	54%	0.537	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-67.6	-26.8	168.2	-67.8	177.3	-168.5	0	0	111.7	D315 R316 N320	D315-E318 HydrophobicContact CB-CG 4.19Å; D315-E318 WeakPolarHBondContact O-CB 3.24Å; D315-E318 PolarHBondContact O-N 3.49Å; R316-E318 VanDerWaalsContact C-N 3.28Å; R316-E318 PolarHBondContact O-N 3.07Å; E318-N320 VanDerWaalsContact C-N 3.26Å; E318-N320 WeakPolarHBondContact CB-OD1 3.16Å; E318-N320 PolarHBondContact O-N 3.03Å
319	G	78.6	Confident	79.1	Confident	1 Å²	1	58 Å²	58	1%	0.01	32%	0.316	C	S	.	.			trans	74.6	3.3	171.4	0	0	0	0	0	115.6	R316 C317 G480 M501	R316-G319 PolarHBondContact O-N 3.24Å; C317-G319 PolarHBondContact O-N 2.72Å; G319-G480 CarbonylContact O-C 3.51Å; G319-M501 WeakPolarHBondContact O-CE 3.07Å
320	N	85.4	Confident	80.8	Confident	67 Å²	67	53.7 Å²	53.7	36%	0.358	29%	0.286	S	S	.	.			trans	-97.7	86.9	-179	60	-23.1	0	0	0	111.5	E318 K335	E318-N320 VanDerWaalsContact C-N 3.26Å; E318-N320 WeakPolarHBondContact CB-OD1 3.16Å; E318-N320 PolarHBondContact O-N 3.03Å; N320-K335 WeakPolarHBondContact O-CD 3.37Å; N320-K335 WeakPolarHBondContact O-CE 3.04Å; N320-K335 PolarHBondContact O-NZ 2.91Å
321	F	93.4	Very high	82.4	Confident	15 Å²	15	48.6 Å²	48.6	7%	0.066	25%	0.25	C	C	.	.			trans	-91.5	152.3	-179.9	-62.1	-78.6	0	0	0	112.5	R316 I324 F333 F334 K335 W340 M501 L506	R316-F321 HydrophobicContact CB-CZ 4.43Å; R316-F321 WeakPolarHBondContact O-CZ 3.41Å; F321-I324 HydrophobicContact CB-CD1 4.12Å; F321-I324 HydrophobicContact CB-CG1 3.88Å; F321-I324 HydrophobicContact CD2-CD1 4.26Å; F321-I324 HydrophobicContact CG-CD1 4.49Å; F321-I324 HydrophobicContact CG-CG1 4.41Å; F321-F333 HydrophobicContact CD1-CB 3.68Å; F321-F333 HydrophobicContact CD1-CD1 4.28Å; F321-F333 HydrophobicContact CD1-CG 4.49Å; F321-F333 AromaticContact CD2-CD1 3.7Å; F321-F333 HydrophobicContact CD2-CD1 3.7Å; F321-F333 HydrophobicContact CD2-CE1 4.46Å; F321-F333 HydrophobicContact CE1-CB 3.75Å; F321-F333 HydrophobicContact CE1-CD1 4.4Å; F321-F333 HydrophobicContact CE1-CG 4.49Å; F321-F333 AromaticContact CE2-CD1 3.85Å; F321-F333 HydrophobicContact CE2-CD1 3.85Å; F321-F333 HydrophobicContact CG-CB 4.12Å; F321-F333 AromaticContact CG-CD1 3.93Å; F321-F333 HydrophobicContact CG-CD1 3.93Å; F321-F333 HydrophobicContact CZ-CB 4.26Å; F321-F333 HydrophobicContact CZ-CD1 4.2Å; F321-F334 WeakPolarHBondContact CB-O 3.45Å; F321-K335 HydrophobicContact CD1-CB 4.22Å; F321-W340 HydrophobicContact CD1-CE3 4.45Å; F321-W340 HydrophobicContact CD1-CZ3 4.35Å; F321-W340 AromaticContact CE1-CE3 3.67Å; F321-W340 HydrophobicContact CE1-CE3 3.67Å; F321-W340 AromaticContact CE1-CZ3 3.62Å; F321-W340 HydrophobicContact CE1-CZ3 3.62Å; F321-M501 HydrophobicContact CD2-CE 3.56Å; F321-M501 HydrophobicContact CD2-SD 4.16Å; F321-M501 HydrophobicContact CE2-CE 3.77Å; F321-M501 HydrophobicContact CE2-SD 4.32Å; F321-L506 HydrophobicContact CE2-CD1 3.3Å; F321-L506 HydrophobicContact CZ-CD1 3.38Å; F321-L506 HydrophobicContact CZ-CD2 4.34Å
322	D	93.9	Very high	84.1	Confident	44 Å²	44	43.2 Å²	43.2	24%	0.235	23%	0.226	C	C	.	.	S	Bend	trans	-86.6	-28	177.8	-54.4	-26.7	0	0	0	111.5	F334 K335 G336 V369 V370 Q371	D322-F334 PolarHBondContact N-O 3.1Å; D322-K335 WeakPolarHBondContact OD1-CD 3.18Å; D322-K335 IonicContact OD1-NZ 2.66Å; D322-K335 PolarHBondContact OD1-NZ 3.13Å; D322-K335 WeakPolarHBondContact OD2-CA 3.29Å; D322-G336 PolarHBondContact OD2-N 2.97Å; D322-V369 HydrophobicContact CB-CG1 3.95Å; D322-V370 CarbonylContact C-O 3.58Å; D322-V370 WeakPolarHBondContact CB-O 3.44Å; D322-Q371 CarbonylContact O-C 3.45Å; D322-Q371 WeakPolarHBondContact O-CA 3.28Å; D322-Q371 VanDerWaalsContact O-O 3.09Å
323	A	95.8	Very high	85.3	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	150.4	170.7	0	0	0	0	0	110.5	F334 V370 D466	A323-F334 HydrophobicContact CB-CB 4.12Å; A323-F334 HydrophobicContact CB-CD2 3.89Å; A323-F334 HydrophobicContact CB-CG 4.36Å; A323-F334 PolarHBondContact O-N 2.59Å; A323-V370 HydrophobicContact CB-CG1 4.12Å; A323-V370 WeakPolarHBondContact CB-O 3.31Å; A323-D466 VanDerWaalsContact CA-OD2 3.23Å; A323-D466 WeakPolarHBondContact CA-OD2 3.26Å; A323-D466 WeakPolarHBondContact CB-OD2 3.2Å
324	I	95.9	Very high	86.2	Confident	5 Å²	5	33 Å²	33	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	113.4	176.3	-55.3	169.3	0	0	0	109.1	F321 T331 F332 F333 D466 T468 F478 M501	F321-I324 HydrophobicContact CB-CD1 4.12Å; F321-I324 HydrophobicContact CB-CG1 3.88Å; F321-I324 HydrophobicContact CD2-CD1 4.26Å; F321-I324 HydrophobicContact CG-CD1 4.49Å; F321-I324 HydrophobicContact CG-CG1 4.41Å; I324-T331 HydrophobicContact CG2-CG2 3.93Å; I324-F332 CarbonylContact C-O 3.52Å; I324-F332 VanDerWaalsContact CA-O 3.23Å; I324-F332 WeakPolarHBondContact CA-O 3.27Å; I324-F333 HydrophobicContact CB-CD1 4.41Å; I324-F333 HydrophobicContact CB-CE1 4.46Å; I324-F333 HydrophobicContact CD1-CD1 3.76Å; I324-F333 HydrophobicContact CD1-CE1 3.68Å; I324-F333 HydrophobicContact CG1-CD1 3.62Å; I324-F333 HydrophobicContact CG1-CE1 3.91Å; I324-F333 HydrophobicContact CG1-CG 4.42Å; I324-F333 HydrophobicContact CG2-CD1 3.97Å; I324-F333 HydrophobicContact CG2-CE1 3.69Å; I324-F333 HydrophobicContact CG2-CE2 4.4Å; I324-F333 HydrophobicContact CG2-CG 4.43Å; I324-F333 HydrophobicContact CG2-CZ 3.93Å; I324-D466 HydrophobicContact CB-CB 4.31Å; I324-D466 PolarHBondContact N-OD2 3.15Å; I324-T468 HydrophobicContact CG2-CG2 4.46Å; I324-F478 HydrophobicContact CB-CD2 4.14Å; I324-F478 HydrophobicContact CB-CE2 4.13Å; I324-F478 HydrophobicContact CD1-CB 3.8Å; I324-F478 HydrophobicContact CD1-CD1 3.57Å; I324-F478 HydrophobicContact CD1-CD2 3.77Å; I324-F478 HydrophobicContact CD1-CE1 4.04Å; I324-F478 HydrophobicContact CD1-CE2 4.22Å; I324-F478 HydrophobicContact CD1-CG 3.42Å; I324-F478 VanDerWaalsContact CD1-CG 3.42Å; I324-F478 HydrophobicContact CD1-CZ 4.35Å; I324-F478 HydrophobicContact CG2-CD2 4.3Å; I324-F478 HydrophobicContact CG2-CE2 3.8Å; I324-F478 HydrophobicContact CG2-CZ 3.93Å; I324-M501 HydrophobicContact CD1-CE 4.37Å; I324-M501 HydrophobicContact CD1-SD 3.72Å
325	A	93.1	Very high	86.7	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.008	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.1	-172.8	0	0	0	0	0	112.1	I327 T331 F332 F334 A373	A325-I327 HydrophobicContact CB-CD1 4.17Å; A325-I327 HydrophobicContact CB-CG1 4.07Å; A325-T331 CarbonylContact O-C 3.56Å; A325-T331 WeakPolarHBondContact O-CA 3.41Å; A325-F332 PolarHBondContact N-O 3.06Å; A325-F332 PolarHBondContact O-N 3.39Å; A325-F334 HydrophobicContact CB-CE2 4.45Å; A325-A373 HydrophobicContact CB-CB 3.7Å; A325-A373 WeakPolarHBondContact CB-O 3.49Å
326	N	86	Confident	87	Confident	28 Å²	28	30.5 Å²	30.5	15%	0.15	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118	164.7	-171.3	-66.6	0	0	0	108.7	G329 E330 T468 V469 N471	N326-G329 PolarHBondContact OD1-N 3.28Å; N326-E330 CarbonylContact C-O 3.48Å; N326-E330 WeakPolarHBondContact CA-O 3.49Å; N326-T468 PolarHBondContact N-OG1 2.67Å; N326-V469 WeakPolarHBondContact CB-O 3.11Å; N326-N471 PolarHBondContact ND2-OD1 3.28Å; N326-N471 PolarHBondContact OD1-OD1 2.87Å
327	I	81.6	Confident	87	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.036	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	107.1	-178.4	-61.2	171.4	0	0	0	106.9	A325 G329 E330 F332 W360 A375 I382	A325-I327 HydrophobicContact CB-CD1 4.17Å; A325-I327 HydrophobicContact CB-CG1 4.07Å; I327-G329 VanDerWaalsContact C-N 3.29Å; I327-G329 PolarHBondContact O-N 3.31Å; I327-E330 PolarHBondContact N-O 2.77Å; I327-E330 PolarHBondContact O-N 2.78Å; I327-E330 VanDerWaalsContact O-N 3.07Å; I327-F332 HydrophobicContact CB-CD2 3.89Å; I327-F332 HydrophobicContact CB-CE2 3.79Å; I327-F332 HydrophobicContact CD1-CD2 3.9Å; I327-F332 HydrophobicContact CD1-CE2 4.28Å; I327-F332 HydrophobicContact CD1-CG 4.19Å; I327-F332 HydrophobicContact CG1-CD2 4.16Å; I327-F332 HydrophobicContact CG1-CE2 4.48Å; I327-F332 HydrophobicContact CG2-CE2 4.36Å; I327-W360 HydrophobicContact CD1-CH2 3.96Å; I327-W360 HydrophobicContact CD1-CZ2 3.96Å; I327-A375 HydrophobicContact CG2-CB 4.48Å; I327-I382 HydrophobicContact CD1-CG2 3.94Å; I327-I382 HydrophobicContact CG1-CG2 4.4Å; I327-I382 HydrophobicContact CG2-CD1 3.4Å; I327-I382 HydrophobicContact CG2-CG1 3.66Å; I327-I382 HydrophobicContact CG2-CG2 4.4Å
328	R	71.1	Confident	87	Confident	137 Å²	137	29.3 Å²	29.3	52%	0.517	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	40.5	175.5	-59.9	-175.4	173.3	-173.9	5.8	114.6	G380 D395	R328-G380 PolarHBondContact NE-O 2.84Å; R328-G380 PolarHBondContact NH2-O 2.55Å; R328-G380 VanDerWaalsContact NH2-O 3.08Å; R328-D395 IonicContact CZ-OD1 2.83Å; R328-D395 IonicContact NH1-OD1 2.73Å; R328-D395 PolarHBondContact NH1-OD1 3.2Å; R328-D395 IonicContact NH2-OD1 3.74Å; R328-D395 PolarHBondContact NH2-OD1 2.91Å
329	G	67.4	Low	87.3	Confident	13 Å²	13	24.1 Å²	24.1	13%	0.134	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.7	-18	178.4	0	0	0	0	0	113.6	N326 I327 P344 N471	N326-G329 PolarHBondContact OD1-N 3.28Å; I327-G329 VanDerWaalsContact C-N 3.29Å; I327-G329 PolarHBondContact O-N 3.31Å; G329-P344 WeakPolarHBondContact O-CA 3.42Å; G329-P344 WeakPolarHBondContact O-CB 3.23Å; G329-P344 WeakPolarHBondContact O-CG 3.15Å; G329-N471 VanDerWaalsContact CA-OD1 3.23Å; G329-N471 WeakPolarHBondContact CA-OD1 3.36Å; G329-N471 PolarHBondContact O-ND2 2.85Å; G329-N471 PolarHBondContact O-OD1 2.62Å
330	E	78.9	Confident	87.7	Confident	38 Å²	38	24.3 Å²	24.3	18%	0.178	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	142.2	-178.2	-65.3	-173.2	118.5	0	0	110.7	N326 I327 F332 R341 L342 P344	N326-E330 CarbonylContact C-O 3.48Å; N326-E330 WeakPolarHBondContact CA-O 3.49Å; I327-E330 PolarHBondContact N-O 2.77Å; I327-E330 PolarHBondContact O-N 2.78Å; I327-E330 VanDerWaalsContact O-N 3.07Å; E330-F332 HydrophobicContact CB-CD2 4.4Å; E330-F332 HydrophobicContact CB-CE2 3.82Å; E330-R341 HydrophobicContact CB-CG 4.05Å; E330-R341 IonicContact OE1-CZ 3.65Å; E330-R341 IonicContact OE1-NE 2.84Å; E330-R341 PolarHBondContact OE1-NE 3.17Å; E330-R341 IonicContact OE1-NH1 3.28Å; E330-R341 PolarHBondContact OE1-NH1 2.71Å; E330-R341 IonicContact OE1-NH2 2.74Å; E330-R341 WeakPolarHBondContact OE2-CD 3.22Å; E330-R341 IonicContact OE2-CZ 3.72Å; E330-R341 IonicContact OE2-NE 3.61Å; E330-R341 IonicContact OE2-NH1 2.75Å; E330-R341 PolarHBondContact OE2-NH1 3.45Å; E330-L342 CarbonylContact C-O 3.59Å; E330-L342 WeakPolarHBondContact CA-O 3.41Å; E330-L342 VanDerWaalsContact CB-O 3.23Å; E330-L342 WeakPolarHBondContact CB-O 3.22Å; E330-P344 HydrophobicContact CG-CG 4.22Å
331	T	84.6	Confident	87.4	Confident	10 Å²	10	24.4 Å²	24.4	6%	0.061	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.7	178.7	-51.7	0	0	0	0	110.2	I324 A325 F333 R341 L342 W505	I324-T331 HydrophobicContact CG2-CG2 3.93Å; A325-T331 CarbonylContact O-C 3.56Å; A325-T331 WeakPolarHBondContact O-CA 3.41Å; T331-F333 HydrophobicContact CG2-CD2 4.28Å; T331-F333 HydrophobicContact CG2-CE2 3.61Å; T331-F333 HydrophobicContact CG2-CZ 4.06Å; T331-R341 CarbonylContact O-C 3.59Å; T331-R341 WeakPolarHBondContact O-CA 3.34Å; T331-L342 PolarHBondContact N-O 2.88Å; T331-L342 PolarHBondContact O-N 3.27Å; T331-W505 HydrophobicContact CG2-CE3 4.35Å; T331-W505 HydrophobicContact CG2-CZ3 3.88Å
332	F	91.3	Very high	86.5	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.018	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.4	179.8	-71.3	-109.1	0	0	0	110	I324 A325 I327 E330 F334 F339 W340 R341 F359 W360	I324-F332 CarbonylContact C-O 3.52Å; I324-F332 VanDerWaalsContact CA-O 3.23Å; I324-F332 WeakPolarHBondContact CA-O 3.27Å; A325-F332 PolarHBondContact N-O 3.06Å; A325-F332 PolarHBondContact O-N 3.39Å; I327-F332 HydrophobicContact CB-CD2 3.89Å; I327-F332 HydrophobicContact CB-CE2 3.79Å; I327-F332 HydrophobicContact CD1-CD2 3.9Å; I327-F332 HydrophobicContact CD1-CE2 4.28Å; I327-F332 HydrophobicContact CD1-CG 4.19Å; I327-F332 HydrophobicContact CG1-CD2 4.16Å; I327-F332 HydrophobicContact CG1-CE2 4.48Å; I327-F332 HydrophobicContact CG2-CE2 4.36Å; E330-F332 HydrophobicContact CB-CD2 4.4Å; E330-F332 HydrophobicContact CB-CE2 3.82Å; F332-F334 HydrophobicContact CB-CD2 4.22Å; F332-F334 HydrophobicContact CB-CE2 3.45Å; F332-F334 VanDerWaalsContact CB-CE2 3.45Å; F332-F334 HydrophobicContact CB-CZ 3.71Å; F332-F334 HydrophobicContact CD1-CZ 4.07Å; F332-F334 HydrophobicContact CG-CE2 4.37Å; F332-F334 HydrophobicContact CG-CZ 4.18Å; F332-F339 AromaticContact CD1-CD2 3.61Å; F332-F339 HydrophobicContact CD1-CD2 3.61Å; F332-F339 AromaticContact CD1-CE2 3.79Å; F332-F339 HydrophobicContact CD1-CE2 3.79Å; F332-F339 HydrophobicContact CD1-CG 4.5Å; F332-F339 HydrophobicContact CE1-CD2 4.06Å; F332-F339 AromaticContact CE1-CE2 3.72Å; F332-F339 HydrophobicContact CE1-CE2 3.72Å; F332-W340 CarbonylContact C-O 3.48Å; F332-W340 WeakPolarHBondContact CA-O 3.28Å; F332-R341 HydrophobicContact CD1-CB 4.3Å; F332-R341 HydrophobicContact CD1-CG 4.26Å; F332-R341 HydrophobicContact CD2-CG 4.2Å; F332-R341 HydrophobicContact CE1-CB 4.24Å; F332-R341 HydrophobicContact CE1-CG 3.96Å; F332-R341 HydrophobicContact CE2-CG 3.88Å; F332-R341 HydrophobicContact CG-CG 4.38Å; F332-R341 HydrophobicContact CZ-CG 3.77Å; F332-F359 HydrophobicContact CE1-CD1 4.43Å; F332-F359 AromaticContact CE1-CE1 3.69Å; F332-F359 HydrophobicContact CE1-CE1 3.69Å; F332-F359 AromaticContact CE1-CZ 3.84Å; F332-F359 HydrophobicContact CE1-CZ 3.84Å; F332-F359 HydrophobicContact CZ-CE1 4.04Å; F332-F359 AromaticContact CZ-CZ 3.94Å; F332-F359 HydrophobicContact CZ-CZ 3.94Å; F332-W360 HydrophobicContact CE1-CZ2 4.35Å
333	F	94.5	Very high	84.9	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	108.8	175.7	-70.6	-98.2	0	0	0	108.4	F321 I324 T331 F339 W340 L342 M501 W505 L506	F321-F333 HydrophobicContact CD1-CB 3.68Å; F321-F333 HydrophobicContact CD1-CD1 4.28Å; F321-F333 HydrophobicContact CD1-CG 4.49Å; F321-F333 AromaticContact CD2-CD1 3.7Å; F321-F333 HydrophobicContact CD2-CD1 3.7Å; F321-F333 HydrophobicContact CD2-CE1 4.46Å; F321-F333 HydrophobicContact CE1-CB 3.75Å; F321-F333 HydrophobicContact CE1-CD1 4.4Å; F321-F333 HydrophobicContact CE1-CG 4.49Å; F321-F333 AromaticContact CE2-CD1 3.85Å; F321-F333 HydrophobicContact CE2-CD1 3.85Å; F321-F333 HydrophobicContact CG-CB 4.12Å; F321-F333 AromaticContact CG-CD1 3.93Å; F321-F333 HydrophobicContact CG-CD1 3.93Å; F321-F333 HydrophobicContact CZ-CB 4.26Å; F321-F333 HydrophobicContact CZ-CD1 4.2Å; I324-F333 HydrophobicContact CB-CD1 4.41Å; I324-F333 HydrophobicContact CB-CE1 4.46Å; I324-F333 HydrophobicContact CD1-CD1 3.76Å; I324-F333 HydrophobicContact CD1-CE1 3.68Å; I324-F333 HydrophobicContact CG1-CD1 3.62Å; I324-F333 HydrophobicContact CG1-CE1 3.91Å; I324-F333 HydrophobicContact CG1-CG 4.42Å; I324-F333 HydrophobicContact CG2-CD1 3.97Å; I324-F333 HydrophobicContact CG2-CE1 3.69Å; I324-F333 HydrophobicContact CG2-CE2 4.4Å; I324-F333 HydrophobicContact CG2-CG 4.43Å; I324-F333 HydrophobicContact CG2-CZ 3.93Å; T331-F333 HydrophobicContact CG2-CD2 4.28Å; T331-F333 HydrophobicContact CG2-CE2 3.61Å; T331-F333 HydrophobicContact CG2-CZ 4.06Å; F333-F339 CarbonylContact O-C 3.58Å; F333-F339 WeakPolarHBondContact O-CA 3.23Å; F333-F339 WeakPolarHBondContact O-CB 3.4Å; F333-W340 HydrophobicContact CB-CB 4.36Å; F333-W340 PolarHBondContact N-O 2.99Å; F333-W340 PolarHBondContact O-N 2.97Å; F333-L342 HydrophobicContact CD2-CD1 3.79Å; F333-L342 HydrophobicContact CE2-CD1 3.61Å; F333-L342 HydrophobicContact CE2-CD2 4.17Å; F333-L342 HydrophobicContact CE2-CG 4.45Å; F333-M501 HydrophobicContact CD1-SD 4.28Å; F333-M501 HydrophobicContact CE1-CG 4.25Å; F333-M501 HydrophobicContact CE1-SD 3.59Å; F333-M501 VanDerWaalsContact CE1-SD 3.59Å; F333-W505 HydrophobicContact CE2-CE3 4.09Å; F333-W505 HydrophobicContact CZ-CB 3.91Å; F333-W505 HydrophobicContact CZ-CD2 4.02Å; F333-W505 AromaticContact CZ-CE3 3.62Å; F333-W505 HydrophobicContact CZ-CE3 3.62Å; F333-W505 HydrophobicContact CZ-CG 4.19Å; F333-W505 HydrophobicContact CZ-CZ3 4.42Å; F333-L506 HydrophobicContact CD1-CD1 4.41Å; F333-L506 HydrophobicContact CD1-CD2 4.16Å; F333-L506 HydrophobicContact CD2-CD2 3.9Å; F333-L506 HydrophobicContact CE1-CD1 4.48Å; F333-L506 HydrophobicContact CE1-CD2 4.36Å; F333-L506 HydrophobicContact CE2-CD2 4.11Å; F333-L506 HydrophobicContact CG-CD2 3.93Å; F333-L506 HydrophobicContact CZ-CD2 4.34Å
334	F	94.7	Very high	83.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	136.4	-175.4	-62.8	-86.5	0	0	0	111.2	F321 D322 A323 A325 F332 F339 L356 W360 V370 A373	F321-F334 WeakPolarHBondContact CB-O 3.45Å; D322-F334 PolarHBondContact N-O 3.1Å; A323-F334 HydrophobicContact CB-CB 4.12Å; A323-F334 HydrophobicContact CB-CD2 3.89Å; A323-F334 HydrophobicContact CB-CG 4.36Å; A323-F334 PolarHBondContact O-N 2.59Å; A325-F334 HydrophobicContact CB-CE2 4.45Å; F332-F334 HydrophobicContact CB-CD2 4.22Å; F332-F334 HydrophobicContact CB-CE2 3.45Å; F332-F334 VanDerWaalsContact CB-CE2 3.45Å; F332-F334 HydrophobicContact CB-CZ 3.71Å; F332-F334 HydrophobicContact CD1-CZ 4.07Å; F332-F334 HydrophobicContact CG-CE2 4.37Å; F332-F334 HydrophobicContact CG-CZ 4.18Å; F334-F339 HydrophobicContact CD1-CB 3.64Å; F334-F339 HydrophobicContact CD1-CG 4.35Å; F334-F339 HydrophobicContact CE1-CB 3.98Å; F334-F339 HydrophobicContact CE1-CG 4.23Å; F334-F339 HydrophobicContact CG-CB 4.26Å; F334-L356 HydrophobicContact CD1-CD1 3.76Å; F334-L356 HydrophobicContact CE1-CD1 3.75Å; F334-W360 AromaticContact CE1-NE1 3.58Å; F334-W360 HydrophobicContact CZ-CZ2 4.22Å; F334-V370 HydrophobicContact CB-CB 4.34Å; F334-V370 HydrophobicContact CD1-CB 4.2Å; F334-V370 HydrophobicContact CD1-CG2 4.25Å; F334-V370 HydrophobicContact CD2-CG1 4.47Å; F334-V370 HydrophobicContact CG-CB 4.16Å; F334-V370 HydrophobicContact CG-CG1 4.45Å; F334-A373 HydrophobicContact CE2-CB 4.29Å
335	K	93.6	Very high	81.6	Confident	45 Å²	45	33.3 Å²	33.3	20%	0.196	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	106	173.6	-171.1	53.5	169.6	-177.4	0	111.5	P314 N320 F321 D322 W338 W340	P314-K335 HydrophobicContact CB-CG 4.16Å; P314-K335 HydrophobicContact CG-CG 4.31Å; N320-K335 WeakPolarHBondContact O-CD 3.37Å; N320-K335 WeakPolarHBondContact O-CE 3.04Å; N320-K335 PolarHBondContact O-NZ 2.91Å; F321-K335 HydrophobicContact CD1-CB 4.22Å; D322-K335 WeakPolarHBondContact OD1-CD 3.18Å; D322-K335 IonicContact OD1-NZ 2.66Å; D322-K335 PolarHBondContact OD1-NZ 3.13Å; D322-K335 WeakPolarHBondContact OD2-CA 3.29Å; K335-W338 CarbonylContact C-O 3.55Å; K335-W338 PolarHBondContact N-O 3.19Å; K335-W338 VanDerWaalsContact O-CB 3.29Å; K335-W338 WeakPolarHBondContact O-CB 3.33Å; K335-W338 PolarHBondContact O-N 3.31Å; K335-W338 VanDerWaalsContact O-N 3.1Å; K335-W340 HydrophobicContact CB-CZ3 3.88Å
336	G	89.5	Confident	80	Confident	15 Å²	15	35.3 Å²	35.3	16%	0.155	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	-134	-172.5	0	0	0	0	0	110.5	D322 W338 R368	D322-G336 PolarHBondContact OD2-N 2.97Å; G336-W338 PolarHBondContact O-N 3.17Å; G336-R368 CarbonylContact C-O 3.57Å; G336-R368 WeakPolarHBondContact CA-O 3.29Å
337	P	87.1	Confident	79	Confident	43 Å²	43	39.5 Å²	39.5	28%	0.279	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	16	-176.9	34.5	-36.1	0	0	0	113.3	R355 L356 R368	P337-R355 WeakPolarHBondContact O-CA 3.38Å; P337-L356 PolarHBondContact O-N 2.77Å; P337-R368 VanDerWaalsContact N-O 3.12Å
338	W	87.4	Confident	77.8	Confident	26 Å²	26	39.7 Å²	39.7	10%	0.098	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153.9	-169.8	-58.7	110	0	0	0	111	F311 I313 P314 K335 G336 P353 A354 R355	F311-W338 HydrophobicContact CB-CZ2 4.32Å; I313-W338 HydrophobicContact CG1-CH2 4.35Å; I313-W338 HydrophobicContact CG1-CZ2 4.27Å; P314-W338 HydrophobicContact CG-CB 4.01Å; P314-W338 VanDerWaalsContact CG-CD1 3.45Å; P314-W338 HydrophobicContact CG-CG 3.89Å; K335-W338 CarbonylContact C-O 3.55Å; K335-W338 PolarHBondContact N-O 3.19Å; K335-W338 VanDerWaalsContact O-CB 3.29Å; K335-W338 WeakPolarHBondContact O-CB 3.33Å; K335-W338 PolarHBondContact O-N 3.31Å; K335-W338 VanDerWaalsContact O-N 3.1Å; G336-W338 PolarHBondContact O-N 3.17Å; W338-P353 HydrophobicContact CB-CB 3.74Å; W338-P353 HydrophobicContact CB-CG 4.08Å; W338-P353 HydrophobicContact CD2-CG 4.21Å; W338-P353 HydrophobicContact CE3-CB 4.24Å; W338-P353 HydrophobicContact CE3-CG 4.04Å; W338-P353 HydrophobicContact CG-CB 4.37Å; W338-P353 HydrophobicContact CG-CG 4.24Å; W338-A354 CarbonylContact C-O 3.58Å; W338-A354 VanDerWaalsContact CA-O 3.26Å; W338-A354 WeakPolarHBondContact CA-O 3.23Å; W338-R355 HydrophobicContact CE3-CB 4.49Å; W338-R355 HydrophobicContact CE3-CG 3.61Å; W338-R355 HydrophobicContact CH2-CG 3.75Å; W338-R355 HydrophobicContact CZ3-CB 4.4Å; W338-R355 HydrophobicContact CZ3-CG 3.18Å
339	F	88.6	Confident	77	Confident	7 Å²	7	36.4 Å²	36.4	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	156.8	168.4	71.3	-85.7	0	0	0	112.2	F332 F333 F334 R341 P353 A354 F359	F332-F339 AromaticContact CD1-CD2 3.61Å; F332-F339 HydrophobicContact CD1-CD2 3.61Å; F332-F339 AromaticContact CD1-CE2 3.79Å; F332-F339 HydrophobicContact CD1-CE2 3.79Å; F332-F339 HydrophobicContact CD1-CG 4.5Å; F332-F339 HydrophobicContact CE1-CD2 4.06Å; F332-F339 AromaticContact CE1-CE2 3.72Å; F332-F339 HydrophobicContact CE1-CE2 3.72Å; F333-F339 CarbonylContact O-C 3.58Å; F333-F339 WeakPolarHBondContact O-CA 3.23Å; F333-F339 WeakPolarHBondContact O-CB 3.4Å; F334-F339 HydrophobicContact CD1-CB 3.64Å; F334-F339 HydrophobicContact CD1-CG 4.35Å; F334-F339 HydrophobicContact CE1-CB 3.98Å; F334-F339 HydrophobicContact CE1-CG 4.23Å; F334-F339 HydrophobicContact CG-CB 4.26Å; F339-R341 HydrophobicContact CE2-CB 4.4Å; F339-P353 CarbonylContact O-C 3.5Å; F339-P353 VanDerWaalsContact O-CA 3.23Å; F339-P353 WeakPolarHBondContact O-CA 3.36Å; F339-P353 WeakPolarHBondContact O-CB 3.47Å; F339-A354 HydrophobicContact CD1-CB 4.28Å; F339-A354 HydrophobicContact CE1-CB 3.66Å; F339-A354 HydrophobicContact CE2-CB 4.01Å; F339-A354 HydrophobicContact CZ-CB 3.5Å; F339-A354 VanDerWaalsContact CZ-CB 3.5Å; F339-A354 PolarHBondContact N-O 3.48Å; F339-A354 PolarHBondContact O-N 3.31Å; F339-F359 HydrophobicContact CE1-CB 3.44Å; F339-F359 VanDerWaalsContact CE1-CB 3.44Å; F339-F359 HydrophobicContact CE1-CD1 4.28Å; F339-F359 AromaticContact CE1-CG 3.87Å; F339-F359 HydrophobicContact CE1-CG 3.87Å; F339-F359 HydrophobicContact CE2-CD2 4.44Å; F339-F359 HydrophobicContact CE2-CG 4.32Å; F339-F359 HydrophobicContact CZ-CB 3.44Å; F339-F359 VanDerWaalsContact CZ-CB 3.44Å; F339-F359 AromaticContact CZ-CD1 3.81Å; F339-F359 HydrophobicContact CZ-CD1 3.81Å; F339-F359 AromaticContact CZ-CD2 3.66Å; F339-F359 HydrophobicContact CZ-CD2 3.66Å; F339-F359 HydrophobicContact CZ-CE1 4.47Å; F339-F359 HydrophobicContact CZ-CE2 4.33Å; F339-F359 AromaticContact CZ-CG 3.35Å; F339-F359 HydrophobicContact CZ-CG 3.35Å
340	W	87.4	Confident	76.3	Confident	4 Å²	4	38 Å²	38	2%	0.015	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	155.1	167.2	-65.7	-97.9	0	0	0	109.6	P314 R316 F321 F332 F333 K335 L348 P351 P353	P314-W340 HydrophobicContact CB-CH2 4.08Å; P314-W340 HydrophobicContact CG-CH2 3.76Å; P314-W340 HydrophobicContact CG-CZ3 4.45Å; P314-W340 WeakPolarHBondContact O-CH2 3.48Å; P314-W340 VanDerWaalsContact O-CZ2 3.28Å; P314-W340 WeakPolarHBondContact O-CZ2 3.15Å; R316-W340 HydrophobicContact CB-CD2 4Å; R316-W340 HydrophobicContact CB-CE3 4.49Å; R316-W340 HydrophobicContact CB-CG 4.46Å; R316-W340 HydrophobicContact CB-CH2 4.16Å; R316-W340 HydrophobicContact CB-CZ2 3.66Å; F321-W340 HydrophobicContact CD1-CE3 4.45Å; F321-W340 HydrophobicContact CD1-CZ3 4.35Å; F321-W340 AromaticContact CE1-CE3 3.67Å; F321-W340 HydrophobicContact CE1-CE3 3.67Å; F321-W340 AromaticContact CE1-CZ3 3.62Å; F321-W340 HydrophobicContact CE1-CZ3 3.62Å; F332-W340 CarbonylContact C-O 3.48Å; F332-W340 WeakPolarHBondContact CA-O 3.28Å; F333-W340 HydrophobicContact CB-CB 4.36Å; F333-W340 PolarHBondContact N-O 2.99Å; F333-W340 PolarHBondContact O-N 2.97Å; K335-W340 HydrophobicContact CB-CZ3 3.88Å; W340-L348 HydrophobicContact CB-CD1 3.96Å; W340-L348 HydrophobicContact CG-CD1 4.46Å; W340-P351 PolarHBondContact NE1-O 3.41Å; W340-P353 HydrophobicContact CD2-CB 3.79Å; W340-P353 VanDerWaalsContact CE2-CB 3.44Å; W340-P353 HydrophobicContact CE3-CB 4.15Å; W340-P353 HydrophobicContact CG-CB 4.4Å; W340-P353 HydrophobicContact CH2-CB 4.02Å; W340-P353 HydrophobicContact CH2-CG 4.04Å; W340-P353 HydrophobicContact CZ2-CB 3.58Å; W340-P353 HydrophobicContact CZ2-CG 3.49Å; W340-P353 VanDerWaalsContact CZ2-CG 3.49Å; W340-P353 HydrophobicContact CZ3-CB 4.26Å
341	R	79.5	Confident	75.3	Confident	69 Å²	69	40 Å²	40	26%	0.26	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.7	179.8	-174.8	179.9	67.8	144.7	1.3	109.9	E330 T331 F332 F339 V349	E330-R341 HydrophobicContact CB-CG 4.05Å; E330-R341 IonicContact OE1-CZ 3.65Å; E330-R341 IonicContact OE1-NE 2.84Å; E330-R341 PolarHBondContact OE1-NE 3.17Å; E330-R341 IonicContact OE1-NH1 3.28Å; E330-R341 PolarHBondContact OE1-NH1 2.71Å; E330-R341 IonicContact OE1-NH2 2.74Å; E330-R341 WeakPolarHBondContact OE2-CD 3.22Å; E330-R341 IonicContact OE2-CZ 3.72Å; E330-R341 IonicContact OE2-NE 3.61Å; E330-R341 IonicContact OE2-NH1 2.75Å; E330-R341 PolarHBondContact OE2-NH1 3.45Å; T331-R341 CarbonylContact O-C 3.59Å; T331-R341 WeakPolarHBondContact O-CA 3.34Å; F332-R341 HydrophobicContact CD1-CB 4.3Å; F332-R341 HydrophobicContact CD1-CG 4.26Å; F332-R341 HydrophobicContact CD2-CG 4.2Å; F332-R341 HydrophobicContact CE1-CB 4.24Å; F332-R341 HydrophobicContact CE1-CG 3.96Å; F332-R341 HydrophobicContact CE2-CG 3.88Å; F332-R341 HydrophobicContact CG-CG 4.38Å; F332-R341 HydrophobicContact CZ-CG 3.77Å; F339-R341 HydrophobicContact CE2-CB 4.4Å; R341-V349 HydrophobicContact CB-CG2 4.33Å; R341-V349 HydrophobicContact CG-CG2 4.36Å; R341-V349 VanDerWaalsContact O-CB 3.26Å; R341-V349 WeakPolarHBondContact O-CB 3.18Å; R341-V349 WeakPolarHBondContact O-CG2 3.29Å; R341-V349 PolarHBondContact O-N 2.91Å
342	L	73.9	Confident	74.1	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.2	170.8	-80.6	63.6	0	0	0	108.9	E330 T331 F333 G346 Q347 L348 W505 L506	E330-L342 CarbonylContact C-O 3.59Å; E330-L342 WeakPolarHBondContact CA-O 3.41Å; E330-L342 VanDerWaalsContact CB-O 3.23Å; E330-L342 WeakPolarHBondContact CB-O 3.22Å; T331-L342 PolarHBondContact N-O 2.88Å; T331-L342 PolarHBondContact O-N 3.27Å; F333-L342 HydrophobicContact CD2-CD1 3.79Å; F333-L342 HydrophobicContact CE2-CD1 3.61Å; F333-L342 HydrophobicContact CE2-CD2 4.17Å; F333-L342 HydrophobicContact CE2-CG 4.45Å; L342-G346 WeakPolarHBondContact CD2-O 3.06Å; L342-Q347 CarbonylContact C-O 3.4Å; L342-Q347 VanDerWaalsContact CA-O 3.29Å; L342-Q347 WeakPolarHBondContact CA-O 3.26Å; L342-L348 HydrophobicContact CD1-CD1 3.61Å; L342-W505 HydrophobicContact CD2-CB 4.48Å; L342-W505 HydrophobicContact CD2-CE3 3.95Å; L342-W505 WeakPolarHBondContact CD2-O 3.46Å; L342-L506 HydrophobicContact CD1-CD2 4.28Å
343	Q	61.8	Low	73.4	Confident	78 Å²	78	49.1 Å²	49.1	36%	0.364	27%	0.271	S	S	.	.			trans	-66.8	167.3	171.6	-65	-176.3	-41.4	0	0	110.9	S345 G346 Q347 V349	Q343-S345 PolarHBondContact O-N 3.06Å; Q343-G346 PolarHBondContact O-N 2.78Å; Q343-Q347 PolarHBondContact N-O 3.26Å; Q343-V349 HydrophobicContact CG-CG2 3.59Å
344	P	59.4	Low	72.3	Confident	82 Å²	82	51.4 Å²	51.4	53%	0.532	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.1	176.3	-22.9	35	0	0	0	114.4	G329 E330 G346	G329-P344 WeakPolarHBondContact O-CA 3.42Å; G329-P344 WeakPolarHBondContact O-CB 3.23Å; G329-P344 WeakPolarHBondContact O-CG 3.15Å; E330-P344 HydrophobicContact CG-CG 4.22Å; P344-G346 PolarHBondContact O-N 2.72Å
345	S	62.4	Low	71.4	Confident	90 Å²	90	55.4 Å²	55.4	63%	0.629	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-11	172.8	55.4	0	0	0	0	114.1	Q343 Q347	Q343-S345 PolarHBondContact O-N 3.06Å; S345-Q347 VanDerWaalsContact C-N 3.34Å; S345-Q347 PolarHBondContact OG-N 2.95Å
346	G	60.2	Low	70.7	Confident	43 Å²	43	53.3 Å²	53.3	44%	0.443	30%	0.296	S	S	.	.	S	Bend	trans	86.1	0.2	-172.3	0	0	0	0	0	114.2	L342 Q343 P344	L342-G346 WeakPolarHBondContact CD2-O 3.06Å; Q343-G346 PolarHBondContact O-N 2.78Å; P344-G346 PolarHBondContact O-N 2.72Å
347	Q	63	Low	69.9	Low	115 Å²	115	55.6 Å²	55.6	54%	0.537	30%	0.302	S	S	.	.			trans	-79.1	131.9	179.2	-173.3	173.5	2.9	0	0	111.4	L342 Q343 S345 V349	L342-Q347 CarbonylContact C-O 3.4Å; L342-Q347 VanDerWaalsContact CA-O 3.29Å; L342-Q347 WeakPolarHBondContact CA-O 3.26Å; Q343-Q347 PolarHBondContact N-O 3.26Å; S345-Q347 VanDerWaalsContact C-N 3.34Å; S345-Q347 PolarHBondContact OG-N 2.95Å; Q347-V349 PolarHBondContact O-N 2.73Å
348	L	57.1	Low	68.5	Low	12 Å²	12	62.6 Å²	62.6	6%	0.063	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-65.8	124	173.9	-175.6	64.9	0	0	0	110.3	W340 L342 S350 D507	W340-L348 HydrophobicContact CB-CD1 3.96Å; W340-L348 HydrophobicContact CG-CD1 4.46Å; L342-L348 HydrophobicContact CD1-CD1 3.61Å; L348-S350 VanDerWaalsContact C-N 3.35Å; L348-S350 WeakPolarHBondContact CG-O 3.46Å; L348-S350 PolarHBondContact O-N 3.06Å; L348-D507 WeakPolarHBondContact CB-OD2 3.06Å
349	V	53.8	Low	67.5	Low	67 Å²	67	63.1 Å²	63.1	41%	0.406	33%	0.326	S	S	.	.	S	Bend	trans	-65.5	-39.3	-178.6	172.6	0	0	0	0	111.7	R341 Q343 Q347	R341-V349 HydrophobicContact CB-CG2 4.33Å; R341-V349 HydrophobicContact CG-CG2 4.36Å; R341-V349 VanDerWaalsContact O-CB 3.26Å; R341-V349 WeakPolarHBondContact O-CB 3.18Å; R341-V349 WeakPolarHBondContact O-CG2 3.29Å; R341-V349 PolarHBondContact O-N 2.91Å; Q343-V349 HydrophobicContact CG-CG2 3.59Å; Q347-V349 PolarHBondContact O-N 2.73Å
350	S	54.1	Low	66.8	Low	48 Å²	48	62.9 Å²	62.9	34%	0.336	33%	0.325	S	S	.	.			trans	-153.4	134.1	-179.7	166.9	0	0	0	0	110.1	L348 R352	L348-S350 VanDerWaalsContact C-N 3.35Å; L348-S350 WeakPolarHBondContact CG-O 3.46Å; L348-S350 PolarHBondContact O-N 3.06Å; S350-R352 WeakPolarHBondContact CB-O 3.47Å; S350-R352 PolarHBondContact O-N 3.25Å; S350-R352 PolarHBondContact OG-N 2.97Å; S350-R352 PolarHBondContact OG-O 2.83Å
351	P	56.9	Low	66	Low	80 Å²	80	66 Å²	66	52%	0.519	34%	0.339	S	S	.	.	S	Bend	trans	-63.2	-28.1	169.4	-24.8	35.5	0	0	0	113.6	R316 W340	R316-P351 PolarHBondContact NH1-O 3.4Å; W340-P351 PolarHBondContact NE1-O 3.41Å
352	R	60.9	Low	65.8	Low	191 Å²	191	65.3 Å²	65.3	72%	0.721	35%	0.354	S	S	*	.	S	Bend	trans	-87.7	134.1	174.6	-71.6	-160.4	-74.8	168.8	-3.8	110.2	S350	S350-R352 WeakPolarHBondContact CB-O 3.47Å; S350-R352 PolarHBondContact O-N 3.25Å; S350-R352 PolarHBondContact OG-N 2.97Å; S350-R352 PolarHBondContact OG-O 2.83Å
353	P	76.2	Confident	66.2	Low	14 Å²	14	65.7 Å²	65.7	9%	0.091	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-70.4	145.6	178.4	25.9	-29.7	0	0	0	111.6	I313 W338 F339 W340	I313-P353 HydrophobicContact CG2-CG 3.54Å; W338-P353 HydrophobicContact CB-CB 3.74Å; W338-P353 HydrophobicContact CB-CG 4.08Å; W338-P353 HydrophobicContact CD2-CG 4.21Å; W338-P353 HydrophobicContact CE3-CB 4.24Å; W338-P353 HydrophobicContact CE3-CG 4.04Å; W338-P353 HydrophobicContact CG-CB 4.37Å; W338-P353 HydrophobicContact CG-CG 4.24Å; F339-P353 CarbonylContact O-C 3.5Å; F339-P353 VanDerWaalsContact O-CA 3.23Å; F339-P353 WeakPolarHBondContact O-CA 3.36Å; F339-P353 WeakPolarHBondContact O-CB 3.47Å; W340-P353 HydrophobicContact CD2-CB 3.79Å; W340-P353 VanDerWaalsContact CE2-CB 3.44Å; W340-P353 HydrophobicContact CE3-CB 4.15Å; W340-P353 HydrophobicContact CG-CB 4.4Å; W340-P353 HydrophobicContact CH2-CB 4.02Å; W340-P353 HydrophobicContact CH2-CG 4.04Å; W340-P353 HydrophobicContact CZ2-CB 3.58Å; W340-P353 HydrophobicContact CZ2-CG 3.49Å; W340-P353 VanDerWaalsContact CZ2-CG 3.49Å; W340-P353 HydrophobicContact CZ3-CB 4.26Å
354	A	70	Confident	67.4	Low	47 Å²	47	63.6 Å²	63.6	39%	0.388	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	158.5	166.9	0	0	0	0	0	110.6	W338 F339	W338-A354 CarbonylContact C-O 3.58Å; W338-A354 VanDerWaalsContact CA-O 3.26Å; W338-A354 WeakPolarHBondContact CA-O 3.23Å; F339-A354 HydrophobicContact CD1-CB 4.28Å; F339-A354 HydrophobicContact CE1-CB 3.66Å; F339-A354 HydrophobicContact CE2-CB 4.01Å; F339-A354 HydrophobicContact CZ-CB 3.5Å; F339-A354 VanDerWaalsContact CZ-CB 3.5Å; F339-A354 PolarHBondContact N-O 3.48Å; F339-A354 PolarHBondContact O-N 3.31Å
355	R	76.4	Confident	68.4	Low	85 Å²	85	63 Å²	63	32%	0.321	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.5	176.8	-78.5	-170.6	153.5	-169.5	-6.2	111.4	P337 W338 H357 R358 F359	P337-R355 WeakPolarHBondContact O-CA 3.38Å; W338-R355 HydrophobicContact CE3-CB 4.49Å; W338-R355 HydrophobicContact CE3-CG 3.61Å; W338-R355 HydrophobicContact CH2-CG 3.75Å; W338-R355 HydrophobicContact CZ3-CB 4.4Å; W338-R355 HydrophobicContact CZ3-CG 3.18Å; R355-H357 PolarHBondContact O-N 3.44Å; R355-R358 HydrophobicContact CB-CB 4.04Å; R355-R358 HydrophobicContact CB-CG 3.87Å; R355-R358 PolarHBondContact O-N 2.8Å; R355-R358 VanDerWaalsContact O-N 3.1Å; R355-F359 PolarHBondContact O-N 3Å
356	L	78.1	Confident	69.6	Low	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-50.2	-57	179.2	-175.5	74.6	0	0	0	112	F334 P337 R358 F359 W360 L363 V367 V370	F334-L356 HydrophobicContact CD1-CD1 3.76Å; F334-L356 HydrophobicContact CE1-CD1 3.75Å; P337-L356 PolarHBondContact O-N 2.77Å; L356-R358 PolarHBondContact O-N 2.84Å; L356-F359 PolarHBondContact O-N 3.12Å; L356-F359 VanDerWaalsContact O-N 3.13Å; L356-W360 VanDerWaalsContact CD1-CD1 3.44Å; L356-W360 PolarHBondContact O-N 2.95Å; L356-L363 HydrophobicContact CD2-CD2 3.66Å; L356-L363 HydrophobicContact CG-CD2 3.86Å; L356-V367 WeakPolarHBondContact CD2-O 3.49Å; L356-V370 HydrophobicContact CD1-CG2 3.68Å; L356-V370 HydrophobicContact CD2-CG2 3.96Å; L356-V370 HydrophobicContact CG-CG2 4.46Å
357	H	74.2	Confident	71.1	Confident	63 Å²	63	64 Å²	64	29%	0.292	34%	0.335	S	S	.	.	H	α-helix	trans	-71	-13.1	-176.9	-59.4	86.4	0	0	0	114.8	R355 P364 A365 V367	R355-H357 PolarHBondContact O-N 3.44Å; H357-P364 PolarHBondContact NE2-O 3.25Å; H357-A365 WeakPolarHBondContact NE2-CA 3.35Å; H357-V367 PolarHBondContact CE1-O 3.3Å; H357-V367 PolarHBondContact NE2-O 3.43Å
358	R	57.1	Low	72.3	Confident	191 Å²	191	65.2 Å²	65.2	72%	0.721	34%	0.335	S	S	*	.	H	α-helix	trans	-85.3	-23.1	173.5	-71.1	-170.1	177.7	173.9	-3.7	112	R355 L356	R355-R358 HydrophobicContact CB-CB 4.04Å; R355-R358 HydrophobicContact CB-CG 3.87Å; R355-R358 PolarHBondContact O-N 2.8Å; R355-R358 VanDerWaalsContact O-N 3.1Å; L356-R358 PolarHBondContact O-N 2.84Å
359	F	65.9	Low	74	Confident	37 Å²	37	67.6 Å²	67.6	16%	0.162	35%	0.35	C	S	.	.	H	α-helix	trans	-100.1	-41.1	-178.6	-173.4	-90.5	0	0	0	112.2	F332 F339 R355 L356 E361 R396	F332-F359 HydrophobicContact CE1-CD1 4.43Å; F332-F359 AromaticContact CE1-CE1 3.69Å; F332-F359 HydrophobicContact CE1-CE1 3.69Å; F332-F359 AromaticContact CE1-CZ 3.84Å; F332-F359 HydrophobicContact CE1-CZ 3.84Å; F332-F359 HydrophobicContact CZ-CE1 4.04Å; F332-F359 AromaticContact CZ-CZ 3.94Å; F332-F359 HydrophobicContact CZ-CZ 3.94Å; F339-F359 HydrophobicContact CE1-CB 3.44Å; F339-F359 VanDerWaalsContact CE1-CB 3.44Å; F339-F359 HydrophobicContact CE1-CD1 4.28Å; F339-F359 AromaticContact CE1-CG 3.87Å; F339-F359 HydrophobicContact CE1-CG 3.87Å; F339-F359 HydrophobicContact CE2-CD2 4.44Å; F339-F359 HydrophobicContact CE2-CG 4.32Å; F339-F359 HydrophobicContact CZ-CB 3.44Å; F339-F359 VanDerWaalsContact CZ-CB 3.44Å; F339-F359 AromaticContact CZ-CD1 3.81Å; F339-F359 HydrophobicContact CZ-CD1 3.81Å; F339-F359 AromaticContact CZ-CD2 3.66Å; F339-F359 HydrophobicContact CZ-CD2 3.66Å; F339-F359 HydrophobicContact CZ-CE1 4.47Å; F339-F359 HydrophobicContact CZ-CE2 4.33Å; F339-F359 AromaticContact CZ-CG 3.35Å; F339-F359 HydrophobicContact CZ-CG 3.35Å; R355-F359 PolarHBondContact O-N 3Å; L356-F359 PolarHBondContact O-N 3.12Å; L356-F359 VanDerWaalsContact O-N 3.13Å; F359-E361 PolarHBondContact O-N 3.36Å; F359-R396 HydrophobicContact CD1-CG 4.4Å; F359-R396 HydrophobicContact CE1-CG 4.01Å; F359-R396 HydrophobicContact CZ-CG 4.11Å; F359-R396 WeakPolarHBondContact O-CB 3.28Å; F359-R396 VanDerWaalsContact O-CD 3.28Å; F359-R396 WeakPolarHBondContact O-CD 3.46Å
360	W	74.9	Confident	76	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.008	33%	0.331	C	S	.	.	S	Bend	trans	-94.9	92.4	177.7	-61.2	102.5	0	0	0	110.2	I327 F332 F334 L356 L363 I382 L384 F393 D395	I327-W360 HydrophobicContact CD1-CH2 3.96Å; I327-W360 HydrophobicContact CD1-CZ2 3.96Å; F332-W360 HydrophobicContact CE1-CZ2 4.35Å; F334-W360 AromaticContact CE1-NE1 3.58Å; F334-W360 HydrophobicContact CZ-CZ2 4.22Å; L356-W360 VanDerWaalsContact CD1-CD1 3.44Å; L356-W360 PolarHBondContact O-N 2.95Å; W360-L363 HydrophobicContact CB-CB 4.18Å; W360-L363 HydrophobicContact CB-CD2 4.42Å; W360-L363 WeakPolarHBondContact O-CB 3.14Å; W360-L363 PolarHBondContact O-N 2.95Å; W360-I382 HydrophobicContact CH2-CB 4.49Å; W360-I382 HydrophobicContact CH2-CD1 4Å; W360-I382 HydrophobicContact CH2-CG2 3.74Å; W360-I382 HydrophobicContact CZ3-CB 4.36Å; W360-I382 HydrophobicContact CZ3-CD1 4Å; W360-I382 HydrophobicContact CZ3-CG2 3.94Å; W360-L384 HydrophobicContact CB-CD1 4.4Å; W360-L384 HydrophobicContact CD2-CD1 3.7Å; W360-L384 HydrophobicContact CE3-CD1 4.09Å; W360-L384 HydrophobicContact CG-CD1 3.82Å; W360-L384 HydrophobicContact CZ2-CD2 4.34Å; W360-F393 HydrophobicContact CB-CE1 3.94Å; W360-F393 HydrophobicContact CB-CZ 4.11Å; W360-F393 HydrophobicContact CE3-CB 4.32Å; W360-F393 AromaticContact CE3-CD1 3.75Å; W360-F393 HydrophobicContact CE3-CD1 3.75Å; W360-F393 HydrophobicContact CE3-CD2 4.32Å; W360-F393 HydrophobicContact CE3-CE1 4.12Å; W360-F393 AromaticContact CE3-CG 3.87Å; W360-F393 HydrophobicContact CE3-CG 3.87Å; W360-F393 HydrophobicContact CZ3-CB 4.18Å; W360-F393 HydrophobicContact CZ3-CD1 4.42Å; W360-F393 HydrophobicContact CZ3-CG 4.21Å; W360-D395 WeakPolarHBondContact CZ3-O 3.43Å
361	E	69.9	Low	77.9	Confident	68 Å²	68	63.6 Å²	63.6	32%	0.318	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-71.9	131.5	-172.8	-62.7	-179.9	-131.7	0	0	111	F359 L363 F393 R396 Q397 L398	F359-E361 PolarHBondContact O-N 3.36Å; E361-L363 VanDerWaalsContact C-N 3.29Å; E361-L363 PolarHBondContact O-N 2.69Å; E361-F393 WeakPolarHBondContact O-CE1 2.97Å; E361-R396 WeakPolarHBondContact CB-O 3.49Å; E361-R396 PolarHBondContact N-O 2.78Å; E361-R396 IonicContact OE1-CZ 3.61Å; E361-R396 IonicContact OE1-NE 3.03Å; E361-R396 IonicContact OE1-NH2 3.96Å; E361-R396 PolarHBondContact OE1-NH2 3.11Å; E361-Q397 PolarHBondContact OE1-NE2 3.34Å; E361-Q397 PolarHBondContact OE2-NE2 2.79Å; E361-L398 WeakPolarHBondContact O-CB 3.41Å; E361-L398 PolarHBondContact O-N 3.33Å
362	G	74.8	Confident	79.8	Confident	55 Å²	55	59.8 Å²	59.8	57%	0.567	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	-6.5	-175.8	0	0	0	0	0	114.6	P364 L398	G362-P364 WeakPolarHBondContact O-CD 3.42Å; G362-L398 WeakPolarHBondContact O-CD2 3.45Å
363	L	83.8	Confident	81.5	Confident	11 Å²	11	50.8 Å²	50.8	6%	0.058	26%	0.263	C	S	.	.			trans	-61.4	124.4	171.4	-169.1	68.5	0	0	0	109.5	L356 W360 E361 A365 V367 W391 F393	L356-L363 HydrophobicContact CD2-CD2 3.66Å; L356-L363 HydrophobicContact CG-CD2 3.86Å; W360-L363 HydrophobicContact CB-CB 4.18Å; W360-L363 HydrophobicContact CB-CD2 4.42Å; W360-L363 WeakPolarHBondContact O-CB 3.14Å; W360-L363 PolarHBondContact O-N 2.95Å; E361-L363 VanDerWaalsContact C-N 3.29Å; E361-L363 PolarHBondContact O-N 2.69Å; L363-A365 PolarHBondContact O-N 2.98Å; L363-V367 HydrophobicContact CD1-CB 4.16Å; L363-V367 HydrophobicContact CD1-CG1 4.06Å; L363-V367 HydrophobicContact CD1-CG2 4.45Å; L363-V367 HydrophobicContact CD2-CB 4.23Å; L363-V367 HydrophobicContact CD2-CG1 4.13Å; L363-V367 HydrophobicContact CG-CB 4.03Å; L363-V367 HydrophobicContact CG-CG1 4.25Å; L363-W391 HydrophobicContact CD1-CB 4.49Å; L363-W391 HydrophobicContact CD1-CD2 4.15Å; L363-W391 HydrophobicContact CD1-CG 4.08Å; L363-F393 HydrophobicContact CB-CZ 4.02Å; L363-F393 HydrophobicContact CD1-CE2 4.24Å; L363-F393 HydrophobicContact CD1-CZ 3.92Å
364	P	87.4	Confident	82.3	Confident	35 Å²	35	50.5 Å²	50.5	23%	0.227	26%	0.26	C	S	.	.			trans	-61.2	137.3	-176.5	-23.8	33.7	0	0	0	112.3	H357 G362 Q366 V367	H357-P364 PolarHBondContact NE2-O 3.25Å; G362-P364 WeakPolarHBondContact O-CD 3.42Å; P364-Q366 HydrophobicContact CB-CG 4.28Å; P364-Q366 VanDerWaalsContact CB-NE2 3.27Å; P364-Q366 PolarHBondContact O-N 3Å; P364-V367 HydrophobicContact CB-CG2 4.27Å; P364-V367 HydrophobicContact CG-CG2 4.46Å; P364-V367 WeakPolarHBondContact O-CB 3.46Å; P364-V367 PolarHBondContact O-N 2.93Å
365	A	80.3	Confident	83	Confident	69 Å²	69	49.1 Å²	49.1	57%	0.57	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-17.6	-173.4	0	0	0	0	0	115.4	H357 L363	H357-A365 WeakPolarHBondContact NE2-CA 3.35Å; L363-A365 PolarHBondContact O-N 2.98Å
366	Q	87.2	Confident	83.4	Confident	146 Å²	146	47.7 Å²	47.7	68%	0.682	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-23.1	173.1	65.6	-88	26.9	0	0	113.3	P364 R368	P364-Q366 HydrophobicContact CB-CG 4.28Å; P364-Q366 VanDerWaalsContact CB-NE2 3.27Å; P364-Q366 PolarHBondContact O-N 3Å; Q366-R368 PolarHBondContact O-N 3.49Å
367	V	90.8	Very high	83.2	Confident	9 Å²	9	54.1 Å²	54.1	6%	0.055	27%	0.273	C	S	.	.			trans	-82.8	84.6	-178.3	-174.3	0	0	0	0	109.3	L356 H357 L363 P364 W391	L356-V367 WeakPolarHBondContact CD2-O 3.49Å; H357-V367 PolarHBondContact CE1-O 3.3Å; H357-V367 PolarHBondContact NE2-O 3.43Å; L363-V367 HydrophobicContact CD1-CB 4.16Å; L363-V367 HydrophobicContact CD1-CG1 4.06Å; L363-V367 HydrophobicContact CD1-CG2 4.45Å; L363-V367 HydrophobicContact CD2-CB 4.23Å; L363-V367 HydrophobicContact CD2-CG1 4.13Å; L363-V367 HydrophobicContact CG-CB 4.03Å; L363-V367 HydrophobicContact CG-CG1 4.25Å; P364-V367 HydrophobicContact CB-CG2 4.27Å; P364-V367 HydrophobicContact CG-CG2 4.46Å; P364-V367 WeakPolarHBondContact O-CB 3.46Å; P364-V367 PolarHBondContact O-N 2.93Å; V367-W391 HydrophobicContact CG1-CH2 4.33Å; V367-W391 HydrophobicContact CG1-CZ3 4.33Å; V367-W391 HydrophobicContact CG2-CH2 3.69Å; V367-W391 HydrophobicContact CG2-CZ2 3.51Å; V367-W391 HydrophobicContact CG2-CZ3 4.42Å
368	R	88.6	Confident	83	Confident	140 Å²	140	54.9 Å²	54.9	53%	0.528	30%	0.298	S	S	.	.			trans	-94.4	-8	-175.2	-64.7	177.3	-179.1	-118.2	-0.4	114.2	G336 P337 Q366	G336-R368 CarbonylContact C-O 3.57Å; G336-R368 WeakPolarHBondContact CA-O 3.29Å; P337-R368 VanDerWaalsContact N-O 3.12Å; Q366-R368 PolarHBondContact O-N 3.49Å
369	V	93.3	Very high	84	Confident	62 Å²	62	49.3 Å²	49.3	38%	0.376	28%	0.283	S	S	.	.			trans	-135.1	129.9	-176.6	-178	0	0	0	0	107.9	D322 S386	D322-V369 HydrophobicContact CB-CG1 3.95Å; V369-S386 VanDerWaalsContact O-CB 3.28Å; V369-S386 WeakPolarHBondContact O-CB 3.45Å; V369-S386 PolarHBondContact O-OG 3.28Å
370	V	95.6	Very high	84.5	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.006	29%	0.287	C	S	.	.			trans	-102.4	120.4	167.6	177.6	0	0	0	0	106.2	D322 A323 F334 L356 A372 A373 L384	D322-V370 CarbonylContact C-O 3.58Å; D322-V370 WeakPolarHBondContact CB-O 3.44Å; A323-V370 HydrophobicContact CB-CG1 4.12Å; A323-V370 WeakPolarHBondContact CB-O 3.31Å; F334-V370 HydrophobicContact CB-CB 4.34Å; F334-V370 HydrophobicContact CD1-CB 4.2Å; F334-V370 HydrophobicContact CD1-CG2 4.25Å; F334-V370 HydrophobicContact CD2-CG1 4.47Å; F334-V370 HydrophobicContact CG-CB 4.16Å; F334-V370 HydrophobicContact CG-CG1 4.45Å; L356-V370 HydrophobicContact CD1-CG2 3.68Å; L356-V370 HydrophobicContact CD2-CG2 3.96Å; L356-V370 HydrophobicContact CG-CG2 4.46Å; V370-A372 WeakPolarHBondContact CG1-O 3.19Å; V370-A373 HydrophobicContact CG1-CB 4.09Å; V370-L384 HydrophobicContact CG1-CB 4.34Å; V370-L384 HydrophobicContact CG1-CD2 4.32Å; V370-L384 HydrophobicContact CG2-CD1 4.37Å
371	Q	94.6	Very high	85.1	Confident	30 Å²	30	51.2 Å²	51.2	14%	0.14	30%	0.296	C	S	.	.			trans	-95.5	-21.2	-176.4	75.6	-163.9	12.1	0	0	112.9	D322 F385 G387 V416 D417	D322-Q371 CarbonylContact O-C 3.45Å; D322-Q371 WeakPolarHBondContact O-CA 3.28Å; D322-Q371 VanDerWaalsContact O-O 3.09Å; Q371-F385 HydrophobicContact CG-CB 4.05Å; Q371-F385 WeakPolarHBondContact CG-O 3.46Å; Q371-F385 PolarHBondContact N-O 3.43Å; Q371-G387 VanDerWaalsContact CD-N 3.33Å; Q371-G387 PolarHBondContact NE2-O 3.21Å; Q371-V416 VanDerWaalsContact CG-O 3.31Å; Q371-V416 WeakPolarHBondContact CG-O 3.5Å; Q371-D417 VanDerWaalsContact O-O 3.13Å
372	A	96.2	Very high	86	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	152.9	171.7	0	0	0	0	0	108.5	V370 F385 V416 V419	V370-A372 WeakPolarHBondContact CG1-O 3.19Å; A372-F385 HydrophobicContact CB-CB 4.14Å; A372-F385 HydrophobicContact CB-CD2 4.28Å; A372-F385 HydrophobicContact CB-CG 4.4Å; A372-F385 WeakPolarHBondContact O-CB 3.47Å; A372-F385 WeakPolarHBondContact O-CD2 3.37Å; A372-F385 PolarHBondContact O-N 3.16Å; A372-V416 HydrophobicContact CB-CG2 3.98Å; A372-V419 HydrophobicContact CB-CB 4.3Å; A372-V419 HydrophobicContact CB-CG2 3.87Å
373	A	96	Very high	87	Confident	2 Å²	2	45.6 Å²	45.6	2%	0.017	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	149.2	173.3	0	0	0	0	0	111.5	A325 F334 V370 L383 L384	A325-A373 HydrophobicContact CB-CB 3.7Å; A325-A373 WeakPolarHBondContact CB-O 3.49Å; F334-A373 HydrophobicContact CE2-CB 4.29Å; V370-A373 HydrophobicContact CG1-CB 4.09Å; A373-L383 VanDerWaalsContact CA-O 3.24Å; A373-L383 WeakPolarHBondContact CA-O 3.4Å; A373-L384 HydrophobicContact CB-CD2 3.51Å
374	Y	92.9	Very high	87.6	Confident	7 Å²	7	45.2 Å²	45.2	3%	0.027	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	157.4	169.8	79	-68.3	0	0	0	112.3	R376 I382 L383 F385 V419 T428 E441	Y374-R376 HydrophobicContact CE2-CB 3.96Å; Y374-R376 HydrophobicContact CE2-CG 4.5Å; Y374-I382 WeakPolarHBondContact O-CA 2.91Å; Y374-L383 HydrophobicContact CD1-CB 4.04Å; Y374-L383 HydrophobicContact CE1-CB 3.69Å; Y374-L383 HydrophobicContact CE1-CD1 4.14Å; Y374-L383 HydrophobicContact CE1-CD2 3.91Å; Y374-L383 HydrophobicContact CE1-CG 4.12Å; Y374-L383 PolarHBondContact N-O 2.63Å; Y374-L383 VanDerWaalsContact N-O 3.14Å; Y374-L383 PolarHBondContact O-N 3.17Å; Y374-F385 AromaticContact CD1-CE2 3.82Å; Y374-F385 HydrophobicContact CD1-CE2 3.82Å; Y374-F385 HydrophobicContact CD1-CZ 4.43Å; Y374-F385 AromaticContact CE1-CE2 3.77Å; Y374-F385 HydrophobicContact CE1-CE2 3.77Å; Y374-F385 AromaticContact CE1-CZ 3.94Å; Y374-F385 HydrophobicContact CE1-CZ 3.94Å; Y374-V419 WeakPolarHBondContact CB-O 3.41Å; Y374-V419 HydrophobicContact CD1-CB 4Å; Y374-V419 HydrophobicContact CD1-CG1 3.33Å; Y374-V419 HydrophobicContact CE1-CG1 3.5Å; Y374-V419 VanDerWaalsContact CE1-CG1 3.5Å; Y374-V419 HydrophobicContact CG-CG1 3.95Å; Y374-T428 HydrophobicContact CD2-CG2 4.46Å; Y374-T428 HydrophobicContact CE1-CG2 4.32Å; Y374-T428 HydrophobicContact CE2-CG2 3.78Å; Y374-E441 PolarHBondContact OH-OE1 3.17Å
375	A	86	Confident	88.1	Confident	18 Å²	18	43.6 Å²	43.6	15%	0.149	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.4	166.1	0	0	0	0	0	109.9	I327 H377 I382	I327-A375 HydrophobicContact CG2-CB 4.48Å; A375-H377 PolarHBondContact O-N 3.32Å; A375-I382 HydrophobicContact CB-CG1 4.45Å
376	R	84.8	Confident	88.8	Confident	55 Å²	55	41.5 Å²	41.5	21%	0.208	22%	0.224	C	C	.	.			trans	-76.4	121.9	176.6	-178.7	166.1	63.1	-172.8	0.6	110.1	Y374 G378 D379 G380 R381 L383 E441	Y374-R376 HydrophobicContact CE2-CB 3.96Å; Y374-R376 HydrophobicContact CE2-CG 4.5Å; R376-G378 VanDerWaalsContact C-N 3.34Å; R376-G378 PolarHBondContact O-N 3.5Å; R376-D379 IonicContact CZ-OD1 3.84Å; R376-D379 IonicContact CZ-OD2 3.91Å; R376-D379 IonicContact NE-OD1 3.14Å; R376-D379 PolarHBondContact NE-OD1 3.09Å; R376-D379 IonicContact NE-OD2 2.87Å; R376-D379 PolarHBondContact NE-OD2 2.75Å; R376-D379 IonicContact NH2-OD1 3.45Å; R376-D379 IonicContact NH2-OD2 3.31Å; R376-D379 PolarHBondContact NH2-OD2 2.74Å; R376-G380 VanDerWaalsContact O-CA 3.25Å; R376-G380 WeakPolarHBondContact O-CA 3.12Å; R376-G380 PolarHBondContact O-N 3.39Å; R376-R381 PolarHBondContact N-O 2.74Å; R376-L383 HydrophobicContact CB-CD1 4.26Å; R376-E441 WeakPolarHBondContact CD-OE2 3.41Å; R376-E441 IonicContact NH1-OE2 3.61Å; R376-E441 PolarHBondContact NH1-OE2 3.1Å
377	H	72.8	Confident	89.1	Confident	135 Å²	135	35.2 Å²	35.2	63%	0.625	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-31.5	-174.7	-70.8	-88.5	0	0	0	114.3	A375 D379 S421	A375-H377 PolarHBondContact O-N 3.32Å; H377-D379 PolarHBondContact O-N 3.24Å; H377-S421 WeakPolarHBondContact CD2-CB 3.5Å; H377-S421 PolarHBondContact CD2-OG 3.36Å
378	G	69.7	Low	89.4	Confident	80 Å²	80	37.7 Å²	37.7	83%	0.825	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-36.4	-173.7	0	0	0	0	0	114	R376	R376-G378 VanDerWaalsContact C-N 3.34Å; R376-G378 PolarHBondContact O-N 3.5Å
379	D	79.3	Confident	89.7	Confident	73 Å²	73	35 Å²	35	39%	0.39	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135	2.9	-174.8	63.6	-2.9	0	0	0	114.3	R376 H377 R381	R376-D379 IonicContact CZ-OD1 3.84Å; R376-D379 IonicContact CZ-OD2 3.91Å; R376-D379 IonicContact NE-OD1 3.14Å; R376-D379 PolarHBondContact NE-OD1 3.09Å; R376-D379 IonicContact NE-OD2 2.87Å; R376-D379 PolarHBondContact NE-OD2 2.75Å; R376-D379 IonicContact NH2-OD1 3.45Å; R376-D379 IonicContact NH2-OD2 3.31Å; R376-D379 PolarHBondContact NH2-OD2 2.74Å; H377-D379 PolarHBondContact O-N 3.24Å; D379-R381 HydrophobicContact CB-CG 4.43Å; D379-R381 PolarHBondContact O-N 3.17Å; D379-R381 PolarHBondContact OD1-N 3.13Å; D379-R381 WeakPolarHBondContact OD2-CD 3.41Å; D379-R381 WeakPolarHBondContact OD2-CG 3.35Å; D379-R381 IonicContact OD2-CZ 3.22Å; D379-R381 IonicContact OD2-NE 3.08Å; D379-R381 PolarHBondContact OD2-NE 3.28Å
380	G	76.1	Confident	89.9	Confident	24 Å²	24	32.5 Å²	32.5	25%	0.247	19%	0.192	C	C	.	.			trans	69.5	13.5	176.5	0	0	0	0	0	114.7	R328 R376	R328-G380 PolarHBondContact NE-O 2.84Å; R328-G380 PolarHBondContact NH2-O 2.55Å; R328-G380 VanDerWaalsContact NH2-O 3.08Å; R376-G380 VanDerWaalsContact O-CA 3.25Å; R376-G380 WeakPolarHBondContact O-CA 3.12Å; R376-G380 PolarHBondContact O-N 3.39Å
381	R	86.9	Confident	90	Very high	55 Å²	55	32.8 Å²	32.8	21%	0.208	19%	0.193	C	C	.	.			trans	-76.4	150.6	176.1	-64.9	-175.6	-162.4	-152.6	-16.5	111.3	R376 D379 V392 F393 E399	R376-R381 PolarHBondContact N-O 2.74Å; D379-R381 HydrophobicContact CB-CG 4.43Å; D379-R381 PolarHBondContact O-N 3.17Å; D379-R381 PolarHBondContact OD1-N 3.13Å; D379-R381 WeakPolarHBondContact OD2-CD 3.41Å; D379-R381 WeakPolarHBondContact OD2-CG 3.35Å; D379-R381 IonicContact OD2-CZ 3.22Å; D379-R381 IonicContact OD2-NE 3.08Å; D379-R381 PolarHBondContact OD2-NE 3.28Å; R381-V392 HydrophobicContact CB-CG1 4.01Å; R381-V392 HydrophobicContact CG-CG1 4.36Å; R381-F393 WeakPolarHBondContact CA-O 3.34Å; R381-E399 WeakPolarHBondContact CD-OE2 2.89Å; R381-E399 VanDerWaalsContact CZ-CD 3.44Å; R381-E399 IonicContact CZ-OE1 3.71Å; R381-E399 IonicContact CZ-OE2 2.96Å; R381-E399 IonicContact NE-OE2 3.43Å; R381-E399 PolarHBondContact NE-OE2 3.24Å; R381-E399 IonicContact NH1-OE1 3.18Å; R381-E399 PolarHBondContact NH1-OE1 2.99Å; R381-E399 IonicContact NH1-OE2 2.65Å; R381-E399 PolarHBondContact NH1-OE2 3.35Å; R381-E399 IonicContact NH2-OE1 3.61Å; R381-E399 PolarHBondContact NH2-OE1 3.42Å; R381-E399 IonicContact NH2-OE2 3.38Å; R381-E399 PolarHBondContact NH2-OE2 2.92Å
382	I	89.7	Confident	89.9	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.015	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127	-176.5	-59.9	155.6	0	0	0	108	I327 W360 Y374 A375 L384 F393 D395	I327-I382 HydrophobicContact CD1-CG2 3.94Å; I327-I382 HydrophobicContact CG1-CG2 4.4Å; I327-I382 HydrophobicContact CG2-CD1 3.4Å; I327-I382 HydrophobicContact CG2-CG1 3.66Å; I327-I382 HydrophobicContact CG2-CG2 4.4Å; W360-I382 HydrophobicContact CH2-CB 4.49Å; W360-I382 HydrophobicContact CH2-CD1 4Å; W360-I382 HydrophobicContact CH2-CG2 3.74Å; W360-I382 HydrophobicContact CZ3-CB 4.36Å; W360-I382 HydrophobicContact CZ3-CD1 4Å; W360-I382 HydrophobicContact CZ3-CG2 3.94Å; Y374-I382 WeakPolarHBondContact O-CA 2.91Å; A375-I382 HydrophobicContact CB-CG1 4.45Å; I382-L384 HydrophobicContact CG2-CD2 4.05Å; I382-F393 HydrophobicContact CB-CB 4.17Å; I382-F393 PolarHBondContact N-O 2.84Å; I382-F393 PolarHBondContact O-N 2.93Å; I382-D395 WeakPolarHBondContact CD1-O 3.38Å
383	L	95.3	Very high	89.5	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.7	178.4	-72.3	79.1	0	0	0	108.6	A373 Y374 R376 F385 F390 W391 V392	A373-L383 VanDerWaalsContact CA-O 3.24Å; A373-L383 WeakPolarHBondContact CA-O 3.4Å; Y374-L383 HydrophobicContact CD1-CB 4.04Å; Y374-L383 HydrophobicContact CE1-CB 3.69Å; Y374-L383 HydrophobicContact CE1-CD1 4.14Å; Y374-L383 HydrophobicContact CE1-CD2 3.91Å; Y374-L383 HydrophobicContact CE1-CG 4.12Å; Y374-L383 PolarHBondContact N-O 2.63Å; Y374-L383 VanDerWaalsContact N-O 3.14Å; Y374-L383 PolarHBondContact O-N 3.17Å; R376-L383 HydrophobicContact CB-CD1 4.26Å; L383-F385 HydrophobicContact CB-CE2 3.64Å; L383-F385 HydrophobicContact CB-CZ 4.09Å; L383-F385 HydrophobicContact CD2-CZ 4.22Å; L383-F390 HydrophobicContact CD2-CD2 3.77Å; L383-F390 HydrophobicContact CD2-CE2 3.82Å; L383-F390 HydrophobicContact CG-CD2 4.34Å; L383-W391 WeakPolarHBondContact CA-O 3.25Å; L383-V392 HydrophobicContact CG-CG2 4.3Å
384	L	96.4	Very high	88.7	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.4	172.6	-54.7	-174.5	0	0	0	109	W360 V370 A373 I382 F390 W391 F393	W360-L384 HydrophobicContact CB-CD1 4.4Å; W360-L384 HydrophobicContact CD2-CD1 3.7Å; W360-L384 HydrophobicContact CE3-CD1 4.09Å; W360-L384 HydrophobicContact CG-CD1 3.82Å; W360-L384 HydrophobicContact CZ2-CD2 4.34Å; V370-L384 HydrophobicContact CG1-CB 4.34Å; V370-L384 HydrophobicContact CG1-CD2 4.32Å; V370-L384 HydrophobicContact CG2-CD1 4.37Å; A373-L384 HydrophobicContact CB-CD2 3.51Å; I382-L384 HydrophobicContact CG2-CD2 4.05Å; L384-F390 CarbonylContact O-C 3.58Å; L384-F390 WeakPolarHBondContact O-CA 3.45Å; L384-F390 WeakPolarHBondContact O-CB 3.46Å; L384-W391 PolarHBondContact N-O 2.95Å; L384-W391 PolarHBondContact O-N 3.45Å; L384-F393 HydrophobicContact CB-CE2 4.37Å; L384-F393 HydrophobicContact CD1-CD2 4.08Å; L384-F393 HydrophobicContact CD1-CE2 3.64Å; L384-F393 HydrophobicContact CD1-CZ 4.2Å; L384-F393 HydrophobicContact CG-CD2 4.01Å; L384-F393 HydrophobicContact CG-CE2 3.93Å
385	F	97.1	Very high	87.7	Confident	1 Å²	1	40.7 Å²	40.7	0%	0.004	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	138.8	-178.5	-63.3	-102.1	0	0	0	110.1	Q371 A372 Y374 L383 F390 L405 L408 V416 V419 L430	Q371-F385 HydrophobicContact CG-CB 4.05Å; Q371-F385 WeakPolarHBondContact CG-O 3.46Å; Q371-F385 PolarHBondContact N-O 3.43Å; A372-F385 HydrophobicContact CB-CB 4.14Å; A372-F385 HydrophobicContact CB-CD2 4.28Å; A372-F385 HydrophobicContact CB-CG 4.4Å; A372-F385 WeakPolarHBondContact O-CB 3.47Å; A372-F385 WeakPolarHBondContact O-CD2 3.37Å; A372-F385 PolarHBondContact O-N 3.16Å; Y374-F385 AromaticContact CD1-CE2 3.82Å; Y374-F385 HydrophobicContact CD1-CE2 3.82Å; Y374-F385 HydrophobicContact CD1-CZ 4.43Å; Y374-F385 AromaticContact CE1-CE2 3.77Å; Y374-F385 HydrophobicContact CE1-CE2 3.77Å; Y374-F385 AromaticContact CE1-CZ 3.94Å; Y374-F385 HydrophobicContact CE1-CZ 3.94Å; L383-F385 HydrophobicContact CB-CE2 3.64Å; L383-F385 HydrophobicContact CB-CZ 4.09Å; L383-F385 HydrophobicContact CD2-CZ 4.22Å; F385-F390 HydrophobicContact CD1-CB 3.56Å; F385-F390 HydrophobicContact CD1-CG 4.41Å; F385-F390 HydrophobicContact CE1-CB 3.64Å; F385-F390 HydrophobicContact CE1-CD1 4.3Å; F385-F390 HydrophobicContact CE1-CG 4.04Å; F385-F390 HydrophobicContact CG-CB 4.02Å; F385-F390 HydrophobicContact CZ-CB 4.17Å; F385-F390 HydrophobicContact CZ-CG 4.47Å; F385-L405 HydrophobicContact CD1-CD1 4.28Å; F385-L405 HydrophobicContact CD1-CD2 4.03Å; F385-L405 HydrophobicContact CD1-CG 4.19Å; F385-L405 HydrophobicContact CE1-CD2 4.31Å; F385-L405 HydrophobicContact CE1-CG 4.34Å; F385-L408 HydrophobicContact CE1-CD1 3.61Å; F385-L408 HydrophobicContact CZ-CD1 3.87Å; F385-V416 HydrophobicContact CB-CG2 3.91Å; F385-V416 HydrophobicContact CD1-CG2 3.73Å; F385-V416 HydrophobicContact CE1-CG2 4.48Å; F385-V416 HydrophobicContact CG-CG2 3.88Å; F385-V419 HydrophobicContact CD1-CG2 4.5Å; F385-V419 HydrophobicContact CD2-CG2 4.09Å; F385-V419 HydrophobicContact CE1-CG2 4.33Å; F385-V419 HydrophobicContact CE2-CB 4.17Å; F385-V419 HydrophobicContact CE2-CG1 4.22Å; F385-V419 HydrophobicContact CE2-CG2 3.93Å; F385-V419 HydrophobicContact CG-CG2 4.39Å; F385-V419 HydrophobicContact CZ-CG1 4.3Å; F385-V419 HydrophobicContact CZ-CG2 4.06Å; F385-L430 HydrophobicContact CE1-CD2 4.44Å
386	S	96.3	Very high	86.7	Confident	25 Å²	25	43.7 Å²	43.7	18%	0.175	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	118.7	174.5	-165.4	0	0	0	0	109.5	V369 Q389	V369-S386 VanDerWaalsContact O-CB 3.28Å; V369-S386 WeakPolarHBondContact O-CB 3.45Å; V369-S386 PolarHBondContact O-OG 3.28Å; S386-Q389 PolarHBondContact N-O 3.4Å; S386-Q389 PolarHBondContact O-N 3.28Å
387	G	93.9	Very high	85.8	Confident	14 Å²	14	45.9 Å²	45.9	14%	0.144	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	-138.6	-170.9	0	0	0	0	0	112	Q371 Q389 E415	Q371-G387 VanDerWaalsContact CD-N 3.33Å; Q371-G387 PolarHBondContact NE2-O 3.21Å; G387-Q389 PolarHBondContact O-N 3.48Å; G387-E415 WeakPolarHBondContact CA-OE1 3.21Å
388	P	95.3	Very high	86.3	Confident	62 Å²	62	41.9 Å²	41.9	40%	0.403	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	19.2	179.7	35.5	-36.6	0	0	0	113.1	L405	P388-L405 WeakPolarHBondContact O-CD1 3.48Å; P388-L405 PolarHBondContact O-N 3.15Å
389	Q	96.4	Very high	87.2	Confident	83 Å²	83	41.3 Å²	41.3	39%	0.388	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	158.1	-177.2	-59.8	-174.6	-55.4	0	0	113.3	S386 G387 W391 A402 R403	S386-Q389 PolarHBondContact N-O 3.4Å; S386-Q389 PolarHBondContact O-N 3.28Å; G387-Q389 PolarHBondContact O-N 3.48Å; Q389-W391 HydrophobicContact CB-CH2 3.72Å; Q389-W391 HydrophobicContact CB-CZ2 4.35Å; Q389-W391 HydrophobicContact CB-CZ3 3.97Å; Q389-A402 HydrophobicContact CB-CB 4.47Å; Q389-R403 CarbonylContact C-O 3.5Å; Q389-R403 WeakPolarHBondContact CA-O 3.23Å
390	F	96.7	Very high	87.3	Confident	9 Å²	9	43.1 Å²	43.1	4%	0.039	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	157.9	170.3	73.3	-87.4	0	0	0	112.2	L383 L384 F385 V392 R403 P404 E407 L408	L383-F390 HydrophobicContact CD2-CD2 3.77Å; L383-F390 HydrophobicContact CD2-CE2 3.82Å; L383-F390 HydrophobicContact CG-CD2 4.34Å; L384-F390 CarbonylContact O-C 3.58Å; L384-F390 WeakPolarHBondContact O-CA 3.45Å; L384-F390 WeakPolarHBondContact O-CB 3.46Å; F385-F390 HydrophobicContact CD1-CB 3.56Å; F385-F390 HydrophobicContact CD1-CG 4.41Å; F385-F390 HydrophobicContact CE1-CB 3.64Å; F385-F390 HydrophobicContact CE1-CD1 4.3Å; F385-F390 HydrophobicContact CE1-CG 4.04Å; F385-F390 HydrophobicContact CG-CB 4.02Å; F385-F390 HydrophobicContact CZ-CB 4.17Å; F385-F390 HydrophobicContact CZ-CG 4.47Å; F390-V392 HydrophobicContact CD2-CG2 4.08Å; F390-V392 HydrophobicContact CE2-CG2 3.77Å; F390-R403 HydrophobicContact CD1-CB 3.9Å; F390-R403 WeakPolarHBondContact CD1-O 3.45Å; F390-R403 HydrophobicContact CD2-CB 4.26Å; F390-R403 HydrophobicContact CE1-CB 3.46Å; F390-R403 VanDerWaalsContact CE1-CB 3.46Å; F390-R403 HydrophobicContact CE2-CB 3.85Å; F390-R403 HydrophobicContact CE2-CG 4.1Å; F390-R403 HydrophobicContact CG-CB 4.28Å; F390-R403 HydrophobicContact CZ-CB 3.43Å; F390-R403 VanDerWaalsContact CZ-CB 3.43Å; F390-R403 HydrophobicContact CZ-CG 4.02Å; F390-R403 PolarHBondContact N-O 3.44Å; F390-R403 PolarHBondContact O-N 3Å; F390-P404 WeakPolarHBondContact CE1-O 3.19Å; F390-E407 HydrophobicContact CE1-CB 4.48Å; F390-L408 HydrophobicContact CD1-CD1 4.17Å; F390-L408 HydrophobicContact CE1-CD1 4.03Å; F390-L408 HydrophobicContact CE1-CD2 4.47Å; F390-L408 HydrophobicContact CE1-CG 3.94Å; F390-L408 HydrophobicContact CZ-CD1 4.43Å; F390-L408 HydrophobicContact CZ-CD2 4.29Å; F390-L408 HydrophobicContact CZ-CG 4.25Å
391	W	96.8	Very high	87.9	Confident	8 Å²	8	43.9 Å²	43.9	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.7	179.1	-67.8	-101.8	0	0	0	109.5	L363 V367 L383 L384 Q389 F393 L398 A402	L363-W391 HydrophobicContact CD1-CB 4.49Å; L363-W391 HydrophobicContact CD1-CD2 4.15Å; L363-W391 HydrophobicContact CD1-CG 4.08Å; V367-W391 HydrophobicContact CG1-CH2 4.33Å; V367-W391 HydrophobicContact CG1-CZ3 4.33Å; V367-W391 HydrophobicContact CG2-CH2 3.69Å; V367-W391 HydrophobicContact CG2-CZ2 3.51Å; V367-W391 HydrophobicContact CG2-CZ3 4.42Å; L383-W391 WeakPolarHBondContact CA-O 3.25Å; L384-W391 PolarHBondContact N-O 2.95Å; L384-W391 PolarHBondContact O-N 3.45Å; Q389-W391 HydrophobicContact CB-CH2 3.72Å; Q389-W391 HydrophobicContact CB-CZ2 4.35Å; Q389-W391 HydrophobicContact CB-CZ3 3.97Å; W391-F393 HydrophobicContact CB-CD2 4.32Å; W391-F393 HydrophobicContact CB-CE2 3.64Å; W391-F393 HydrophobicContact CB-CZ 4.44Å; W391-L398 HydrophobicContact CB-CD1 3.81Å; W391-L398 HydrophobicContact CG-CD1 4.2Å; W391-A402 HydrophobicContact CZ2-CB 3.74Å
392	V	94	Very high	88.2	Confident	9 Å²	9	43.3 Å²	43.3	6%	0.055	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125.1	-178.9	-171.8	0	0	0	0	109.6	R381 L383 F390 E399 R400	R381-V392 HydrophobicContact CB-CG1 4.01Å; R381-V392 HydrophobicContact CG-CG1 4.36Å; L383-V392 HydrophobicContact CG-CG2 4.3Å; F390-V392 HydrophobicContact CD2-CG2 4.08Å; F390-V392 HydrophobicContact CE2-CG2 3.77Å; V392-E399 PolarHBondContact O-N 2.04Å; V392-R400 HydrophobicContact CB-CB 4.07Å; V392-R400 HydrophobicContact CB-CG 4.49Å; V392-R400 HydrophobicContact CG2-CB 4.29Å; V392-R400 PolarHBondContact N-O 3.29Å; V392-R400 VanDerWaalsContact N-O 3.14Å; V392-R400 PolarHBondContact O-N 3.2Å; V392-R400 VanDerWaalsContact O-N 3.1Å
393	F	86.8	Confident	88.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.1	179.7	-70.7	-97.6	0	0	0	111.1	W360 E361 L363 R381 I382 L384 W391 Q397 L398	W360-F393 HydrophobicContact CB-CE1 3.94Å; W360-F393 HydrophobicContact CB-CZ 4.11Å; W360-F393 HydrophobicContact CE3-CB 4.32Å; W360-F393 AromaticContact CE3-CD1 3.75Å; W360-F393 HydrophobicContact CE3-CD1 3.75Å; W360-F393 HydrophobicContact CE3-CD2 4.32Å; W360-F393 HydrophobicContact CE3-CE1 4.12Å; W360-F393 AromaticContact CE3-CG 3.87Å; W360-F393 HydrophobicContact CE3-CG 3.87Å; W360-F393 HydrophobicContact CZ3-CB 4.18Å; W360-F393 HydrophobicContact CZ3-CD1 4.42Å; W360-F393 HydrophobicContact CZ3-CG 4.21Å; E361-F393 WeakPolarHBondContact O-CE1 2.97Å; L363-F393 HydrophobicContact CB-CZ 4.02Å; L363-F393 HydrophobicContact CD1-CE2 4.24Å; L363-F393 HydrophobicContact CD1-CZ 3.92Å; R381-F393 WeakPolarHBondContact CA-O 3.34Å; I382-F393 HydrophobicContact CB-CB 4.17Å; I382-F393 PolarHBondContact N-O 2.84Å; I382-F393 PolarHBondContact O-N 2.93Å; L384-F393 HydrophobicContact CB-CE2 4.37Å; L384-F393 HydrophobicContact CD1-CD2 4.08Å; L384-F393 HydrophobicContact CD1-CE2 3.64Å; L384-F393 HydrophobicContact CD1-CZ 4.2Å; L384-F393 HydrophobicContact CG-CD2 4.01Å; L384-F393 HydrophobicContact CG-CE2 3.93Å; W391-F393 HydrophobicContact CB-CD2 4.32Å; W391-F393 HydrophobicContact CB-CE2 3.64Å; W391-F393 HydrophobicContact CB-CZ 4.44Å; F393-Q397 VanDerWaalsContact CA-O 3.32Å; F393-Q397 WeakPolarHBondContact CA-O 3.46Å; F393-Q397 VanDerWaalsContact CD1-C 3.46Å; F393-Q397 WeakPolarHBondContact CD1-O 3.43Å; F393-L398 HydrophobicContact CD1-CB 4.35Å; F393-L398 HydrophobicContact CD2-CD1 4.38Å; F393-L398 HydrophobicContact CE1-CB 3.9Å; F393-L398 HydrophobicContact CE1-CD1 4.1Å; F393-L398 HydrophobicContact CE2-CD1 3.89Å; F393-L398 HydrophobicContact CZ-CB 4.31Å; F393-L398 HydrophobicContact CZ-CD1 3.72Å
394	Q	79.9	Confident	88.5	Confident	114 Å²	114	49.3 Å²	49.3	53%	0.533	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	117.7	160.3	-174.4	173.7	19.5	0	0	106.9	R396 Q397	Q394-R396 PolarHBondContact O-N 3.42Å; Q394-Q397 PolarHBondContact N-O 3.08Å; Q394-Q397 PolarHBondContact O-N 3Å
395	D	70.7	Confident	88.5	Confident	82 Å²	82	49.4 Å²	49.4	44%	0.439	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	-105.4	-171.1	-47.2	-37.4	0	0	0	111.2	R328 W360 I382	R328-D395 IonicContact CZ-OD1 2.83Å; R328-D395 IonicContact NH1-OD1 2.73Å; R328-D395 PolarHBondContact NH1-OD1 3.2Å; R328-D395 IonicContact NH2-OD1 3.74Å; R328-D395 PolarHBondContact NH2-OD1 2.91Å; W360-D395 WeakPolarHBondContact CZ3-O 3.43Å; I382-D395 WeakPolarHBondContact CD1-O 3.38Å
396	R	65.1	Low	88.3	Confident	80 Å²	80	52.3 Å²	52.3	30%	0.302	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-4.3	175.5	-63.2	-166.2	-40.4	164.6	7.5	113.8	F359 E361 Q394	F359-R396 HydrophobicContact CD1-CG 4.4Å; F359-R396 HydrophobicContact CE1-CG 4.01Å; F359-R396 HydrophobicContact CZ-CG 4.11Å; F359-R396 WeakPolarHBondContact O-CB 3.28Å; F359-R396 VanDerWaalsContact O-CD 3.28Å; F359-R396 WeakPolarHBondContact O-CD 3.46Å; E361-R396 WeakPolarHBondContact CB-O 3.49Å; E361-R396 PolarHBondContact N-O 2.78Å; E361-R396 IonicContact OE1-CZ 3.61Å; E361-R396 IonicContact OE1-NE 3.03Å; E361-R396 IonicContact OE1-NH2 3.96Å; E361-R396 PolarHBondContact OE1-NH2 3.11Å; Q394-R396 PolarHBondContact O-N 3.42Å
397	Q	65.8	Low	88.2	Confident	102 Å²	102	55 Å²	55	48%	0.477	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.7	-176.2	-65.4	-63.2	-24.9	0	0	110.9	E361 F393 Q394 E399	E361-Q397 PolarHBondContact OE1-NE2 3.34Å; E361-Q397 PolarHBondContact OE2-NE2 2.79Å; F393-Q397 VanDerWaalsContact CA-O 3.32Å; F393-Q397 WeakPolarHBondContact CA-O 3.46Å; F393-Q397 VanDerWaalsContact CD1-C 3.46Å; F393-Q397 WeakPolarHBondContact CD1-O 3.43Å; Q394-Q397 PolarHBondContact N-O 3.08Å; Q394-Q397 PolarHBondContact O-N 3Å; Q397-E399 PolarHBondContact O-N 3.16Å; Q397-E399 VanDerWaalsContact O-N 3.15Å
398	L	84.8	Confident	88.1	Confident	50 Å²	50	54.9 Å²	54.9	26%	0.262	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	112.1	173.4	-177.4	68.6	0	0	0	110.1	E361 G362 W391 F393 R400	E361-L398 WeakPolarHBondContact O-CB 3.41Å; E361-L398 PolarHBondContact O-N 3.33Å; G362-L398 WeakPolarHBondContact O-CD2 3.45Å; W391-L398 HydrophobicContact CB-CD1 3.81Å; W391-L398 HydrophobicContact CG-CD1 4.2Å; F393-L398 HydrophobicContact CD1-CB 4.35Å; F393-L398 HydrophobicContact CD2-CD1 4.38Å; F393-L398 HydrophobicContact CE1-CB 3.9Å; F393-L398 HydrophobicContact CE1-CD1 4.1Å; F393-L398 HydrophobicContact CE2-CD1 3.89Å; F393-L398 HydrophobicContact CZ-CB 4.31Å; F393-L398 HydrophobicContact CZ-CD1 3.72Å; L398-R400 VanDerWaalsContact CD1-O 3.22Å; L398-R400 WeakPolarHBondContact CD1-O 3.49Å
399	E	87.1	Confident	87.8	Confident	68 Å²	68	53.7 Å²	53.7	32%	0.318	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-43	176.5	-169.2	-160.8	147	0	0	110.9	R381 V392 Q397	R381-E399 WeakPolarHBondContact CD-OE2 2.89Å; R381-E399 VanDerWaalsContact CZ-CD 3.44Å; R381-E399 IonicContact CZ-OE1 3.71Å; R381-E399 IonicContact CZ-OE2 2.96Å; R381-E399 IonicContact NE-OE2 3.43Å; R381-E399 PolarHBondContact NE-OE2 3.24Å; R381-E399 IonicContact NH1-OE1 3.18Å; R381-E399 PolarHBondContact NH1-OE1 2.99Å; R381-E399 IonicContact NH1-OE2 2.65Å; R381-E399 PolarHBondContact NH1-OE2 3.35Å; R381-E399 IonicContact NH2-OE1 3.61Å; R381-E399 PolarHBondContact NH2-OE1 3.42Å; R381-E399 IonicContact NH2-OE2 3.38Å; R381-E399 PolarHBondContact NH2-OE2 2.92Å; V392-E399 PolarHBondContact O-N 2.04Å; Q397-E399 PolarHBondContact O-N 3.16Å; Q397-E399 VanDerWaalsContact O-N 3.15Å
400	R	82.8	Confident	87.7	Confident	112 Å²	112	50 Å²	50	42%	0.423	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	125.4	178.8	-57.7	-176.4	177.9	-172.6	-2.1	110	V392 L398	V392-R400 HydrophobicContact CB-CB 4.07Å; V392-R400 HydrophobicContact CB-CG 4.49Å; V392-R400 HydrophobicContact CG2-CB 4.29Å; V392-R400 PolarHBondContact N-O 3.29Å; V392-R400 VanDerWaalsContact N-O 3.14Å; V392-R400 PolarHBondContact O-N 3.2Å; V392-R400 VanDerWaalsContact O-N 3.1Å; L398-R400 VanDerWaalsContact CD1-O 3.22Å; L398-R400 WeakPolarHBondContact CD1-O 3.49Å
401	G	87.4	Confident	87.5	Confident	39 Å²	39	52.4 Å²	52.4	40%	0.402	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	-173	174.5	0	0	0	0	0	113.5	R403	G401-R403 WeakPolarHBondContact O-CG 3.31Å; G401-R403 PolarHBondContact O-N 3.31Å
402	A	94	Very high	87.2	Confident	44 Å²	44	57.7 Å²	57.7	36%	0.364	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.2	124.1	-169.2	0	0	0	0	0	113.3	Q389 W391	Q389-A402 HydrophobicContact CB-CB 4.47Å; W391-A402 HydrophobicContact CZ2-CB 3.74Å
403	R	95.3	Very high	87	Confident	78 Å²	78	60.3 Å²	60.3	29%	0.294	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	140.9	176.3	-56.1	-62.6	-76.2	-112.1	-8.5	109.8	Q389 F390 G401 E407	Q389-R403 CarbonylContact C-O 3.5Å; Q389-R403 WeakPolarHBondContact CA-O 3.23Å; F390-R403 HydrophobicContact CD1-CB 3.9Å; F390-R403 WeakPolarHBondContact CD1-O 3.45Å; F390-R403 HydrophobicContact CD2-CB 4.26Å; F390-R403 HydrophobicContact CE1-CB 3.46Å; F390-R403 VanDerWaalsContact CE1-CB 3.46Å; F390-R403 HydrophobicContact CE2-CB 3.85Å; F390-R403 HydrophobicContact CE2-CG 4.1Å; F390-R403 HydrophobicContact CG-CB 4.28Å; F390-R403 HydrophobicContact CZ-CB 3.43Å; F390-R403 VanDerWaalsContact CZ-CB 3.43Å; F390-R403 HydrophobicContact CZ-CG 4.02Å; F390-R403 PolarHBondContact N-O 3.44Å; F390-R403 PolarHBondContact O-N 3Å; G401-R403 WeakPolarHBondContact O-CG 3.31Å; G401-R403 PolarHBondContact O-N 3.31Å; R403-E407 IonicContact CZ-OE1 2.71Å; R403-E407 IonicContact CZ-OE2 2.9Å; R403-E407 VanDerWaalsContact NE-CD 3.26Å; R403-E407 IonicContact NE-OE1 2.59Å; R403-E407 PolarHBondContact NE-OE1 2.95Å; R403-E407 IonicContact NE-OE2 3.13Å; R403-E407 PolarHBondContact NE-OE2 2.97Å; R403-E407 VanDerWaalsContact NH2-CD 3.28Å; R403-E407 IonicContact NH2-OE1 2.71Å; R403-E407 PolarHBondContact NH2-OE1 2.91Å; R403-E407 IonicContact NH2-OE2 3.6Å; R403-E407 PolarHBondContact NH2-OE2 3.16Å
404	P	96.4	Very high	87.3	Confident	54 Å²	54	62.9 Å²	62.9	35%	0.351	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	145.5	178.1	31.2	-33.7	0	0	0	111.6	F390 T406 E407	F390-P404 WeakPolarHBondContact CE1-O 3.19Å; P404-T406 PolarHBondContact O-N 3Å; P404-T406 VanDerWaalsContact O-N 3.08Å; P404-E407 WeakPolarHBondContact CD-OE1 3.45Å; P404-E407 HydrophobicContact CG-CG 4.14Å; P404-E407 WeakPolarHBondContact O-CB 3.42Å; P404-E407 PolarHBondContact O-N 2.83Å
405	L	95.4	Very high	87.9	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.016	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-63.5	-14.5	177	-81.7	86.1	0	0	0	113.6	F385 P388 E407 L408 G409 L410 V416	F385-L405 HydrophobicContact CD1-CD1 4.28Å; F385-L405 HydrophobicContact CD1-CD2 4.03Å; F385-L405 HydrophobicContact CD1-CG 4.19Å; F385-L405 HydrophobicContact CE1-CD2 4.31Å; F385-L405 HydrophobicContact CE1-CG 4.34Å; P388-L405 WeakPolarHBondContact O-CD1 3.48Å; P388-L405 PolarHBondContact O-N 3.15Å; L405-E407 PolarHBondContact O-N 3.28Å; L405-L408 WeakPolarHBondContact O-CA 3.41Å; L405-L408 WeakPolarHBondContact O-CB 3.42Å; L405-L408 PolarHBondContact O-N 3.02Å; L405-G409 PolarHBondContact O-N 3.21Å; L405-L410 HydrophobicContact CB-CB 4.23Å; L405-L410 HydrophobicContact CD2-CD2 3.86Å; L405-L410 PolarHBondContact O-N 2.74Å; L405-V416 HydrophobicContact CD2-CB 4.37Å; L405-V416 HydrophobicContact CD2-CG1 3.6Å; L405-V416 HydrophobicContact CD2-CG2 3.98Å
406	T	94.5	Very high	89.1	Confident	63 Å²	63	56.6 Å²	56.6	39%	0.387	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-59.3	-25.7	170.8	55.6	0	0	0	0	112.8	P404 L408 G409 L410 P412	P404-T406 PolarHBondContact O-N 3Å; P404-T406 VanDerWaalsContact O-N 3.08Å; T406-L408 PolarHBondContact O-N 2.79Å; T406-G409 WeakPolarHBondContact O-CA 3.07Å; T406-G409 PolarHBondContact O-N 3.14Å; T406-L410 WeakPolarHBondContact CA-O 3.42Å; T406-P412 HydrophobicContact CG2-CB 4.16Å; T406-P412 HydrophobicContact CG2-CG 4.04Å
407	E	93.8	Very high	90.5	Very high	81 Å²	81	54.5 Å²	54.5	38%	0.379	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-67.5	-26.7	172.5	-68.9	-174	-159.6	0	0	113	F390 R403 P404 L405	F390-E407 HydrophobicContact CE1-CB 4.48Å; R403-E407 IonicContact CZ-OE1 2.71Å; R403-E407 IonicContact CZ-OE2 2.9Å; R403-E407 VanDerWaalsContact NE-CD 3.26Å; R403-E407 IonicContact NE-OE1 2.59Å; R403-E407 PolarHBondContact NE-OE1 2.95Å; R403-E407 IonicContact NE-OE2 3.13Å; R403-E407 PolarHBondContact NE-OE2 2.97Å; R403-E407 VanDerWaalsContact NH2-CD 3.28Å; R403-E407 IonicContact NH2-OE1 2.71Å; R403-E407 PolarHBondContact NH2-OE1 2.91Å; R403-E407 IonicContact NH2-OE2 3.6Å; R403-E407 PolarHBondContact NH2-OE2 3.16Å; P404-E407 WeakPolarHBondContact CD-OE1 3.45Å; P404-E407 HydrophobicContact CG-CG 4.14Å; P404-E407 WeakPolarHBondContact O-CB 3.42Å; P404-E407 PolarHBondContact O-N 2.83Å; L405-E407 PolarHBondContact O-N 3.28Å
408	L	92.1	Very high	91.8	Very high	12 Å²	12	49.6 Å²	49.6	6%	0.063	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-87.9	7.5	172.1	-54.9	178.3	0	0	0	111.5	F385 F390 L405 T406 L410 L430 Y439 P446	F385-L408 HydrophobicContact CE1-CD1 3.61Å; F385-L408 HydrophobicContact CZ-CD1 3.87Å; F390-L408 HydrophobicContact CD1-CD1 4.17Å; F390-L408 HydrophobicContact CE1-CD1 4.03Å; F390-L408 HydrophobicContact CE1-CD2 4.47Å; F390-L408 HydrophobicContact CE1-CG 3.94Å; F390-L408 HydrophobicContact CZ-CD1 4.43Å; F390-L408 HydrophobicContact CZ-CD2 4.29Å; F390-L408 HydrophobicContact CZ-CG 4.25Å; L405-L408 WeakPolarHBondContact O-CA 3.41Å; L405-L408 WeakPolarHBondContact O-CB 3.42Å; L405-L408 PolarHBondContact O-N 3.02Å; T406-L408 PolarHBondContact O-N 2.79Å; L408-L410 HydrophobicContact CB-CD1 4.03Å; L408-L430 HydrophobicContact CB-CD2 4.41Å; L408-L430 HydrophobicContact CD1-CD2 3.84Å; L408-Y439 HydrophobicContact CB-CD2 4.46Å; L408-Y439 HydrophobicContact CB-CE2 4.33Å; L408-Y439 HydrophobicContact CD2-CE1 4.36Å; L408-Y439 HydrophobicContact CD2-CE2 4.29Å; L408-Y439 VanDerWaalsContact O-CD2 3.31Å; L408-Y439 WeakPolarHBondContact O-CD2 3.3Å; L408-P446 WeakPolarHBondContact O-CG 3.4Å
409	G	88.9	Confident	92.3	Very high	36 Å²	36	47.3 Å²	47.3	37%	0.371	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	20.4	177.1	0	0	0	0	0	115.2	L405 T406	L405-G409 PolarHBondContact O-N 3.21Å; T406-G409 WeakPolarHBondContact O-CA 3.07Å; T406-G409 PolarHBondContact O-N 3.14Å
410	L	92.9	Very high	92.6	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.037	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-81.8	155.7	170.4	-79.6	78.6	0	0	0	111.4	L405 T406 L408 E414 V416 L430	L405-L410 HydrophobicContact CB-CB 4.23Å; L405-L410 HydrophobicContact CD2-CD2 3.86Å; L405-L410 PolarHBondContact O-N 2.74Å; T406-L410 WeakPolarHBondContact CA-O 3.42Å; L408-L410 HydrophobicContact CB-CD1 4.03Å; L410-E414 HydrophobicContact CB-CB 4.28Å; L410-E414 HydrophobicContact CD2-CB 4.33Å; L410-E414 HydrophobicContact CD2-CG 4.07Å; L410-V416 HydrophobicContact CD2-CG1 3.69Å; L410-L430 HydrophobicContact CD1-CB 4.49Å; L410-L430 HydrophobicContact CD1-CD1 4.36Å; L410-L430 HydrophobicContact CD1-CD2 3.86Å; L410-L430 HydrophobicContact CD1-CG 4.45Å
411	P	92.3	Very high	92.8	Very high	58 Å²	58	39.5 Å²	39.5	38%	0.377	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-57.7	150.8	173	-23.3	34.3	0	0	0	112.8	G413 E414	P411-G413 PolarHBondContact O-N 2.86Å; P411-E414 HydrophobicContact CB-CB 4.44Å; P411-E414 VanDerWaalsContact O-CB 3.24Å; P411-E414 WeakPolarHBondContact O-CB 3.4Å; P411-E414 PolarHBondContact O-N 3.35Å
412	P	91.8	Very high	92.4	Very high	119 Å²	119	38.5 Å²	38.5	77%	0.773	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	131.1	176.2	-23.1	33.3	0	0	0	112.4	T406 E414	T406-P412 HydrophobicContact CG2-CB 4.16Å; T406-P412 HydrophobicContact CG2-CG 4.04Å; P412-E414 VanDerWaalsContact C-N 3.28Å
413	G	88.8	Confident	91.4	Very high	64 Å²	64	39.5 Å²	39.5	66%	0.66	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.1	0.7	-179.9	0	0	0	0	0	114.8	P411	P411-G413 PolarHBondContact O-N 2.86Å
414	E	92.9	Very high	90.3	Very high	55 Å²	55	39.2 Å²	39.2	26%	0.257	24%	0.242	S	C	.	.			trans	-73.1	152.7	175	-158.6	63.2	-119.7	0	0	111.5	L410 P411 P412 R432	L410-E414 HydrophobicContact CB-CB 4.28Å; L410-E414 HydrophobicContact CD2-CB 4.33Å; L410-E414 HydrophobicContact CD2-CG 4.07Å; P411-E414 HydrophobicContact CB-CB 4.44Å; P411-E414 VanDerWaalsContact O-CB 3.24Å; P411-E414 WeakPolarHBondContact O-CB 3.4Å; P411-E414 PolarHBondContact O-N 3.35Å; P412-E414 VanDerWaalsContact C-N 3.28Å; E414-R432 WeakPolarHBondContact OE1-CG 3.3Å; E414-R432 IonicContact OE1-NE 3.49Å
415	E	94.1	Very high	89.5	Confident	62 Å²	62	39.7 Å²	39.7	29%	0.29	24%	0.242	S	C	.	.			trans	-124.9	173.3	175.6	-53.3	176.8	152	0	0	109.4	G387 R432	G387-E415 WeakPolarHBondContact CA-OE1 3.21Å; E415-R432 WeakPolarHBondContact O-CD 3.46Å; E415-R432 IonicContact OE2-CZ 3.7Å; E415-R432 IonicContact OE2-NH1 3.92Å; E415-R432 IonicContact OE2-NH2 2.77Å; E415-R432 PolarHBondContact OE2-NH2 3.13Å
416	V	95.2	Very high	88.7	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	26%	0.264	C	S	.	.			trans	-127.1	142	178.8	-69.1	0	0	0	0	109.4	Q371 A372 F385 L405 L410 V419 L430 V431	Q371-V416 VanDerWaalsContact CG-O 3.31Å; Q371-V416 WeakPolarHBondContact CG-O 3.5Å; A372-V416 HydrophobicContact CB-CG2 3.98Å; F385-V416 HydrophobicContact CB-CG2 3.91Å; F385-V416 HydrophobicContact CD1-CG2 3.73Å; F385-V416 HydrophobicContact CE1-CG2 4.48Å; F385-V416 HydrophobicContact CG-CG2 3.88Å; L405-V416 HydrophobicContact CD2-CB 4.37Å; L405-V416 HydrophobicContact CD2-CG1 3.6Å; L405-V416 HydrophobicContact CD2-CG2 3.98Å; L410-V416 HydrophobicContact CD2-CG1 3.69Å; V416-V419 HydrophobicContact CB-CG2 4.02Å; V416-V419 HydrophobicContact CG1-CG2 4.37Å; V416-V419 HydrophobicContact CG2-CG2 3.68Å; V416-L430 HydrophobicContact CG1-CB 4.01Å; V416-L430 HydrophobicContact CG1-CD2 4.11Å; V416-V431 WeakPolarHBondContact CA-O 3.13Å
417	D	93.2	Very high	88.2	Confident	36 Å²	36	40.9 Å²	40.9	19%	0.193	26%	0.255	C	S	.	.	S	Bend	trans	-92.9	-32.6	173.4	-53.7	-28.8	0	0	0	110.2	Q371 V431 R432 G433	Q371-D417 VanDerWaalsContact O-O 3.13Å; D417-V431 PolarHBondContact N-O 3.5Å; D417-R432 WeakPolarHBondContact OD1-CD 3.24Å; D417-R432 IonicContact OD1-CZ 2.94Å; D417-R432 IonicContact OD1-NH1 3.65Å; D417-R432 PolarHBondContact OD1-NH1 2.94Å; D417-G433 PolarHBondContact OD2-N 2.92Å
418	A	94.6	Very high	88.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	147.2	176.5	0	0	0	0	0	111.4	V431 D466 V467	A418-V431 HydrophobicContact CB-CB 3.9Å; A418-V431 HydrophobicContact CB-CG2 4.14Å; A418-V431 PolarHBondContact N-O 3.32Å; A418-V431 PolarHBondContact O-N 3.21Å; A418-D466 VanDerWaalsContact CA-OD1 3.26Å; A418-D466 WeakPolarHBondContact CA-OD1 3.4Å; A418-D466 WeakPolarHBondContact CB-OD1 3.23Å; A418-V467 HydrophobicContact CB-CB 3.99Å; A418-V467 HydrophobicContact CB-CG2 3.79Å
419	V	95.2	Very high	88.2	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	127.5	169.1	-173.5	0	0	0	0	108.9	A372 Y374 F385 V416 T428 Y429 L430	A372-V419 HydrophobicContact CB-CB 4.3Å; A372-V419 HydrophobicContact CB-CG2 3.87Å; Y374-V419 WeakPolarHBondContact CB-O 3.41Å; Y374-V419 HydrophobicContact CD1-CB 4Å; Y374-V419 HydrophobicContact CD1-CG1 3.33Å; Y374-V419 HydrophobicContact CE1-CG1 3.5Å; Y374-V419 VanDerWaalsContact CE1-CG1 3.5Å; Y374-V419 HydrophobicContact CG-CG1 3.95Å; F385-V419 HydrophobicContact CD1-CG2 4.5Å; F385-V419 HydrophobicContact CD2-CG2 4.09Å; F385-V419 HydrophobicContact CE1-CG2 4.33Å; F385-V419 HydrophobicContact CE2-CB 4.17Å; F385-V419 HydrophobicContact CE2-CG1 4.22Å; F385-V419 HydrophobicContact CE2-CG2 3.93Å; F385-V419 HydrophobicContact CG-CG2 4.39Å; F385-V419 HydrophobicContact CZ-CG1 4.3Å; F385-V419 HydrophobicContact CZ-CG2 4.06Å; V416-V419 HydrophobicContact CB-CG2 4.02Å; V416-V419 HydrophobicContact CG1-CG2 4.37Å; V416-V419 HydrophobicContact CG2-CG2 3.68Å; V419-T428 HydrophobicContact CG1-CG2 3.81Å; V419-Y429 WeakPolarHBondContact CA-O 3.43Å; V419-L430 HydrophobicContact CG1-CD2 4.43Å; V419-L430 HydrophobicContact CG1-CG 4.25Å; V419-L430 HydrophobicContact CG2-CD2 4.12Å; V419-L430 HydrophobicContact CG2-CG 4.33Å
420	F	92.3	Very high	88.6	Confident	5 Å²	5	35 Å²	35	2%	0.022	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.9	176.1	69	-77.4	0	0	0	111.4	W422 Y429 V431 W457 V467 V469 T475	F420-W422 HydrophobicContact CD2-CB 4.36Å; F420-W422 HydrophobicContact CE2-CB 3.98Å; F420-W422 AromaticContact CE2-CD1 3.97Å; F420-W422 HydrophobicContact CE2-CG 4.11Å; F420-Y429 HydrophobicContact CE1-CG 4.32Å; F420-Y429 HydrophobicContact CE2-CD2 4.34Å; F420-Y429 HydrophobicContact CE2-CG 4.38Å; F420-Y429 HydrophobicContact CZ-CD1 4.5Å; F420-Y429 HydrophobicContact CZ-CD2 4.4Å; F420-Y429 AromaticContact CZ-CG 3.99Å; F420-Y429 HydrophobicContact CZ-CG 3.99Å; F420-Y429 PolarHBondContact N-O 2.82Å; F420-Y429 VanDerWaalsContact N-O 3.08Å; F420-Y429 PolarHBondContact O-N 3.25Å; F420-V431 HydrophobicContact CE1-CG2 4.17Å; F420-W457 HydrophobicContact CZ-CH2 4.27Å; F420-W457 AromaticContact CZ-CZ2 3.79Å; F420-W457 HydrophobicContact CZ-CZ2 3.79Å; F420-V467 HydrophobicContact CD1-CB 3.62Å; F420-V467 HydrophobicContact CD1-CG1 3.54Å; F420-V467 HydrophobicContact CD1-CG2 4.46Å; F420-V467 HydrophobicContact CD2-CG1 4.28Å; F420-V467 HydrophobicContact CE1-CB 3.9Å; F420-V467 HydrophobicContact CE1-CG1 3.58Å; F420-V467 HydrophobicContact CE1-CG2 4.35Å; F420-V467 HydrophobicContact CE2-CG1 4.3Å; F420-V467 HydrophobicContact CG-CB 4.28Å; F420-V467 HydrophobicContact CG-CG1 3.91Å; F420-V467 HydrophobicContact CZ-CG1 3.97Å; F420-V469 HydrophobicContact CD2-CG2 3.81Å; F420-T475 HydrophobicContact CE2-CG2 4.31Å
421	S	86.8	Confident	88.7	Confident	11 Å²	11	34.7 Å²	34.7	8%	0.077	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.5	168.4	176.3	0	0	0	0	109.5	H377 P423	H377-S421 WeakPolarHBondContact CD2-CB 3.5Å; H377-S421 PolarHBondContact CD2-OG 3.36Å; S421-P423 WeakPolarHBondContact O-CD 3.42Å
422	W	80.3	Confident	88.8	Confident	17 Å²	17	35.6 Å²	35.6	6%	0.064	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	116	-179.1	-158.6	40	0	0	0	111	F420 Q424 N425 G426 K427 Y429 T475 I491	F420-W422 HydrophobicContact CD2-CB 4.36Å; F420-W422 HydrophobicContact CE2-CB 3.98Å; F420-W422 AromaticContact CE2-CD1 3.97Å; F420-W422 HydrophobicContact CE2-CG 4.11Å; W422-Q424 HydrophobicContact CD2-CB 3.99Å; W422-Q424 HydrophobicContact CD2-CG 4.1Å; W422-Q424 VanDerWaalsContact CE2-NE2 3.27Å; W422-Q424 HydrophobicContact CE3-CB 4.03Å; W422-Q424 HydrophobicContact CH2-CB 4.48Å; W422-Q424 HydrophobicContact CZ2-CB 4.47Å; W422-Q424 HydrophobicContact CZ2-CG 4.11Å; W422-Q424 HydrophobicContact CZ3-CB 4.26Å; W422-Q424 PolarHBondContact O-N 3.27Å; W422-N425 PolarHBondContact O-N 2.91Å; W422-G426 WeakPolarHBondContact O-CA 3.39Å; W422-G426 PolarHBondContact O-N 2.99Å; W422-K427 PolarHBondContact N-O 2.96Å; W422-Y429 HydrophobicContact CB-CD2 3.83Å; W422-Y429 HydrophobicContact CB-CE2 3.57Å; W422-Y429 HydrophobicContact CD2-CE2 4.47Å; W422-Y429 HydrophobicContact CE3-CE2 4.05Å; W422-Y429 AromaticContact CE3-CZ 3.94Å; W422-Y429 HydrophobicContact CG-CE2 4.37Å; W422-T475 PolarHBondContact NE1-OG1 2.8Å; W422-I491 HydrophobicContact CH2-CG2 3.91Å; W422-I491 HydrophobicContact CZ2-CG2 4.09Å
423	P	73	Confident	88.7	Confident	66 Å²	66	30.9 Å²	30.9	43%	0.429	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.7	-174	-25.2	35	0	0	0	114.5	S421 V469	S421-P423 WeakPolarHBondContact O-CD 3.42Å; P423-V469 HydrophobicContact CG-CG1 3.8Å
424	Q	72.6	Confident	88.8	Confident	71 Å²	71	34.4 Å²	34.4	33%	0.332	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-37.4	-174.3	-60.7	-177.1	22.7	0	0	112.8	W422 N489	W422-Q424 HydrophobicContact CD2-CB 3.99Å; W422-Q424 HydrophobicContact CD2-CG 4.1Å; W422-Q424 VanDerWaalsContact CE2-NE2 3.27Å; W422-Q424 HydrophobicContact CE3-CB 4.03Å; W422-Q424 HydrophobicContact CH2-CB 4.48Å; W422-Q424 HydrophobicContact CZ2-CB 4.47Å; W422-Q424 HydrophobicContact CZ2-CG 4.11Å; W422-Q424 HydrophobicContact CZ3-CB 4.26Å; W422-Q424 PolarHBondContact O-N 3.27Å; Q424-N489 VanDerWaalsContact NE2-N 3.13Å
425	N	78.7	Confident	88.9	Confident	64 Å²	64	36.2 Å²	36.2	34%	0.342	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	1	179.9	64.1	12.3	0	0	0	113.2	W422 K427 Y429	W422-N425 PolarHBondContact O-N 2.91Å; N425-K427 HydrophobicContact CB-CG 4.45Å; N425-K427 PolarHBondContact O-N 3.31Å; N425-K427 WeakPolarHBondContact OD1-CB 3.39Å; N425-K427 PolarHBondContact OD1-N 3.41Å; N425-Y429 PolarHBondContact ND2-OH 2.94Å
426	G	78.3	Confident	88.9	Confident	47 Å²	47	33.7 Å²	33.7	49%	0.485	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.1	16.7	178.4	0	0	0	0	0	114.2	W422	W422-G426 WeakPolarHBondContact O-CA 3.39Å; W422-G426 PolarHBondContact O-N 2.99Å
427	K	85.4	Confident	88.8	Confident	45 Å²	45	34.5 Å²	34.5	20%	0.196	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	150.6	178.1	-57.7	-63.9	176.3	-175	0	110.8	W422 N425 Y429 R438 D440	W422-K427 PolarHBondContact N-O 2.96Å; N425-K427 HydrophobicContact CB-CG 4.45Å; N425-K427 PolarHBondContact O-N 3.31Å; N425-K427 WeakPolarHBondContact OD1-CB 3.39Å; N425-K427 PolarHBondContact OD1-N 3.41Å; K427-Y429 HydrophobicContact CB-CD2 4.49Å; K427-Y429 HydrophobicContact CB-CE2 3.91Å; K427-Y429 WeakPolarHBondContact O-CD2 3.25Å; K427-R438 HydrophobicContact CB-CG 3.62Å; K427-R438 HydrophobicContact CG-CG 4.05Å; K427-D440 HydrophobicContact CD-CB 4.27Å; K427-D440 IonicContact NZ-OD1 2.8Å; K427-D440 PolarHBondContact NZ-OD1 2.91Å; K427-D440 IonicContact NZ-OD2 3.53Å; K427-D440 PolarHBondContact NZ-OD2 3.04Å
428	T	92.8	Very high	88.8	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	136.2	173.3	-59.3	0	0	0	0	109	Y374 V419 Y439 E441	Y374-T428 HydrophobicContact CD2-CG2 4.46Å; Y374-T428 HydrophobicContact CE1-CG2 4.32Å; Y374-T428 HydrophobicContact CE2-CG2 3.78Å; V419-T428 HydrophobicContact CG1-CG2 3.81Å; T428-Y439 PolarHBondContact N-O 3Å; T428-Y439 PolarHBondContact O-N 3.44Å; T428-E441 WeakPolarHBondContact OG1-CG 3.37Å; T428-E441 PolarHBondContact OG1-OE1 3.09Å
429	Y	92.7	Very high	88.8	Confident	2 Å²	2	37 Å²	37	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.7	-178.6	-72.7	-105.4	0	0	0	108.8	V419 F420 W422 N425 K427 Y436 W437 R438 W457	V419-Y429 WeakPolarHBondContact CA-O 3.43Å; F420-Y429 HydrophobicContact CE1-CG 4.32Å; F420-Y429 HydrophobicContact CE2-CD2 4.34Å; F420-Y429 HydrophobicContact CE2-CG 4.38Å; F420-Y429 HydrophobicContact CZ-CD1 4.5Å; F420-Y429 HydrophobicContact CZ-CD2 4.4Å; F420-Y429 AromaticContact CZ-CG 3.99Å; F420-Y429 HydrophobicContact CZ-CG 3.99Å; F420-Y429 PolarHBondContact N-O 2.82Å; F420-Y429 VanDerWaalsContact N-O 3.08Å; F420-Y429 PolarHBondContact O-N 3.25Å; W422-Y429 HydrophobicContact CB-CD2 3.83Å; W422-Y429 HydrophobicContact CB-CE2 3.57Å; W422-Y429 HydrophobicContact CD2-CE2 4.47Å; W422-Y429 HydrophobicContact CE3-CE2 4.05Å; W422-Y429 AromaticContact CE3-CZ 3.94Å; W422-Y429 HydrophobicContact CG-CE2 4.37Å; N425-Y429 PolarHBondContact ND2-OH 2.94Å; K427-Y429 HydrophobicContact CB-CD2 4.49Å; K427-Y429 HydrophobicContact CB-CE2 3.91Å; K427-Y429 WeakPolarHBondContact O-CD2 3.25Å; Y429-Y436 AromaticContact CD1-CD2 3.43Å; Y429-Y436 HydrophobicContact CD1-CD2 3.43Å; Y429-Y436 VanDerWaalsContact CD1-CD2 3.43Å; Y429-Y436 AromaticContact CD1-CE2 3.44Å; Y429-Y436 HydrophobicContact CD1-CE2 3.44Å; Y429-Y436 VanDerWaalsContact CD1-CE2 3.44Å; Y429-Y436 HydrophobicContact CD1-CG 4.45Å; Y429-Y436 AromaticContact CE1-CD2 3.93Å; Y429-Y436 HydrophobicContact CE1-CD2 3.93Å; Y429-Y436 AromaticContact CE1-CE2 3.41Å; Y429-Y436 HydrophobicContact CE1-CE2 3.41Å; Y429-Y436 VanDerWaalsContact CE1-CE2 3.41Å; Y429-W437 WeakPolarHBondContact CA-O 3.5Å; Y429-R438 HydrophobicContact CD1-CG 4.48Å; Y429-R438 HydrophobicContact CE1-CB 4.37Å; Y429-R438 HydrophobicContact CE1-CG 4.08Å; Y429-R438 HydrophobicContact CE2-CG 4.15Å; Y429-R438 WeakPolarHBondContact OH-CD 3.05Å; Y429-W457 AromaticContact CD1-CH2 3.57Å; Y429-W457 HydrophobicContact CD1-CH2 3.57Å; Y429-W457 HydrophobicContact CD1-CZ2 4.13Å; Y429-W457 AromaticContact CE1-CH2 3.63Å; Y429-W457 HydrophobicContact CE1-CH2 3.63Å; Y429-W457 HydrophobicContact CE1-CZ2 4.03Å; Y429-W457 HydrophobicContact CG-CH2 4.48Å
430	L	95.8	Very high	88.5	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.3	175.7	-57.1	102.6	0	0	0	108.2	F385 L408 L410 V416 V419 Y436 W437 Y439	F385-L430 HydrophobicContact CE1-CD2 4.44Å; L408-L430 HydrophobicContact CB-CD2 4.41Å; L408-L430 HydrophobicContact CD1-CD2 3.84Å; L410-L430 HydrophobicContact CD1-CB 4.49Å; L410-L430 HydrophobicContact CD1-CD1 4.36Å; L410-L430 HydrophobicContact CD1-CD2 3.86Å; L410-L430 HydrophobicContact CD1-CG 4.45Å; V416-L430 HydrophobicContact CG1-CB 4.01Å; V416-L430 HydrophobicContact CG1-CD2 4.11Å; V419-L430 HydrophobicContact CG1-CD2 4.43Å; V419-L430 HydrophobicContact CG1-CG 4.25Å; V419-L430 HydrophobicContact CG2-CD2 4.12Å; V419-L430 HydrophobicContact CG2-CG 4.33Å; L430-Y436 CarbonylContact O-C 3.57Å; L430-Y436 WeakPolarHBondContact O-CA 3.24Å; L430-Y436 WeakPolarHBondContact O-CB 3.35Å; L430-W437 HydrophobicContact CB-CB 4.49Å; L430-W437 HydrophobicContact CD1-CB 4.49Å; L430-W437 PolarHBondContact N-O 3.35Å; L430-W437 PolarHBondContact O-N 2.92Å; L430-Y439 HydrophobicContact CD1-CG 4.49Å
431	V	95	Very high	88.3	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.3	-173.2	-175.7	0	0	0	0	109.7	V416 D417 A418 F420 Q435 L454 P464	V416-V431 WeakPolarHBondContact CA-O 3.13Å; D417-V431 PolarHBondContact N-O 3.5Å; A418-V431 HydrophobicContact CB-CB 3.9Å; A418-V431 HydrophobicContact CB-CG2 4.14Å; A418-V431 PolarHBondContact N-O 3.32Å; A418-V431 PolarHBondContact O-N 3.21Å; F420-V431 HydrophobicContact CE1-CG2 4.17Å; V431-Q435 WeakPolarHBondContact CA-O 3.43Å; V431-L454 HydrophobicContact CG1-CD1 3.65Å; V431-L454 HydrophobicContact CG1-CD2 3.99Å; V431-L454 HydrophobicContact CG1-CG 4.25Å; V431-L454 HydrophobicContact CG2-CD2 4.26Å; V431-P464 HydrophobicContact CG1-CG 4.1Å
432	R	94.4	Very high	88.4	Confident	77 Å²	77	44.4 Å²	44.4	29%	0.291	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	118.6	170.6	-177.9	58	163.9	-172.8	-10.6	109.5	E414 E415 D417 R434 Q435 W437	E414-R432 WeakPolarHBondContact OE1-CG 3.3Å; E414-R432 IonicContact OE1-NE 3.49Å; E415-R432 WeakPolarHBondContact O-CD 3.46Å; E415-R432 IonicContact OE2-CZ 3.7Å; E415-R432 IonicContact OE2-NH1 3.92Å; E415-R432 IonicContact OE2-NH2 2.77Å; E415-R432 PolarHBondContact OE2-NH2 3.13Å; D417-R432 WeakPolarHBondContact OD1-CD 3.24Å; D417-R432 IonicContact OD1-CZ 2.94Å; D417-R432 IonicContact OD1-NH1 3.65Å; D417-R432 PolarHBondContact OD1-NH1 2.94Å; R432-R434 PolarHBondContact O-N 3Å; R432-Q435 PolarHBondContact N-O 3.47Å; R432-Q435 PolarHBondContact O-N 3.49Å; R432-Q435 VanDerWaalsContact O-O 3.07Å; R432-W437 HydrophobicContact CB-CH2 4.49Å; R432-W437 HydrophobicContact CB-CZ3 3.9Å
433	G	91.3	Very high	88.8	Confident	19 Å²	19	45.7 Å²	45.7	20%	0.196	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	-121.8	-176	0	0	0	0	0	111.1	D417 Q435 L454 S463	D417-G433 PolarHBondContact OD2-N 2.92Å; G433-Q435 VanDerWaalsContact C-N 3.3Å; G433-L454 VanDerWaalsContact O-CD1 3.27Å; G433-L454 WeakPolarHBondContact O-CD1 3.46Å; G433-S463 VanDerWaalsContact C-OG 3.28Å; G433-S463 WeakPolarHBondContact CA-OG 3.13Å; G433-S463 WeakPolarHBondContact O-CA 3.4Å
434	R	91.2	Very high	89.6	Confident	138 Å²	138	45.6 Å²	45.6	52%	0.521	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	3.6	-179.1	-62.7	-176	64.8	104	8.4	113.4	R432 D453 L454 P462	R432-R434 PolarHBondContact O-N 3Å; R434-D453 CarbonylContact O-C 3.59Å; R434-D453 WeakPolarHBondContact O-CA 3.23Å; R434-L454 WeakPolarHBondContact O-CB 3.32Å; R434-L454 PolarHBondContact O-N 2.89Å; R434-P462 VanDerWaalsContact NH1-CB 3.26Å
435	Q	93.4	Very high	90.5	Very high	94 Å²	94	50.3 Å²	50.3	44%	0.439	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	156.8	-169.7	-69.1	-176.2	-53.2	0	0	111	V431 R432 G433 P451 R452	V431-Q435 WeakPolarHBondContact CA-O 3.43Å; R432-Q435 PolarHBondContact N-O 3.47Å; R432-Q435 PolarHBondContact O-N 3.49Å; R432-Q435 VanDerWaalsContact O-O 3.07Å; G433-Q435 VanDerWaalsContact C-N 3.3Å; Q435-P451 HydrophobicContact CB-CB 4.04Å; Q435-R452 CarbonylContact C-O 3.45Å; Q435-R452 WeakPolarHBondContact CA-O 3.37Å
436	Y	93.9	Very high	91	Very high	8 Å²	8	49 Å²	49	3%	0.031	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.5	173.7	76.1	-84.4	0	0	0	111.9	Y429 L430 R438 Y450 P451 R452 D453 L454 W457	Y429-Y436 AromaticContact CD1-CD2 3.43Å; Y429-Y436 HydrophobicContact CD1-CD2 3.43Å; Y429-Y436 VanDerWaalsContact CD1-CD2 3.43Å; Y429-Y436 AromaticContact CD1-CE2 3.44Å; Y429-Y436 HydrophobicContact CD1-CE2 3.44Å; Y429-Y436 VanDerWaalsContact CD1-CE2 3.44Å; Y429-Y436 HydrophobicContact CD1-CG 4.45Å; Y429-Y436 AromaticContact CE1-CD2 3.93Å; Y429-Y436 HydrophobicContact CE1-CD2 3.93Å; Y429-Y436 AromaticContact CE1-CE2 3.41Å; Y429-Y436 HydrophobicContact CE1-CE2 3.41Å; Y429-Y436 VanDerWaalsContact CE1-CE2 3.41Å; L430-Y436 CarbonylContact O-C 3.57Å; L430-Y436 WeakPolarHBondContact O-CA 3.24Å; L430-Y436 WeakPolarHBondContact O-CB 3.35Å; Y436-R438 HydrophobicContact CE2-CB 4.48Å; Y436-Y450 HydrophobicContact CD2-CD1 4.29Å; Y436-Y450 AromaticContact CD2-CE1 3.91Å; Y436-Y450 HydrophobicContact CD2-CE1 3.91Å; Y436-Y450 HydrophobicContact CE2-CD1 4.05Å; Y436-Y450 AromaticContact CE2-CE1 3.24Å; Y436-Y450 HydrophobicContact CE2-CE1 3.24Å; Y436-Y450 AromaticContact CZ-CE1 3.61Å; Y436-Y450 WeakPolarHBondContact O-CD1 3.41Å; Y436-P451 CarbonylContact O-C 3.48Å; Y436-P451 VanDerWaalsContact O-CA 3.24Å; Y436-P451 WeakPolarHBondContact O-CA 3.48Å; Y436-R452 HydrophobicContact CD1-CB 4.46Å; Y436-R452 WeakPolarHBondContact CD1-O 3.39Å; Y436-R452 HydrophobicContact CE1-CB 3.89Å; Y436-R452 PolarHBondContact N-O 3.49Å; Y436-R452 PolarHBondContact O-N 2.96Å; Y436-D453 WeakPolarHBondContact CE1-O 3.39Å; Y436-L454 HydrophobicContact CD1-CD2 3.93Å; Y436-L454 HydrophobicContact CD1-CG 4.31Å; Y436-L454 HydrophobicContact CG-CD2 4.31Å; Y436-W457 HydrophobicContact CD1-CH2 4.4Å; Y436-W457 AromaticContact CD1-CZ3 3.74Å; Y436-W457 HydrophobicContact CD1-CZ3 3.74Å; Y436-W457 HydrophobicContact CD2-CH2 4.3Å; Y436-W457 HydrophobicContact CD2-CZ3 4.42Å; Y436-W457 HydrophobicContact CE1-CH2 4.23Å; Y436-W457 AromaticContact CE1-CZ3 3.6Å; Y436-W457 HydrophobicContact CE1-CZ3 3.6Å; Y436-W457 HydrophobicContact CE2-CH2 4.1Å; Y436-W457 HydrophobicContact CE2-CZ3 4.29Å; Y436-W457 HydrophobicContact CG-CH2 4.42Å; Y436-W457 HydrophobicContact CG-CZ3 4.14Å; Y436-W457 AromaticContact CZ-CZ3 3.89Å
437	W	94.8	Very high	91.7	Very high	19 Å²	19	48.1 Å²	48.1	7%	0.072	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	141.8	169.5	-68.4	-108.3	0	0	0	108.8	Y429 L430 R432 P451	Y429-W437 WeakPolarHBondContact CA-O 3.5Å; L430-W437 HydrophobicContact CB-CB 4.49Å; L430-W437 HydrophobicContact CD1-CB 4.49Å; L430-W437 PolarHBondContact N-O 3.35Å; L430-W437 PolarHBondContact O-N 2.92Å; R432-W437 HydrophobicContact CB-CH2 4.49Å; R432-W437 HydrophobicContact CB-CZ3 3.9Å; W437-P451 HydrophobicContact CD2-CB 3.89Å; W437-P451 HydrophobicContact CE3-CB 4.19Å; W437-P451 HydrophobicContact CH2-CB 3.89Å; W437-P451 HydrophobicContact CH2-CG 4.14Å; W437-P451 HydrophobicContact CZ2-CB 3.6Å; W437-P451 HydrophobicContact CZ2-CG 3.57Å; W437-P451 HydrophobicContact CZ3-CB 4.17Å
438	R	93.1	Very high	91.9	Very high	72 Å²	72	51.7 Å²	51.7	27%	0.272	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.6	170.6	-167.8	173.4	71.2	-164.4	0.2	108.8	K427 Y429 Y436 P446 D447 Y450	K427-R438 HydrophobicContact CB-CG 3.62Å; K427-R438 HydrophobicContact CG-CG 4.05Å; Y429-R438 HydrophobicContact CD1-CG 4.48Å; Y429-R438 HydrophobicContact CE1-CB 4.37Å; Y429-R438 HydrophobicContact CE1-CG 4.08Å; Y429-R438 HydrophobicContact CE2-CG 4.15Å; Y429-R438 WeakPolarHBondContact OH-CD 3.05Å; Y436-R438 HydrophobicContact CE2-CB 4.48Å; R438-P446 WeakPolarHBondContact O-CA 3.4Å; R438-D447 IonicContact CZ-OD2 2.77Å; R438-D447 IonicContact NE-OD2 2.82Å; R438-D447 PolarHBondContact NE-OD2 2.96Å; R438-D447 IonicContact NH2-OD2 2.96Å; R438-D447 PolarHBondContact NH2-OD2 3.06Å; R438-D447 PolarHBondContact O-N 3.2Å; R438-Y450 HydrophobicContact CB-CD1 4.31Å; R438-Y450 HydrophobicContact CB-CD2 4.08Å; R438-Y450 HydrophobicContact CB-CE1 3.83Å; R438-Y450 HydrophobicContact CB-CE2 3.54Å; R438-Y450 HydrophobicContact CB-CG 4.43Å; R438-Y450 VanDerWaalsContact CZ-OH 3.25Å; R438-Y450 PolarHBondContact NE-OH 3.17Å; R438-Y450 PolarHBondContact NH1-OH 3.41Å
439	Y	93.8	Very high	91.7	Very high	16 Å²	16	54.1 Å²	54.1	6%	0.063	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.8	-176.5	-174.3	-95.2	0	0	0	110.7	L408 T428 L430 E441 A444 P446	L408-Y439 HydrophobicContact CB-CD2 4.46Å; L408-Y439 HydrophobicContact CB-CE2 4.33Å; L408-Y439 HydrophobicContact CD2-CE1 4.36Å; L408-Y439 HydrophobicContact CD2-CE2 4.29Å; L408-Y439 VanDerWaalsContact O-CD2 3.31Å; L408-Y439 WeakPolarHBondContact O-CD2 3.3Å; T428-Y439 PolarHBondContact N-O 3Å; T428-Y439 PolarHBondContact O-N 3.44Å; L430-Y439 HydrophobicContact CD1-CG 4.49Å; Y439-E441 HydrophobicContact CD1-CG 4.18Å; Y439-E441 HydrophobicContact CE1-CG 4.38Å; Y439-A444 VanDerWaalsContact OH-CA 3.29Å; Y439-A444 WeakPolarHBondContact OH-CA 3.02Å; Y439-A444 PolarHBondContact OH-O 3.06Å; Y439-P446 HydrophobicContact CD2-CG 4.23Å
440	D	89.8	Confident	91.6	Very high	28 Å²	28	55.7 Å²	55.7	15%	0.15	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	104.2	174.4	-170.6	-11.2	0	0	0	109.7	K427 A442 A443 A444 R445	K427-D440 HydrophobicContact CD-CB 4.27Å; K427-D440 IonicContact NZ-OD1 2.8Å; K427-D440 PolarHBondContact NZ-OD1 2.91Å; K427-D440 IonicContact NZ-OD2 3.53Å; K427-D440 PolarHBondContact NZ-OD2 3.04Å; D440-A442 VanDerWaalsContact C-N 3.26Å; D440-A442 PolarHBondContact O-N 2.97Å; D440-A442 PolarHBondContact OD1-N 2.76Å; D440-A443 HydrophobicContact CB-CB 4Å; D440-A443 PolarHBondContact O-N 3.49Å; D440-A443 PolarHBondContact OD1-N 3.1Å; D440-A444 WeakPolarHBondContact O-CA 3.3Å; D440-A444 PolarHBondContact O-N 3.07Å; D440-R445 WeakPolarHBondContact CB-O 3.43Å; D440-R445 PolarHBondContact N-O 2.78Å; D440-R445 PolarHBondContact O-N 2.87Å
441	E	88.1	Confident	91.5	Very high	45 Å²	45	58.1 Å²	58.1	21%	0.21	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-33.4	178.7	-63.8	-77.8	-177.1	0	0	112.2	Y374 R376 T428 Y439 A444	Y374-E441 PolarHBondContact OH-OE1 3.17Å; R376-E441 WeakPolarHBondContact CD-OE2 3.41Å; R376-E441 IonicContact NH1-OE2 3.61Å; R376-E441 PolarHBondContact NH1-OE2 3.1Å; T428-E441 WeakPolarHBondContact OG1-CG 3.37Å; T428-E441 PolarHBondContact OG1-OE1 3.09Å; Y439-E441 HydrophobicContact CD1-CG 4.18Å; Y439-E441 HydrophobicContact CE1-CG 4.38Å; E441-A444 PolarHBondContact O-N 3.42Å
442	A	87.6	Confident	91.3	Very high	100 Å²	100	64.6 Å²	64.6	83%	0.826	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-38.1	-179	0	0	0	0	0	111.9	D440 A444	D440-A442 VanDerWaalsContact C-N 3.26Å; D440-A442 PolarHBondContact O-N 2.97Å; D440-A442 PolarHBondContact OD1-N 2.76Å; A442-A444 VanDerWaalsContact C-N 3.31Å
443	A	88.9	Confident	91.1	Very high	45 Å²	45	64.1 Å²	64.1	37%	0.372	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.1	175.2	0	0	0	0	0	113.2	D440 R445	D440-A443 HydrophobicContact CB-CB 4Å; D440-A443 PolarHBondContact O-N 3.49Å; D440-A443 PolarHBondContact OD1-N 3.1Å; A443-R445 VanDerWaalsContact C-N 3.25Å; A443-R445 HydrophobicContact CB-CG 3.92Å; A443-R445 PolarHBondContact O-N 3.3Å
444	A	90.1	Very high	91	Very high	64 Å²	64	63.8 Å²	63.8	53%	0.529	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	43.5	-174.1	0	0	0	0	0	113.5	Y439 D440 E441 A442	Y439-A444 VanDerWaalsContact OH-CA 3.29Å; Y439-A444 WeakPolarHBondContact OH-CA 3.02Å; Y439-A444 PolarHBondContact OH-O 3.06Å; D440-A444 WeakPolarHBondContact O-CA 3.3Å; D440-A444 PolarHBondContact O-N 3.07Å; E441-A444 PolarHBondContact O-N 3.42Å; A442-A444 VanDerWaalsContact C-N 3.31Å
445	R	90.6	Very high	90.6	Very high	170 Å²	170	61.4 Å²	61.4	64%	0.642	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-156.2	156.1	179.7	66.2	-176.5	-177.3	-179.3	-1	112.6	D440 A443	D440-R445 WeakPolarHBondContact CB-O 3.43Å; D440-R445 PolarHBondContact N-O 2.78Å; D440-R445 PolarHBondContact O-N 2.87Å; A443-R445 VanDerWaalsContact C-N 3.25Å; A443-R445 HydrophobicContact CB-CG 3.92Å; A443-R445 PolarHBondContact O-N 3.3Å
446	P	91.1	Very high	90.3	Very high	35 Å²	35	59.9 Å²	59.9	23%	0.227	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	148.1	168	-18.8	30.1	0	0	0	112.5	L408 R438 Y439	L408-P446 WeakPolarHBondContact O-CG 3.4Å; R438-P446 WeakPolarHBondContact O-CA 3.4Å; Y439-P446 HydrophobicContact CD2-CG 4.23Å
447	D	91.2	Very high	90	Very high	29 Å²	29	59.7 Å²	59.7	16%	0.155	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-67.7	148.6	168	-80.4	-18.2	0	0	0	110.9	R438 Y450	R438-D447 IonicContact CZ-OD2 2.77Å; R438-D447 IonicContact NE-OD2 2.82Å; R438-D447 PolarHBondContact NE-OD2 2.96Å; R438-D447 IonicContact NH2-OD2 2.96Å; R438-D447 PolarHBondContact NH2-OD2 3.06Å; R438-D447 PolarHBondContact O-N 3.2Å; D447-Y450 HydrophobicContact CB-CD2 3.79Å; D447-Y450 HydrophobicContact CB-CE2 3.72Å; D447-Y450 WeakPolarHBondContact O-CD2 3.4Å
448	P	90.8	Very high	89.8	Confident	120 Å²	120	63.2 Å²	63.2	78%	0.779	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	146.2	176.9	26.7	-33.1	0	0	0	111.9
449	G	88.1	Confident	89.6	Confident	53 Å²	53	62.3 Å²	62.3	55%	0.546	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	27.7	177.5	0	0	0	0	0	114.7	R452	G449-R452 WeakPolarHBondContact O-CG 3.42Å; G449-R452 PolarHBondContact O-NE 3.35Å
450	Y	91.6	Very high	89.4	Confident	36 Å²	36	62.7 Å²	62.7	14%	0.141	38%	0.38	C	S	.	.			trans	-114	153.2	168.8	-75.7	-80.3	0	0	0	110.2	Y436 R438 D447 R452	Y436-Y450 HydrophobicContact CD2-CD1 4.29Å; Y436-Y450 AromaticContact CD2-CE1 3.91Å; Y436-Y450 HydrophobicContact CD2-CE1 3.91Å; Y436-Y450 HydrophobicContact CE2-CD1 4.05Å; Y436-Y450 AromaticContact CE2-CE1 3.24Å; Y436-Y450 HydrophobicContact CE2-CE1 3.24Å; Y436-Y450 AromaticContact CZ-CE1 3.61Å; Y436-Y450 WeakPolarHBondContact O-CD1 3.41Å; R438-Y450 HydrophobicContact CB-CD1 4.31Å; R438-Y450 HydrophobicContact CB-CD2 4.08Å; R438-Y450 HydrophobicContact CB-CE1 3.83Å; R438-Y450 HydrophobicContact CB-CE2 3.54Å; R438-Y450 HydrophobicContact CB-CG 4.43Å; R438-Y450 VanDerWaalsContact CZ-OH 3.25Å; R438-Y450 PolarHBondContact NE-OH 3.17Å; R438-Y450 PolarHBondContact NH1-OH 3.41Å; D447-Y450 HydrophobicContact CB-CD2 3.79Å; D447-Y450 HydrophobicContact CB-CE2 3.72Å; D447-Y450 WeakPolarHBondContact O-CD2 3.4Å; Y450-R452 HydrophobicContact CD1-CB 3.98Å; Y450-R452 HydrophobicContact CD1-CG 3.7Å; Y450-R452 HydrophobicContact CE1-CB 3.94Å; Y450-R452 HydrophobicContact CE1-CG 3.73Å; Y450-R452 HydrophobicContact CG-CG 4.42Å
451	P	92.9	Very high	89.5	Confident	52 Å²	52	61.6 Å²	61.6	34%	0.338	38%	0.375	S	S	.	.			cis	-71.6	156.2	6.7	26.6	-32.2	0	0	0	114.4	Q435 Y436 W437	Q435-P451 HydrophobicContact CB-CB 4.04Å; Y436-P451 CarbonylContact O-C 3.48Å; Y436-P451 VanDerWaalsContact O-CA 3.24Å; Y436-P451 WeakPolarHBondContact O-CA 3.48Å; W437-P451 HydrophobicContact CD2-CB 3.89Å; W437-P451 HydrophobicContact CE3-CB 4.19Å; W437-P451 HydrophobicContact CH2-CB 3.89Å; W437-P451 HydrophobicContact CH2-CG 4.14Å; W437-P451 HydrophobicContact CZ2-CB 3.6Å; W437-P451 HydrophobicContact CZ2-CG 3.57Å; W437-P451 HydrophobicContact CZ3-CB 4.17Å
452	R	91.1	Very high	89.4	Confident	136 Å²	136	62.8 Å²	62.8	51%	0.513	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	157.8	172.3	-69.3	-172.3	177	-133.2	1.4	110.7	Q435 Y436 G449 Y450	Q435-R452 CarbonylContact C-O 3.45Å; Q435-R452 WeakPolarHBondContact CA-O 3.37Å; Y436-R452 HydrophobicContact CD1-CB 4.46Å; Y436-R452 WeakPolarHBondContact CD1-O 3.39Å; Y436-R452 HydrophobicContact CE1-CB 3.89Å; Y436-R452 PolarHBondContact N-O 3.49Å; Y436-R452 PolarHBondContact O-N 2.96Å; G449-R452 WeakPolarHBondContact O-CG 3.42Å; G449-R452 PolarHBondContact O-NE 3.35Å; Y450-R452 HydrophobicContact CD1-CB 3.98Å; Y450-R452 HydrophobicContact CD1-CG 3.7Å; Y450-R452 HydrophobicContact CE1-CB 3.94Å; Y450-R452 HydrophobicContact CE1-CG 3.73Å; Y450-R452 HydrophobicContact CG-CG 4.42Å
453	D	90.2	Very high	89.5	Confident	68 Å²	68	59.9 Å²	59.9	36%	0.364	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	141.8	174.3	-166.2	-82.1	0	0	0	110.7	R434 Y436 S455	R434-D453 CarbonylContact O-C 3.59Å; R434-D453 WeakPolarHBondContact O-CA 3.23Å; Y436-D453 WeakPolarHBondContact CE1-O 3.39Å; D453-S455 PolarHBondContact O-N 2.81Å; D453-S455 WeakPolarHBondContact OD1-CB 3.28Å; D453-S455 PolarHBondContact OD1-N 3.07Å
454	L	88.3	Confident	89.8	Confident	11 Å²	11	57.9 Å²	57.9	6%	0.058	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-63.7	-2	175.6	-79.3	168.9	0	0	0	113.6	V431 G433 R434 Y436 L456 W457 P464 F477	V431-L454 HydrophobicContact CG1-CD1 3.65Å; V431-L454 HydrophobicContact CG1-CD2 3.99Å; V431-L454 HydrophobicContact CG1-CG 4.25Å; V431-L454 HydrophobicContact CG2-CD2 4.26Å; G433-L454 VanDerWaalsContact O-CD1 3.27Å; G433-L454 WeakPolarHBondContact O-CD1 3.46Å; R434-L454 WeakPolarHBondContact O-CB 3.32Å; R434-L454 PolarHBondContact O-N 2.89Å; Y436-L454 HydrophobicContact CD1-CD2 3.93Å; Y436-L454 HydrophobicContact CD1-CG 4.31Å; Y436-L454 HydrophobicContact CG-CD2 4.31Å; L454-L456 PolarHBondContact O-N 3.39Å; L454-W457 HydrophobicContact CD2-CE3 3.8Å; L454-W457 HydrophobicContact CD2-CZ3 3.67Å; L454-W457 PolarHBondContact O-N 3.31Å; L454-P464 HydrophobicContact CD1-CG 4.33Å; L454-F477 HydrophobicContact CD2-CE1 4.45Å
455	S	84	Confident	89.9	Confident	88 Å²	88	57.8 Å²	57.8	62%	0.615	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-53.5	-12.9	175.6	67.2	0	0	0	0	115.1	D453 W457	D453-S455 PolarHBondContact O-N 2.81Å; D453-S455 WeakPolarHBondContact OD1-CB 3.28Å; D453-S455 PolarHBondContact OD1-N 3.07Å; S455-W457 PolarHBondContact O-N 2.98Å
456	L	86.2	Confident	90.1	Very high	62 Å²	62	49.7 Å²	49.7	33%	0.325	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-57.7	-38	170.1	179.2	65.1	0	0	0	112	L454 E458 I491	L454-L456 PolarHBondContact O-N 3.39Å; L456-E458 PolarHBondContact O-N 2.9Å; L456-I491 HydrophobicContact CD1-CD1 4.36Å
457	W	88.2	Confident	90.2	Very high	5 Å²	5	48.1 Å²	48.1	2%	0.019	29%	0.293	C	S	.	.	S	Bend	trans	-91.4	96.4	176.7	-66.2	-91.5	0	0	0	109.6	F420 Y429 Y436 L454 S455 G459 A460 F477 F486 I491	F420-W457 HydrophobicContact CZ-CH2 4.27Å; F420-W457 AromaticContact CZ-CZ2 3.79Å; F420-W457 HydrophobicContact CZ-CZ2 3.79Å; Y429-W457 AromaticContact CD1-CH2 3.57Å; Y429-W457 HydrophobicContact CD1-CH2 3.57Å; Y429-W457 HydrophobicContact CD1-CZ2 4.13Å; Y429-W457 AromaticContact CE1-CH2 3.63Å; Y429-W457 HydrophobicContact CE1-CH2 3.63Å; Y429-W457 HydrophobicContact CE1-CZ2 4.03Å; Y429-W457 HydrophobicContact CG-CH2 4.48Å; Y436-W457 HydrophobicContact CD1-CH2 4.4Å; Y436-W457 AromaticContact CD1-CZ3 3.74Å; Y436-W457 HydrophobicContact CD1-CZ3 3.74Å; Y436-W457 HydrophobicContact CD2-CH2 4.3Å; Y436-W457 HydrophobicContact CD2-CZ3 4.42Å; Y436-W457 HydrophobicContact CE1-CH2 4.23Å; Y436-W457 AromaticContact CE1-CZ3 3.6Å; Y436-W457 HydrophobicContact CE1-CZ3 3.6Å; Y436-W457 HydrophobicContact CE2-CH2 4.1Å; Y436-W457 HydrophobicContact CE2-CZ3 4.29Å; Y436-W457 HydrophobicContact CG-CH2 4.42Å; Y436-W457 HydrophobicContact CG-CZ3 4.14Å; Y436-W457 AromaticContact CZ-CZ3 3.89Å; L454-W457 HydrophobicContact CD2-CE3 3.8Å; L454-W457 HydrophobicContact CD2-CZ3 3.67Å; L454-W457 PolarHBondContact O-N 3.31Å; S455-W457 PolarHBondContact O-N 2.98Å; W457-G459 PolarHBondContact O-N 3.47Å; W457-A460 HydrophobicContact CB-CB 3.73Å; W457-A460 VanDerWaalsContact O-CB 3.31Å; W457-A460 WeakPolarHBondContact O-CB 3.39Å; W457-A460 PolarHBondContact O-N 3.37Å; W457-A460 VanDerWaalsContact O-N 3.11Å; W457-F477 HydrophobicContact CB-CE2 4.33Å; W457-F477 HydrophobicContact CB-CZ 4.02Å; W457-F477 AromaticContact CD1-CE2 3.68Å; W457-F477 AromaticContact CD1-CZ 3.75Å; W457-F477 HydrophobicContact CD2-CE2 4.38Å; W457-F477 AromaticContact CD2-CZ 3.66Å; W457-F477 HydrophobicContact CD2-CZ 3.66Å; W457-F477 AromaticContact CE2-CZ 3.97Å; W457-F477 HydrophobicContact CE3-CZ 4.21Å; W457-F477 AromaticContact CG-CE2 3.89Å; W457-F477 HydrophobicContact CG-CE2 3.89Å; W457-F477 AromaticContact CG-CZ 3.54Å; W457-F477 HydrophobicContact CG-CZ 3.54Å; W457-F477 AromaticContact NE1-CZ 3.99Å; W457-F486 HydrophobicContact CB-CE1 3.8Å; W457-F486 HydrophobicContact CB-CZ 3.99Å; W457-F486 HydrophobicContact CG-CE1 4.44Å; W457-I491 CarbonylContact C-O 3.53Å; W457-I491 WeakPolarHBondContact CA-O 3.2Å
458	E	90.1	Very high	90.3	Very high	93 Å²	93	47 Å²	47	44%	0.435	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-64.5	119.5	-179.9	-65.3	-180	-144.1	0	0	110.6	L456 F486 I491 K492 A493	L456-E458 PolarHBondContact O-N 2.9Å; E458-F486 WeakPolarHBondContact O-CE1 3.21Å; E458-I491 PolarHBondContact N-O 3.07Å; E458-K492 HydrophobicContact CB-CG 4.12Å; E458-K492 WeakPolarHBondContact OE1-CE 3.47Å; E458-K492 IonicContact OE1-NZ 2.71Å; E458-K492 PolarHBondContact OE1-NZ 3.45Å; E458-K492 WeakPolarHBondContact OE2-CD 3.36Å; E458-K492 VanDerWaalsContact OE2-CE 3.23Å; E458-K492 WeakPolarHBondContact OE2-CE 3.31Å; E458-K492 IonicContact OE2-NZ 3.46Å; E458-K492 PolarHBondContact OE2-NZ 3.04Å; E458-A493 PolarHBondContact O-N 3.16Å
459	G	88.1	Confident	90.2	Very high	52 Å²	52	42.1 Å²	42.1	54%	0.536	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	-0.1	-177.7	0	0	0	0	0	114.6	W457	W457-G459 PolarHBondContact O-N 3.47Å
460	A	90.4	Very high	90	Very high	24 Å²	24	40.5 Å²	40.5	20%	0.198	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-65.1	144.9	173.8	0	0	0	0	0	111	W457 F477 F486	W457-A460 HydrophobicContact CB-CB 3.73Å; W457-A460 VanDerWaalsContact O-CB 3.31Å; W457-A460 WeakPolarHBondContact O-CB 3.39Å; W457-A460 PolarHBondContact O-N 3.37Å; W457-A460 VanDerWaalsContact O-N 3.11Å; A460-F477 HydrophobicContact CB-CD1 4Å; A460-F477 HydrophobicContact CB-CE1 4.08Å; A460-F477 HydrophobicContact CB-CG 4.36Å; A460-F477 HydrophobicContact CB-CZ 4.5Å; A460-F486 HydrophobicContact CB-CE2 4.44Å; A460-F486 HydrophobicContact CB-CZ 3.87Å
461	P	92.2	Very high	89.3	Confident	6 Å²	6	42.9 Å²	42.9	4%	0.039	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-67.7	146.2	176.2	31.6	-36.6	0	0	0	110.4	S463 P464 F477 K479 W484	P461-S463 PolarHBondContact O-N 3.42Å; P461-P464 HydrophobicContact CG-CB 4.28Å; P461-F477 HydrophobicContact CG-CB 4.18Å; P461-K479 HydrophobicContact CB-CB 4.19Å; P461-K479 HydrophobicContact CB-CD 3.74Å; P461-K479 HydrophobicContact CG-CB 4.15Å; P461-K479 HydrophobicContact CG-CD 4.45Å; P461-W484 HydrophobicContact CB-CD2 4.32Å; P461-W484 HydrophobicContact CB-CE3 4.13Å; P461-W484 HydrophobicContact CB-CH2 3.8Å; P461-W484 HydrophobicContact CB-CZ2 3.93Å; P461-W484 HydrophobicContact CB-CZ3 3.9Å; P461-W484 HydrophobicContact CG-CD2 4Å; P461-W484 HydrophobicContact CG-CE3 3.61Å; P461-W484 HydrophobicContact CG-CH2 4.18Å; P461-W484 HydrophobicContact CG-CZ2 4.46Å; P461-W484 HydrophobicContact CG-CZ3 3.75Å
462	P	86.3	Confident	88.6	Confident	69 Å²	69	43.7 Å²	43.7	45%	0.448	26%	0.257	S	S	.	.	S	Bend	trans	-68.3	126.7	172.8	29.8	-34	0	0	0	109.4	R434 K479	R434-P462 VanDerWaalsContact NH1-CB 3.26Å; P462-K479 WeakPolarHBondContact O-CE 3.27Å; P462-K479 PolarHBondContact O-NZ 3.21Å
463	S	89.9	Confident	88.2	Confident	40 Å²	40	37.6 Å²	37.6	28%	0.28	24%	0.237	S	C	.	.	S	Bend	trans	58.9	70.1	-179.7	-48.1	0	0	0	0	112.5	G433 P461 K479	G433-S463 VanDerWaalsContact C-OG 3.28Å; G433-S463 WeakPolarHBondContact CA-OG 3.13Å; G433-S463 WeakPolarHBondContact O-CA 3.4Å; P461-S463 PolarHBondContact O-N 3.42Å; S463-K479 PolarHBondContact O-NZ 3.46Å
464	P	93.8	Very high	88.2	Confident	2 Å²	2	35 Å²	35	1%	0.013	22%	0.223	C	C	.	.			trans	-62	150.8	175.4	29.7	-35.8	0	0	0	110.9	V431 L454 P461 V467 F477 F478	V431-P464 HydrophobicContact CG1-CG 4.1Å; L454-P464 HydrophobicContact CD1-CG 4.33Å; P461-P464 HydrophobicContact CG-CB 4.28Å; P464-V467 HydrophobicContact CB-CG2 4.24Å; P464-V467 HydrophobicContact CG-CG2 4Å; P464-F477 HydrophobicContact CB-CD1 4.01Å; P464-F477 HydrophobicContact CG-CD1 3.96Å; P464-F477 HydrophobicContact CG-CE1 4.39Å; P464-F478 CarbonylContact C-O 3.35Å; P464-F478 WeakPolarHBondContact CA-O 3.43Å
465	D	92	Very high	88.3	Confident	62 Å²	62	34.5 Å²	34.5	33%	0.332	22%	0.221	S	C	.	.	S	Bend	trans	-78.5	-32.2	175.7	-61.1	-16.5	0	0	0	111.3	F478 K479 G480	D465-F478 PolarHBondContact N-O 3.2Å; D465-K479 WeakPolarHBondContact OD2-CA 3.34Å; D465-G480 PolarHBondContact OD2-N 3.46Å
466	D	95.4	Very high	88.8	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	170.9	163.7	-149.3	-22.2	0	0	0	110.4	A323 I324 A418 F478	A323-D466 VanDerWaalsContact CA-OD2 3.23Å; A323-D466 WeakPolarHBondContact CA-OD2 3.26Å; A323-D466 WeakPolarHBondContact CB-OD2 3.2Å; I324-D466 HydrophobicContact CB-CB 4.31Å; I324-D466 PolarHBondContact N-OD2 3.15Å; A418-D466 VanDerWaalsContact CA-OD1 3.26Å; A418-D466 WeakPolarHBondContact CA-OD1 3.4Å; A418-D466 WeakPolarHBondContact CB-OD1 3.23Å; D466-F478 PolarHBondContact O-N 3.45Å
467	V	94.1	Very high	89.2	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	128.4	175	-175.1	0	0	0	0	108.9	A418 F420 P464 T475 Y476 F477	A418-V467 HydrophobicContact CB-CB 3.99Å; A418-V467 HydrophobicContact CB-CG2 3.79Å; F420-V467 HydrophobicContact CD1-CB 3.62Å; F420-V467 HydrophobicContact CD1-CG1 3.54Å; F420-V467 HydrophobicContact CD1-CG2 4.46Å; F420-V467 HydrophobicContact CD2-CG1 4.28Å; F420-V467 HydrophobicContact CE1-CB 3.9Å; F420-V467 HydrophobicContact CE1-CG1 3.58Å; F420-V467 HydrophobicContact CE1-CG2 4.35Å; F420-V467 HydrophobicContact CE2-CG1 4.3Å; F420-V467 HydrophobicContact CG-CB 4.28Å; F420-V467 HydrophobicContact CG-CG1 3.91Å; F420-V467 HydrophobicContact CZ-CG1 3.97Å; P464-V467 HydrophobicContact CB-CG2 4.24Å; P464-V467 HydrophobicContact CG-CG2 4Å; V467-T475 HydrophobicContact CG1-CG2 3.73Å; V467-Y476 CarbonylContact C-O 3.58Å; V467-Y476 VanDerWaalsContact CA-O 3.28Å; V467-Y476 WeakPolarHBondContact CA-O 3.18Å; V467-F477 HydrophobicContact CG1-CD1 4.46Å; V467-F477 HydrophobicContact CG1-CD2 4.08Å; V467-F477 HydrophobicContact CG1-CE1 4.31Å; V467-F477 HydrophobicContact CG1-CE2 3.92Å; V467-F477 HydrophobicContact CG1-CG 4.33Å; V467-F477 HydrophobicContact CG1-CZ 4.03Å; V467-F477 HydrophobicContact CG2-CD1 3.48Å; V467-F477 VanDerWaalsContact CG2-CD1 3.48Å; V467-F477 HydrophobicContact CG2-CD2 4.5Å; V467-F477 HydrophobicContact CG2-CE1 3.56Å; V467-F477 HydrophobicContact CG2-CG 3.97Å; V467-F477 HydrophobicContact CG2-CZ 4.12Å
468	T	92.3	Very high	89.5	Confident	6 Å²	6	28.2 Å²	28.2	4%	0.037	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	160.7	176.3	-156.2	0	0	0	0	112.1	I324 N326 Y476 F478	I324-T468 HydrophobicContact CG2-CG2 4.46Å; N326-T468 PolarHBondContact N-OG1 2.67Å; T468-Y476 PolarHBondContact N-O 2.88Å; T468-Y476 PolarHBondContact O-N 3.2Å; T468-F478 HydrophobicContact CG2-CE2 3.53Å; T468-F478 HydrophobicContact CG2-CZ 3.89Å
469	V	88.1	Confident	89.7	Confident	17 Å²	17	27.1 Å²	27.1	10%	0.103	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.5	174.5	-175.7	0	0	0	0	108.7	N326 F420 P423 D474 T475	N326-V469 WeakPolarHBondContact CB-O 3.11Å; F420-V469 HydrophobicContact CD2-CG2 3.81Å; P423-V469 HydrophobicContact CG-CG1 3.8Å; V469-D474 CarbonylContact C-O 3.48Å; V469-D474 WeakPolarHBondContact CA-O 3.18Å; V469-T475 HydrophobicContact CG2-CG2 4.34Å
470	S	83.7	Confident	89.8	Confident	19 Å²	19	26 Å²	26	13%	0.133	16%	0.162	C	C	.	.			trans	-73.8	169.7	177.8	65	0	0	0	0	112.2	S472 G473 D474	S470-S472 PolarHBondContact O-N 2.9Å; S470-S472 PolarHBondContact OG-N 3.16Å; S470-S472 PolarHBondContact OG-OG 3.49Å; S470-G473 WeakPolarHBondContact O-CA 3.27Å; S470-G473 PolarHBondContact O-N 3.35Å; S470-D474 PolarHBondContact N-O 3.49Å; S470-D474 PolarHBondContact OG-N 3.16Å; S470-D474 PolarHBondContact OG-O 3.48Å
471	N	76.9	Confident	89.8	Confident	87 Å²	87	26.8 Å²	26.8	47%	0.465	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.8	174.9	-54.7	-17.9	0	0	0	112.9	N326 G329 G473	N326-N471 PolarHBondContact ND2-OD1 3.28Å; N326-N471 PolarHBondContact OD1-OD1 2.87Å; G329-N471 VanDerWaalsContact CA-OD1 3.23Å; G329-N471 WeakPolarHBondContact CA-OD1 3.36Å; G329-N471 PolarHBondContact O-ND2 2.85Å; G329-N471 PolarHBondContact O-OD1 2.62Å; N471-G473 VanDerWaalsContact C-N 3.27Å
472	S	80	Confident	89.8	Confident	68 Å²	68	30.4 Å²	30.4	48%	0.476	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-15.8	174	52.4	0	0	0	0	112.9	S470 D474 K488	S470-S472 PolarHBondContact O-N 2.9Å; S470-S472 PolarHBondContact OG-N 3.16Å; S470-S472 PolarHBondContact OG-OG 3.49Å; S472-D474 PolarHBondContact OG-OD2 2.59Å; S472-K488 WeakPolarHBondContact O-CD 3.37Å
473	G	81.4	Confident	90.2	Very high	9 Å²	9	28.2 Å²	28.2	9%	0.093	17%	0.167	C	C	.	.	S	Bend	trans	91.6	12.5	-176.8	0	0	0	0	0	114.4	S470 N471 K488	S470-G473 WeakPolarHBondContact O-CA 3.27Å; S470-G473 PolarHBondContact O-N 3.35Å; N471-G473 VanDerWaalsContact C-N 3.27Å; G473-K488 WeakPolarHBondContact O-CA 3.19Å
474	D	89.9	Confident	90.6	Very high	14 Å²	14	28.2 Å²	28.2	8%	0.075	16%	0.161	C	C	.	.			trans	-79	141.1	172.3	-56.5	-49.3	0	0	0	109.5	V469 S470 S472 Y476 R485 F486 P487 K488	V469-D474 CarbonylContact C-O 3.48Å; V469-D474 WeakPolarHBondContact CA-O 3.18Å; S470-D474 PolarHBondContact N-O 3.49Å; S470-D474 PolarHBondContact OG-N 3.16Å; S470-D474 PolarHBondContact OG-O 3.48Å; S472-D474 PolarHBondContact OG-OD2 2.59Å; D474-Y476 HydrophobicContact CB-CE2 3.65Å; D474-Y476 WeakPolarHBondContact O-CD2 3.24Å; D474-Y476 WeakPolarHBondContact O-CE2 3.4Å; D474-R485 HydrophobicContact CB-CG 4.5Å; D474-R485 IonicContact OD2-CZ 2.68Å; D474-R485 IonicContact OD2-NE 3.68Å; D474-R485 IonicContact OD2-NH2 3.66Å; D474-R485 PolarHBondContact OD2-NH2 2.92Å; D474-F486 CarbonylContact C-O 3.56Å; D474-F486 WeakPolarHBondContact CA-O 3.44Å; D474-P487 WeakPolarHBondContact OD1-CA 3.34Å; D474-K488 PolarHBondContact OD1-N 3.5Å
475	T	91.3	Very high	90.6	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135.1	179.4	-50.3	0	0	0	0	109.8	F420 W422 V467 V469 F477 F486	F420-T475 HydrophobicContact CE2-CG2 4.31Å; W422-T475 PolarHBondContact NE1-OG1 2.8Å; V467-T475 HydrophobicContact CG1-CG2 3.73Å; V469-T475 HydrophobicContact CG2-CG2 4.34Å; T475-F477 HydrophobicContact CG2-CD2 4.21Å; T475-F477 HydrophobicContact CG2-CE2 3.74Å; T475-F486 PolarHBondContact N-O 3.03Å; T475-F486 WeakPolarHBondContact O-CB 3.42Å; T475-F486 PolarHBondContact O-N 3.4Å
476	Y	94.1	Very high	90.6	Very high	20 Å²	20	29 Å²	29	8%	0.078	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	123.1	-178.9	-61.5	-98.4	0	0	0	109.7	V467 T468 D474 F478 Y483 W484 R485 W505	V467-Y476 CarbonylContact C-O 3.58Å; V467-Y476 VanDerWaalsContact CA-O 3.28Å; V467-Y476 WeakPolarHBondContact CA-O 3.18Å; T468-Y476 PolarHBondContact N-O 2.88Å; T468-Y476 PolarHBondContact O-N 3.2Å; D474-Y476 HydrophobicContact CB-CE2 3.65Å; D474-Y476 WeakPolarHBondContact O-CD2 3.24Å; D474-Y476 WeakPolarHBondContact O-CE2 3.4Å; Y476-F478 HydrophobicContact CG-CZ 4.45Å; Y476-Y483 AromaticContact CD1-CD2 3.68Å; Y476-Y483 HydrophobicContact CD1-CD2 3.68Å; Y476-Y483 AromaticContact CD1-CE2 3.95Å; Y476-Y483 HydrophobicContact CD1-CE2 3.95Å; Y476-Y483 HydrophobicContact CE1-CD2 4.24Å; Y476-Y483 HydrophobicContact CE1-CE2 4.02Å; Y476-W484 WeakPolarHBondContact CA-O 3.46Å; Y476-R485 HydrophobicContact CD1-CB 3.93Å; Y476-R485 HydrophobicContact CD1-CG 4.08Å; Y476-R485 HydrophobicContact CE1-CB 3.74Å; Y476-R485 HydrophobicContact CE1-CG 3.53Å; Y476-R485 PolarHBondContact OH-NE 3.44Å; Y476-W505 HydrophobicContact CD1-CH2 4.37Å; Y476-W505 AromaticContact CD1-CZ2 3.58Å; Y476-W505 HydrophobicContact CD1-CZ2 3.58Å; Y476-W505 HydrophobicContact CD2-CH2 4.28Å; Y476-W505 HydrophobicContact CD2-CZ2 4.28Å; Y476-W505 HydrophobicContact CE1-CH2 4.38Å; Y476-W505 AromaticContact CE1-CZ2 3.61Å; Y476-W505 HydrophobicContact CE1-CZ2 3.61Å; Y476-W505 HydrophobicContact CE2-CH2 4.34Å; Y476-W505 HydrophobicContact CE2-CZ2 4.34Å; Y476-W505 HydrophobicContact CG-CH2 4.3Å; Y476-W505 AromaticContact CG-CZ2 3.91Å; Y476-W505 HydrophobicContact CG-CZ2 3.91Å
477	F	95.4	Very high	90.4	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.7	171.1	-74.2	-112.3	0	0	0	108.3	L454 W457 A460 P461 P464 V467 T475 Y483 W484 F486	L454-F477 HydrophobicContact CD2-CE1 4.45Å; W457-F477 HydrophobicContact CB-CE2 4.33Å; W457-F477 HydrophobicContact CB-CZ 4.02Å; W457-F477 AromaticContact CD1-CE2 3.68Å; W457-F477 AromaticContact CD1-CZ 3.75Å; W457-F477 HydrophobicContact CD2-CE2 4.38Å; W457-F477 AromaticContact CD2-CZ 3.66Å; W457-F477 HydrophobicContact CD2-CZ 3.66Å; W457-F477 AromaticContact CE2-CZ 3.97Å; W457-F477 HydrophobicContact CE3-CZ 4.21Å; W457-F477 AromaticContact CG-CE2 3.89Å; W457-F477 HydrophobicContact CG-CE2 3.89Å; W457-F477 AromaticContact CG-CZ 3.54Å; W457-F477 HydrophobicContact CG-CZ 3.54Å; W457-F477 AromaticContact NE1-CZ 3.99Å; A460-F477 HydrophobicContact CB-CD1 4Å; A460-F477 HydrophobicContact CB-CE1 4.08Å; A460-F477 HydrophobicContact CB-CG 4.36Å; A460-F477 HydrophobicContact CB-CZ 4.5Å; P461-F477 HydrophobicContact CG-CB 4.18Å; P464-F477 HydrophobicContact CB-CD1 4.01Å; P464-F477 HydrophobicContact CG-CD1 3.96Å; P464-F477 HydrophobicContact CG-CE1 4.39Å; V467-F477 HydrophobicContact CG1-CD1 4.46Å; V467-F477 HydrophobicContact CG1-CD2 4.08Å; V467-F477 HydrophobicContact CG1-CE1 4.31Å; V467-F477 HydrophobicContact CG1-CE2 3.92Å; V467-F477 HydrophobicContact CG1-CG 4.33Å; V467-F477 HydrophobicContact CG1-CZ 4.03Å; V467-F477 HydrophobicContact CG2-CD1 3.48Å; V467-F477 VanDerWaalsContact CG2-CD1 3.48Å; V467-F477 HydrophobicContact CG2-CD2 4.5Å; V467-F477 HydrophobicContact CG2-CE1 3.56Å; V467-F477 HydrophobicContact CG2-CG 3.97Å; V467-F477 HydrophobicContact CG2-CZ 4.12Å; T475-F477 HydrophobicContact CG2-CD2 4.21Å; T475-F477 HydrophobicContact CG2-CE2 3.74Å; F477-Y483 CarbonylContact O-C 3.57Å; F477-Y483 WeakPolarHBondContact O-CA 3.41Å; F477-W484 HydrophobicContact CB-CB 4.35Å; F477-W484 PolarHBondContact N-O 3.1Å; F477-W484 PolarHBondContact O-N 2.86Å; F477-F486 HydrophobicContact CB-CE2 4.46Å; F477-F486 AromaticContact CD2-CD2 3.62Å; F477-F486 HydrophobicContact CD2-CD2 3.62Å; F477-F486 AromaticContact CD2-CE2 3.41Å; F477-F486 HydrophobicContact CD2-CE2 3.41Å; F477-F486 VanDerWaalsContact CD2-CE2 3.41Å; F477-F486 HydrophobicContact CD2-CZ 4.26Å; F477-F486 HydrophobicContact CE2-CD2 4.01Å; F477-F486 AromaticContact CE2-CE2 3.9Å; F477-F486 HydrophobicContact CE2-CE2 3.9Å; F477-F486 HydrophobicContact CE2-CZ 4.41Å; F477-F486 HydrophobicContact CG-CE2 4.11Å
478	F	94.6	Very high	89.9	Confident	2 Å²	2	36.7 Å²	36.7	1%	0.009	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	141.4	-179.9	-58.6	-86.7	0	0	0	110.6	I324 P464 D465 D466 T468 Y476 Y483 M501 W505	I324-F478 HydrophobicContact CB-CD2 4.14Å; I324-F478 HydrophobicContact CB-CE2 4.13Å; I324-F478 HydrophobicContact CD1-CB 3.8Å; I324-F478 HydrophobicContact CD1-CD1 3.57Å; I324-F478 HydrophobicContact CD1-CD2 3.77Å; I324-F478 HydrophobicContact CD1-CE1 4.04Å; I324-F478 HydrophobicContact CD1-CE2 4.22Å; I324-F478 HydrophobicContact CD1-CG 3.42Å; I324-F478 VanDerWaalsContact CD1-CG 3.42Å; I324-F478 HydrophobicContact CD1-CZ 4.35Å; I324-F478 HydrophobicContact CG2-CD2 4.3Å; I324-F478 HydrophobicContact CG2-CE2 3.8Å; I324-F478 HydrophobicContact CG2-CZ 3.93Å; P464-F478 CarbonylContact C-O 3.35Å; P464-F478 WeakPolarHBondContact CA-O 3.43Å; D465-F478 PolarHBondContact N-O 3.2Å; D466-F478 PolarHBondContact O-N 3.45Å; T468-F478 HydrophobicContact CG2-CE2 3.53Å; T468-F478 HydrophobicContact CG2-CZ 3.89Å; Y476-F478 HydrophobicContact CG-CZ 4.45Å; F478-Y483 HydrophobicContact CE1-CG 4.34Å; F478-M501 HydrophobicContact CD1-SD 3.53Å; F478-M501 VanDerWaalsContact CD1-SD 3.53Å; F478-M501 HydrophobicContact CE1-SD 3.86Å; F478-W505 HydrophobicContact CE1-CZ2 4.48Å; F478-W505 HydrophobicContact CZ-CH2 4.41Å; F478-W505 HydrophobicContact CZ-CZ2 4.23Å
479	K	93.2	Very high	89.2	Confident	70 Å²	70	41.9 Å²	41.9	30%	0.304	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	119.8	171	-167.4	178.4	179.1	86.6	0	110.5	P461 P462 S463 D465 H482 W484	P461-K479 HydrophobicContact CB-CB 4.19Å; P461-K479 HydrophobicContact CB-CD 3.74Å; P461-K479 HydrophobicContact CG-CB 4.15Å; P461-K479 HydrophobicContact CG-CD 4.45Å; P462-K479 WeakPolarHBondContact O-CE 3.27Å; P462-K479 PolarHBondContact O-NZ 3.21Å; S463-K479 PolarHBondContact O-NZ 3.46Å; D465-K479 WeakPolarHBondContact OD2-CA 3.34Å; K479-H482 PolarHBondContact N-O 3.14Å; K479-H482 PolarHBondContact O-N 3.25Å; K479-W484 HydrophobicContact CB-CH2 4.08Å; K479-W484 HydrophobicContact CB-CZ3 3.67Å
480	G	90.1	Very high	89	Confident	30 Å²	30	42.7 Å²	42.7	31%	0.309	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	-140.2	-168.1	0	0	0	0	0	110.9	G319 D465 H482 M501	G319-G480 CarbonylContact O-C 3.51Å; D465-G480 PolarHBondContact OD2-N 3.46Å; G480-H482 PolarHBondContact O-N 2.83Å; G480-M501 WeakPolarHBondContact O-CE 3.3Å
481	A	90.2	Very high	89.1	Confident	39 Å²	39	44.6 Å²	44.6	32%	0.322	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	15.1	-179.9	0	0	0	0	0	115.1	M501	A481-M501 WeakPolarHBondContact O-CB 3.44Å; A481-M501 PolarHBondContact O-N 2.92Å
482	H	93.7	Very high	89.8	Confident	83 Å²	83	45.6 Å²	45.6	38%	0.384	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.7	-171.4	-61.5	86.6	0	0	0	112.8	K479 G480 W484 P498 Q499	K479-H482 PolarHBondContact N-O 3.14Å; K479-H482 PolarHBondContact O-N 3.25Å; G480-H482 PolarHBondContact O-N 2.83Å; H482-W484 HydrophobicContact CB-CH2 4.33Å; H482-W484 HydrophobicContact CB-CZ3 4.2Å; H482-P498 HydrophobicContact CB-CB 3.91Å; H482-Q499 VanDerWaalsContact CA-O 3.3Å; H482-Q499 WeakPolarHBondContact CA-O 3.3Å
483	Y	94.9	Very high	90.4	Very high	23 Å²	23	43.4 Å²	43.4	9%	0.09	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	156.8	173.7	73.6	-90.6	0	0	0	112.9	Y476 F477 F478 R485 P498 Q499 M501 N504 W505	Y476-Y483 AromaticContact CD1-CD2 3.68Å; Y476-Y483 HydrophobicContact CD1-CD2 3.68Å; Y476-Y483 AromaticContact CD1-CE2 3.95Å; Y476-Y483 HydrophobicContact CD1-CE2 3.95Å; Y476-Y483 HydrophobicContact CE1-CD2 4.24Å; Y476-Y483 HydrophobicContact CE1-CE2 4.02Å; F477-Y483 CarbonylContact O-C 3.57Å; F477-Y483 WeakPolarHBondContact O-CA 3.41Å; F478-Y483 HydrophobicContact CE1-CG 4.34Å; Y483-R485 HydrophobicContact CD2-CB 4.46Å; Y483-R485 HydrophobicContact CE2-CB 4.21Å; Y483-P498 WeakPolarHBondContact O-CA 3.48Å; Y483-Q499 HydrophobicContact CD1-CB 4.17Å; Y483-Q499 WeakPolarHBondContact CD1-O 3.24Å; Y483-Q499 HydrophobicContact CD2-CB 4.42Å; Y483-Q499 HydrophobicContact CE1-CB 3.57Å; Y483-Q499 HydrophobicContact CE2-CB 3.86Å; Y483-Q499 HydrophobicContact CE2-CG 4.47Å; Y483-Q499 PolarHBondContact N-O 3.22Å; Y483-Q499 PolarHBondContact O-N 2.71Å; Y483-M501 HydrophobicContact CD1-CB 4.22Å; Y483-N504 HydrophobicContact CE1-CB 3.98Å; Y483-N504 PolarHBondContact OH-ND2 3.32Å; Y483-W505 AromaticContact CD1-CD1 3.82Å; Y483-W505 AromaticContact CD1-NE1 3.51Å; Y483-W505 AromaticContact CE1-CD1 3.57Å; Y483-W505 AromaticContact CE1-NE1 3.31Å; Y483-W505 VanDerWaalsContact CE1-NE1 3.31Å; Y483-W505 AromaticContact CG-NE1 3.96Å; Y483-W505 AromaticContact CZ-NE1 3.59Å
484	W	96.3	Very high	90.9	Very high	40 Å²	40	45.4 Å²	45.4	15%	0.152	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.3	172.8	-68.1	-108.9	0	0	0	108.3	P461 Y476 F477 K479 H482 F486 A497 P498	P461-W484 HydrophobicContact CB-CD2 4.32Å; P461-W484 HydrophobicContact CB-CE3 4.13Å; P461-W484 HydrophobicContact CB-CH2 3.8Å; P461-W484 HydrophobicContact CB-CZ2 3.93Å; P461-W484 HydrophobicContact CB-CZ3 3.9Å; P461-W484 HydrophobicContact CG-CD2 4Å; P461-W484 HydrophobicContact CG-CE3 3.61Å; P461-W484 HydrophobicContact CG-CH2 4.18Å; P461-W484 HydrophobicContact CG-CZ2 4.46Å; P461-W484 HydrophobicContact CG-CZ3 3.75Å; Y476-W484 WeakPolarHBondContact CA-O 3.46Å; F477-W484 HydrophobicContact CB-CB 4.35Å; F477-W484 PolarHBondContact N-O 3.1Å; F477-W484 PolarHBondContact O-N 2.86Å; K479-W484 HydrophobicContact CB-CH2 4.08Å; K479-W484 HydrophobicContact CB-CZ3 3.67Å; H482-W484 HydrophobicContact CB-CH2 4.33Å; H482-W484 HydrophobicContact CB-CZ3 4.2Å; W484-F486 HydrophobicContact CB-CE2 3.9Å; W484-A497 HydrophobicContact CB-CB 4.28Å; W484-A497 HydrophobicContact CG-CB 4.06Å; W484-P498 HydrophobicContact CD2-CB 4.07Å; W484-P498 HydrophobicContact CE3-CB 4.43Å; W484-P498 HydrophobicContact CH2-CB 3.96Å; W484-P498 HydrophobicContact CH2-CG 4.43Å; W484-P498 HydrophobicContact CZ2-CB 3.6Å; W484-P498 HydrophobicContact CZ2-CG 3.84Å; W484-P498 HydrophobicContact CZ3-CB 4.35Å
485	R	95	Very high	90.8	Very high	81 Å²	81	51.3 Å²	51.3	31%	0.306	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	134.8	176.3	-178.6	177	179.1	-172.1	1.4	110.3	D474 Y476 Y483 A493 E494	D474-R485 HydrophobicContact CB-CG 4.5Å; D474-R485 IonicContact OD2-CZ 2.68Å; D474-R485 IonicContact OD2-NE 3.68Å; D474-R485 IonicContact OD2-NH2 3.66Å; D474-R485 PolarHBondContact OD2-NH2 2.92Å; Y476-R485 HydrophobicContact CD1-CB 3.93Å; Y476-R485 HydrophobicContact CD1-CG 4.08Å; Y476-R485 HydrophobicContact CE1-CB 3.74Å; Y476-R485 HydrophobicContact CE1-CG 3.53Å; Y476-R485 PolarHBondContact OH-NE 3.44Å; Y483-R485 HydrophobicContact CD2-CB 4.46Å; Y483-R485 HydrophobicContact CE2-CB 4.21Å; R485-A493 WeakPolarHBondContact O-CA 3.41Å; R485-E494 HydrophobicContact CB-CG 4.45Å; R485-E494 WeakPolarHBondContact CD-OE2 3.41Å; R485-E494 IonicContact CZ-OE1 3.49Å; R485-E494 IonicContact NE-OE1 3.04Å; R485-E494 IonicContact NH1-OE1 3.88Å; R485-E494 PolarHBondContact O-N 3.46Å
486	F	92	Very high	90.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113	172.1	-68.2	-105.6	0	0	0	107.1	W457 E458 A460 D474 T475 F477 W484 I491 A493	W457-F486 HydrophobicContact CB-CE1 3.8Å; W457-F486 HydrophobicContact CB-CZ 3.99Å; W457-F486 HydrophobicContact CG-CE1 4.44Å; E458-F486 WeakPolarHBondContact O-CE1 3.21Å; A460-F486 HydrophobicContact CB-CE2 4.44Å; A460-F486 HydrophobicContact CB-CZ 3.87Å; D474-F486 CarbonylContact C-O 3.56Å; D474-F486 WeakPolarHBondContact CA-O 3.44Å; T475-F486 PolarHBondContact N-O 3.03Å; T475-F486 WeakPolarHBondContact O-CB 3.42Å; T475-F486 PolarHBondContact O-N 3.4Å; F477-F486 HydrophobicContact CB-CE2 4.46Å; F477-F486 AromaticContact CD2-CD2 3.62Å; F477-F486 HydrophobicContact CD2-CD2 3.62Å; F477-F486 AromaticContact CD2-CE2 3.41Å; F477-F486 HydrophobicContact CD2-CE2 3.41Å; F477-F486 VanDerWaalsContact CD2-CE2 3.41Å; F477-F486 HydrophobicContact CD2-CZ 4.26Å; F477-F486 HydrophobicContact CE2-CD2 4.01Å; F477-F486 AromaticContact CE2-CE2 3.9Å; F477-F486 HydrophobicContact CE2-CE2 3.9Å; F477-F486 HydrophobicContact CE2-CZ 4.41Å; F477-F486 HydrophobicContact CG-CE2 4.11Å; W484-F486 HydrophobicContact CB-CE2 3.9Å; F486-I491 WeakPolarHBondContact CE1-O 3.33Å; F486-A493 HydrophobicContact CD1-CB 4.42Å; F486-A493 HydrophobicContact CE1-CB 3.9Å; F486-A493 HydrophobicContact CE2-CB 3.99Å; F486-A493 HydrophobicContact CZ-CB 3.66Å
487	P	90.1	Very high	90.3	Very high	43 Å²	43	56 Å²	56	28%	0.279	30%	0.301	S	S	.	.			trans	-56.7	151.5	178.2	-25.8	35.1	0	0	0	111.6	D474 N489 S490 E494	D474-P487 WeakPolarHBondContact OD1-CA 3.34Å; P487-N489 PolarHBondContact O-N 3.34Å; P487-S490 WeakPolarHBondContact O-CA 3.03Å; P487-S490 WeakPolarHBondContact O-CB 3.27Å; P487-S490 PolarHBondContact O-N 2.93Å; P487-E494 HydrophobicContact CG-CG 3.89Å
488	K	84.6	Confident	90.2	Very high	119 Å²	119	59 Å²	59	52%	0.517	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	132.8	175.3	-174.3	-177.2	-173.1	168.7	0	111	S472 G473 D474 S490	S472-K488 WeakPolarHBondContact O-CD 3.37Å; G473-K488 WeakPolarHBondContact O-CA 3.19Å; D474-K488 PolarHBondContact OD1-N 3.5Å; K488-S490 PolarHBondContact O-N 3.33Å
489	N	77.3	Confident	90.1	Very high	116 Å²	116	61.2 Å²	61.2	62%	0.62	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	10.5	-177	-51.6	-27.9	0	0	0	115.2	Q424 P487	Q424-N489 VanDerWaalsContact NE2-N 3.13Å; P487-N489 PolarHBondContact O-N 3.34Å
490	S	85.2	Confident	90	Very high	34 Å²	34	59.7 Å²	59.7	24%	0.238	33%	0.328	C	S	.	.			trans	-104.2	143.3	171.5	-173.4	0	0	0	0	110.8	P487 K488 K492	P487-S490 WeakPolarHBondContact O-CA 3.03Å; P487-S490 WeakPolarHBondContact O-CB 3.27Å; P487-S490 PolarHBondContact O-N 2.93Å; K488-S490 PolarHBondContact O-N 3.33Å; S490-K492 PolarHBondContact OG-N 3.07Å; S490-K492 PolarHBondContact OG-O 3.25Å
491	I	85.6	Confident	90.1	Very high	58 Å²	58	58.3 Å²	58.3	30%	0.297	31%	0.314	S	S	.	.	S	Bend	trans	-105.2	7.7	166.5	58.7	171.3	0	0	0	111.6	W422 L456 W457 E458 F486	W422-I491 HydrophobicContact CH2-CG2 3.91Å; W422-I491 HydrophobicContact CZ2-CG2 4.09Å; L456-I491 HydrophobicContact CD1-CD1 4.36Å; W457-I491 CarbonylContact C-O 3.53Å; W457-I491 WeakPolarHBondContact CA-O 3.2Å; E458-I491 PolarHBondContact N-O 3.07Å; F486-I491 WeakPolarHBondContact CE1-O 3.33Å
492	K	90.5	Very high	89.9	Confident	108 Å²	108	56.9 Å²	56.9	47%	0.47	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-110.8	134.1	176.5	-52.4	-165.5	-177.2	-131	0	110.4	E458 S490	E458-K492 HydrophobicContact CB-CG 4.12Å; E458-K492 WeakPolarHBondContact OE1-CE 3.47Å; E458-K492 IonicContact OE1-NZ 2.71Å; E458-K492 PolarHBondContact OE1-NZ 3.45Å; E458-K492 WeakPolarHBondContact OE2-CD 3.36Å; E458-K492 VanDerWaalsContact OE2-CE 3.23Å; E458-K492 WeakPolarHBondContact OE2-CE 3.31Å; E458-K492 IonicContact OE2-NZ 3.46Å; E458-K492 PolarHBondContact OE2-NZ 3.04Å; S490-K492 PolarHBondContact OG-N 3.07Å; S490-K492 PolarHBondContact OG-O 3.25Å
493	A	92.6	Very high	89.5	Confident	23 Å²	23	54.7 Å²	54.7	19%	0.19	30%	0.296	C	S	.	.			trans	-65.6	154.6	174.9	0	0	0	0	0	111.3	E458 R485 F486 A497	E458-A493 PolarHBondContact O-N 3.16Å; R485-A493 WeakPolarHBondContact O-CA 3.41Å; F486-A493 HydrophobicContact CD1-CB 4.42Å; F486-A493 HydrophobicContact CE1-CB 3.9Å; F486-A493 HydrophobicContact CE2-CB 3.99Å; F486-A493 HydrophobicContact CZ-CB 3.66Å; A493-A497 HydrophobicContact CB-CB 4.48Å
494	E	92.2	Very high	89.1	Confident	50 Å²	50	57.5 Å²	57.5	23%	0.234	31%	0.313	C	S	.	.			trans	-61.9	143.5	171	-66.3	-179.1	156	0	0	111	R485 P487 D496 A497	R485-E494 HydrophobicContact CB-CG 4.45Å; R485-E494 WeakPolarHBondContact CD-OE2 3.41Å; R485-E494 IonicContact CZ-OE1 3.49Å; R485-E494 IonicContact NE-OE1 3.04Å; R485-E494 IonicContact NH1-OE1 3.88Å; R485-E494 PolarHBondContact O-N 3.46Å; P487-E494 HydrophobicContact CG-CG 3.89Å; E494-D496 VanDerWaalsContact CB-OD1 3.27Å; E494-D496 WeakPolarHBondContact CB-OD1 3.37Å; E494-D496 PolarHBondContact O-N 3.19Å; E494-D496 VanDerWaalsContact O-N 3.14Å; E494-A497 VanDerWaalsContact O-CB 3.28Å; E494-A497 WeakPolarHBondContact O-CB 3.37Å; E494-A497 PolarHBondContact O-N 3.06Å; E494-A497 VanDerWaalsContact O-N 3.09Å
495	P	88.1	Confident	88.6	Confident	139 Å²	139	56.9 Å²	56.9	90%	0.903	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-22.6	-174.2	-22.5	33.2	0	0	0	114.9
496	D	87.7	Confident	88	Confident	91 Å²	91	53 Å²	53	49%	0.487	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	5.4	-179.5	62.6	-47.1	0	0	0	113.2	E494 Q499	E494-D496 VanDerWaalsContact CB-OD1 3.27Å; E494-D496 WeakPolarHBondContact CB-OD1 3.37Å; E494-D496 PolarHBondContact O-N 3.19Å; E494-D496 VanDerWaalsContact O-N 3.14Å; D496-Q499 PolarHBondContact O-NE2 2.7Å; D496-Q499 VanDerWaalsContact O-NE2 3.1Å; D496-Q499 PolarHBondContact OD2-NE2 2.71Å
497	A	87.7	Confident	87.5	Confident	26 Å²	26	57.6 Å²	57.6	22%	0.215	32%	0.32	C	S	.	.			trans	-74.4	147.9	173.1	0	0	0	0	0	112.4	W484 A493 E494	W484-A497 HydrophobicContact CB-CB 4.28Å; W484-A497 HydrophobicContact CG-CB 4.06Å; A493-A497 HydrophobicContact CB-CB 4.48Å; E494-A497 VanDerWaalsContact O-CB 3.28Å; E494-A497 WeakPolarHBondContact O-CB 3.37Å; E494-A497 PolarHBondContact O-N 3.06Å; E494-A497 VanDerWaalsContact O-N 3.09Å
498	P	93.2	Very high	87.2	Confident	63 Å²	63	56.2 Å²	56.2	41%	0.409	31%	0.311	S	S	.	.	S	Bend	cis	-78.7	149.4	0.4	26.7	-30.4	0	0	0	114.7	H482 Y483 W484	H482-P498 HydrophobicContact CB-CB 3.91Å; Y483-P498 WeakPolarHBondContact O-CA 3.48Å; W484-P498 HydrophobicContact CD2-CB 4.07Å; W484-P498 HydrophobicContact CE3-CB 4.43Å; W484-P498 HydrophobicContact CH2-CB 3.96Å; W484-P498 HydrophobicContact CH2-CG 4.43Å; W484-P498 HydrophobicContact CZ2-CB 3.6Å; W484-P498 HydrophobicContact CZ2-CG 3.84Å; W484-P498 HydrophobicContact CZ3-CB 4.35Å
499	Q	92.8	Very high	87	Confident	50 Å²	50	55.7 Å²	55.7	23%	0.234	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	150.5	174.1	-71.2	-67.8	-20	0	0	111.3	H482 Y483 D496	H482-Q499 VanDerWaalsContact CA-O 3.3Å; H482-Q499 WeakPolarHBondContact CA-O 3.3Å; Y483-Q499 HydrophobicContact CD1-CB 4.17Å; Y483-Q499 WeakPolarHBondContact CD1-O 3.24Å; Y483-Q499 HydrophobicContact CD2-CB 4.42Å; Y483-Q499 HydrophobicContact CE1-CB 3.57Å; Y483-Q499 HydrophobicContact CE2-CB 3.86Å; Y483-Q499 HydrophobicContact CE2-CG 4.47Å; Y483-Q499 PolarHBondContact N-O 3.22Å; Y483-Q499 PolarHBondContact O-N 2.71Å; D496-Q499 PolarHBondContact O-NE2 2.7Å; D496-Q499 VanDerWaalsContact O-NE2 3.1Å; D496-Q499 PolarHBondContact OD2-NE2 2.71Å
500	P	91	Very high	86.7	Confident	37 Å²	37	54 Å²	54	24%	0.24	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129.9	-179.5	31.5	-34	0	0	0	111.1	P503 N504	P500-P503 HydrophobicContact CB-CG 4.37Å; P500-P503 HydrophobicContact CG-CG 4.39Å; P500-N504 WeakPolarHBondContact O-CB 3.37Å; P500-N504 PolarHBondContact O-ND2 2.79Å
501	M	90.6	Very high	85.4	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-75	-44.5	-176.6	-178.1	165.1	49.5	0	0	112.8	G319 F321 I324 F333 F478 G480 A481 Y483 N504 W505 L506	G319-M501 WeakPolarHBondContact O-CE 3.07Å; F321-M501 HydrophobicContact CD2-CE 3.56Å; F321-M501 HydrophobicContact CD2-SD 4.16Å; F321-M501 HydrophobicContact CE2-CE 3.77Å; F321-M501 HydrophobicContact CE2-SD 4.32Å; I324-M501 HydrophobicContact CD1-CE 4.37Å; I324-M501 HydrophobicContact CD1-SD 3.72Å; F333-M501 HydrophobicContact CD1-SD 4.28Å; F333-M501 HydrophobicContact CE1-CG 4.25Å; F333-M501 HydrophobicContact CE1-SD 3.59Å; F333-M501 VanDerWaalsContact CE1-SD 3.59Å; F478-M501 HydrophobicContact CD1-SD 3.53Å; F478-M501 VanDerWaalsContact CD1-SD 3.53Å; F478-M501 HydrophobicContact CE1-SD 3.86Å; G480-M501 WeakPolarHBondContact O-CE 3.3Å; A481-M501 WeakPolarHBondContact O-CB 3.44Å; A481-M501 PolarHBondContact O-N 2.92Å; Y483-M501 HydrophobicContact CD1-CB 4.22Å; M501-N504 PolarHBondContact O-N 2.77Å; M501-W505 HydrophobicContact CG-CB 4.1Å; M501-W505 HydrophobicContact CG-CG 4.24Å; M501-W505 WeakPolarHBondContact O-CB 3.45Å; M501-W505 PolarHBondContact O-N 3.09Å; M501-L506 HydrophobicContact CG-CD1 4.15Å
502	G	86.1	Confident	83.5	Confident	9 Å²	9	58.8 Å²	58.8	9%	0.093	36%	0.36	C	S	.	.	H	α-helix	trans	-51.2	-56.1	-175.5	0	0	0	0	0	114.1	L506 D507 C508	G502-L506 CarbonylContact O-C 3.52Å; G502-L506 WeakPolarHBondContact O-CA 3.27Å; G502-L506 PolarHBondContact O-N 2.82Å; G502-D507 PolarHBondContact O-N 3.24Å; G502-C508 VanDerWaalsContact C-CB 3.48Å; G502-C508 WeakPolarHBondContact O-CB 3.42Å; G502-C508 PolarHBondContact O-N 2.91Å; G502-C508 VanDerWaalsContact O-N 3.08Å
503	P	86.8	Confident	81.3	Confident	37 Å²	37	62.7 Å²	62.7	24%	0.24	38%	0.377	C	S	.	.	H	α-helix	trans	-69.7	-31	-179.4	-19.2	32.5	0	0	0	114.1	P500 C508	P500-P503 HydrophobicContact CB-CG 4.37Å; P500-P503 HydrophobicContact CG-CG 4.39Å; P503-C508 WeakPolarHBondContact CA-O 3.27Å
504	N	85.8	Confident	78.6	Confident	82 Å²	82	64.2 Å²	64.2	44%	0.439	40%	0.395	S	S	.	.	H	α-helix	trans	-90.7	-22.7	-171.9	-65.9	0.2	0	0	0	113.2	Y483 P500 M501	Y483-N504 HydrophobicContact CE1-CB 3.98Å; Y483-N504 PolarHBondContact OH-ND2 3.32Å; P500-N504 WeakPolarHBondContact O-CB 3.37Å; P500-N504 PolarHBondContact O-ND2 2.79Å; M501-N504 PolarHBondContact O-N 2.77Å
505	W	84.9	Confident	76.1	Confident	27 Å²	27	67.7 Å²	67.7	10%	0.102	42%	0.422	C	S	.	.	H	α-helix	trans	-125	-24.8	-175.8	-69.3	80.5	0	0	0	114.3	T331 F333 L342 Y476 F478 Y483 M501	T331-W505 HydrophobicContact CG2-CE3 4.35Å; T331-W505 HydrophobicContact CG2-CZ3 3.88Å; F333-W505 HydrophobicContact CE2-CE3 4.09Å; F333-W505 HydrophobicContact CZ-CB 3.91Å; F333-W505 HydrophobicContact CZ-CD2 4.02Å; F333-W505 AromaticContact CZ-CE3 3.62Å; F333-W505 HydrophobicContact CZ-CE3 3.62Å; F333-W505 HydrophobicContact CZ-CG 4.19Å; F333-W505 HydrophobicContact CZ-CZ3 4.42Å; L342-W505 HydrophobicContact CD2-CB 4.48Å; L342-W505 HydrophobicContact CD2-CE3 3.95Å; L342-W505 WeakPolarHBondContact CD2-O 3.46Å; Y476-W505 HydrophobicContact CD1-CH2 4.37Å; Y476-W505 AromaticContact CD1-CZ2 3.58Å; Y476-W505 HydrophobicContact CD1-CZ2 3.58Å; Y476-W505 HydrophobicContact CD2-CH2 4.28Å; Y476-W505 HydrophobicContact CD2-CZ2 4.28Å; Y476-W505 HydrophobicContact CE1-CH2 4.38Å; Y476-W505 AromaticContact CE1-CZ2 3.61Å; Y476-W505 HydrophobicContact CE1-CZ2 3.61Å; Y476-W505 HydrophobicContact CE2-CH2 4.34Å; Y476-W505 HydrophobicContact CE2-CZ2 4.34Å; Y476-W505 HydrophobicContact CG-CH2 4.3Å; Y476-W505 AromaticContact CG-CZ2 3.91Å; Y476-W505 HydrophobicContact CG-CZ2 3.91Å; F478-W505 HydrophobicContact CE1-CZ2 4.48Å; F478-W505 HydrophobicContact CZ-CH2 4.41Å; F478-W505 HydrophobicContact CZ-CZ2 4.23Å; Y483-W505 AromaticContact CD1-CD1 3.82Å; Y483-W505 AromaticContact CD1-NE1 3.51Å; Y483-W505 AromaticContact CE1-CD1 3.57Å; Y483-W505 AromaticContact CE1-NE1 3.31Å; Y483-W505 VanDerWaalsContact CE1-NE1 3.31Å; Y483-W505 AromaticContact CG-NE1 3.96Å; Y483-W505 AromaticContact CZ-NE1 3.59Å; M501-W505 HydrophobicContact CG-CB 4.1Å; M501-W505 HydrophobicContact CG-CG 4.24Å; M501-W505 WeakPolarHBondContact O-CB 3.45Å; M501-W505 PolarHBondContact O-N 3.09Å
506	L	83.3	Confident	73.8	Confident	0 Å²	0	73 Å²	73	0%	0	42%	0.424	C	S	.	.	S	Bend	trans	-124.8	16.2	-164.5	-62.6	164.2	0	0	0	113.1	R316 F321 F333 L342 M501 G502 C508	R316-L506 WeakPolarHBondContact CD-O 3.44Å; R316-L506 HydrophobicContact CG-CB 4.41Å; R316-L506 PolarHBondContact NE-O 3.14Å; F321-L506 HydrophobicContact CE2-CD1 3.3Å; F321-L506 HydrophobicContact CZ-CD1 3.38Å; F321-L506 HydrophobicContact CZ-CD2 4.34Å; F333-L506 HydrophobicContact CD1-CD1 4.41Å; F333-L506 HydrophobicContact CD1-CD2 4.16Å; F333-L506 HydrophobicContact CD2-CD2 3.9Å; F333-L506 HydrophobicContact CE1-CD1 4.48Å; F333-L506 HydrophobicContact CE1-CD2 4.36Å; F333-L506 HydrophobicContact CE2-CD2 4.11Å; F333-L506 HydrophobicContact CG-CD2 3.93Å; F333-L506 HydrophobicContact CZ-CD2 4.34Å; L342-L506 HydrophobicContact CD1-CD2 4.28Å; M501-L506 HydrophobicContact CG-CD1 4.15Å; G502-L506 CarbonylContact O-C 3.52Å; G502-L506 WeakPolarHBondContact O-CA 3.27Å; G502-L506 PolarHBondContact O-N 2.82Å; L506-C508 PolarHBondContact O-N 2.94Å; L506-C508 VanDerWaalsContact O-N 3.16Å
507	D	81.5	Confident	71.4	Confident	96 Å²	96	72.3 Å²	72.3	51%	0.513	43%	0.43	S	S	.	.			trans	49.5	41.1	-179.3	-63.3	-29.8	0	0	0	112.3	R316 L348 G502	R316-D507 PolarHBondContact NH2-O 3.19Å; L348-D507 WeakPolarHBondContact CB-OD2 3.06Å; G502-D507 PolarHBondContact O-N 3.24Å
508	C	84.3	Confident	68.9	Low	14 Å²	14	76.9 Å²	76.9	10%	0.095	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-89.7	151.3	174.1	-63.1	0	0	0	0	110.7	C317 G502 P503 L506 A510	C317-C508 WeakPolarHBondContact CA-SG 3.19Å; C317-C508 HydrophobicContact CB-CB 3.89Å; C317-C508 WeakPolarHBondContact CB-SG 3.46Å; C317-C508 WeakPolarHBondContact SG-CB 3.49Å; C317-C508 CovalentContact SG-SG 2.04Å; C317-C508 PolarHBondContact SG-SG 3.42Å; G502-C508 VanDerWaalsContact C-CB 3.48Å; G502-C508 WeakPolarHBondContact O-CB 3.42Å; G502-C508 PolarHBondContact O-N 2.91Å; G502-C508 VanDerWaalsContact O-N 3.08Å; P503-C508 WeakPolarHBondContact CA-O 3.27Å; L506-C508 PolarHBondContact O-N 2.94Å; L506-C508 VanDerWaalsContact O-N 3.16Å; C508-A510 PolarHBondContact O-N 2.98Å
509	P	79.7	Confident	66.1	Low	109 Å²	109	85 Å²	85	71%	0.708	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-58.9	141.7	173.1	23.6	-31.5	0	0	0	110.4
510	A	70.7	Confident	63.4	Low	79 Å²	79	88 Å²	88	65%	0.653	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-53.7	134.5	173.5	0	0	0	0	0	109.5	C508 S512	C508-A510 PolarHBondContact O-N 2.98Å; A510-S512 PolarHBondContact O-N 3.02Å
511	P	58.7	Low	60.8	Low	69 Å²	69	92.2 Å²	92.2	45%	0.448	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-55.7	129.4	177.9	21.4	-31.1	0	0	0	108.7	F513	P511-F513 HydrophobicContact CB-CD2 4.01Å; P511-F513 HydrophobicContact CB-CE2 4.24Å; P511-F513 HydrophobicContact CG-CD2 4.49Å; P511-F513 PolarHBondContact O-N 3.1Å
512	S	46.2	Very low	58.2	Low	125 Å²	125	101.9 Å²	101.9	87%	0.874	57%	0.573	S	S	*	*			trans	-74.3	59.8	-176.1	53.5	0	0	0	0	111.8	A510 G514	A510-S512 PolarHBondContact O-N 3.02Å; S512-G514 PolarHBondContact O-N 2.88Å; S512-G514 VanDerWaalsContact O-N 3.09Å
513	F	44.6	Very low	55.7	Low	190 Å²	190	106.4 Å²	106.4	83%	0.833	61%	0.61	S	S	*	*			trans	-82.5	76.8	163	-74.3	-76	0	0	0	109.1	P511	P511-F513 HydrophobicContact CB-CD2 4.01Å; P511-F513 HydrophobicContact CB-CE2 4.24Å; P511-F513 HydrophobicContact CG-CD2 4.49Å; P511-F513 PolarHBondContact O-N 3.1Å
514	G	35.2	Very low	53.3	Low	55 Å²	55	110.8 Å²	110.8	57%	0.567	64%	0.636	S	S	*	*			trans	-70.2	131.7	152.5	0	0	0	0	0	108	S512 R516	S512-G514 PolarHBondContact O-N 2.88Å; S512-G514 VanDerWaalsContact O-N 3.09Å; G514-R516 PolarHBondContact O-N 2.77Å
515	P	39.8	Very low	51.1	Low	123 Å²	123	112.8 Å²	112.8	80%	0.799	65%	0.653	S	S	*	*			trans	-59.3	115.9	167.5	24.4	-29.6	0	0	0	106.9	A517	P515-A517 PolarHBondContact O-N 3.02Å
516	R	38.5	Very low	48.7	Very low	251 Å²	251	120.2 Å²	120.2	95%	0.947	69%	0.689	S	S	*	*			trans	-68.2	76.3	162.4	-89.4	-175.3	174.7	-177.5	0.1	107.4	G514 P518	G514-R516 PolarHBondContact O-N 2.77Å; R516-P518 WeakPolarHBondContact O-CD 3.45Å
517	A	37.3	Very low	46.4	Very low	75 Å²	75	125 Å²	125	62%	0.62	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-64.9	122.5	153.8	0	0	0	0	0	106.2	P515 R519	P515-A517 PolarHBondContact O-N 3.02Å; A517-R519 PolarHBondContact O-N 2.76Å; A517-R519 VanDerWaalsContact O-N 3.1Å
518	P	37.1	Very low	44	Very low	123 Å²	123	132.5 Å²	132.5	80%	0.799	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-55.7	121.1	169.5	-16.4	28.2	0	0	0	107.3	R516	R516-P518 WeakPolarHBondContact O-CD 3.45Å
519	R	33.3	Very low	41.7	Very low	234 Å²	234	138 Å²	138	88%	0.883	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-60.1	127.1	173	-77	-179.4	-179.7	179.4	0.1	107.6	A517	A517-R519 PolarHBondContact O-N 2.76Å; A517-R519 VanDerWaalsContact O-N 3.1Å
520	P	37	Very low	39.4	Very low	112 Å²	112	138 Å²	138	73%	0.727	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-63.1	136.4	170	26.4	-30	0	0	0	107.8	K522	P520-K522 PolarHBondContact O-N 3.45Å
521	P	35.7	Very low	37.6	Very low	125 Å²	125	141.3 Å²	141.3	81%	0.812	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-61.8	138.1	179.4	23.4	-29.9	0	0	0	110	A523	P521-A523 PolarHBondContact O-N 3.43Å
522	K	35.8	Very low	36.2	Very low	204 Å²	204	144.2 Å²	144.2	89%	0.887	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-57.1	131.2	177.4	-82.4	178.1	172.5	-179.4	0	110.2	P520 T524	P520-K522 PolarHBondContact O-N 3.45Å; K522-T524 PolarHBondContact O-N 3.47Å
523	A	33.6	Very low	35.5	Very low	104 Å²	104	147.2 Å²	147.2	86%	0.86	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-63.5	127.5	170.8	0	0	0	0	0	111.1	P521	P521-A523 PolarHBondContact O-N 3.43Å
524	T	36.7	Very low	34.8	Very low	130 Å²	130	144.3 Å²	144.3	80%	0.798	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-98.7	146.6	159.5	32.5	0	0	0	0	109.8	K522	K522-T524 PolarHBondContact O-N 3.47Å
525	P	39.3	Very low	34.6	Very low	123 Å²	123	150.9 Å²	150.9	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-83.1	138.3	-176.6	8.7	8.2	0	0	0	113.3
526	E	35.3	Very low	34.2	Very low	183 Å²	183	152.3 Å²	152.3	86%	0.855	82%	0.824	S	S	*	*			trans	66.2	105.5	151.5	-68	-171.6	169.5	0	0	123
527	S	34.4	Very low	34	Very low	102 Å²	102	146.9 Å²	146.9	71%	0.713	81%	0.813	S	S	*	*				50.7	105.1	125.1	75.2	0	0	0	0	119.6
528	R	31.1	Very low	33.8	Very low	252 Å²	252	152 Å²	152	95%	0.951	82%	0.824	S	S	*	*				-140.5	134.3	124.8	-72.9	-162	177.4	178.2	-2	110.2
529	V	35.9	Very low	33.4	Very low	130 Å²	130	151 Å²	151	79%	0.788	83%	0.826	S	S	*	*			trans	-62.9	138.3	177.5	176.1	0	0	0	0	110.2
530	C	30.6	Very low	33.3	Very low	110 Å²	110	144.5 Å²	144.5	74%	0.743	82%	0.823	S	S	*	*				178.9	124.6	122.1	-91.3	0	0	0	0	113
531	D	32.4	Very low	33	Very low	148 Å²	148	142.7 Å²	142.7	79%	0.791	83%	0.825	S	S	*	*			trans	50.5	112.2	140.9	-66	-26.3	0	0	0	121.6
532	C	30.1	Very low	32.8	Very low	129 Å²	129	148.9 Å²	148.9	87%	0.872	83%	0.832	S	S	*	*			trans	-77.7	118.4	157.4	-64	0	0	0	0	109.6
533	Q	30.9	Very low	32.7	Very low	189 Å²	189	150.7 Å²	150.7	88%	0.883	83%	0.834	S	S	*	*			trans	-122.5	117.5	148.5	-84.7	-174.7	-30.8	0	0	108.9
534	C	31.3	Very low	32.8	Very low	128 Å²	128	152 Å²	152	87%	0.865	83%	0.833	S	S	*	*			trans	-79.4	126.2	165.3	-74.1	0	0	0	0	108.5
535	E	30.6	Very low	32.8	Very low	194 Å²	194	150.4 Å²	150.4	91%	0.907	83%	0.833	S	S	*	*			trans	-123.7	123.4	152.9	-80.3	-163.4	155.5	0	0	110
536	L	31.4	Very low	32.8	Very low	152 Å²	152	150.6 Å²	150.6	80%	0.796	83%	0.834	S	S	*	*			trans	-77.2	139.4	171.1	-94.5	141.9	0	0	0	110.1
537	N	34.7	Very low	32.7	Very low	137 Å²	137	149.7 Å²	149.7	73%	0.733	83%	0.834	S	S	*	*			trans	70.6	119.5	156.4	-58.7	-27.3	0	0	0	118.9
538	Q	32.1	Very low	32.9	Very low	182 Å²	182	150.7 Å²	150.7	85%	0.85	84%	0.839	S	S	*	*				170.5	137.9	98.9	-87	-177.2	31	0	0	112.7
539	A	28.3	Very low	33.1	Very low	102 Å²	102	146.3 Å²	146.3	84%	0.843	83%	0.833	S	S	*	*			trans	61	146.1	149.6	0	0	0	0	0	119.7
540	A	31.1	Very low	32.9	Very low	98 Å²	98	148.5 Å²	148.5	81%	0.81	84%	0.84	S	S	*	*			cis	-165.7	149.2	-4	0	0	0	0	0	109.2
541	G	32.3	Very low	33.1	Very low	75 Å²	75	150.9 Å²	150.9	77%	0.773	84%	0.844	S	S	*	*			trans	53.6	113.3	141.8	0	0	0	0	0	121.8
542	R	30.7	Very low	33.2	Very low	254 Å²	254	151.6 Å²	151.6	96%	0.958	85%	0.847	S	S	*	*				-165.5	123.9	122.6	-106.5	167.6	-175.2	-165.4	1.3	111.5
543	R	34.6	Very low	34	Very low	243 Å²	243	151 Å²	151	92%	0.917	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-79.2	152.1	173.8	-74	-179.8	174.2	-177.4	-2.1	111
544	P	35.9	Very low	34.2	Very low	130 Å²	130	149.8 Å²	149.8	84%	0.844	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-82.3	147	177.7	33.1	-32	0	0	0	112.4
545	A	35.2	Very low	34.5	Very low	98 Å²	98	151.8 Å²	151.8	81%	0.81	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-83.2	151.8	176.5	0	0	0	0	0	112.2
546	P	39.8	Very low	34.8	Very low	126 Å²	126	148.1 Å²	148.1	82%	0.818	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-96.6	153	-172.8	36.5	-30.7	0	0	0	114.3
547	L	33.8	Very low	35.1	Very low	164 Å²	164	152.6 Å²	152.6	86%	0.859	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-74.2	147.6	170.9	-80.4	134.8	0	0	0	112
548	P	38.8	Very low	35.4	Very low	123 Å²	123	152.2 Å²	152.2	80%	0.799	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-89.5	134.3	179.5	33.8	-29.5	0	0	0	112.6
549	L	33.8	Very low	35.9	Very low	161 Å²	161	149.9 Å²	149.9	84%	0.843	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-83.2	134	165.9	-96.9	113.9	0	0	0	110.5
550	L	33.5	Very low	36.4	Very low	175 Å²	175	149.9 Å²	149.9	92%	0.916	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-83.9	126.2	166.1	-82.2	154.1	0	0	0	109.7
551	L	34.8	Very low	36.8	Very low	160 Å²	160	150.4 Å²	150.4	84%	0.838	84%	0.836	S	S	*	*			trans	-125.9	124.8	170	-86.8	163	0	0	0	109.5
552	L	34.3	Very low	37.1	Very low	163 Å²	163	161.8 Å²	161.8	85%	0.853	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-71.7	148.4	167.2	-90.7	92.4	0	0	0	111
553	P	45.9	Very low	37.4	Very low	117 Å²	117	157.2 Å²	157.2	76%	0.76	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-95.1	131.2	166	33.6	-25.6	0	0	0	112.1
554	L	35.9	Very low	37.6	Very low	164 Å²	164	152.7 Å²	152.7	86%	0.859	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-76	133.4	159.1	-97.5	92.9	0	0	0	109.7
555	L	37.4	Very low	37.7	Very low	169 Å²	169	153.9 Å²	153.9	89%	0.885	85%	0.847	S	S	*	*			trans	-106.9	120.3	164	-94.3	158.2	0	0	0	108.8
556	V	36.3	Very low	37.8	Very low	117 Å²	117	157.2 Å²	157.2	71%	0.709	85%	0.85	S	S	*	*			trans	-121.4	126.4	163.5	175.4	0	0	0	0	107.4
557	R	38.9	Very low	37.7	Very low	247 Å²	247	159.2 Å²	159.2	93%	0.932	85%	0.852	S	S	*	*			trans	-120.6	137.1	162.1	-101.3	-172	173.4	-170.7	-1.3	108.8
558	V	40.9	Very low	38	Very low	129 Å²	129	158.9 Å²	158.9	78%	0.782	85%	0.851	S	S	*	*			trans	-88.9	139.8	-174.9	171	0	0	0	0	111.5
559	V	41.3	Very low	37.9	Very low	133 Å²	133	161.4 Å²	161.4	81%	0.806	86%	0.855	S	S	*	*			trans	-8	138.6	155.7	-176	0	0	0	0	119.8
560	A	38.6	Very low	38.2	Very low	101 Å²	101	161.5 Å²	161.5	84%	0.835	86%	0.856	S	S	*	*			trans	-160.1	125.8	136.2	0	0	0	0	0	114.1
561	S	40	Very low	38.6	Very low	109 Å²	109	160.3 Å²	160.3	76%	0.762	85%	0.851	S	S	*	*			trans	-17.1	129.3	159.5	-161	0	0	0	0	120.4
562	R	39.4	Very low	39	Very low	315 Å²	315	160.4 Å²	160.4	100%	1.189	85%	0.852	S	S	*	*				177.8	0	101	-98.7	-170.4	-176.8	-168.8	1.4	111.4

Retrieved 562 of 562 residues in 181.6 ms (Link to these results)

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