A0A096MMK1_PAPAN Loading...

Kelch-like protein 3

AlphaFold DB (A0A0D9RLK8), UniProt , Accession A0A096MMK1, Species PAPAN (Papio anubis, Olive baboon), Gene KLHL3, Length 587 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	32.6	Very low	30.1	Very low	233 Å²	233	157.9 Å²	157.9	100%	1.148	86%	0.861	S	S	*	*				0	112.3	0	-91.5	178.4	-91.4	0	0	106.2
2	E	28.5	Very low	30.1	Very low	197 Å²	197	155.5 Å²	155.5	92%	0.921	86%	0.855	S	S	*	*			trans	38.3	123.4	147.4	-63	167.7	170.7	0	0	117.4
3	G	26.6	Very low	30.2	Very low	69 Å²	69	155.8 Å²	155.8	71%	0.711	85%	0.853	S	S	*	*			cis	133.4	132.6	24.3	0	0	0	0	0	106.9
4	E	29.4	Very low	30.5	Very low	194 Å²	194	155.7 Å²	155.7	91%	0.907	85%	0.849	S	S	*	*			trans	154.7	98.1	140.6	-85.5	-175.7	166.4	0	0	111.1
5	S	29	Very low	30.8	Very low	123 Å²	123	158.5 Å²	158.5	86%	0.86	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-88.1	126.8	166.6	-53.4	0	0	0	0	109.2	K7	S5-K7 PolarHBondContact O-N 3.18Å
6	I	30.3	Very low	31.1	Very low	160 Å²	160	154.6 Å²	154.6	82%	0.821	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-67.6	117	177.8	-62.4	165.5	0	0	0	109.3	L8	I6-L8 HydrophobicContact CG2-CD1 4.45Å
7	K	30.8	Very low	31.2	Very low	200 Å²	200	150.2 Å²	150.2	87%	0.87	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-92.6	116.2	167.9	-86.2	-178.2	175	178.4	0	109.5	S5	S5-K7 PolarHBondContact O-N 3.18Å
8	L	30	Very low	31.8	Very low	166 Å²	166	150.9 Å²	150.9	87%	0.869	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-75.1	121.9	159	-94.4	86	0	0	0	108.8	I6	I6-L8 HydrophobicContact CG2-CD1 4.45Å
9	S	29.8	Very low	32.1	Very low	104 Å²	104	151.8 Å²	151.8	73%	0.727	85%	0.853	S	S	*	*			trans	-115.6	108.8	164.9	58.7	0	0	0	0	109.2	Q11	S9-Q11 PolarHBondContact O-N 3.04Å
10	S	30.7	Very low	33.1	Very low	118 Å²	118	153.6 Å²	153.6	83%	0.825	85%	0.854	S	S	*	*			trans	-79.4	108.8	166.2	40.7	0	0	0	0	109.1
11	Q	33.4	Very low	33.8	Very low	173 Å²	173	156 Å²	156	81%	0.808	86%	0.855	S	S	*	*			trans	-97.2	109.9	167.1	-82.5	-177.5	-18.4	0	0	108.9	S9 L13	S9-Q11 PolarHBondContact O-N 3.04Å; Q11-L13 PolarHBondContact O-N 3.14Å
12	T	30.2	Very low	34.2	Very low	129 Å²	129	151.4 Å²	151.4	79%	0.791	84%	0.836	S	S	*	*			trans	-83.2	107	169.3	-40.7	0	0	0	0	108.3
13	L	31.2	Very low	35.4	Very low	159 Å²	159	151.5 Å²	151.5	83%	0.832	84%	0.836	S	S	*	*			trans	-82.5	112.8	171.6	-87.8	146.9	0	0	0	109.3	Q11	Q11-L13 PolarHBondContact O-N 3.14Å
14	I	34	Very low	36.8	Very low	155 Å²	155	158 Å²	158	80%	0.795	84%	0.839	S	S	*	*			trans	-99	117	164.1	-60.9	176	0	0	0	107
15	Q	35.7	Very low	38	Very low	197 Å²	197	154.8 Å²	154.8	92%	0.921	83%	0.833	S	S	*	*			trans	-70.4	132.1	171.5	-89.5	176.7	-27	0	0	110.6
16	A	34.8	Very low	39.8	Very low	97 Å²	97	155.8 Å²	155.8	80%	0.802	83%	0.827	S	S	*	*			trans	-132.8	134.8	160.4	0	0	0	0	0	108.7
17	G	33.6	Very low	41.8	Very low	80 Å²	80	154.2 Å²	154.2	83%	0.825	83%	0.825	S	S	*	*			trans	-73.8	163.9	-177	0	0	0	0	0	114.5
18	D	41.4	Very low	43.8	Very low	162 Å²	162	149.9 Å²	149.9	87%	0.866	82%	0.815	S	S	*	*			trans	-57.5	133.5	-177.8	-82.5	-36.9	0	0	0	114.5
19	D	38.4	Very low	46.1	Very low	169 Å²	169	146.4 Å²	146.4	90%	0.904	80%	0.797	S	S	*	*			trans	-161.8	122.4	134.5	-99.7	-26.9	0	0	0	110.3
20	E	52.1	Low	48.2	Very low	187 Å²	187	147 Å²	147	87%	0.874	80%	0.798	S	S	*	*			trans	-73	119.7	-177.6	-73.2	-176.1	138.1	0	0	113.3
21	K	46.8	Very low	50.5	Low	204 Å²	204	143.6 Å²	143.6	89%	0.887	78%	0.778	S	S	*	*	S	Bend	trans	170.1	97.9	132.1	-96.4	170.9	-176.9	174	0	113.4
22	N	42.4	Very low	52.8	Low	137 Å²	137	141.3 Å²	141.3	73%	0.733	77%	0.767	S	S	*	*			trans	138.9	88.3	153.2	-94.4	-23.1	0	0	0	108.2	R24	N22-R24 PolarHBondContact O-N 3.38Å
23	Q	52.8	Low	55.2	Low	199 Å²	199	141.4 Å²	141.4	93%	0.93	76%	0.76	S	S	*	*			trans	-69.9	78.6	168.5	-80.7	178.5	-11.3	0	0	109.4
24	R	56.4	Low	57.6	Low	206 Å²	206	136.2 Å²	136.2	78%	0.777	75%	0.745	S	S	*	*			trans	-86	103	158.9	-74.4	-178.1	178.7	175.9	-0.2	106.9	N22 I26	N22-R24 PolarHBondContact O-N 3.38Å; R24-I26 PolarHBondContact O-N 3.14Å
25	T	54.3	Low	59.9	Low	126 Å²	126	135.8 Å²	135.8	77%	0.773	74%	0.737	S	S	*	*			trans	-75.5	93.4	170.3	-16.5	0	0	0	0	108	T27	T25-T27 PolarHBondContact O-N 3.43Å
26	I	66.3	Low	62.2	Low	143 Å²	143	128.2 Å²	128.2	73%	0.733	71%	0.708	S	S	*	*			trans	-73.1	108.5	172.9	-59.3	175.2	0	0	0	106.9	R24 V28	R24-I26 PolarHBondContact O-N 3.14Å; I26-V28 HydrophobicContact CG2-CG2 4Å
27	T	72.6	Confident	64.6	Low	128 Å²	128	126.9 Å²	126.9	79%	0.785	68%	0.684	S	S	*	*			trans	-94.7	107.1	177.6	-41.4	0	0	0	0	108.2	T25	T25-T27 PolarHBondContact O-N 3.43Å
28	V	72.8	Confident	67.1	Low	108 Å²	108	129.7 Å²	129.7	66%	0.655	67%	0.674	S	S	*	*			trans	-95.6	114.6	175.7	-176.5	0	0	0	0	108.2	I26 P30	I26-V28 HydrophobicContact CG2-CG2 4Å; V28-P30 VanDerWaalsContact O-CD 3.22Å; V28-P30 WeakPolarHBondContact O-CD 3.43Å
29	N	79	Confident	69.2	Low	94 Å²	94	125.8 Å²	125.8	50%	0.503	66%	0.656	S	S	.	*			trans	-94.8	102.2	172.8	-176.8	-9.9	0	0	0	109.7	A31 H32	N29-A31 PolarHBondContact O-N 3.07Å; N29-A31 WeakPolarHBondContact OD1-CB 3.49Å; N29-A31 PolarHBondContact OD1-N 3.37Å; N29-H32 HydrophobicContact CB-CB 4.17Å; N29-H32 WeakPolarHBondContact O-CB 3.38Å; N29-H32 PolarHBondContact O-N 3.22Å; N29-H32 VanDerWaalsContact O-N 3.14Å
30	P	73.7	Confident	71.5	Confident	115 Å²	115	120.3 Å²	120.3	75%	0.747	63%	0.626	S	S	*	*	H	α-helix	trans	-64.4	-22	-177.5	25.1	-33.3	0	0	0	113.1	V28	V28-P30 VanDerWaalsContact O-CD 3.22Å; V28-P30 WeakPolarHBondContact O-CD 3.43Å
31	A	78.4	Confident	73.2	Confident	47 Å²	47	113 Å²	113	39%	0.388	59%	0.593	S	S	.	*	H	α-helix	trans	-84.5	-9.8	179.3	0	0	0	0	0	113.8	N29 K35	N29-A31 PolarHBondContact O-N 3.07Å; N29-A31 WeakPolarHBondContact OD1-CB 3.49Å; N29-A31 PolarHBondContact OD1-N 3.37Å; A31-K35 WeakPolarHBondContact O-CG 3.4Å; A31-K35 PolarHBondContact O-N 2.94Å; A31-K35 VanDerWaalsContact O-N 3.14Å
32	H	82.6	Confident	75.1	Confident	126 Å²	126	107.8 Å²	107.8	58%	0.583	57%	0.571	S	S	*	*	H	α-helix	trans	-64.3	-46	-177.5	179.6	-95.7	0	0	0	111.8	N29 K35 A36	N29-H32 HydrophobicContact CB-CB 4.17Å; N29-H32 WeakPolarHBondContact O-CB 3.38Å; N29-H32 PolarHBondContact O-N 3.22Å; N29-H32 VanDerWaalsContact O-N 3.14Å; H32-K35 PolarHBondContact O-N 3.16Å; H32-A36 PolarHBondContact O-N 3.43Å
33	M	80.9	Confident	77.2	Confident	131 Å²	131	103.6 Å²	103.6	65%	0.645	55%	0.548	S	S	*	.	H	α-helix	trans	-64.5	-48.4	-178.3	-58.3	179	-162.5	0	0	111.1	K35 A36 F37	M33-K35 VanDerWaalsContact C-N 3.35Å; M33-K35 PolarHBondContact O-N 3.14Å; M33-A36 PolarHBondContact O-N 3.04Å; M33-A36 VanDerWaalsContact O-N 3.16Å; M33-F37 WeakPolarHBondContact O-CD2 3.5Å; M33-F37 PolarHBondContact O-N 2.88Å
34	G	80.2	Confident	78.8	Confident	50 Å²	50	95.4 Å²	95.4	52%	0.515	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-39	178	0	0	0	0	0	113.6	K38	G34-K38 WeakPolarHBondContact O-CB 3.44Å; G34-K38 PolarHBondContact O-N 3.05Å
35	K	82.2	Confident	80.2	Confident	146 Å²	146	90 Å²	90	64%	0.635	50%	0.503	S	S	*	.	H	α-helix	trans	-65.2	-40.5	174.6	-74.4	-179.3	-172.1	-175.2	0	112.3	A31 H32 M33 K38 V39	A31-K35 WeakPolarHBondContact O-CG 3.4Å; A31-K35 PolarHBondContact O-N 2.94Å; A31-K35 VanDerWaalsContact O-N 3.14Å; H32-K35 PolarHBondContact O-N 3.16Å; M33-K35 VanDerWaalsContact C-N 3.35Å; M33-K35 PolarHBondContact O-N 3.14Å; K35-K38 PolarHBondContact O-N 3.43Å; K35-V39 WeakPolarHBondContact O-CG2 3.35Å; K35-V39 PolarHBondContact O-N 3.47Å; K35-V39 VanDerWaalsContact O-N 3.14Å
36	A	84.7	Confident	81.7	Confident	38 Å²	38	90.6 Å²	90.6	31%	0.314	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-46.2	177.8	0	0	0	0	0	111.6	H32 M33 K38 V39 M40	H32-A36 PolarHBondContact O-N 3.43Å; M33-A36 PolarHBondContact O-N 3.04Å; M33-A36 VanDerWaalsContact O-N 3.16Å; A36-K38 VanDerWaalsContact C-N 3.32Å; A36-K38 PolarHBondContact O-N 3.31Å; A36-V39 PolarHBondContact O-N 3.02Å; A36-M40 HydrophobicContact CB-CE 4.28Å; A36-M40 WeakPolarHBondContact O-CG 3.43Å; A36-M40 PolarHBondContact O-N 3.43Å
37	F	85.8	Confident	82.6	Confident	68 Å²	68	90.1 Å²	90.1	30%	0.298	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-37.5	176.3	-88.6	-88.4	0	0	0	112.8	M33 V39 M40 N41 V67	M33-F37 WeakPolarHBondContact O-CD2 3.5Å; M33-F37 PolarHBondContact O-N 2.88Å; F37-V39 PolarHBondContact O-N 2.97Å; F37-M40 HydrophobicContact CB-CE 4.41Å; F37-M40 HydrophobicContact CD1-CE 4.03Å; F37-M40 HydrophobicContact CD2-CE 3.92Å; F37-M40 HydrophobicContact CE1-CE 4.27Å; F37-M40 HydrophobicContact CE2-CE 4.15Å; F37-M40 HydrophobicContact CG-CE 3.85Å; F37-M40 HydrophobicContact CZ-CE 4.33Å; F37-M40 PolarHBondContact O-N 3.42Å; F37-N41 PolarHBondContact O-N 3.18Å; F37-V67 HydrophobicContact CE1-CG1 3.99Å
38	K	85.6	Confident	82.9	Confident	139 Å²	139	88.3 Å²	88.3	60%	0.604	47%	0.474	S	S	*	.	H	α-helix	trans	-60.2	-45.2	173.5	-170.7	172.8	-178.4	172.5	0	112.4	G34 K35 A36 N41 E42	G34-K38 WeakPolarHBondContact O-CB 3.44Å; G34-K38 PolarHBondContact O-N 3.05Å; K35-K38 PolarHBondContact O-N 3.43Å; A36-K38 VanDerWaalsContact C-N 3.32Å; A36-K38 PolarHBondContact O-N 3.31Å; K38-N41 PolarHBondContact O-N 3.44Å; K38-E42 WeakPolarHBondContact O-CG 3.34Å; K38-E42 PolarHBondContact O-N 3.22Å
39	V	85.4	Confident	83.4	Confident	80 Å²	80	89.9 Å²	89.9	49%	0.485	48%	0.478	S	S	.	.	H	α-helix	trans	-64.6	-40.3	175.6	174.9	0	0	0	0	111.1	K35 A36 F37 N41 E42 L43	K35-V39 WeakPolarHBondContact O-CG2 3.35Å; K35-V39 PolarHBondContact O-N 3.47Å; K35-V39 VanDerWaalsContact O-N 3.14Å; A36-V39 PolarHBondContact O-N 3.02Å; F37-V39 PolarHBondContact O-N 2.97Å; V39-N41 VanDerWaalsContact C-N 3.31Å; V39-N41 PolarHBondContact O-N 3.39Å; V39-E42 PolarHBondContact O-N 3.24Å; V39-L43 HydrophobicContact CG1-CD1 4.29Å; V39-L43 WeakPolarHBondContact O-CG 3.27Å; V39-L43 PolarHBondContact O-N 3.33Å
40	M	87.1	Confident	83.6	Confident	55 Å²	55	86.5 Å²	86.5	27%	0.271	46%	0.462	S	S	.	.	H	α-helix	trans	-62.8	-36.7	176	-71	-173.7	-81.1	0	0	112.3	A36 F37 L43 R44 V67 Y109	A36-M40 HydrophobicContact CB-CE 4.28Å; A36-M40 WeakPolarHBondContact O-CG 3.43Å; A36-M40 PolarHBondContact O-N 3.43Å; F37-M40 HydrophobicContact CB-CE 4.41Å; F37-M40 HydrophobicContact CD1-CE 4.03Å; F37-M40 HydrophobicContact CD2-CE 3.92Å; F37-M40 HydrophobicContact CE1-CE 4.27Å; F37-M40 HydrophobicContact CE2-CE 4.15Å; F37-M40 HydrophobicContact CG-CE 3.85Å; F37-M40 HydrophobicContact CZ-CE 4.33Å; F37-M40 PolarHBondContact O-N 3.42Å; M40-L43 PolarHBondContact O-N 3.18Å; M40-R44 PolarHBondContact O-N 2.97Å; M40-V67 HydrophobicContact SD-CG2 3.8Å; M40-Y109 HydrophobicContact CB-CD1 4.39Å; M40-Y109 HydrophobicContact CB-CE1 4.34Å
41	N	87.1	Confident	84.3	Confident	34 Å²	34	84.3 Å²	84.3	18%	0.182	44%	0.444	C	S	.	.	H	α-helix	trans	-67.4	-41.9	173.6	-165.3	30.2	0	0	0	112	F37 K38 V39 L43 R44 S45 Y109	F37-N41 PolarHBondContact O-N 3.18Å; K38-N41 PolarHBondContact O-N 3.44Å; V39-N41 VanDerWaalsContact C-N 3.31Å; V39-N41 PolarHBondContact O-N 3.39Å; N41-L43 VanDerWaalsContact C-N 3.29Å; N41-L43 PolarHBondContact O-N 3.27Å; N41-R44 WeakPolarHBondContact O-CB 3.38Å; N41-R44 PolarHBondContact O-N 3.18Å; N41-R44 PolarHBondContact OD1-NE 3.23Å; N41-R44 PolarHBondContact OD1-NH2 3.3Å; N41-S45 PolarHBondContact O-N 3.06Å; N41-S45 PolarHBondContact O-OG 3.26Å; N41-Y109 HydrophobicContact CB-CD1 4.17Å; N41-Y109 HydrophobicContact CB-CG 4.48Å
42	E	86.6	Confident	84.7	Confident	93 Å²	93	82.3 Å²	82.3	44%	0.435	43%	0.427	S	S	.	.	H	α-helix	trans	-62	-36.1	175	-72.6	177.5	-165.2	0	0	112.6	K38 V39 K46	K38-E42 WeakPolarHBondContact O-CG 3.34Å; K38-E42 PolarHBondContact O-N 3.22Å; V39-E42 PolarHBondContact O-N 3.24Å; E42-K46 WeakPolarHBondContact O-CG 3.22Å; E42-K46 PolarHBondContact O-N 2.98Å
43	L	86.4	Confident	85	Confident	49 Å²	49	78.3 Å²	78.3	26%	0.257	41%	0.409	S	S	.	.	H	α-helix	trans	-66.4	-42	174	-70.5	171.6	0	0	0	111.4	V39 M40 N41 K46 Q47 L48 L49	V39-L43 HydrophobicContact CG1-CD1 4.29Å; V39-L43 WeakPolarHBondContact O-CG 3.27Å; V39-L43 PolarHBondContact O-N 3.33Å; M40-L43 PolarHBondContact O-N 3.18Å; N41-L43 VanDerWaalsContact C-N 3.29Å; N41-L43 PolarHBondContact O-N 3.27Å; L43-K46 CarbonylContact O-C 3.54Å; L43-K46 PolarHBondContact O-N 3.12Å; L43-Q47 PolarHBondContact O-N 3.19Å; L43-Q47 VanDerWaalsContact O-N 3.12Å; L43-L48 HydrophobicContact CD2-CB 4.02Å; L43-L48 HydrophobicContact CD2-CD1 4.26Å; L43-L48 PolarHBondContact O-N 3.04Å; L43-L49 HydrophobicContact CD1-CD1 4.43Å
44	R	87.6	Confident	85.3	Confident	28 Å²	28	72.1 Å²	72.1	11%	0.106	38%	0.378	C	S	.	.	H	α-helix	trans	-58.6	-48.8	174	-174.9	-174.5	64.5	129.1	-1	111.5	M40 N41 K46 Q47 E62 D106 Y109	M40-R44 PolarHBondContact O-N 2.97Å; N41-R44 WeakPolarHBondContact O-CB 3.38Å; N41-R44 PolarHBondContact O-N 3.18Å; N41-R44 PolarHBondContact OD1-NE 3.23Å; N41-R44 PolarHBondContact OD1-NH2 3.3Å; R44-K46 PolarHBondContact O-N 3.18Å; R44-Q47 PolarHBondContact O-N 3Å; R44-E62 VanDerWaalsContact CG-O 3.28Å; R44-E62 WeakPolarHBondContact CG-O 3.24Å; R44-D106 IonicContact CZ-OD1 3.16Å; R44-D106 IonicContact NH1-OD1 2.75Å; R44-D106 PolarHBondContact NH1-OD1 2.96Å; R44-D106 IonicContact NH2-OD1 2.67Å; R44-D106 PolarHBondContact NH2-OD1 2.78Å; R44-Y109 HydrophobicContact CB-CE1 4.32Å
45	S	85	Confident	85.7	Confident	92 Å²	92	70.3 Å²	70.3	64%	0.643	36%	0.357	S	S	*	.	H	α-helix	trans	-62.1	-24.8	178.9	-57	0	0	0	0	113.6	N41	N41-S45 PolarHBondContact O-N 3.06Å; N41-S45 PolarHBondContact O-OG 3.26Å
46	K	85.8	Confident	85.9	Confident	138 Å²	138	63.4 Å²	63.4	60%	0.6	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	1.7	175.8	-68.1	175.2	-176.1	168.6	0	113.4	E42 L43 R44 L48	E42-K46 WeakPolarHBondContact O-CG 3.22Å; E42-K46 PolarHBondContact O-N 2.98Å; L43-K46 CarbonylContact O-C 3.54Å; L43-K46 PolarHBondContact O-N 3.12Å; R44-K46 PolarHBondContact O-N 3.18Å; K46-L48 HydrophobicContact CB-CD1 3.81Å; K46-L48 HydrophobicContact CB-CG 3.9Å; K46-L48 HydrophobicContact CD-CD1 4.15Å; K46-L48 PolarHBondContact O-N 2.74Å
47	Q	85	Confident	85.8	Confident	134 Å²	134	67.9 Å²	67.9	63%	0.626	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	34.1	-175.9	-62	178.7	-19.2	0	0	112.8	L43 R44 E62	L43-Q47 PolarHBondContact O-N 3.19Å; L43-Q47 VanDerWaalsContact O-N 3.12Å; R44-Q47 PolarHBondContact O-N 3Å; Q47-E62 VanDerWaalsContact CB-OE2 3.24Å; Q47-E62 WeakPolarHBondContact CB-OE2 3.42Å; Q47-E62 VanDerWaalsContact CG-OE2 3.27Å; Q47-E62 WeakPolarHBondContact CG-OE2 3.49Å
48	L	78.8	Confident	85.7	Confident	89 Å²	89	72.4 Å²	72.4	47%	0.466	37%	0.369	S	S	.	.			trans	-101.1	127.5	-179.6	-68	173.1	0	0	0	109.5	L43 K46 C50 H64	L43-L48 HydrophobicContact CD2-CB 4.02Å; L43-L48 HydrophobicContact CD2-CD1 4.26Å; L43-L48 PolarHBondContact O-N 3.04Å; K46-L48 HydrophobicContact CB-CD1 3.81Å; K46-L48 HydrophobicContact CB-CG 3.9Å; K46-L48 HydrophobicContact CD-CD1 4.15Å; K46-L48 PolarHBondContact O-N 2.74Å; L48-C50 PolarHBondContact O-N 2.85Å; L48-H64 PolarHBondContact O-NE2 3.27Å
49	L	83.3	Confident	85.8	Confident	141 Å²	141	68.1 Å²	68.1	74%	0.738	36%	0.355	S	S	*	.	S	Bend	trans	66.7	11	179.9	-51.4	173.2	0	0	0	115.3	L43 D51 H64	L43-L49 HydrophobicContact CD1-CD1 4.43Å; L49-D51 PolarHBondContact O-N 3.18Å; L49-H64 PolarHBondContact O-CD2 2.98Å
50	C	84.3	Confident	86	Confident	23 Å²	23	69.6 Å²	69.6	16%	0.155	36%	0.356	C	S	.	.			trans	-65.2	126.2	171.7	-60.5	0	0	0	0	111	L48 E62	L48-C50 PolarHBondContact O-N 2.85Å; C50-E62 HydrophobicContact CB-CB 3.97Å
51	D	87.4	Confident	86	Confident	70 Å²	70	67.7 Å²	67.7	37%	0.374	35%	0.347	S	S	.	.			trans	-115.1	-1.9	-175.6	61.9	-7.6	0	0	0	113.1	L49 A63 H64 R65	L49-D51 PolarHBondContact O-N 3.18Å; D51-A63 PolarHBondContact N-O 3.14Å; D51-H64 VanDerWaalsContact OD1-CA 3.26Å; D51-H64 WeakPolarHBondContact OD1-CA 3.22Å; D51-R65 WeakPolarHBondContact OD1-CG 3.26Å; D51-R65 PolarHBondContact OD1-N 2.92Å
52	V	87.4	Confident	86.1	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	146.5	174.2	65.7	0	0	0	0	111.8	I54 A63 R65 L68 F79 I91	V52-I54 HydrophobicContact CG2-CD1 3.79Å; V52-A63 HydrophobicContact CG1-CB 4.22Å; V52-A63 WeakPolarHBondContact CG1-O 3.4Å; V52-A63 PolarHBondContact N-O 3.44Å; V52-A63 PolarHBondContact O-N 3.47Å; V52-R65 HydrophobicContact CB-CG 3.72Å; V52-R65 HydrophobicContact CG1-CG 3.68Å; V52-L68 HydrophobicContact CG1-CD1 4.19Å; V52-F79 HydrophobicContact CG1-CZ 4.46Å; V52-F79 HydrophobicContact CG2-CE1 4.4Å; V52-F79 HydrophobicContact CG2-CZ 4.43Å; V52-I91 HydrophobicContact CG2-CD1 3.85Å; V52-I91 HydrophobicContact CG2-CG1 4.34Å
53	M	88.4	Confident	86.3	Confident	43 Å²	43	64.3 Å²	64.3	21%	0.212	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	118.1	169.3	-178.9	-179.7	-76.6	0	0	108.5	V55 E60 I61 E62 K89 K90 I91	M53-V55 HydrophobicContact CG-CG2 4.2Å; M53-E60 HydrophobicContact CG-CB 4.39Å; M53-E60 HydrophobicContact SD-CB 4.24Å; M53-I61 CarbonylContact C-O 3.59Å; M53-I61 WeakPolarHBondContact CA-O 3.28Å; M53-E62 HydrophobicContact CE-CG 4.01Å; M53-K89 PolarHBondContact N-O 3.25Å; M53-K90 CarbonylContact O-C 3.58Å; M53-K90 WeakPolarHBondContact O-CA 3.42Å; M53-K90 HydrophobicContact SD-CG 4.46Å; M53-I91 PolarHBondContact O-N 3.23Å
54	I	88.4	Confident	86.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.3	175.1	-52.1	-61.8	0	0	0	108	V52 I61 L68 F75 I91 I93 L101 I105	V52-I54 HydrophobicContact CG2-CD1 3.79Å; I54-I61 PolarHBondContact N-O 3.34Å; I54-I61 PolarHBondContact O-N 3Å; I54-L68 HydrophobicContact CD1-CD1 4.35Å; I54-L68 HydrophobicContact CG1-CD1 4.13Å; I54-F75 HydrophobicContact CD1-CE1 4.26Å; I54-I91 CarbonylContact C-O 3.57Å; I54-I91 WeakPolarHBondContact CA-O 3.38Å; I54-I91 HydrophobicContact CD1-CB 4.15Å; I54-I91 HydrophobicContact CD1-CD1 4.49Å; I54-I93 HydrophobicContact CG2-CD1 3.57Å; I54-I93 HydrophobicContact CG2-CG1 3.85Å; I54-L101 HydrophobicContact CG2-CD2 3.68Å; I54-I105 HydrophobicContact CB-CD1 4.34Å; I54-I105 HydrophobicContact CG1-CD1 4.45Å
55	V	86.8	Confident	86.6	Confident	13 Å²	13	63.6 Å²	63.6	8%	0.079	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.1	178.2	-178.7	0	0	0	0	109.5	M53 V59 E60 K90 I91 E92 I93	M53-V55 HydrophobicContact CG-CG2 4.2Å; V55-V59 WeakPolarHBondContact CA-O 3.39Å; V55-E60 HydrophobicContact CG1-CG 4.41Å; V55-E60 HydrophobicContact CG2-CB 4.27Å; V55-E60 HydrophobicContact CG2-CG 3.84Å; V55-K90 HydrophobicContact CG2-CD 4.28Å; V55-K90 HydrophobicContact CG2-CG 3.97Å; V55-I91 PolarHBondContact N-O 3.16Å; V55-E92 CarbonylContact O-C 3.46Å; V55-E92 VanDerWaalsContact O-CA 3.3Å; V55-E92 WeakPolarHBondContact O-CA 3.44Å; V55-I93 PolarHBondContact O-N 3.38Å
56	A	86.4	Confident	86.7	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	123.5	166.1	0	0	0	0	0	107.6	D58 V59 L101	A56-D58 PolarHBondContact O-N 2.67Å; A56-V59 PolarHBondContact N-O 3.5Å; A56-V59 VanDerWaalsContact N-O 3.17Å; A56-V59 PolarHBondContact O-N 2.75Å; A56-L101 HydrophobicContact CB-CB 4.27Å; A56-L101 HydrophobicContact CB-CD2 3.42Å; A56-L101 VanDerWaalsContact CB-CD2 3.42Å; A56-L101 HydrophobicContact CB-CG 4.5Å
57	E	84.3	Confident	86.8	Confident	131 Å²	131	57.8 Å²	57.8	61%	0.612	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	-119.3	-173.1	-57.4	177.7	147.2	0	0	111.4	G98	E57-G98 PolarHBondContact OE2-N 2.99Å
58	D	81.9	Confident	87	Confident	164 Å²	164	51.4 Å²	51.4	88%	0.877	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	4	-179.1	-65.5	-38.5	0	0	0	113.6	A56	A56-D58 PolarHBondContact O-N 2.67Å
59	V	87.8	Confident	87.4	Confident	49 Å²	49	48.2 Å²	48.2	30%	0.297	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.4	-175.3	-174.4	0	0	0	0	110.7	V55 A56 I61	V55-V59 WeakPolarHBondContact CA-O 3.39Å; A56-V59 PolarHBondContact N-O 3.5Å; A56-V59 VanDerWaalsContact N-O 3.17Å; A56-V59 PolarHBondContact O-N 2.75Å; V59-I61 HydrophobicContact CG1-CD1 4.12Å; V59-I61 HydrophobicContact CG1-CG1 3.88Å
60	E	89.5	Confident	87.6	Confident	111 Å²	111	45.3 Å²	45.3	52%	0.519	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.1	175.6	-56.1	-167	151.2	0	0	110.9	M53 V55 K90	M53-E60 HydrophobicContact CG-CB 4.39Å; M53-E60 HydrophobicContact SD-CB 4.24Å; V55-E60 HydrophobicContact CG1-CG 4.41Å; V55-E60 HydrophobicContact CG2-CB 4.27Å; V55-E60 HydrophobicContact CG2-CG 3.84Å; E60-K90 WeakPolarHBondContact OE1-CE 3.29Å; E60-K90 IonicContact OE1-NZ 2.65Å; E60-K90 PolarHBondContact OE1-NZ 3.15Å
61	I	88.4	Confident	87.7	Confident	15 Å²	15	46.6 Å²	46.6	8%	0.077	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	118.6	-174.6	-53.1	168	0	0	0	109.6	M53 I54 V59 L101 I105	M53-I61 CarbonylContact C-O 3.59Å; M53-I61 WeakPolarHBondContact CA-O 3.28Å; I54-I61 PolarHBondContact N-O 3.34Å; I54-I61 PolarHBondContact O-N 3Å; V59-I61 HydrophobicContact CG1-CD1 4.12Å; V59-I61 HydrophobicContact CG1-CG1 3.88Å; I61-L101 HydrophobicContact CD1-CG 4.33Å; I61-I105 HydrophobicContact CB-CD1 4.19Å; I61-I105 HydrophobicContact CD1-CD1 3.86Å; I61-I105 HydrophobicContact CG2-CD1 3.89Å; I61-I105 HydrophobicContact CG2-CG2 4.17Å
62	E	89.6	Confident	87.8	Confident	55 Å²	55	43.3 Å²	43.3	26%	0.257	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	136.2	171.7	-64.3	-157.2	161.8	0	0	111.6	R44 Q47 C50 M53	R44-E62 VanDerWaalsContact CG-O 3.28Å; R44-E62 WeakPolarHBondContact CG-O 3.24Å; Q47-E62 VanDerWaalsContact CB-OE2 3.24Å; Q47-E62 WeakPolarHBondContact CB-OE2 3.42Å; Q47-E62 VanDerWaalsContact CG-OE2 3.27Å; Q47-E62 WeakPolarHBondContact CG-OE2 3.49Å; C50-E62 HydrophobicContact CB-CB 3.97Å; M53-E62 HydrophobicContact CE-CG 4.01Å
63	A	90.4	Very high	87.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	173.8	-177.3	0	0	0	0	0	112.4	D51 V52 L68	D51-A63 PolarHBondContact N-O 3.14Å; V52-A63 HydrophobicContact CG1-CB 4.22Å; V52-A63 WeakPolarHBondContact CG1-O 3.4Å; V52-A63 PolarHBondContact N-O 3.44Å; V52-A63 PolarHBondContact O-N 3.47Å; A63-L68 HydrophobicContact CB-CD1 3.79Å; A63-L68 HydrophobicContact CB-CG 4.23Å
64	H	91.1	Very high	87.9	Confident	18 Å²	18	47.5 Å²	47.5	8%	0.083	26%	0.263	C	S	.	.			trans	-102.5	123.1	173.9	-52.4	90.4	0	0	0	110.4	L48 L49 D51 V66 V67 L68 Y109	L48-H64 PolarHBondContact O-NE2 3.27Å; L49-H64 PolarHBondContact O-CD2 2.98Å; D51-H64 VanDerWaalsContact OD1-CA 3.26Å; D51-H64 WeakPolarHBondContact OD1-CA 3.22Å; H64-V66 VanDerWaalsContact C-N 3.26Å; H64-V66 HydrophobicContact CB-CG1 4.4Å; H64-V66 PolarHBondContact O-N 3.48Å; H64-V67 HydrophobicContact CB-CB 4.22Å; H64-V67 HydrophobicContact CB-CG2 3.85Å; H64-V67 PolarHBondContact O-N 3.36Å; H64-V67 VanDerWaalsContact O-N 3.14Å; H64-L68 PolarHBondContact O-N 2.69Å; H64-L68 VanDerWaalsContact O-N 3.14Å; H64-Y109 WeakPolarHBondContact CB-OH 3.27Å; H64-Y109 PolarHBondContact N-OH 3.29Å; H64-Y109 AromaticContact ND1-CE1 3.75Å; H64-Y109 AromaticContact ND1-CZ 3.8Å; H64-Y109 PolarHBondContact ND1-OH 3.14Å
65	R	88.4	Confident	87.9	Confident	44 Å²	44	47.5 Å²	47.5	17%	0.166	26%	0.263	C	S	.	.	H	α-helix	trans	-54.3	-42.2	178.5	-72.6	169.1	158.8	-115.6	-3.2	112.3	D51 V52 V67 L68 A69 F79 E85 S86 A88	D51-R65 WeakPolarHBondContact OD1-CG 3.26Å; D51-R65 PolarHBondContact OD1-N 2.92Å; V52-R65 HydrophobicContact CB-CG 3.72Å; V52-R65 HydrophobicContact CG1-CG 3.68Å; R65-V67 VanDerWaalsContact C-N 3.34Å; R65-V67 PolarHBondContact O-N 2.77Å; R65-L68 PolarHBondContact O-N 3.32Å; R65-A69 VanDerWaalsContact O-CB 3.24Å; R65-A69 WeakPolarHBondContact O-CB 3.32Å; R65-A69 PolarHBondContact O-N 2.85Å; R65-F79 HydrophobicContact CB-CD2 3.97Å; R65-F79 HydrophobicContact CB-CE2 4.11Å; R65-F79 HydrophobicContact CB-CG 4.37Å; R65-F79 HydrophobicContact CG-CD1 4.33Å; R65-F79 HydrophobicContact CG-CD2 4.22Å; R65-F79 HydrophobicContact CG-CE1 4.24Å; R65-F79 HydrophobicContact CG-CE2 4.13Å; R65-F79 HydrophobicContact CG-CG 4.34Å; R65-F79 HydrophobicContact CG-CZ 4.15Å; R65-E85 PolarHBondContact NH2-O 3.34Å; R65-S86 VanDerWaalsContact CZ-O 3.3Å; R65-S86 PolarHBondContact NH1-O 3.03Å; R65-S86 PolarHBondContact NH2-O 2.81Å; R65-A88 PolarHBondContact NH2-O 2.71Å
66	V	87.4	Confident	87.8	Confident	104 Å²	104	49.1 Å²	49.1	63%	0.63	28%	0.275	S	S	*	.	H	α-helix	trans	-63.9	-38.2	-178.8	69.3	0	0	0	0	112.4	H64 A70	H64-V66 VanDerWaalsContact C-N 3.26Å; H64-V66 HydrophobicContact CB-CG1 4.4Å; H64-V66 PolarHBondContact O-N 3.48Å; V66-A70 VanDerWaalsContact O-CB 3.22Å; V66-A70 WeakPolarHBondContact O-CB 3.44Å; V66-A70 PolarHBondContact O-N 3.27Å
67	V	88.1	Confident	87.8	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.03	30%	0.297	C	S	.	.	H	α-helix	trans	-72.7	-44.7	-179	-179.6	0	0	0	0	110.1	F37 M40 H64 R65 A70 C71 I108 Y109	F37-V67 HydrophobicContact CE1-CG1 3.99Å; M40-V67 HydrophobicContact SD-CG2 3.8Å; H64-V67 HydrophobicContact CB-CB 4.22Å; H64-V67 HydrophobicContact CB-CG2 3.85Å; H64-V67 PolarHBondContact O-N 3.36Å; H64-V67 VanDerWaalsContact O-N 3.14Å; R65-V67 VanDerWaalsContact C-N 3.34Å; R65-V67 PolarHBondContact O-N 2.77Å; V67-A70 PolarHBondContact O-N 2.87Å; V67-C71 PolarHBondContact O-N 3.13Å; V67-C71 PolarHBondContact O-SG 3.11Å; V67-C71 VanDerWaalsContact O-SG 3.34Å; V67-I108 HydrophobicContact CG1-CG2 3.82Å; V67-Y109 HydrophobicContact CB-CE1 4.14Å; V67-Y109 HydrophobicContact CG1-CD1 4.14Å; V67-Y109 HydrophobicContact CG1-CD2 4.43Å; V67-Y109 HydrophobicContact CG1-CE1 3.75Å; V67-Y109 HydrophobicContact CG1-CE2 4.04Å; V67-Y109 HydrophobicContact CG1-CG 4.47Å; V67-Y109 HydrophobicContact CG2-CE1 4.1Å
68	L	88.4	Confident	87.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.1	-46.5	175.8	-69.1	-179.9	0	0	0	111.8	V52 I54 A63 H64 R65 A70 C71 S72 F75 F79 I105 I108	V52-L68 HydrophobicContact CG1-CD1 4.19Å; I54-L68 HydrophobicContact CD1-CD1 4.35Å; I54-L68 HydrophobicContact CG1-CD1 4.13Å; A63-L68 HydrophobicContact CB-CD1 3.79Å; A63-L68 HydrophobicContact CB-CG 4.23Å; H64-L68 PolarHBondContact O-N 2.69Å; H64-L68 VanDerWaalsContact O-N 3.14Å; R65-L68 PolarHBondContact O-N 3.32Å; L68-A70 VanDerWaalsContact C-N 3.33Å; L68-A70 PolarHBondContact O-N 3.16Å; L68-C71 PolarHBondContact O-N 3.34Å; L68-S72 WeakPolarHBondContact O-CB 3.41Å; L68-S72 PolarHBondContact O-N 3.07Å; L68-F75 HydrophobicContact CB-CB 3.99Å; L68-F75 HydrophobicContact CB-CD2 3.91Å; L68-F75 HydrophobicContact CB-CG 3.97Å; L68-F75 HydrophobicContact CD2-CD2 4.16Å; L68-F75 HydrophobicContact CD2-CE2 4.11Å; L68-F75 HydrophobicContact CG-CD2 4.44Å; L68-F79 HydrophobicContact CB-CE2 3.87Å; L68-F79 HydrophobicContact CD1-CE2 4.19Å; L68-F79 HydrophobicContact CD1-CZ 4.23Å; L68-I105 HydrophobicContact CD2-CG1 4.38Å; L68-I105 HydrophobicContact CD2-CG2 4.48Å; L68-I108 HydrophobicContact CD2-CD1 3.61Å; L68-I108 HydrophobicContact CD2-CG2 4.26Å
69	A	87.8	Confident	87.9	Confident	22 Å²	22	40 Å²	40	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-36.6	177.1	0	0	0	0	0	113.1	R65 C71 C76 F79	R65-A69 VanDerWaalsContact O-CB 3.24Å; R65-A69 WeakPolarHBondContact O-CB 3.32Å; R65-A69 PolarHBondContact O-N 2.85Å; A69-C71 VanDerWaalsContact C-N 3.31Å; A69-C71 PolarHBondContact O-N 3.44Å; A69-C76 HydrophobicContact CB-CB 4.2Å; A69-C76 WeakPolarHBondContact O-CB 3.41Å; A69-F79 HydrophobicContact CB-CD2 4.16Å
70	A	87.3	Confident	87.6	Confident	79 Å²	79	42.7 Å²	42.7	65%	0.653	25%	0.253	S	S	*	.	H	α-helix	trans	-68.1	-32.1	-179.3	0	0	0	0	0	112.7	V66 V67 L68	V66-A70 VanDerWaalsContact O-CB 3.22Å; V66-A70 WeakPolarHBondContact O-CB 3.44Å; V66-A70 PolarHBondContact O-N 3.27Å; V67-A70 PolarHBondContact O-N 2.87Å; L68-A70 VanDerWaalsContact C-N 3.33Å; L68-A70 PolarHBondContact O-N 3.16Å
71	C	86.8	Confident	86.9	Confident	50 Å²	50	38.5 Å²	38.5	34%	0.338	24%	0.239	S	C	.	.	H	α-helix	trans	-104.5	-15.5	-172.6	-53	0	0	0	0	113.8	V67 L68 A69 I108 L132	V67-C71 PolarHBondContact O-N 3.13Å; V67-C71 PolarHBondContact O-SG 3.11Å; V67-C71 VanDerWaalsContact O-SG 3.34Å; L68-C71 PolarHBondContact O-N 3.34Å; A69-C71 VanDerWaalsContact C-N 3.31Å; A69-C71 PolarHBondContact O-N 3.44Å; C71-I108 HydrophobicContact CB-CG1 4.26Å; C71-I108 HydrophobicContact CB-CG2 3.81Å; C71-L132 WeakPolarHBondContact O-CD2 3.38Å
72	S	90.4	Very high	85.8	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.007	28%	0.281	C	S	.	.			trans	-131.9	118.6	-179.8	166.1	0	0	0	0	110.3	L68 Y74 F75 C76 L130	L68-S72 WeakPolarHBondContact O-CB 3.41Å; L68-S72 PolarHBondContact O-N 3.07Å; S72-Y74 PolarHBondContact O-N 3.36Å; S72-Y74 PolarHBondContact OG-N 2.88Å; S72-F75 PolarHBondContact O-N 2.81Å; S72-F75 WeakPolarHBondContact OG-CD2 3.45Å; S72-F75 PolarHBondContact OG-N 3.43Å; S72-C76 PolarHBondContact O-N 3.27Å; S72-L130 PolarHBondContact OG-O 2.86Å
73	P	88.6	Confident	84.9	Confident	71 Å²	71	48.9 Å²	48.9	46%	0.461	30%	0.295	S	S	.	.	H	α-helix	trans	-64	-27.9	176	-15.3	25.6	0	0	0	112.8	C76 A77 Q131	P73-C76 WeakPolarHBondContact O-CB 3.43Å; P73-C76 PolarHBondContact O-N 3.42Å; P73-A77 WeakPolarHBondContact O-CB 3.41Å; P73-A77 PolarHBondContact O-N 3.17Å; P73-Q131 HydrophobicContact CG-CB 4.3Å
74	Y	88.9	Confident	83.6	Confident	65 Å²	65	53.5 Å²	53.5	26%	0.255	33%	0.327	S	S	.	.	H	α-helix	trans	-59.9	-52	172.6	176.2	-97.4	0	0	0	111.4	S72 C76 A77 M78 L130	S72-Y74 PolarHBondContact O-N 3.36Å; S72-Y74 PolarHBondContact OG-N 2.88Å; Y74-C76 VanDerWaalsContact C-N 3.33Å; Y74-C76 PolarHBondContact O-N 2.84Å; Y74-A77 PolarHBondContact O-N 2.65Å; Y74-M78 HydrophobicContact CD1-CE 4.26Å; Y74-M78 HydrophobicContact CE1-CE 3.34Å; Y74-M78 HydrophobicContact CE2-CE 4.45Å; Y74-M78 VanDerWaalsContact CZ-CE 3.45Å; Y74-M78 WeakPolarHBondContact O-CB 3.35Å; Y74-M78 PolarHBondContact O-N 2.84Å; Y74-M78 VanDerWaalsContact OH-CE 3.29Å; Y74-M78 WeakPolarHBondContact OH-CE 3.44Å; Y74-L130 HydrophobicContact CD1-CD2 3.6Å; Y74-L130 HydrophobicContact CE1-CD2 3.82Å; Y74-L130 HydrophobicContact CG-CD2 4.4Å
75	F	87.9	Confident	82.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-66.9	-34.8	176.2	-72.7	-54.6	0	0	0	112.4	I54 L68 S72 M78 F79 I93 I108 L130	I54-F75 HydrophobicContact CD1-CE1 4.26Å; L68-F75 HydrophobicContact CB-CB 3.99Å; L68-F75 HydrophobicContact CB-CD2 3.91Å; L68-F75 HydrophobicContact CB-CG 3.97Å; L68-F75 HydrophobicContact CD2-CD2 4.16Å; L68-F75 HydrophobicContact CD2-CE2 4.11Å; L68-F75 HydrophobicContact CG-CD2 4.44Å; S72-F75 PolarHBondContact O-N 2.81Å; S72-F75 WeakPolarHBondContact OG-CD2 3.45Å; S72-F75 PolarHBondContact OG-N 3.43Å; F75-M78 HydrophobicContact CD1-SD 4.33Å; F75-M78 PolarHBondContact O-N 3.35Å; F75-F79 HydrophobicContact CB-CD2 4.18Å; F75-F79 HydrophobicContact CB-CE2 3.8Å; F75-F79 HydrophobicContact CB-CZ 4.47Å; F75-F79 HydrophobicContact CD1-CE2 4.11Å; F75-F79 AromaticContact CD1-CZ 3.96Å; F75-F79 HydrophobicContact CD1-CZ 3.96Å; F75-F79 HydrophobicContact CG-CE2 4.22Å; F75-F79 WeakPolarHBondContact O-CB 3.41Å; F75-F79 WeakPolarHBondContact O-CD2 3.39Å; F75-F79 VanDerWaalsContact O-CG 3.29Å; F75-F79 WeakPolarHBondContact O-CG 3.24Å; F75-F79 PolarHBondContact O-N 3.28Å; F75-I93 HydrophobicContact CE1-CD1 3.81Å; F75-I93 HydrophobicContact CZ-CD1 3.74Å; F75-I108 HydrophobicContact CE2-CD1 4.4Å; F75-L130 HydrophobicContact CE1-CD2 4.45Å; F75-L130 HydrophobicContact CE2-CD1 4.2Å; F75-L130 HydrophobicContact CE2-CD2 3.9Å; F75-L130 HydrophobicContact CZ-CD1 4.43Å; F75-L130 HydrophobicContact CZ-CD2 3.73Å
76	C	85.6	Confident	81.4	Confident	47 Å²	47	55.2 Å²	55.2	32%	0.318	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-50.6	174	-169.8	0	0	0	0	111	A69 S72 P73 Y74 M78 F79 T80	A69-C76 HydrophobicContact CB-CB 4.2Å; A69-C76 WeakPolarHBondContact O-CB 3.41Å; S72-C76 PolarHBondContact O-N 3.27Å; P73-C76 WeakPolarHBondContact O-CB 3.43Å; P73-C76 PolarHBondContact O-N 3.42Å; Y74-C76 VanDerWaalsContact C-N 3.33Å; Y74-C76 PolarHBondContact O-N 2.84Å; C76-M78 VanDerWaalsContact C-N 3.33Å; C76-M78 PolarHBondContact O-N 2.85Å; C76-F79 PolarHBondContact O-N 2.91Å; C76-T80 WeakPolarHBondContact O-CB 3.33Å; C76-T80 WeakPolarHBondContact O-CG2 3.34Å; C76-T80 PolarHBondContact O-N 3.37Å; C76-T80 PolarHBondContact O-OG1 3.47Å
77	A	84.8	Confident	80.5	Confident	57 Å²	57	59.3 Å²	59.3	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-62.3	-40.9	178.3	0	0	0	0	0	111.8	P73 Y74 G81	P73-A77 WeakPolarHBondContact O-CB 3.41Å; P73-A77 PolarHBondContact O-N 3.17Å; Y74-A77 PolarHBondContact O-N 2.65Å; A77-G81 PolarHBondContact O-N 3.47Å
78	M	84.9	Confident	80	Confident	22 Å²	22	60.6 Å²	60.6	11%	0.108	36%	0.36	C	S	.	.	H	α-helix	trans	-63.6	-42.1	177.9	-175.7	-176.8	-72.5	0	0	112.9	Y74 F75 C76 E85 I91	Y74-M78 HydrophobicContact CD1-CE 4.26Å; Y74-M78 HydrophobicContact CE1-CE 3.34Å; Y74-M78 HydrophobicContact CE2-CE 4.45Å; Y74-M78 VanDerWaalsContact CZ-CE 3.45Å; Y74-M78 WeakPolarHBondContact O-CB 3.35Å; Y74-M78 PolarHBondContact O-N 2.84Å; Y74-M78 VanDerWaalsContact OH-CE 3.29Å; Y74-M78 WeakPolarHBondContact OH-CE 3.44Å; F75-M78 HydrophobicContact CD1-SD 4.33Å; F75-M78 PolarHBondContact O-N 3.35Å; C76-M78 VanDerWaalsContact C-N 3.33Å; C76-M78 PolarHBondContact O-N 2.85Å; M78-E85 HydrophobicContact CG-CB 4.08Å; M78-I91 HydrophobicContact CE-CG2 4.49Å; M78-I91 HydrophobicContact SD-CD1 4.09Å; M78-I91 HydrophobicContact SD-CG2 3.85Å
79	F	84.3	Confident	79.6	Confident	24 Å²	24	68.2 Å²	68.2	11%	0.105	39%	0.393	C	S	.	.	H	α-helix	trans	-86.4	-24.4	-176.2	-61.1	-35	0	0	0	114.3	V52 R65 L68 A69 F75 C76 I91	V52-F79 HydrophobicContact CG1-CZ 4.46Å; V52-F79 HydrophobicContact CG2-CE1 4.4Å; V52-F79 HydrophobicContact CG2-CZ 4.43Å; R65-F79 HydrophobicContact CB-CD2 3.97Å; R65-F79 HydrophobicContact CB-CE2 4.11Å; R65-F79 HydrophobicContact CB-CG 4.37Å; R65-F79 HydrophobicContact CG-CD1 4.33Å; R65-F79 HydrophobicContact CG-CD2 4.22Å; R65-F79 HydrophobicContact CG-CE1 4.24Å; R65-F79 HydrophobicContact CG-CE2 4.13Å; R65-F79 HydrophobicContact CG-CG 4.34Å; R65-F79 HydrophobicContact CG-CZ 4.15Å; L68-F79 HydrophobicContact CB-CE2 3.87Å; L68-F79 HydrophobicContact CD1-CE2 4.19Å; L68-F79 HydrophobicContact CD1-CZ 4.23Å; A69-F79 HydrophobicContact CB-CD2 4.16Å; F75-F79 HydrophobicContact CB-CD2 4.18Å; F75-F79 HydrophobicContact CB-CE2 3.8Å; F75-F79 HydrophobicContact CB-CZ 4.47Å; F75-F79 HydrophobicContact CD1-CE2 4.11Å; F75-F79 AromaticContact CD1-CZ 3.96Å; F75-F79 HydrophobicContact CD1-CZ 3.96Å; F75-F79 HydrophobicContact CG-CE2 4.22Å; F75-F79 WeakPolarHBondContact O-CB 3.41Å; F75-F79 WeakPolarHBondContact O-CD2 3.39Å; F75-F79 VanDerWaalsContact O-CG 3.29Å; F75-F79 WeakPolarHBondContact O-CG 3.24Å; F75-F79 PolarHBondContact O-N 3.28Å; C76-F79 PolarHBondContact O-N 2.91Å; F79-I91 HydrophobicContact CD1-CD1 4.38Å; F79-I91 HydrophobicContact CE1-CD1 3.54Å; F79-I91 HydrophobicContact CZ-CD1 4.43Å
80	T	81.2	Confident	79.5	Confident	106 Å²	106	72.8 Å²	72.8	65%	0.65	41%	0.409	S	S	*	.	H	α-helix	trans	-98.6	-11.6	-179.9	62	0	0	0	0	113.7	C76	C76-T80 WeakPolarHBondContact O-CB 3.33Å; C76-T80 WeakPolarHBondContact O-CG2 3.34Å; C76-T80 PolarHBondContact O-N 3.37Å; C76-T80 PolarHBondContact O-OG1 3.47Å
81	G	75	Confident	79.4	Confident	23 Å²	23	69.3 Å²	69.3	24%	0.237	38%	0.379	C	S	.	.	S	Bend	trans	-80.5	162.3	175.7	0	0	0	0	0	114	A77 M83 S86	A77-G81 PolarHBondContact O-N 3.47Å; G81-M83 PolarHBondContact O-N 3.44Å; G81-S86 WeakPolarHBondContact O-CB 3.45Å; G81-S86 PolarHBondContact O-OG 3.37Å
82	D	65.8	Low	79.3	Confident	177 Å²	177	73.3 Å²	73.3	95%	0.947	39%	0.393	S	S	*	.	S	Bend	trans	-77.9	26.5	177.5	-76.8	-37.5	0	0	0	113.9
83	M	69.6	Low	79.1	Confident	111 Å²	111	73.5 Å²	73.5	55%	0.547	39%	0.394	S	S	.	.	S	Bend	trans	-83.7	161	-179	-58	-174.1	-157.2	0	0	112	G81 E85 S86	G81-M83 PolarHBondContact O-N 3.44Å; M83-E85 WeakPolarHBondContact CB-OE2 3.49Å; M83-E85 PolarHBondContact O-N 2.94Å; M83-S86 VanDerWaalsContact O-CB 3.3Å; M83-S86 WeakPolarHBondContact O-CB 3.16Å; M83-S86 PolarHBondContact O-N 3.34Å; M83-S86 VanDerWaalsContact O-N 3.14Å; M83-S86 PolarHBondContact O-OG 3.14Å
84	S	63.3	Low	78.7	Confident	98 Å²	98	77 Å²	77	69%	0.685	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-56.6	-34.8	176.7	25.9	0	0	0	0	113.6	S86 K87 A88	S84-S86 PolarHBondContact O-N 2.6Å; S84-K87 PolarHBondContact O-N 3.36Å; S84-K87 VanDerWaalsContact O-N 3.16Å; S84-A88 PolarHBondContact O-N 3.25Å
85	E	67.1	Low	78.3	Confident	78 Å²	78	81.9 Å²	81.9	36%	0.364	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-65.3	-28.9	-178.5	-67.5	81.8	168.4	0	0	111.1	R65 M78 M83 K87 A88	R65-E85 PolarHBondContact NH2-O 3.34Å; M78-E85 HydrophobicContact CG-CB 4.08Å; M83-E85 WeakPolarHBondContact CB-OE2 3.49Å; M83-E85 PolarHBondContact O-N 2.94Å; E85-K87 PolarHBondContact O-N 2.97Å; E85-K87 VanDerWaalsContact O-N 3.15Å; E85-A88 PolarHBondContact O-N 2.9Å
86	S	67	Low	78.2	Confident	20 Å²	20	82.3 Å²	82.3	14%	0.14	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-61.2	-24.2	175.4	72.9	0	0	0	0	112.7	R65 G81 M83 S84	R65-S86 VanDerWaalsContact CZ-O 3.3Å; R65-S86 PolarHBondContact NH1-O 3.03Å; R65-S86 PolarHBondContact NH2-O 2.81Å; G81-S86 WeakPolarHBondContact O-CB 3.45Å; G81-S86 PolarHBondContact O-OG 3.37Å; M83-S86 VanDerWaalsContact O-CB 3.3Å; M83-S86 WeakPolarHBondContact O-CB 3.16Å; M83-S86 PolarHBondContact O-N 3.34Å; M83-S86 VanDerWaalsContact O-N 3.14Å; M83-S86 PolarHBondContact O-OG 3.14Å; S84-S86 PolarHBondContact O-N 2.6Å
87	K	68.2	Low	78.2	Confident	189 Å²	189	82.9 Å²	82.9	82%	0.822	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-109.6	-6.8	-179.5	-64	176.4	-172.8	171	0	113.4	S84 E85	S84-K87 PolarHBondContact O-N 3.36Å; S84-K87 VanDerWaalsContact O-N 3.16Å; E85-K87 PolarHBondContact O-N 2.97Å; E85-K87 VanDerWaalsContact O-N 3.15Å
88	A	78.2	Confident	78.3	Confident	32 Å²	32	80.2 Å²	80.2	26%	0.264	41%	0.413	S	S	.	.			trans	-79.6	135.7	-178.9	0	0	0	0	0	111.4	R65 S84 E85 I91	R65-A88 PolarHBondContact NH2-O 2.71Å; S84-A88 PolarHBondContact O-N 3.25Å; E85-A88 PolarHBondContact O-N 2.9Å; A88-I91 HydrophobicContact CB-CG1 4.31Å
89	K	79.3	Confident	78.4	Confident	160 Å²	160	85.9 Å²	85.9	70%	0.696	44%	0.439	S	S	*	.	S	Bend	trans	-79.1	-24.2	173.3	-163.9	177.2	-179.9	-173.7	0	112.1	M53	M53-K89 PolarHBondContact N-O 3.25Å
90	K	85.7	Confident	78.6	Confident	118 Å²	118	85.2 Å²	85.2	51%	0.513	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.5	178.8	-169	175.8	-170.3	171.1	0	109	M53 V55 E60	M53-K90 CarbonylContact O-C 3.58Å; M53-K90 WeakPolarHBondContact O-CA 3.42Å; M53-K90 HydrophobicContact SD-CG 4.46Å; V55-K90 HydrophobicContact CG2-CD 4.28Å; V55-K90 HydrophobicContact CG2-CG 3.97Å; E60-K90 WeakPolarHBondContact OE1-CE 3.29Å; E60-K90 IonicContact OE1-NZ 2.65Å; E60-K90 PolarHBondContact OE1-NZ 3.15Å
91	I	85.6	Confident	79.1	Confident	6 Å²	6	80.2 Å²	80.2	3%	0.031	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	128.2	-177.2	-61.3	173	0	0	0	108.7	V52 M53 I54 V55 M78 F79 A88	V52-I91 HydrophobicContact CG2-CD1 3.85Å; V52-I91 HydrophobicContact CG2-CG1 4.34Å; M53-I91 PolarHBondContact O-N 3.23Å; I54-I91 CarbonylContact C-O 3.57Å; I54-I91 WeakPolarHBondContact CA-O 3.38Å; I54-I91 HydrophobicContact CD1-CB 4.15Å; I54-I91 HydrophobicContact CD1-CD1 4.49Å; V55-I91 PolarHBondContact N-O 3.16Å; M78-I91 HydrophobicContact CE-CG2 4.49Å; M78-I91 HydrophobicContact SD-CD1 4.09Å; M78-I91 HydrophobicContact SD-CG2 3.85Å; F79-I91 HydrophobicContact CD1-CD1 4.38Å; F79-I91 HydrophobicContact CE1-CD1 3.54Å; F79-I91 HydrophobicContact CZ-CD1 4.43Å; A88-I91 HydrophobicContact CB-CG1 4.31Å
92	E	84.9	Confident	79.7	Confident	135 Å²	135	80.9 Å²	80.9	63%	0.631	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	124	178.8	-169.4	-175.3	157.8	0	0	109.8	V55	V55-E92 CarbonylContact O-C 3.46Å; V55-E92 VanDerWaalsContact O-CA 3.3Å; V55-E92 WeakPolarHBondContact O-CA 3.44Å
93	I	85.2	Confident	80.9	Confident	5 Å²	5	76.8 Å²	76.8	3%	0.026	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-98.8	119.2	172.3	-58	-174.8	0	0	0	107.6	I54 V55 F75 V96 L101 L129 L130	I54-I93 HydrophobicContact CG2-CD1 3.57Å; I54-I93 HydrophobicContact CG2-CG1 3.85Å; V55-I93 PolarHBondContact O-N 3.38Å; F75-I93 HydrophobicContact CE1-CD1 3.81Å; F75-I93 HydrophobicContact CZ-CD1 3.74Å; I93-V96 HydrophobicContact CG2-CB 4.32Å; I93-V96 HydrophobicContact CG2-CG2 3.93Å; I93-L101 HydrophobicContact CB-CD2 4.45Å; I93-L101 HydrophobicContact CD1-CD1 4.12Å; I93-L101 HydrophobicContact CD1-CD2 4.05Å; I93-L129 HydrophobicContact CG2-CD2 4.37Å; I93-L130 HydrophobicContact CD1-CD2 4.21Å
94	K	80.9	Confident	81.9	Confident	143 Å²	143	71.5 Å²	71.5	62%	0.622	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-87.2	156	177	-62.3	-177.3	179.4	-179.4	0	110.1	V96	K94-V96 VanDerWaalsContact C-N 3.31Å; K94-V96 PolarHBondContact O-N 3.28Å
95	D	80.4	Confident	83.1	Confident	168 Å²	168	66.8 Å²	66.8	90%	0.898	32%	0.322	S	S	*	.	S	Bend	trans	65.7	25.5	174.7	-48.3	-46.7	0	0	0	115.2
96	V	84.9	Confident	84.2	Confident	9 Å²	9	65.7 Å²	65.7	6%	0.055	32%	0.319	C	S	.	.	S	Bend	trans	-135.4	132.1	174	-176.2	0	0	0	0	110	I93 K94 L101 A126 L129	I93-V96 HydrophobicContact CG2-CB 4.32Å; I93-V96 HydrophobicContact CG2-CG2 3.93Å; K94-V96 VanDerWaalsContact C-N 3.31Å; K94-V96 PolarHBondContact O-N 3.28Å; V96-L101 HydrophobicContact CG1-CB 3.99Å; V96-A126 HydrophobicContact CG1-CB 3.76Å; V96-A126 HydrophobicContact CG2-CB 4.24Å; V96-L129 HydrophobicContact CG2-CD2 3.62Å
97	D	86.1	Confident	85.4	Confident	60 Å²	60	66.4 Å²	66.4	32%	0.321	32%	0.319	S	S	.	.			trans	-64.3	137.3	173.1	166.2	100	0	0	0	111.3	Q99 T100 L101	D97-Q99 VanDerWaalsContact C-N 3.32Å; D97-Q99 PolarHBondContact O-N 2.9Å; D97-Q99 WeakPolarHBondContact OD2-CA 3.3Å; D97-Q99 VanDerWaalsContact OD2-CB 3.31Å; D97-Q99 WeakPolarHBondContact OD2-CB 3.48Å; D97-Q99 PolarHBondContact OD2-N 3.47Å; D97-T100 PolarHBondContact O-N 3.25Å; D97-T100 PolarHBondContact OD2-N 3.05Å; D97-T100 PolarHBondContact OD2-OG1 2.81Å; D97-L101 PolarHBondContact O-N 2.87Å
98	G	85.8	Confident	86.4	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-34.7	-175.1	0	0	0	0	0	114.6	E57 S102	E57-G98 PolarHBondContact OE2-N 2.99Å; G98-S102 PolarHBondContact O-N 3.04Å; G98-S102 VanDerWaalsContact O-N 3.09Å
99	Q	87.9	Confident	86.9	Confident	140 Å²	140	56.5 Å²	56.5	65%	0.654	27%	0.27	S	S	*	.	H	α-helix	trans	-73.2	-39.2	178.1	-56.7	-172.2	3.8	0	0	111.5	D97 L101 S102 K103	D97-Q99 VanDerWaalsContact C-N 3.32Å; D97-Q99 PolarHBondContact O-N 2.9Å; D97-Q99 WeakPolarHBondContact OD2-CA 3.3Å; D97-Q99 VanDerWaalsContact OD2-CB 3.31Å; D97-Q99 WeakPolarHBondContact OD2-CB 3.48Å; D97-Q99 PolarHBondContact OD2-N 3.47Å; Q99-L101 VanDerWaalsContact C-N 3.34Å; Q99-S102 WeakPolarHBondContact O-CB 3.45Å; Q99-S102 PolarHBondContact O-N 3.24Å; Q99-K103 PolarHBondContact O-N 2.98Å
100	T	89.1	Confident	87.2	Confident	10 Å²	10	51.6 Å²	51.6	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-43.5	175.9	-57	0	0	0	0	110.6	D97 S102 K103 L104 V122 L123 A126	D97-T100 PolarHBondContact O-N 3.25Å; D97-T100 PolarHBondContact OD2-N 3.05Å; D97-T100 PolarHBondContact OD2-OG1 2.81Å; T100-S102 VanDerWaalsContact C-N 3.32Å; T100-S102 PolarHBondContact O-N 3.45Å; T100-K103 PolarHBondContact O-N 3.22Å; T100-L104 HydrophobicContact CG2-CD1 4.32Å; T100-L104 WeakPolarHBondContact O-CG 3.41Å; T100-L104 PolarHBondContact O-N 3.31Å; T100-V122 HydrophobicContact CG2-CG2 4.46Å; T100-V122 WeakPolarHBondContact OG1-CG2 3.14Å; T100-L123 HydrophobicContact CG2-CB 4.41Å; T100-L123 HydrophobicContact CG2-CD1 3.89Å; T100-A126 HydrophobicContact CG2-CB 3.85Å
101	L	90.3	Very high	87.2	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-39.8	175.5	-174	61	0	0	0	112	I54 A56 I61 I93 V96 D97 Q99 K103 L104 I105 L130	I54-L101 HydrophobicContact CG2-CD2 3.68Å; A56-L101 HydrophobicContact CB-CB 4.27Å; A56-L101 HydrophobicContact CB-CD2 3.42Å; A56-L101 VanDerWaalsContact CB-CD2 3.42Å; A56-L101 HydrophobicContact CB-CG 4.5Å; I61-L101 HydrophobicContact CD1-CG 4.33Å; I93-L101 HydrophobicContact CB-CD2 4.45Å; I93-L101 HydrophobicContact CD1-CD1 4.12Å; I93-L101 HydrophobicContact CD1-CD2 4.05Å; V96-L101 HydrophobicContact CG1-CB 3.99Å; D97-L101 PolarHBondContact O-N 2.87Å; Q99-L101 VanDerWaalsContact C-N 3.34Å; L101-K103 VanDerWaalsContact C-N 3.35Å; L101-K103 PolarHBondContact O-N 2.88Å; L101-L104 PolarHBondContact O-N 2.85Å; L101-I105 HydrophobicContact CD1-CD1 4.28Å; L101-I105 HydrophobicContact CD1-CG1 4.35Å; L101-I105 HydrophobicContact CG-CD1 4.05Å; L101-I105 HydrophobicContact CG-CG1 4.48Å; L101-I105 WeakPolarHBondContact O-CG1 3.41Å; L101-I105 PolarHBondContact O-N 3.38Å; L101-L130 HydrophobicContact CD1-CD1 3.74Å
102	S	89.1	Confident	87.3	Confident	37 Å²	37	56.7 Å²	56.7	26%	0.259	29%	0.292	S	S	.	.	H	α-helix	trans	-57.7	-47.9	174	-169.6	0	0	0	0	111.6	G98 Q99 T100 L104 I105 D106	G98-S102 PolarHBondContact O-N 3.04Å; G98-S102 VanDerWaalsContact O-N 3.09Å; Q99-S102 WeakPolarHBondContact O-CB 3.45Å; Q99-S102 PolarHBondContact O-N 3.24Å; T100-S102 VanDerWaalsContact C-N 3.32Å; T100-S102 PolarHBondContact O-N 3.45Å; S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact O-N 3.26Å; S102-I105 PolarHBondContact O-N 3.09Å; S102-D106 WeakPolarHBondContact O-CB 3.3Å; S102-D106 PolarHBondContact O-N 2.97Å
103	K	89.8	Confident	87.5	Confident	91 Å²	91	52.4 Å²	52.4	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-39.9	177.9	-70.9	-179.7	177.7	-177.2	0	112.5	Q99 T100 L101 D106 Y107	Q99-K103 PolarHBondContact O-N 2.98Å; T100-K103 PolarHBondContact O-N 3.22Å; L101-K103 VanDerWaalsContact C-N 3.35Å; L101-K103 PolarHBondContact O-N 2.88Å; K103-D106 PolarHBondContact O-N 3.2Å; K103-Y107 WeakPolarHBondContact O-CB 3.37Å; K103-Y107 PolarHBondContact O-N 2.61Å
104	L	90.9	Very high	87.7	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-68	-38.1	177.4	-70	174.1	0	0	0	112.2	T100 L101 S102 Y107 I108 I113 L123 A126 A127 L130 L132 V135	T100-L104 HydrophobicContact CG2-CD1 4.32Å; T100-L104 WeakPolarHBondContact O-CG 3.41Å; T100-L104 PolarHBondContact O-N 3.31Å; L101-L104 PolarHBondContact O-N 2.85Å; S102-L104 VanDerWaalsContact C-N 3.34Å; S102-L104 PolarHBondContact O-N 3.26Å; L104-Y107 WeakPolarHBondContact O-CB 3.31Å; L104-Y107 PolarHBondContact O-N 3.01Å; L104-I108 WeakPolarHBondContact O-CG1 3.22Å; L104-I108 PolarHBondContact O-N 2.9Å; L104-I108 VanDerWaalsContact O-N 3.11Å; L104-I113 HydrophobicContact CD2-CD1 3.96Å; L104-L123 HydrophobicContact CD1-CD1 4.35Å; L104-L123 HydrophobicContact CD2-CD1 3.54Å; L104-L123 HydrophobicContact CG-CD1 3.85Å; L104-A126 HydrophobicContact CD1-CB 3.56Å; L104-A127 HydrophobicContact CD2-CB 4.3Å; L104-L130 HydrophobicContact CB-CD1 4.26Å; L104-L130 HydrophobicContact CD1-CD1 3.87Å; L104-L132 HydrophobicContact CB-CD1 4.22Å; L104-L132 HydrophobicContact CD2-CD1 3.93Å; L104-V135 HydrophobicContact CD2-CG1 3.97Å; L104-V135 HydrophobicContact CD2-CG2 4.42Å
105	I	89.9	Confident	88.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.3	-42	173.2	-66.6	175.6	0	0	0	109.9	I54 I61 L68 L101 S102 Y107 I108 Y109	I54-I105 HydrophobicContact CB-CD1 4.34Å; I54-I105 HydrophobicContact CG1-CD1 4.45Å; I61-I105 HydrophobicContact CB-CD1 4.19Å; I61-I105 HydrophobicContact CD1-CD1 3.86Å; I61-I105 HydrophobicContact CG2-CD1 3.89Å; I61-I105 HydrophobicContact CG2-CG2 4.17Å; L68-I105 HydrophobicContact CD2-CG1 4.38Å; L68-I105 HydrophobicContact CD2-CG2 4.48Å; L101-I105 HydrophobicContact CD1-CD1 4.28Å; L101-I105 HydrophobicContact CD1-CG1 4.35Å; L101-I105 HydrophobicContact CG-CD1 4.05Å; L101-I105 HydrophobicContact CG-CG1 4.48Å; L101-I105 WeakPolarHBondContact O-CG1 3.41Å; L101-I105 PolarHBondContact O-N 3.38Å; S102-I105 PolarHBondContact O-N 3.09Å; I105-Y107 VanDerWaalsContact C-N 3.27Å; I105-Y107 PolarHBondContact O-N 3.36Å; I105-I108 WeakPolarHBondContact O-CB 3.43Å; I105-I108 PolarHBondContact O-N 3.45Å; I105-I108 VanDerWaalsContact O-N 3.07Å; I105-Y109 HydrophobicContact CG2-CD2 4.21Å; I105-Y109 HydrophobicContact CG2-CE2 4.05Å; I105-Y109 VanDerWaalsContact O-CD2 3.32Å; I105-Y109 WeakPolarHBondContact O-CD2 3.47Å; I105-Y109 PolarHBondContact O-N 3.44Å
106	D	89.6	Confident	88.4	Confident	54 Å²	54	47.7 Å²	47.7	29%	0.289	25%	0.253	S	S	.	.	H	α-helix	trans	-58.5	-41.3	174.7	-68.8	-25.5	0	0	0	111.4	R44 S102 K103 I108 Y109 T110	R44-D106 IonicContact CZ-OD1 3.16Å; R44-D106 IonicContact NH1-OD1 2.75Å; R44-D106 PolarHBondContact NH1-OD1 2.96Å; R44-D106 IonicContact NH2-OD1 2.67Å; R44-D106 PolarHBondContact NH2-OD1 2.78Å; S102-D106 WeakPolarHBondContact O-CB 3.3Å; S102-D106 PolarHBondContact O-N 2.97Å; K103-D106 PolarHBondContact O-N 3.2Å; D106-I108 PolarHBondContact O-N 3.38Å; D106-Y109 PolarHBondContact O-N 3.04Å; D106-Y109 VanDerWaalsContact O-N 3.13Å; D106-T110 WeakPolarHBondContact O-CB 3.42Å; D106-T110 WeakPolarHBondContact O-CG2 3.47Å; D106-T110 PolarHBondContact O-N 3.33Å; D106-T110 PolarHBondContact O-OG1 2.64Å
107	Y	90.9	Very high	88.3	Confident	35 Å²	35	53.8 Å²	53.8	14%	0.137	28%	0.281	C	S	.	.	H	α-helix	trans	-58.4	-42.7	172.6	171	-98.9	0	0	0	112.4	K103 L104 I105 Y109 T110 A111 I113 D134 V135	K103-Y107 WeakPolarHBondContact O-CB 3.37Å; K103-Y107 PolarHBondContact O-N 2.61Å; L104-Y107 WeakPolarHBondContact O-CB 3.31Å; L104-Y107 PolarHBondContact O-N 3.01Å; I105-Y107 VanDerWaalsContact C-N 3.27Å; I105-Y107 PolarHBondContact O-N 3.36Å; Y107-Y109 PolarHBondContact O-N 3.38Å; Y107-Y109 VanDerWaalsContact O-N 3.16Å; Y107-T110 PolarHBondContact O-N 2.87Å; Y107-A111 VanDerWaalsContact O-CA 3.27Å; Y107-A111 WeakPolarHBondContact O-CA 3.29Å; Y107-A111 PolarHBondContact O-N 3.3Å; Y107-I113 HydrophobicContact CD2-CB 3.75Å; Y107-I113 HydrophobicContact CD2-CG2 3.95Å; Y107-I113 HydrophobicContact CE2-CG2 4.23Å; Y107-I113 HydrophobicContact CG-CB 4.3Å; Y107-D134 WeakPolarHBondContact OH-CB 3.49Å; Y107-V135 HydrophobicContact CD1-CG2 3.54Å; Y107-V135 HydrophobicContact CD2-CG2 4.19Å; Y107-V135 HydrophobicContact CE1-CG2 3.4Å; Y107-V135 VanDerWaalsContact CE1-CG2 3.4Å; Y107-V135 HydrophobicContact CE2-CG2 4.06Å; Y107-V135 HydrophobicContact CG-CG2 3.94Å
108	I	89.6	Confident	88.3	Confident	8 Å²	8	59.6 Å²	59.6	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-58.2	-31.6	177.4	-71.6	167.9	0	0	0	112	V67 L68 C71 F75 L104 I105 D106 L132	V67-I108 HydrophobicContact CG1-CG2 3.82Å; L68-I108 HydrophobicContact CD2-CD1 3.61Å; L68-I108 HydrophobicContact CD2-CG2 4.26Å; C71-I108 HydrophobicContact CB-CG1 4.26Å; C71-I108 HydrophobicContact CB-CG2 3.81Å; F75-I108 HydrophobicContact CE2-CD1 4.4Å; L104-I108 WeakPolarHBondContact O-CG1 3.22Å; L104-I108 PolarHBondContact O-N 2.9Å; L104-I108 VanDerWaalsContact O-N 3.11Å; I105-I108 WeakPolarHBondContact O-CB 3.43Å; I105-I108 PolarHBondContact O-N 3.45Å; I105-I108 VanDerWaalsContact O-N 3.07Å; D106-I108 PolarHBondContact O-N 3.38Å; I108-L132 HydrophobicContact CD1-CD2 4.49Å; I108-L132 HydrophobicContact CG1-CD2 4.26Å
109	Y	88.2	Confident	88.3	Confident	6 Å²	6	60.2 Å²	60.2	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-93.5	-28.2	-179.9	-76.4	-95.2	0	0	0	114.3	M40 N41 R44 H64 V67 I105 D106 Y107	M40-Y109 HydrophobicContact CB-CD1 4.39Å; M40-Y109 HydrophobicContact CB-CE1 4.34Å; N41-Y109 HydrophobicContact CB-CD1 4.17Å; N41-Y109 HydrophobicContact CB-CG 4.48Å; R44-Y109 HydrophobicContact CB-CE1 4.32Å; H64-Y109 WeakPolarHBondContact CB-OH 3.27Å; H64-Y109 PolarHBondContact N-OH 3.29Å; H64-Y109 AromaticContact ND1-CE1 3.75Å; H64-Y109 AromaticContact ND1-CZ 3.8Å; H64-Y109 PolarHBondContact ND1-OH 3.14Å; V67-Y109 HydrophobicContact CB-CE1 4.14Å; V67-Y109 HydrophobicContact CG1-CD1 4.14Å; V67-Y109 HydrophobicContact CG1-CD2 4.43Å; V67-Y109 HydrophobicContact CG1-CE1 3.75Å; V67-Y109 HydrophobicContact CG1-CE2 4.04Å; V67-Y109 HydrophobicContact CG1-CG 4.47Å; V67-Y109 HydrophobicContact CG2-CE1 4.1Å; I105-Y109 HydrophobicContact CG2-CD2 4.21Å; I105-Y109 HydrophobicContact CG2-CE2 4.05Å; I105-Y109 VanDerWaalsContact O-CD2 3.32Å; I105-Y109 WeakPolarHBondContact O-CD2 3.47Å; I105-Y109 PolarHBondContact O-N 3.44Å; D106-Y109 PolarHBondContact O-N 3.04Å; D106-Y109 VanDerWaalsContact O-N 3.13Å; Y107-Y109 PolarHBondContact O-N 3.38Å; Y107-Y109 VanDerWaalsContact O-N 3.16Å
110	T	86.9	Confident	88.3	Confident	57 Å²	57	53.8 Å²	53.8	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-107.4	-22.1	-171.9	60.4	0	0	0	0	113.7	D106 Y107 E112	D106-T110 WeakPolarHBondContact O-CB 3.42Å; D106-T110 WeakPolarHBondContact O-CG2 3.47Å; D106-T110 PolarHBondContact O-N 3.33Å; D106-T110 PolarHBondContact O-OG1 2.64Å; Y107-T110 PolarHBondContact O-N 2.87Å; T110-E112 PolarHBondContact O-N 3.39Å; T110-E112 PolarHBondContact OG1-N 3.47Å; T110-E112 PolarHBondContact OG1-O 3.36Å
111	A	85.8	Confident	88.1	Confident	77 Å²	77	59.8 Å²	59.8	64%	0.636	31%	0.306	S	S	*	.	S	Bend	trans	59	19.7	-167.2	0	0	0	0	0	114.1	Y107	Y107-A111 VanDerWaalsContact O-CA 3.27Å; Y107-A111 WeakPolarHBondContact O-CA 3.29Å; Y107-A111 PolarHBondContact O-N 3.3Å
112	E	87	Confident	88.1	Confident	154 Å²	154	63.1 Å²	63.1	72%	0.72	33%	0.327	S	S	*	.			trans	-117.9	131.1	179.5	-68.2	178.4	-175.4	0	0	109.8	T110	T110-E112 PolarHBondContact O-N 3.39Å; T110-E112 PolarHBondContact OG1-N 3.47Å; T110-E112 PolarHBondContact OG1-O 3.36Å
113	I	90	Very high	88.1	Confident	44 Å²	44	61.5 Å²	61.5	23%	0.226	32%	0.315	C	S	.	.			trans	-142.7	135.6	174.6	-163.2	161.7	0	0	0	110.9	L104 Y107 L123 V135	L104-I113 HydrophobicContact CD2-CD1 3.96Å; Y107-I113 HydrophobicContact CD2-CB 3.75Å; Y107-I113 HydrophobicContact CD2-CG2 3.95Å; Y107-I113 HydrophobicContact CE2-CG2 4.23Å; Y107-I113 HydrophobicContact CG-CB 4.3Å; I113-L123 HydrophobicContact CD1-CD1 3.86Å; I113-L123 HydrophobicContact CD1-CD2 3.91Å; I113-L123 HydrophobicContact CD1-CG 4.4Å; I113-L123 HydrophobicContact CG1-CD2 4.35Å; I113-V135 HydrophobicContact CD1-CG1 3.71Å; I113-V135 HydrophobicContact CD1-CG2 4.14Å; I113-V135 HydrophobicContact CG2-CG2 4.4Å
114	E	87.9	Confident	88.1	Confident	145 Å²	145	57.2 Å²	57.2	68%	0.678	30%	0.296	S	S	*	.			trans	-100.8	117.5	177.2	-172.4	-179.3	-170.6	0	0	109.6	T116 N119	E114-T116 HydrophobicContact CG-CG2 4.07Å; E114-N119 PolarHBondContact O-ND2 2.84Å
115	V	89.3	Confident	87.9	Confident	28 Å²	28	59 Å²	59	17%	0.17	31%	0.308	C	S	.	.			trans	-100.2	125.7	177.3	-174.4	0	0	0	0	108.9	V120 L123 F142	V115-V120 HydrophobicContact CG1-CB 4.08Å; V115-V120 HydrophobicContact CG1-CG2 3.98Å; V115-L123 HydrophobicContact CG2-CD2 4.08Å; V115-F142 HydrophobicContact CG1-CB 3.95Å; V115-F142 HydrophobicContact CG1-CD1 3.87Å; V115-F142 HydrophobicContact CG1-CD2 4.42Å; V115-F142 HydrophobicContact CG1-CG 3.81Å
116	T	88.4	Confident	87.9	Confident	45 Å²	45	59.2 Å²	59.2	28%	0.276	31%	0.31	S	S	.	.			trans	-132.6	162.5	-179.2	68.6	0	0	0	0	110.5	E114 E118 N119 V120	E114-T116 HydrophobicContact CG-CG2 4.07Å; T116-E118 PolarHBondContact O-N 3.24Å; T116-N119 VanDerWaalsContact N-CG 3.31Å; T116-N119 PolarHBondContact N-ND2 3.32Å; T116-N119 PolarHBondContact N-OD1 2.93Å; T116-N119 PolarHBondContact O-N 2.98Å; T116-N119 VanDerWaalsContact O-N 3.1Å; T116-N119 PolarHBondContact O-OD1 2.96Å; T116-N119 VanDerWaalsContact OG1-CG 3.23Å; T116-N119 PolarHBondContact OG1-ND2 3.4Å; T116-V120 WeakPolarHBondContact O-CB 3.4Å; T116-V120 PolarHBondContact O-N 3.32Å
117	E	82.6	Confident	87.9	Confident	137 Å²	137	56.7 Å²	56.7	64%	0.64	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-36.7	179.3	-65	179.3	-173.9	0	0	113	F142	E117-F142 HydrophobicContact CG-CE1 4.23Å; E117-F142 HydrophobicContact CG-CZ 3.99Å
118	E	84.4	Confident	87.8	Confident	182 Å²	182	56.8 Å²	56.8	85%	0.85	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-27.5	179.7	-62.3	-179.3	174.9	0	0	112.9	T116	T116-E118 PolarHBondContact O-N 3.24Å
119	N	87.6	Confident	87.7	Confident	14 Å²	14	59.8 Å²	59.8	8%	0.075	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-24.1	-172.7	80	27.9	0	0	0	113.7	E114 T116 Q121 V122 L123	E114-N119 PolarHBondContact O-ND2 2.84Å; T116-N119 VanDerWaalsContact N-CG 3.31Å; T116-N119 PolarHBondContact N-ND2 3.32Å; T116-N119 PolarHBondContact N-OD1 2.93Å; T116-N119 PolarHBondContact O-N 2.98Å; T116-N119 VanDerWaalsContact O-N 3.1Å; T116-N119 PolarHBondContact O-OD1 2.96Å; T116-N119 VanDerWaalsContact OG1-CG 3.23Å; T116-N119 PolarHBondContact OG1-ND2 3.4Å; N119-Q121 VanDerWaalsContact C-N 3.25Å; N119-Q121 PolarHBondContact O-N 3.3Å; N119-V122 WeakPolarHBondContact O-CG2 3.42Å; N119-V122 PolarHBondContact O-N 3.25Å; N119-V122 VanDerWaalsContact O-N 3.15Å; N119-L123 WeakPolarHBondContact O-CB 3.46Å; N119-L123 PolarHBondContact O-N 3.03Å
120	V	86.9	Confident	87.8	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.03	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-33.2	-170.5	69	0	0	0	0	112.9	V115 T116 V122 L123 L124 C139 F142 L143	V115-V120 HydrophobicContact CG1-CB 4.08Å; V115-V120 HydrophobicContact CG1-CG2 3.98Å; T116-V120 WeakPolarHBondContact O-CB 3.4Å; T116-V120 PolarHBondContact O-N 3.32Å; V120-V122 PolarHBondContact O-N 3.32Å; V120-L123 PolarHBondContact O-N 3.42Å; V120-L124 WeakPolarHBondContact O-CB 3.18Å; V120-L124 PolarHBondContact O-N 3.41Å; V120-L124 VanDerWaalsContact O-N 3.09Å; V120-C139 HydrophobicContact CG2-CB 4.01Å; V120-F142 HydrophobicContact CB-CD1 4.39Å; V120-F142 HydrophobicContact CG1-CE1 4.48Å; V120-F142 HydrophobicContact CG2-CD1 4.23Å; V120-L143 HydrophobicContact CG1-CD2 3.93Å; V120-L143 HydrophobicContact CG2-CD1 4.09Å; V120-L143 HydrophobicContact CG2-CD2 4.08Å; V120-L143 HydrophobicContact CG2-CG 3.87Å
121	Q	85.6	Confident	87.9	Confident	136 Å²	136	60.9 Å²	60.9	64%	0.636	32%	0.319	S	S	*	.	H	α-helix	trans	-67.2	-34.8	-179.9	-67.1	-174.3	-4.2	0	0	113	N119 P125	N119-Q121 VanDerWaalsContact C-N 3.25Å; N119-Q121 PolarHBondContact O-N 3.3Å; Q121-P125 WeakPolarHBondContact O-CD 3.48Å; Q121-P125 WeakPolarHBondContact O-CG 3.29Å
122	V	89	Confident	88.1	Confident	71 Å²	71	57.6 Å²	57.6	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-92	-27.5	177.2	-66	0	0	0	0	112.2	T100 N119 V120 P125 A126	T100-V122 HydrophobicContact CG2-CG2 4.46Å; T100-V122 WeakPolarHBondContact OG1-CG2 3.14Å; N119-V122 WeakPolarHBondContact O-CG2 3.42Å; N119-V122 PolarHBondContact O-N 3.25Å; N119-V122 VanDerWaalsContact O-N 3.15Å; V120-V122 PolarHBondContact O-N 3.32Å; V122-P125 WeakPolarHBondContact O-CD 3.5Å; V122-A126 WeakPolarHBondContact O-CB 3.43Å
123	L	90.6	Very high	88.1	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-75.2	-44	-176.8	-174.1	64.7	0	0	0	113	T100 L104 I113 V115 N119 V120 A126 A127 V135	T100-L123 HydrophobicContact CG2-CB 4.41Å; T100-L123 HydrophobicContact CG2-CD1 3.89Å; L104-L123 HydrophobicContact CD1-CD1 4.35Å; L104-L123 HydrophobicContact CD2-CD1 3.54Å; L104-L123 HydrophobicContact CG-CD1 3.85Å; I113-L123 HydrophobicContact CD1-CD1 3.86Å; I113-L123 HydrophobicContact CD1-CD2 3.91Å; I113-L123 HydrophobicContact CD1-CG 4.4Å; I113-L123 HydrophobicContact CG1-CD2 4.35Å; V115-L123 HydrophobicContact CG2-CD2 4.08Å; N119-L123 WeakPolarHBondContact O-CB 3.46Å; N119-L123 PolarHBondContact O-N 3.03Å; V120-L123 PolarHBondContact O-N 3.42Å; L123-A126 PolarHBondContact O-N 3.08Å; L123-A127 VanDerWaalsContact O-CB 3.29Å; L123-A127 WeakPolarHBondContact O-CB 3.5Å; L123-A127 PolarHBondContact O-N 2.98Å; L123-V135 HydrophobicContact CD1-CG1 4.43Å; L123-V135 HydrophobicContact CD2-CG1 4.32Å; L123-V135 HydrophobicContact CG-CG1 4.2Å
124	L	88.8	Confident	88	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-48.3	-179.3	-176.4	99.7	0	0	0	112.6	V120 A126 A127 S128 R136 C139 F158 H162	V120-L124 WeakPolarHBondContact O-CB 3.18Å; V120-L124 PolarHBondContact O-N 3.41Å; V120-L124 VanDerWaalsContact O-N 3.09Å; L124-A126 PolarHBondContact O-N 2.86Å; L124-A127 PolarHBondContact O-N 3.38Å; L124-S128 WeakPolarHBondContact O-CB 3.44Å; L124-S128 PolarHBondContact O-N 2.87Å; L124-R136 HydrophobicContact CD1-CG 3.95Å; L124-C139 HydrophobicContact CB-CB 4.18Å; L124-C139 HydrophobicContact CD1-CB 3.45Å; L124-C139 VanDerWaalsContact CD1-CB 3.45Å; L124-C139 HydrophobicContact CG-CB 4.45Å; L124-F158 HydrophobicContact CB-CE1 4.15Å; L124-F158 HydrophobicContact CB-CZ 4.2Å; L124-F158 HydrophobicContact CD2-CD1 4.13Å; L124-F158 HydrophobicContact CD2-CE1 3.36Å; L124-F158 HydrophobicContact CD2-CZ 3.89Å; L124-F158 HydrophobicContact CG-CE1 4.33Å; L124-H162 HydrophobicContact CD2-CB 3.91Å
125	P	87.4	Confident	88.1	Confident	39 Å²	39	50.5 Å²	50.5	25%	0.253	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-43.2	177.9	-18.8	30.5	0	0	0	112	Q121 V122 S128 L129 F158 H162	Q121-P125 WeakPolarHBondContact O-CD 3.48Å; Q121-P125 WeakPolarHBondContact O-CG 3.29Å; V122-P125 WeakPolarHBondContact O-CD 3.5Å; P125-S128 WeakPolarHBondContact O-CB 3.5Å; P125-S128 PolarHBondContact O-N 2.94Å; P125-L129 WeakPolarHBondContact O-CB 3.35Å; P125-L129 PolarHBondContact O-N 3.15Å; P125-F158 HydrophobicContact CG-CZ 4.29Å; P125-H162 VanDerWaalsContact CG-CE1 3.46Å; P125-H162 WeakPolarHBondContact CG-CE1 3.42Å
126	A	89.3	Confident	88.1	Confident	4 Å²	4	53 Å²	53	3%	0.033	27%	0.268	C	S	.	.	H	α-helix	trans	-65	-41.7	179	0	0	0	0	0	112.1	V96 T100 L104 V122 L123 L124 S128 L129 L130	V96-A126 HydrophobicContact CG1-CB 3.76Å; V96-A126 HydrophobicContact CG2-CB 4.24Å; T100-A126 HydrophobicContact CG2-CB 3.85Å; L104-A126 HydrophobicContact CD1-CB 3.56Å; V122-A126 WeakPolarHBondContact O-CB 3.43Å; L123-A126 PolarHBondContact O-N 3.08Å; L124-A126 PolarHBondContact O-N 2.86Å; A126-S128 VanDerWaalsContact C-N 3.34Å; A126-S128 PolarHBondContact O-N 2.97Å; A126-L129 PolarHBondContact O-N 3.1Å; A126-L130 WeakPolarHBondContact O-CG 3.35Å; A126-L130 PolarHBondContact O-N 3.25Å
127	A	90.4	Very high	88.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-38.4	174.4	0	0	0	0	0	112.1	L104 L123 L124 Q131 L132 V135	L104-A127 HydrophobicContact CD2-CB 4.3Å; L123-A127 VanDerWaalsContact O-CB 3.29Å; L123-A127 WeakPolarHBondContact O-CB 3.5Å; L123-A127 PolarHBondContact O-N 2.98Å; L124-A127 PolarHBondContact O-N 3.38Å; A127-Q131 PolarHBondContact O-N 3.5Å; A127-L132 HydrophobicContact CB-CB 4.47Å; A127-L132 PolarHBondContact O-N 3.23Å; A127-V135 HydrophobicContact CB-CB 3.97Å; A127-V135 HydrophobicContact CB-CG1 3.73Å
128	S	87.6	Confident	88.4	Confident	37 Å²	37	52.2 Å²	52.2	26%	0.259	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-44.5	175.6	-164.4	0	0	0	0	111.6	L124 P125 A126 Q131	L124-S128 WeakPolarHBondContact O-CB 3.44Å; L124-S128 PolarHBondContact O-N 2.87Å; P125-S128 WeakPolarHBondContact O-CB 3.5Å; P125-S128 PolarHBondContact O-N 2.94Å; A126-S128 VanDerWaalsContact C-N 3.34Å; A126-S128 PolarHBondContact O-N 2.97Å; S128-Q131 PolarHBondContact O-N 3.15Å; S128-Q131 VanDerWaalsContact O-N 3.11Å
129	L	88.8	Confident	88.6	Confident	71 Å²	71	43.5 Å²	43.5	37%	0.372	22%	0.223	S	C	.	.	H	α-helix	trans	-59.9	-48.1	176.2	-179.1	68.2	0	0	0	111.8	I93 V96 P125 A126 Q131	I93-L129 HydrophobicContact CG2-CD2 4.37Å; V96-L129 HydrophobicContact CG2-CD2 3.62Å; P125-L129 WeakPolarHBondContact O-CB 3.35Å; P125-L129 PolarHBondContact O-N 3.15Å; A126-L129 PolarHBondContact O-N 3.1Å; L129-Q131 PolarHBondContact O-N 3.18Å
130	L	88.9	Confident	88.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	0.3	177.9	-61	-176.3	0	0	0	113.4	S72 Y74 F75 I93 L101 L104 A126 L132	S72-L130 PolarHBondContact OG-O 2.86Å; Y74-L130 HydrophobicContact CD1-CD2 3.6Å; Y74-L130 HydrophobicContact CE1-CD2 3.82Å; Y74-L130 HydrophobicContact CG-CD2 4.4Å; F75-L130 HydrophobicContact CE1-CD2 4.45Å; F75-L130 HydrophobicContact CE2-CD1 4.2Å; F75-L130 HydrophobicContact CE2-CD2 3.9Å; F75-L130 HydrophobicContact CZ-CD1 4.43Å; F75-L130 HydrophobicContact CZ-CD2 3.73Å; I93-L130 HydrophobicContact CD1-CD2 4.21Å; L101-L130 HydrophobicContact CD1-CD1 3.74Å; L104-L130 HydrophobicContact CB-CD1 4.26Å; L104-L130 HydrophobicContact CD1-CD1 3.87Å; A126-L130 WeakPolarHBondContact O-CG 3.35Å; A126-L130 PolarHBondContact O-N 3.25Å; L130-L132 VanDerWaalsContact C-N 3.28Å; L130-L132 HydrophobicContact CB-CD1 4.19Å; L130-L132 HydrophobicContact CB-CG 4.17Å; L130-L132 HydrophobicContact CD1-CD1 4.45Å; L130-L132 PolarHBondContact O-N 2.83Å
131	Q	89.2	Confident	88.6	Confident	86 Å²	86	46.6 Å²	46.6	40%	0.402	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	36.6	179.8	-58.6	-176.1	1.3	0	0	113.9	P73 A127 S128 L129 M133	P73-Q131 HydrophobicContact CG-CB 4.3Å; A127-Q131 PolarHBondContact O-N 3.5Å; S128-Q131 PolarHBondContact O-N 3.15Å; S128-Q131 VanDerWaalsContact O-N 3.11Å; L129-Q131 PolarHBondContact O-N 3.18Å; Q131-M133 HydrophobicContact CB-CE 3.95Å; Q131-M133 HydrophobicContact CG-CE 4.39Å; Q131-M133 PolarHBondContact O-N 3.32Å
132	L	90	Very high	88.8	Confident	8 Å²	8	42.5 Å²	42.5	4%	0.042	22%	0.22	C	C	.	.			trans	-87.9	84.8	174.4	-65.4	172.4	0	0	0	109.7	C71 L104 I108 A127 L130 D134 V135 R136	C71-L132 WeakPolarHBondContact O-CD2 3.38Å; L104-L132 HydrophobicContact CB-CD1 4.22Å; L104-L132 HydrophobicContact CD2-CD1 3.93Å; I108-L132 HydrophobicContact CD1-CD2 4.49Å; I108-L132 HydrophobicContact CG1-CD2 4.26Å; A127-L132 HydrophobicContact CB-CB 4.47Å; A127-L132 PolarHBondContact O-N 3.23Å; L130-L132 VanDerWaalsContact C-N 3.28Å; L130-L132 HydrophobicContact CB-CD1 4.19Å; L130-L132 HydrophobicContact CB-CG 4.17Å; L130-L132 HydrophobicContact CD1-CD1 4.45Å; L130-L132 PolarHBondContact O-N 2.83Å; L132-D134 PolarHBondContact O-N 3.05Å; L132-V135 HydrophobicContact CB-CB 4.28Å; L132-V135 HydrophobicContact CB-CG2 4.2Å; L132-V135 PolarHBondContact O-N 2.98Å; L132-R136 PolarHBondContact O-N 2.9Å; L132-R136 VanDerWaalsContact O-N 3.08Å
133	M	87.5	Confident	88.7	Confident	85 Å²	85	39.8 Å²	39.8	42%	0.419	20%	0.203	S	C	.	.	H	α-helix	trans	-63.8	-36.1	-170.9	-60.5	-60.3	156.1	0	0	113.5	Q131 R136 Q137	Q131-M133 HydrophobicContact CB-CE 3.95Å; Q131-M133 HydrophobicContact CG-CE 4.39Å; Q131-M133 PolarHBondContact O-N 3.32Å; M133-R136 WeakPolarHBondContact O-CB 3.36Å; M133-R136 PolarHBondContact O-N 3.32Å; M133-R136 PolarHBondContact SD-NH1 2.84Å; M133-R136 VanDerWaalsContact SD-NH1 3.4Å; M133-R136 PolarHBondContact SD-NH2 3.46Å; M133-Q137 PolarHBondContact O-N 3.4Å
134	D	88.5	Confident	88.6	Confident	109 Å²	109	43.8 Å²	43.8	58%	0.583	22%	0.222	S	C	*	.	H	α-helix	trans	-65.5	-41	179.2	-58.1	-42.2	0	0	0	111.8	Y107 L132 Q137 N138	Y107-D134 WeakPolarHBondContact OH-CB 3.49Å; L132-D134 PolarHBondContact O-N 3.05Å; D134-Q137 PolarHBondContact O-N 3.33Å; D134-N138 PolarHBondContact O-N 3.33Å; D134-N138 PolarHBondContact O-ND2 2.99Å
135	V	89.7	Confident	88.5	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67	-43.4	176.1	179.1	0	0	0	0	109.9	L104 Y107 I113 L123 A127 L132 Q137 N138 C139	L104-V135 HydrophobicContact CD2-CG1 3.97Å; L104-V135 HydrophobicContact CD2-CG2 4.42Å; Y107-V135 HydrophobicContact CD1-CG2 3.54Å; Y107-V135 HydrophobicContact CD2-CG2 4.19Å; Y107-V135 HydrophobicContact CE1-CG2 3.4Å; Y107-V135 VanDerWaalsContact CE1-CG2 3.4Å; Y107-V135 HydrophobicContact CE2-CG2 4.06Å; Y107-V135 HydrophobicContact CG-CG2 3.94Å; I113-V135 HydrophobicContact CD1-CG1 3.71Å; I113-V135 HydrophobicContact CD1-CG2 4.14Å; I113-V135 HydrophobicContact CG2-CG2 4.4Å; L123-V135 HydrophobicContact CD1-CG1 4.43Å; L123-V135 HydrophobicContact CD2-CG1 4.32Å; L123-V135 HydrophobicContact CG-CG1 4.2Å; A127-V135 HydrophobicContact CB-CB 3.97Å; A127-V135 HydrophobicContact CB-CG1 3.73Å; L132-V135 HydrophobicContact CB-CB 4.28Å; L132-V135 HydrophobicContact CB-CG2 4.2Å; L132-V135 PolarHBondContact O-N 2.98Å; V135-Q137 VanDerWaalsContact C-N 3.31Å; V135-Q137 PolarHBondContact O-N 3.35Å; V135-N138 PolarHBondContact O-N 3.11Å; V135-C139 PolarHBondContact O-N 3Å; V135-C139 PolarHBondContact O-SG 3.28Å; V135-C139 VanDerWaalsContact O-SG 3.32Å
136	R	88.6	Confident	88.5	Confident	82 Å²	82	49.5 Å²	49.5	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-56.9	-46	175.7	-173.1	-175.7	70.8	-178.2	3.3	111.3	L124 L132 M133 C139 C140	L124-R136 HydrophobicContact CD1-CG 3.95Å; L132-R136 PolarHBondContact O-N 2.9Å; L132-R136 VanDerWaalsContact O-N 3.08Å; M133-R136 WeakPolarHBondContact O-CB 3.36Å; M133-R136 PolarHBondContact O-N 3.32Å; M133-R136 PolarHBondContact SD-NH1 2.84Å; M133-R136 VanDerWaalsContact SD-NH1 3.4Å; M133-R136 PolarHBondContact SD-NH2 3.46Å; R136-C139 PolarHBondContact O-N 2.91Å; R136-C140 PolarHBondContact O-N 3.39Å; R136-C140 PolarHBondContact O-SG 3.27Å; R136-C140 VanDerWaalsContact O-SG 3.33Å
137	Q	87.8	Confident	88.4	Confident	82 Å²	82	50.6 Å²	50.6	38%	0.383	26%	0.259	S	S	.	.	H	α-helix	trans	-63.9	-46.7	179.3	-169.7	61.3	47.1	0	0	111.6	M133 D134 V135 C139 C140 D141	M133-Q137 PolarHBondContact O-N 3.4Å; D134-Q137 PolarHBondContact O-N 3.33Å; V135-Q137 VanDerWaalsContact C-N 3.31Å; V135-Q137 PolarHBondContact O-N 3.35Å; Q137-C139 VanDerWaalsContact C-N 3.29Å; Q137-C139 PolarHBondContact O-N 3.5Å; Q137-C140 WeakPolarHBondContact O-CA 3.11Å; Q137-C140 WeakPolarHBondContact O-CB 3.47Å; Q137-C140 PolarHBondContact O-N 2.95Å; Q137-D141 PolarHBondContact NE2-OD1 2.69Å; Q137-D141 PolarHBondContact O-N 3.12Å
138	N	88.9	Confident	88.1	Confident	82 Å²	82	55.3 Å²	55.3	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-59.7	-38.9	176.8	-79.5	-68.1	0	0	0	112.5	D134 V135 D141 F142	D134-N138 PolarHBondContact O-N 3.33Å; D134-N138 PolarHBondContact O-ND2 2.99Å; V135-N138 PolarHBondContact O-N 3.11Å; N138-D141 PolarHBondContact O-N 3.37Å; N138-F142 WeakPolarHBondContact O-CB 3.49Å; N138-F142 PolarHBondContact O-N 3.31Å
139	C	88.9	Confident	87.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.5	-40.9	173.4	-70.2	0	0	0	0	112.2	V120 L124 V135 R136 Q137 F142 L143	V120-C139 HydrophobicContact CG2-CB 4.01Å; L124-C139 HydrophobicContact CB-CB 4.18Å; L124-C139 HydrophobicContact CD1-CB 3.45Å; L124-C139 VanDerWaalsContact CD1-CB 3.45Å; L124-C139 HydrophobicContact CG-CB 4.45Å; V135-C139 PolarHBondContact O-N 3Å; V135-C139 PolarHBondContact O-SG 3.28Å; V135-C139 VanDerWaalsContact O-SG 3.32Å; R136-C139 PolarHBondContact O-N 2.91Å; Q137-C139 VanDerWaalsContact C-N 3.29Å; Q137-C139 PolarHBondContact O-N 3.5Å; C139-F142 PolarHBondContact O-N 3.36Å; C139-L143 WeakPolarHBondContact O-CG 3.47Å; C139-L143 PolarHBondContact O-N 3.49Å
140	C	87.3	Confident	87.8	Confident	13 Å²	13	54.8 Å²	54.8	9%	0.088	28%	0.28	C	S	.	.	H	α-helix	trans	-63.8	-44.2	174.8	-69.8	0	0	0	0	112	R136 Q137 F142 L143 Q144	R136-C140 PolarHBondContact O-N 3.39Å; R136-C140 PolarHBondContact O-SG 3.27Å; R136-C140 VanDerWaalsContact O-SG 3.33Å; Q137-C140 WeakPolarHBondContact O-CA 3.11Å; Q137-C140 WeakPolarHBondContact O-CB 3.47Å; Q137-C140 PolarHBondContact O-N 2.95Å; C140-F142 VanDerWaalsContact C-N 3.34Å; C140-F142 PolarHBondContact O-N 3.24Å; C140-L143 PolarHBondContact O-N 3.46Å; C140-Q144 WeakPolarHBondContact O-CB 3.29Å; C140-Q144 PolarHBondContact O-N 3.09Å
141	D	87.4	Confident	87.7	Confident	71 Å²	71	57 Å²	57	38%	0.38	29%	0.292	S	S	.	.	H	α-helix	trans	-64.5	-39.9	178.7	-62.9	-14	0	0	0	110.9	Q137 N138 Q144 S145	Q137-D141 PolarHBondContact NE2-OD1 2.69Å; Q137-D141 PolarHBondContact O-N 3.12Å; N138-D141 PolarHBondContact O-N 3.37Å; D141-Q144 PolarHBondContact O-N 3.01Å; D141-S145 PolarHBondContact O-N 3.49Å
142	F	89.4	Confident	87.6	Confident	49 Å²	49	53 Å²	53	22%	0.215	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-50.4	173.3	-179.7	-97.4	0	0	0	111.5	V115 E117 V120 N138 C139 C140 Q144 S145 Q146	V115-F142 HydrophobicContact CG1-CB 3.95Å; V115-F142 HydrophobicContact CG1-CD1 3.87Å; V115-F142 HydrophobicContact CG1-CD2 4.42Å; V115-F142 HydrophobicContact CG1-CG 3.81Å; E117-F142 HydrophobicContact CG-CE1 4.23Å; E117-F142 HydrophobicContact CG-CZ 3.99Å; V120-F142 HydrophobicContact CB-CD1 4.39Å; V120-F142 HydrophobicContact CG1-CE1 4.48Å; V120-F142 HydrophobicContact CG2-CD1 4.23Å; N138-F142 WeakPolarHBondContact O-CB 3.49Å; N138-F142 PolarHBondContact O-N 3.31Å; C139-F142 PolarHBondContact O-N 3.36Å; C140-F142 VanDerWaalsContact C-N 3.34Å; C140-F142 PolarHBondContact O-N 3.24Å; F142-Q144 VanDerWaalsContact C-N 3.28Å; F142-Q144 PolarHBondContact O-N 3.5Å; F142-S145 PolarHBondContact O-N 3.22Å; F142-S145 VanDerWaalsContact O-N 3.12Å; F142-S145 PolarHBondContact O-OG 2.63Å; F142-Q146 HydrophobicContact CE1-CG 4.18Å; F142-Q146 HydrophobicContact CE2-CG 4.41Å; F142-Q146 HydrophobicContact CZ-CG 4.08Å; F142-Q146 WeakPolarHBondContact O-CG 3.22Å; F142-Q146 PolarHBondContact O-N 2.92Å
143	L	88.5	Confident	87.4	Confident	15 Å²	15	52.8 Å²	52.8	8%	0.079	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-37.2	177.6	-72.5	171.8	0	0	0	112.1	V120 C139 C140 S145 Q146 L147 I155 F158 L167	V120-L143 HydrophobicContact CG1-CD2 3.93Å; V120-L143 HydrophobicContact CG2-CD1 4.09Å; V120-L143 HydrophobicContact CG2-CD2 4.08Å; V120-L143 HydrophobicContact CG2-CG 3.87Å; C139-L143 WeakPolarHBondContact O-CG 3.47Å; C139-L143 PolarHBondContact O-N 3.49Å; C140-L143 PolarHBondContact O-N 3.46Å; L143-S145 VanDerWaalsContact C-N 3.34Å; L143-Q146 PolarHBondContact O-N 2.69Å; L143-L147 PolarHBondContact O-N 3.31Å; L143-I155 HydrophobicContact CB-CG2 4.4Å; L143-I155 HydrophobicContact CD2-CD1 4.46Å; L143-I155 HydrophobicContact CD2-CG1 4.4Å; L143-F158 HydrophobicContact CD1-CD1 4.06Å; L143-F158 HydrophobicContact CD1-CE1 4.01Å; L143-L167 HydrophobicContact CB-CD1 4.06Å; L143-L167 HydrophobicContact CB-CD2 4Å; L143-L167 HydrophobicContact CD1-CD2 3.66Å; L143-L167 HydrophobicContact CG-CD2 4.49Å
144	Q	87.5	Confident	87.4	Confident	85 Å²	85	50.1 Å²	50.1	40%	0.397	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-38.9	175.7	-173	175.6	-3.3	0	0	111.8	C140 D141 F142 Q146 L147 L167	C140-Q144 WeakPolarHBondContact O-CB 3.29Å; C140-Q144 PolarHBondContact O-N 3.09Å; D141-Q144 PolarHBondContact O-N 3.01Å; F142-Q144 VanDerWaalsContact C-N 3.28Å; F142-Q144 PolarHBondContact O-N 3.5Å; Q144-Q146 PolarHBondContact O-N 3.39Å; Q144-L147 HydrophobicContact CG-CD1 4.27Å; Q144-L147 PolarHBondContact O-N 3.24Å; Q144-L167 HydrophobicContact CB-CD1 4.32Å
145	S	86.2	Confident	87.3	Confident	80 Å²	80	45.6 Å²	45.6	56%	0.559	24%	0.241	S	C	*	.	H	α-helix	trans	-68.2	-20.2	176.6	78.4	0	0	0	0	114	D141 F142 L143	D141-S145 PolarHBondContact O-N 3.49Å; F142-S145 PolarHBondContact O-N 3.22Å; F142-S145 VanDerWaalsContact O-N 3.12Å; F142-S145 PolarHBondContact O-OG 2.63Å; L143-S145 VanDerWaalsContact C-N 3.34Å
146	Q	87.1	Confident	87.2	Confident	80 Å²	80	46.4 Å²	46.4	37%	0.374	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	15.1	-177.6	-61.4	-55.2	-48	0	0	113.3	F142 L143 Q144 H148 N151	F142-Q146 HydrophobicContact CE1-CG 4.18Å; F142-Q146 HydrophobicContact CE2-CG 4.41Å; F142-Q146 HydrophobicContact CZ-CG 4.08Å; F142-Q146 WeakPolarHBondContact O-CG 3.22Å; F142-Q146 PolarHBondContact O-N 2.92Å; L143-Q146 PolarHBondContact O-N 2.69Å; Q144-Q146 PolarHBondContact O-N 3.39Å; Q146-H148 PolarHBondContact O-N 2.79Å; Q146-N151 PolarHBondContact O-ND2 2.81Å
147	L	87.3	Confident	87	Confident	27 Å²	27	44.3 Å²	44.3	14%	0.141	25%	0.245	C	C	.	.			trans	-63.2	121.8	176.2	-77.6	169.2	0	0	0	110.8	L143 Q144 C152 I155 A171 Y174	L143-L147 PolarHBondContact O-N 3.31Å; Q144-L147 HydrophobicContact CG-CD1 4.27Å; Q144-L147 PolarHBondContact O-N 3.24Å; L147-C152 HydrophobicContact CD2-CB 4.34Å; L147-I155 HydrophobicContact CD2-CB 4.32Å; L147-I155 HydrophobicContact CD2-CD1 3.93Å; L147-I155 HydrophobicContact CD2-CG2 4.09Å; L147-A171 HydrophobicContact CD2-CB 4.09Å; L147-Y174 HydrophobicContact CB-CD2 4.2Å; L147-Y174 HydrophobicContact CB-CE2 4.32Å; L147-Y174 HydrophobicContact CB-CG 4.33Å
148	H	85.8	Confident	86.9	Confident	100 Å²	100	42.5 Å²	42.5	46%	0.463	24%	0.236	S	C	.	.			trans	-137.1	151.5	179.7	-170.3	-96.4	0	0	0	110	Q146 T150 N151 C152	Q146-H148 PolarHBondContact O-N 2.79Å; H148-T150 PolarHBondContact ND1-N 2.85Å; H148-T150 PolarHBondContact ND1-OG1 2.77Å; H148-T150 PolarHBondContact O-N 3.17Å; H148-N151 WeakPolarHBondContact CA-OD1 3.1Å; H148-N151 PolarHBondContact N-OD1 2.97Å; H148-N151 PolarHBondContact O-N 3.23Å; H148-N151 PolarHBondContact O-OD1 2.89Å; H148-C152 WeakPolarHBondContact O-CB 3.38Å; H148-C152 PolarHBondContact O-N 3.48Å
149	P	83.6	Confident	86.8	Confident	11 Å²	11	38.6 Å²	38.6	7%	0.071	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27	-179.2	-28.8	36.4	0	0	0	114.7	Y174 H178 E181 V182	P149-Y174 HydrophobicContact CG-CE1 4.31Å; P149-H178 HydrophobicContact CG-CB 4.46Å; P149-E181 HydrophobicContact CB-CB 3.83Å; P149-E181 HydrophobicContact CG-CB 4.18Å; P149-E181 WeakPolarHBondContact CG-OE2 3.39Å; P149-V182 HydrophobicContact CB-CG2 4.19Å
150	T	84.8	Confident	86.6	Confident	86 Å²	86	43.2 Å²	43.2	53%	0.528	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-18.3	-179.5	58.4	0	0	0	0	115.1	H148	H148-T150 PolarHBondContact ND1-N 2.85Å; H148-T150 PolarHBondContact ND1-OG1 2.77Å; H148-T150 PolarHBondContact O-N 3.17Å
151	N	86.9	Confident	86.5	Confident	47 Å²	47	47.8 Å²	47.8	25%	0.251	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-8.8	-175.3	71.3	8.4	0	0	0	113.4	Q146 H148 L153 G154 I155 E187	Q146-N151 PolarHBondContact O-ND2 2.81Å; H148-N151 WeakPolarHBondContact CA-OD1 3.1Å; H148-N151 PolarHBondContact N-OD1 2.97Å; H148-N151 PolarHBondContact O-N 3.23Å; H148-N151 PolarHBondContact O-OD1 2.89Å; N151-L153 PolarHBondContact O-N 3.22Å; N151-G154 PolarHBondContact O-N 3.22Å; N151-I155 HydrophobicContact CB-CD1 4.47Å; N151-I155 WeakPolarHBondContact O-CG1 3.43Å; N151-I155 PolarHBondContact O-N 2.89Å; N151-E187 WeakPolarHBondContact CA-OE2 3.43Å
152	C	88.1	Confident	86.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-31.3	-172.1	66.3	0	0	0	0	112.8	L147 H148 R156 Y174 V182	L147-C152 HydrophobicContact CD2-CB 4.34Å; H148-C152 WeakPolarHBondContact O-CB 3.38Å; H148-C152 PolarHBondContact O-N 3.48Å; C152-R156 VanDerWaalsContact O-CB 3.24Å; C152-R156 WeakPolarHBondContact O-CB 3.16Å; C152-R156 PolarHBondContact O-N 3.12Å; C152-Y174 HydrophobicContact CB-CD1 3.93Å; C152-Y174 HydrophobicContact CB-CE1 4.47Å; C152-V182 VanDerWaalsContact SG-CG2 3.55Å
153	L	86.5	Confident	85.9	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-75.6	-38.9	178.2	-63.6	176.1	0	0	0	111	N151 R156 A157 A175 V182 E187 F188 L191	N151-L153 PolarHBondContact O-N 3.22Å; L153-R156 WeakPolarHBondContact O-CB 3.4Å; L153-R156 PolarHBondContact O-N 3.48Å; L153-A157 WeakPolarHBondContact O-CB 3.44Å; L153-A157 PolarHBondContact O-N 3.17Å; L153-A175 HydrophobicContact CD2-CB 4.28Å; L153-V182 HydrophobicContact CD1-CG1 3.55Å; L153-V182 HydrophobicContact CD2-CG1 4.08Å; L153-V182 HydrophobicContact CG-CG1 3.74Å; L153-E187 HydrophobicContact CB-CB 4.11Å; L153-E187 WeakPolarHBondContact CB-OE2 3.41Å; L153-E187 HydrophobicContact CD1-CB 4.12Å; L153-E187 PolarHBondContact N-OE2 3.3Å; L153-F188 HydrophobicContact CD1-CB 3.83Å; L153-F188 HydrophobicContact CD1-CD2 4.26Å; L153-L191 HydrophobicContact CB-CD2 4.46Å; L153-L191 HydrophobicContact CD1-CD1 3.88Å; L153-L191 HydrophobicContact CD1-CD2 4.48Å; L153-L191 HydrophobicContact CD1-CG 4.29Å; L153-L191 HydrophobicContact CD2-CD1 4.24Å
154	G	86.1	Confident	85.6	Confident	29 Å²	29	49.6 Å²	49.6	30%	0.299	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-49.5	170.2	0	0	0	0	0	112.1	N151 R156 A157 F158 E187	N151-G154 PolarHBondContact O-N 3.22Å; G154-R156 VanDerWaalsContact C-N 3.3Å; G154-R156 PolarHBondContact O-N 3.34Å; G154-A157 PolarHBondContact O-N 3.26Å; G154-F158 WeakPolarHBondContact O-CB 3.42Å; G154-F158 PolarHBondContact O-N 2.81Å; G154-E187 PolarHBondContact N-OE2 3.42Å
155	I	87.3	Confident	85.5	Confident	14 Å²	14	50.2 Å²	50.2	7%	0.072	29%	0.292	C	S	.	.	H	α-helix	trans	-61.5	-39.7	176.3	-66.1	170.7	0	0	0	110.8	L143 L147 N151 F158 A159 L167 A171	L143-I155 HydrophobicContact CB-CG2 4.4Å; L143-I155 HydrophobicContact CD2-CD1 4.46Å; L143-I155 HydrophobicContact CD2-CG1 4.4Å; L147-I155 HydrophobicContact CD2-CB 4.32Å; L147-I155 HydrophobicContact CD2-CD1 3.93Å; L147-I155 HydrophobicContact CD2-CG2 4.09Å; N151-I155 HydrophobicContact CB-CD1 4.47Å; N151-I155 WeakPolarHBondContact O-CG1 3.43Å; N151-I155 PolarHBondContact O-N 2.89Å; I155-F158 PolarHBondContact O-N 3.38Å; I155-A159 WeakPolarHBondContact O-CB 3.34Å; I155-A159 PolarHBondContact O-N 2.89Å; I155-L167 HydrophobicContact CG2-CD1 4.03Å; I155-L167 HydrophobicContact CG2-CD2 4.1Å; I155-L167 HydrophobicContact CG2-CG 4.1Å; I155-A171 HydrophobicContact CG2-CB 4.33Å
156	R	87.5	Confident	85.4	Confident	18 Å²	18	51.5 Å²	51.5	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-48.3	175.2	-171.7	-176.3	71.2	169.9	0.8	111.7	C152 L153 G154 F158 A159 D160 L168 A171 N172	C152-R156 VanDerWaalsContact O-CB 3.24Å; C152-R156 WeakPolarHBondContact O-CB 3.16Å; C152-R156 PolarHBondContact O-N 3.12Å; L153-R156 WeakPolarHBondContact O-CB 3.4Å; L153-R156 PolarHBondContact O-N 3.48Å; G154-R156 VanDerWaalsContact C-N 3.3Å; G154-R156 PolarHBondContact O-N 3.34Å; R156-F158 VanDerWaalsContact C-N 3.33Å; R156-A159 PolarHBondContact O-N 2.87Å; R156-D160 PolarHBondContact O-N 2.88Å; R156-L168 HydrophobicContact CG-CD1 3.63Å; R156-L168 VanDerWaalsContact O-CD1 3.29Å; R156-L168 WeakPolarHBondContact O-CD1 3.46Å; R156-A171 HydrophobicContact CB-CB 3.93Å; R156-A171 HydrophobicContact CG-CB 4.44Å; R156-N172 PolarHBondContact NH1-OD1 2.85Å
157	A	84.6	Confident	85.4	Confident	38 Å²	38	47.9 Å²	47.9	31%	0.314	28%	0.276	S	S	.	.	H	α-helix	trans	-63.7	-40.7	178.1	0	0	0	0	0	111.6	L153 G154 D160 V161	L153-A157 WeakPolarHBondContact O-CB 3.44Å; L153-A157 PolarHBondContact O-N 3.17Å; G154-A157 PolarHBondContact O-N 3.26Å; A157-D160 PolarHBondContact O-N 3.32Å; A157-V161 WeakPolarHBondContact O-CG2 3.22Å; A157-V161 PolarHBondContact O-N 2.98Å; A157-V161 VanDerWaalsContact O-N 3.12Å
158	F	84.9	Confident	85.4	Confident	43 Å²	43	49 Å²	49	19%	0.189	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-43.6	175.8	-173.4	-108.4	0	0	0	112.1	L124 P125 L143 G154 I155 R156 D160 V161 H162	L124-F158 HydrophobicContact CB-CE1 4.15Å; L124-F158 HydrophobicContact CB-CZ 4.2Å; L124-F158 HydrophobicContact CD2-CD1 4.13Å; L124-F158 HydrophobicContact CD2-CE1 3.36Å; L124-F158 HydrophobicContact CD2-CZ 3.89Å; L124-F158 HydrophobicContact CG-CE1 4.33Å; P125-F158 HydrophobicContact CG-CZ 4.29Å; L143-F158 HydrophobicContact CD1-CD1 4.06Å; L143-F158 HydrophobicContact CD1-CE1 4.01Å; G154-F158 WeakPolarHBondContact O-CB 3.42Å; G154-F158 PolarHBondContact O-N 2.81Å; I155-F158 PolarHBondContact O-N 3.38Å; R156-F158 VanDerWaalsContact C-N 3.33Å; F158-D160 VanDerWaalsContact C-N 3.33Å; F158-D160 PolarHBondContact O-N 3.23Å; F158-V161 PolarHBondContact O-N 3.01Å; F158-H162 AromaticContact CD2-CD2 3.68Å; F158-H162 AromaticContact CD2-NE2 3.68Å; F158-H162 AromaticContact CE1-CD2 3.92Å; F158-H162 AromaticContact CE2-CD2 3.43Å; F158-H162 VanDerWaalsContact CE2-CD2 3.43Å; F158-H162 WeakPolarHBondContact CE2-CD2 3.47Å; F158-H162 AromaticContact CE2-NE2 3.22Å; F158-H162 WeakPolarHBondContact CE2-NE2 3.46Å; F158-H162 AromaticContact CZ-CD2 3.56Å; F158-H162 AromaticContact CZ-NE2 3.69Å; F158-H162 PolarHBondContact O-CD2 3.42Å; F158-H162 PolarHBondContact O-N 3.5Å; F158-H162 VanDerWaalsContact O-N 3.16Å
159	A	87.3	Confident	85.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-36.4	177	0	0	0	0	0	112.7	I155 R156 H162 T163 C164 L167 L168	I155-A159 WeakPolarHBondContact O-CB 3.34Å; I155-A159 PolarHBondContact O-N 2.89Å; R156-A159 PolarHBondContact O-N 2.87Å; A159-H162 CarbonylContact O-C 3.54Å; A159-H162 PolarHBondContact O-N 2.91Å; A159-T163 PolarHBondContact O-N 2.88Å; A159-C164 HydrophobicContact CB-CB 4.26Å; A159-C164 PolarHBondContact O-N 2.97Å; A159-L167 HydrophobicContact CB-CB 4.13Å; A159-L167 HydrophobicContact CB-CD2 4Å; A159-L167 HydrophobicContact CB-CG 3.96Å; A159-L168 HydrophobicContact CB-CB 3.93Å; A159-L168 HydrophobicContact CB-CD1 4.38Å
160	D	85.1	Confident	85.4	Confident	97 Å²	97	54.1 Å²	54.1	52%	0.519	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-48.2	176.6	-165.9	28	0	0	0	111.3	R156 A157 F158 H162 T163 L168	R156-D160 PolarHBondContact O-N 2.88Å; A157-D160 PolarHBondContact O-N 3.32Å; F158-D160 VanDerWaalsContact C-N 3.33Å; F158-D160 PolarHBondContact O-N 3.23Å; D160-H162 VanDerWaalsContact C-N 3.28Å; D160-H162 PolarHBondContact O-N 3.38Å; D160-T163 PolarHBondContact O-N 2.58Å; D160-T163 VanDerWaalsContact O-N 3.14Å; D160-L168 HydrophobicContact CB-CD1 3.99Å
161	V	84.8	Confident	85.5	Confident	110 Å²	110	50 Å²	50	67%	0.667	28%	0.28	S	S	*	.	H	α-helix	trans	-59.4	-38.7	177.9	172.6	0	0	0	0	111.9	A157 F158	A157-V161 WeakPolarHBondContact O-CG2 3.22Å; A157-V161 PolarHBondContact O-N 2.98Å; A157-V161 VanDerWaalsContact O-N 3.12Å; F158-V161 PolarHBondContact O-N 3.01Å
162	H	81.5	Confident	85.5	Confident	40 Å²	40	49.8 Å²	49.8	19%	0.185	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	10.8	-178.8	-62.3	-55.4	0	0	0	114	L124 P125 F158 A159 D160 C164	L124-H162 HydrophobicContact CD2-CB 3.91Å; P125-H162 VanDerWaalsContact CG-CE1 3.46Å; P125-H162 WeakPolarHBondContact CG-CE1 3.42Å; F158-H162 AromaticContact CD2-CD2 3.68Å; F158-H162 AromaticContact CD2-NE2 3.68Å; F158-H162 AromaticContact CE1-CD2 3.92Å; F158-H162 AromaticContact CE2-CD2 3.43Å; F158-H162 VanDerWaalsContact CE2-CD2 3.43Å; F158-H162 WeakPolarHBondContact CE2-CD2 3.47Å; F158-H162 AromaticContact CE2-NE2 3.22Å; F158-H162 WeakPolarHBondContact CE2-NE2 3.46Å; F158-H162 AromaticContact CZ-CD2 3.56Å; F158-H162 AromaticContact CZ-NE2 3.69Å; F158-H162 PolarHBondContact O-CD2 3.42Å; F158-H162 PolarHBondContact O-N 3.5Å; F158-H162 VanDerWaalsContact O-N 3.16Å; A159-H162 CarbonylContact O-C 3.54Å; A159-H162 PolarHBondContact O-N 2.91Å; D160-H162 VanDerWaalsContact C-N 3.28Å; D160-H162 PolarHBondContact O-N 3.38Å; H162-C164 PolarHBondContact O-N 2.87Å; H162-C164 VanDerWaalsContact O-N 3.12Å
163	T	82.2	Confident	85.2	Confident	120 Å²	120	51.3 Å²	51.3	74%	0.736	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	32.4	179.4	49.1	0	0	0	0	113.9	A159 D160 T165	A159-T163 PolarHBondContact O-N 2.88Å; D160-T163 PolarHBondContact O-N 2.58Å; D160-T163 VanDerWaalsContact O-N 3.14Å; T163-T165 PolarHBondContact O-N 2.84Å; T163-T165 VanDerWaalsContact O-N 3.12Å
164	C	83.6	Confident	85.2	Confident	13 Å²	13	53.5 Å²	53.5	9%	0.088	30%	0.3	C	S	.	.			trans	-83.6	82.8	175.5	-67.1	0	0	0	0	109	A159 H162 D166 L167 L168	A159-C164 HydrophobicContact CB-CB 4.26Å; A159-C164 PolarHBondContact O-N 2.97Å; H162-C164 PolarHBondContact O-N 2.87Å; H162-C164 VanDerWaalsContact O-N 3.12Å; C164-D166 VanDerWaalsContact C-N 3.31Å; C164-D166 PolarHBondContact O-N 3.46Å; C164-L167 HydrophobicContact CB-CB 4.15Å; C164-L167 PolarHBondContact O-N 3.03Å; C164-L168 VanDerWaalsContact O-CB 3.26Å; C164-L168 WeakPolarHBondContact O-CB 3.34Å; C164-L168 PolarHBondContact O-N 3.28Å
165	T	84.3	Confident	85.1	Confident	97 Å²	97	52.1 Å²	52.1	60%	0.595	29%	0.286	S	S	*	.	H	α-helix	trans	-59.3	-39.3	-172.5	51.9	0	0	0	0	113.4	T163 L168 Q169	T163-T165 PolarHBondContact O-N 2.84Å; T163-T165 VanDerWaalsContact O-N 3.12Å; T165-L168 PolarHBondContact O-N 2.96Å; T165-Q169 WeakPolarHBondContact O-CB 3.29Å; T165-Q169 PolarHBondContact O-N 3.3Å
166	D	83.8	Confident	84.9	Confident	107 Å²	107	52.2 Å²	52.2	57%	0.572	29%	0.286	S	S	*	.	H	α-helix	trans	-69.8	-48.3	-176.7	-60	-20.6	0	0	0	110.6	C164 L168 Q169 Q170	C164-D166 VanDerWaalsContact C-N 3.31Å; C164-D166 PolarHBondContact O-N 3.46Å; D166-L168 VanDerWaalsContact C-N 3.31Å; D166-L168 PolarHBondContact O-N 2.95Å; D166-Q169 PolarHBondContact O-N 3Å; D166-Q170 VanDerWaalsContact O-CG 3.31Å; D166-Q170 WeakPolarHBondContact O-CG 3.28Å; D166-Q170 PolarHBondContact O-N 3.04Å
167	L	87.8	Confident	84.5	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-40.1	175.2	-177.7	63.2	0	0	0	111.4	L143 Q144 I155 A159 C164 Q169 Q170 A171	L143-L167 HydrophobicContact CB-CD1 4.06Å; L143-L167 HydrophobicContact CB-CD2 4Å; L143-L167 HydrophobicContact CD1-CD2 3.66Å; L143-L167 HydrophobicContact CG-CD2 4.49Å; Q144-L167 HydrophobicContact CB-CD1 4.32Å; I155-L167 HydrophobicContact CG2-CD1 4.03Å; I155-L167 HydrophobicContact CG2-CD2 4.1Å; I155-L167 HydrophobicContact CG2-CG 4.1Å; A159-L167 HydrophobicContact CB-CB 4.13Å; A159-L167 HydrophobicContact CB-CD2 4Å; A159-L167 HydrophobicContact CB-CG 3.96Å; C164-L167 HydrophobicContact CB-CB 4.15Å; C164-L167 PolarHBondContact O-N 3.03Å; L167-Q169 PolarHBondContact O-N 2.96Å; L167-Q170 PolarHBondContact O-N 3.49Å; L167-A171 VanDerWaalsContact O-CB 3.29Å; L167-A171 WeakPolarHBondContact O-CB 3.29Å; L167-A171 PolarHBondContact O-N 3.07Å
168	L	86.3	Confident	84.3	Confident	49 Å²	49	54.5 Å²	54.5	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-45.6	176.5	-179.7	68.2	0	0	0	111.3	R156 A159 D160 C164 T165 D166 N172	R156-L168 HydrophobicContact CG-CD1 3.63Å; R156-L168 VanDerWaalsContact O-CD1 3.29Å; R156-L168 WeakPolarHBondContact O-CD1 3.46Å; A159-L168 HydrophobicContact CB-CB 3.93Å; A159-L168 HydrophobicContact CB-CD1 4.38Å; D160-L168 HydrophobicContact CB-CD1 3.99Å; C164-L168 VanDerWaalsContact O-CB 3.26Å; C164-L168 WeakPolarHBondContact O-CB 3.34Å; C164-L168 PolarHBondContact O-N 3.28Å; T165-L168 PolarHBondContact O-N 2.96Å; D166-L168 VanDerWaalsContact C-N 3.31Å; D166-L168 PolarHBondContact O-N 2.95Å; L168-N172 VanDerWaalsContact O-CB 3.25Å; L168-N172 WeakPolarHBondContact O-CB 3.5Å; L168-N172 PolarHBondContact O-N 2.9Å
169	Q	85.3	Confident	84.3	Confident	134 Å²	134	52.5 Å²	52.5	63%	0.626	28%	0.282	S	S	*	.	H	α-helix	trans	-64.9	-41.9	178.6	-175.3	175.1	-5.2	0	0	111.6	T165 D166 L167 A173	T165-Q169 WeakPolarHBondContact O-CB 3.29Å; T165-Q169 PolarHBondContact O-N 3.3Å; D166-Q169 PolarHBondContact O-N 3Å; L167-Q169 PolarHBondContact O-N 2.96Å; Q169-A173 WeakPolarHBondContact O-CB 3.36Å; Q169-A173 PolarHBondContact O-N 3.07Å
170	Q	84.2	Confident	83.9	Confident	85 Å²	85	54.6 Å²	54.6	40%	0.397	30%	0.295	S	S	.	.	H	α-helix	trans	-66.2	-47.1	177.4	-67	-60.5	-28.8	0	0	111.9	D166 L167 N172 A173 Y174	D166-Q170 VanDerWaalsContact O-CG 3.31Å; D166-Q170 WeakPolarHBondContact O-CG 3.28Å; D166-Q170 PolarHBondContact O-N 3.04Å; L167-Q170 PolarHBondContact O-N 3.49Å; Q170-N172 VanDerWaalsContact C-N 3.32Å; Q170-N172 PolarHBondContact O-N 3.11Å; Q170-A173 PolarHBondContact O-N 2.78Å; Q170-Y174 WeakPolarHBondContact O-CB 3.41Å; Q170-Y174 PolarHBondContact O-N 2.77Å
171	A	87.4	Confident	83.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.7	-39.2	177.1	0	0	0	0	0	111.7	L147 I155 R156 L167 Y174 A175	L147-A171 HydrophobicContact CD2-CB 4.09Å; I155-A171 HydrophobicContact CG2-CB 4.33Å; R156-A171 HydrophobicContact CB-CB 3.93Å; R156-A171 HydrophobicContact CG-CB 4.44Å; L167-A171 VanDerWaalsContact O-CB 3.29Å; L167-A171 WeakPolarHBondContact O-CB 3.29Å; L167-A171 PolarHBondContact O-N 3.07Å; A171-Y174 PolarHBondContact O-N 2.81Å; A171-A175 WeakPolarHBondContact O-CB 3.37Å; A171-A175 PolarHBondContact O-N 2.65Å
172	N	86.6	Confident	83.8	Confident	43 Å²	43	50.2 Å²	50.2	23%	0.23	27%	0.265	C	S	.	.	H	α-helix	trans	-67.7	-43.4	175.9	-165.7	50.7	0	0	0	112.1	R156 L168 Q170 Y174 A175 E176	R156-N172 PolarHBondContact NH1-OD1 2.85Å; L168-N172 VanDerWaalsContact O-CB 3.25Å; L168-N172 WeakPolarHBondContact O-CB 3.5Å; L168-N172 PolarHBondContact O-N 2.9Å; Q170-N172 VanDerWaalsContact C-N 3.32Å; Q170-N172 PolarHBondContact O-N 3.11Å; N172-Y174 VanDerWaalsContact C-N 3.32Å; N172-Y174 PolarHBondContact O-N 3Å; N172-A175 PolarHBondContact O-N 2.97Å; N172-E176 WeakPolarHBondContact O-CB 2.92Å; N172-E176 VanDerWaalsContact O-CG 3.31Å; N172-E176 WeakPolarHBondContact O-CG 3.37Å; N172-E176 PolarHBondContact O-N 3.24Å
173	A	83.1	Confident	83.8	Confident	31 Å²	31	49.1 Å²	49.1	26%	0.256	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-40.8	175	0	0	0	0	0	111.8	Q169 Q170 E176 Q177	Q169-A173 WeakPolarHBondContact O-CB 3.36Å; Q169-A173 PolarHBondContact O-N 3.07Å; Q170-A173 PolarHBondContact O-N 2.78Å; A173-E176 PolarHBondContact O-N 3.4Å; A173-Q177 WeakPolarHBondContact O-CB 3.38Å; A173-Q177 VanDerWaalsContact O-CG 3.27Å; A173-Q177 WeakPolarHBondContact O-CG 3.44Å; A173-Q177 PolarHBondContact O-N 2.98Å
174	Y	84.7	Confident	83.8	Confident	51 Å²	51	50.3 Å²	50.3	20%	0.2	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-45.5	176.2	-169.7	-83.8	0	0	0	111.9	L147 P149 C152 Q170 A171 N172 E176 Q177 H178	L147-Y174 HydrophobicContact CB-CD2 4.2Å; L147-Y174 HydrophobicContact CB-CE2 4.32Å; L147-Y174 HydrophobicContact CB-CG 4.33Å; P149-Y174 HydrophobicContact CG-CE1 4.31Å; C152-Y174 HydrophobicContact CB-CD1 3.93Å; C152-Y174 HydrophobicContact CB-CE1 4.47Å; Q170-Y174 WeakPolarHBondContact O-CB 3.41Å; Q170-Y174 PolarHBondContact O-N 2.77Å; A171-Y174 PolarHBondContact O-N 2.81Å; N172-Y174 VanDerWaalsContact C-N 3.32Å; N172-Y174 PolarHBondContact O-N 3Å; Y174-E176 VanDerWaalsContact C-N 3.33Å; Y174-E176 PolarHBondContact O-N 3.35Å; Y174-Q177 PolarHBondContact O-N 3.26Å; Y174-H178 AromaticContact CD1-ND1 3.94Å; Y174-H178 AromaticContact CD2-ND1 3.95Å; Y174-H178 HydrophobicContact CE1-CB 4.24Å; Y174-H178 AromaticContact CE1-ND1 3.68Å; Y174-H178 AromaticContact CE2-CE1 3.69Å; Y174-H178 AromaticContact CE2-ND1 3.7Å; Y174-H178 AromaticContact CZ-CE1 3.8Å; Y174-H178 AromaticContact CZ-ND1 3.55Å; Y174-H178 PolarHBondContact O-N 3.43Å; Y174-H178 PolarHBondContact O-ND1 3.46Å
175	A	85.2	Confident	83.7	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-37.1	176.8	0	0	0	0	0	112.3	L153 A171 N172 F179	L153-A175 HydrophobicContact CD2-CB 4.28Å; A171-A175 WeakPolarHBondContact O-CB 3.37Å; A171-A175 PolarHBondContact O-N 2.65Å; N172-A175 PolarHBondContact O-N 2.97Å; A175-F179 WeakPolarHBondContact O-CA 3.44Å; A175-F179 PolarHBondContact O-N 2.95Å
176	E	83.4	Confident	83.5	Confident	16 Å²	16	54.1 Å²	54.1	8%	0.075	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-34.7	173.3	-73.1	177.9	165.3	0	0	112.2	N172 A173 Y174 L199 S202 K204 T206	N172-E176 WeakPolarHBondContact O-CB 2.92Å; N172-E176 VanDerWaalsContact O-CG 3.31Å; N172-E176 WeakPolarHBondContact O-CG 3.37Å; N172-E176 PolarHBondContact O-N 3.24Å; A173-E176 PolarHBondContact O-N 3.4Å; Y174-E176 VanDerWaalsContact C-N 3.33Å; Y174-E176 PolarHBondContact O-N 3.35Å; E176-L199 HydrophobicContact CG-CD1 4.19Å; E176-S202 VanDerWaalsContact OE1-CB 3.31Å; E176-S202 WeakPolarHBondContact OE1-CB 3.21Å; E176-S202 PolarHBondContact OE1-OG 3.42Å; E176-K204 VanDerWaalsContact OE2-CB 3.3Å; E176-K204 WeakPolarHBondContact OE2-CB 3.29Å; E176-T206 PolarHBondContact O-N 2.81Å
177	Q	79.2	Confident	83.4	Confident	59 Å²	59	52 Å²	52	28%	0.276	26%	0.262	S	S	.	.	H	α-helix	trans	-76.7	-40	179.6	-74.5	174	6.7	0	0	113.5	A173 Y174 T206	A173-Q177 WeakPolarHBondContact O-CB 3.38Å; A173-Q177 VanDerWaalsContact O-CG 3.27Å; A173-Q177 WeakPolarHBondContact O-CG 3.44Å; A173-Q177 PolarHBondContact O-N 2.98Å; Y174-Q177 PolarHBondContact O-N 3.26Å; Q177-T206 WeakPolarHBondContact O-CB 3.44Å
178	H	80.4	Confident	83.3	Confident	45 Å²	45	51.7 Å²	51.7	21%	0.208	26%	0.261	C	S	.	.	S	Bend	trans	-104.8	24.6	-176.3	-61.8	88.1	0	0	0	113	P149 Y174 P180 E181 V182	P149-H178 HydrophobicContact CG-CB 4.46Å; Y174-H178 AromaticContact CD1-ND1 3.94Å; Y174-H178 AromaticContact CD2-ND1 3.95Å; Y174-H178 HydrophobicContact CE1-CB 4.24Å; Y174-H178 AromaticContact CE1-ND1 3.68Å; Y174-H178 AromaticContact CE2-CE1 3.69Å; Y174-H178 AromaticContact CE2-ND1 3.7Å; Y174-H178 AromaticContact CZ-CE1 3.8Å; Y174-H178 AromaticContact CZ-ND1 3.55Å; Y174-H178 PolarHBondContact O-N 3.43Å; Y174-H178 PolarHBondContact O-ND1 3.46Å; H178-P180 VanDerWaalsContact C-N 3.34Å; H178-P180 VanDerWaalsContact O-N 3.14Å; H178-E181 PolarHBondContact O-N 3.12Å; H178-V182 HydrophobicContact CB-CG2 4.44Å; H178-V182 WeakPolarHBondContact O-CG2 3.43Å; H178-V182 PolarHBondContact O-N 3.32Å; H178-V182 VanDerWaalsContact O-N 3.12Å
179	F	84.3	Confident	83.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-49	-41.6	-174.4	-175.6	-98.1	0	0	0	115.4	A175 E181 V182 M183 F188 L199 L205 V207 V213 A216	A175-F179 WeakPolarHBondContact O-CA 3.44Å; A175-F179 PolarHBondContact O-N 2.95Å; F179-E181 PolarHBondContact O-N 2.91Å; F179-V182 PolarHBondContact O-N 3.14Å; F179-M183 HydrophobicContact CE1-CB 4.44Å; F179-M183 HydrophobicContact CE1-SD 4.21Å; F179-M183 HydrophobicContact CZ-CB 4.45Å; F179-M183 PolarHBondContact O-N 3.26Å; F179-F188 HydrophobicContact CE2-CE2 4.18Å; F179-L199 HydrophobicContact CD2-CD2 3.92Å; F179-L199 HydrophobicContact CD2-CG 4.16Å; F179-L199 HydrophobicContact CE2-CD2 3.65Å; F179-L199 HydrophobicContact CE2-CG 3.97Å; F179-L205 HydrophobicContact CB-CD1 4.24Å; F179-L205 HydrophobicContact CB-CD2 4.39Å; F179-L205 HydrophobicContact CB-CG 4.02Å; F179-L205 HydrophobicContact CD1-CD1 4.29Å; F179-L205 HydrophobicContact CD1-CD2 3.69Å; F179-L205 HydrophobicContact CD1-CG 4.17Å; F179-L205 HydrophobicContact CD2-CD1 3.52Å; F179-L205 HydrophobicContact CD2-CD2 4.42Å; F179-L205 HydrophobicContact CD2-CG 4.16Å; F179-L205 HydrophobicContact CE1-CD2 3.99Å; F179-L205 HydrophobicContact CE2-CD1 3.85Å; F179-L205 HydrophobicContact CG-CD1 3.74Å; F179-L205 HydrophobicContact CG-CD2 3.9Å; F179-L205 HydrophobicContact CG-CG 3.84Å; F179-L205 HydrophobicContact CZ-CD1 4.35Å; F179-L205 HydrophobicContact CZ-CD2 4.47Å; F179-V207 HydrophobicContact CD1-CG1 3.65Å; F179-V207 HydrophobicContact CE1-CG1 4.35Å; F179-V207 HydrophobicContact CG-CG1 4.46Å; F179-V213 HydrophobicContact CE1-CG2 4.43Å; F179-A216 HydrophobicContact CE1-CB 4.08Å; F179-A216 HydrophobicContact CZ-CB 3.9Å
180	P	79.9	Confident	83.1	Confident	44 Å²	44	48.7 Å²	48.7	29%	0.286	26%	0.256	S	S	.	.	H	α-helix	trans	-61.2	-27.6	179.3	-24.2	35.4	0	0	0	114.4	H178 M183	H178-P180 VanDerWaalsContact C-N 3.34Å; H178-P180 VanDerWaalsContact O-N 3.14Å; P180-M183 HydrophobicContact CB-CE 4.31Å; P180-M183 VanDerWaalsContact O-CE 3.3Å; P180-M183 WeakPolarHBondContact O-CE 3.38Å; P180-M183 VanDerWaalsContact O-CG 3.31Å; P180-M183 WeakPolarHBondContact O-CG 3.34Å
181	E	81.4	Confident	83	Confident	115 Å²	115	45.1 Å²	45.1	54%	0.537	24%	0.239	S	C	.	.	H	α-helix	trans	-87.5	-39.9	177.3	-65.3	175.2	-151.8	0	0	110.6	P149 H178 F179 M183 L184	P149-E181 HydrophobicContact CB-CB 3.83Å; P149-E181 HydrophobicContact CG-CB 4.18Å; P149-E181 WeakPolarHBondContact CG-OE2 3.39Å; H178-E181 PolarHBondContact O-N 3.12Å; F179-E181 PolarHBondContact O-N 2.91Å; E181-M183 VanDerWaalsContact C-N 3.32Å; E181-M183 PolarHBondContact O-N 3.46Å; E181-L184 PolarHBondContact O-N 2.9Å
182	V	85.2	Confident	82.9	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-39.5	178.6	176.7	0	0	0	0	111.8	P149 C152 L153 H178 F179 L184 G185	P149-V182 HydrophobicContact CB-CG2 4.19Å; C152-V182 VanDerWaalsContact SG-CG2 3.55Å; L153-V182 HydrophobicContact CD1-CG1 3.55Å; L153-V182 HydrophobicContact CD2-CG1 4.08Å; L153-V182 HydrophobicContact CG-CG1 3.74Å; H178-V182 HydrophobicContact CB-CG2 4.44Å; H178-V182 WeakPolarHBondContact O-CG2 3.43Å; H178-V182 PolarHBondContact O-N 3.32Å; H178-V182 VanDerWaalsContact O-N 3.12Å; F179-V182 PolarHBondContact O-N 3.14Å; V182-L184 PolarHBondContact O-N 3.06Å; V182-G185 PolarHBondContact O-N 3.36Å
183	M	82.6	Confident	82.7	Confident	16 Å²	16	46.9 Å²	46.9	8%	0.079	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-18.2	-179.2	69.8	-179.8	-174.3	0	0	114.1	F179 P180 E181 F188 K212 A216	F179-M183 HydrophobicContact CE1-CB 4.44Å; F179-M183 HydrophobicContact CE1-SD 4.21Å; F179-M183 HydrophobicContact CZ-CB 4.45Å; F179-M183 PolarHBondContact O-N 3.26Å; P180-M183 HydrophobicContact CB-CE 4.31Å; P180-M183 VanDerWaalsContact O-CE 3.3Å; P180-M183 WeakPolarHBondContact O-CE 3.38Å; P180-M183 VanDerWaalsContact O-CG 3.31Å; P180-M183 WeakPolarHBondContact O-CG 3.34Å; E181-M183 VanDerWaalsContact C-N 3.32Å; E181-M183 PolarHBondContact O-N 3.46Å; M183-F188 HydrophobicContact CB-CD1 4.5Å; M183-K212 HydrophobicContact CE-CB 4.18Å; M183-K212 HydrophobicContact CE-CD 3.84Å; M183-K212 HydrophobicContact CE-CG 4.34Å; M183-K212 HydrophobicContact SD-CB 4.28Å; M183-A216 HydrophobicContact CB-CB 3.94Å; M183-A216 HydrophobicContact SD-CB 3.98Å
184	L	80.6	Confident	82.7	Confident	145 Å²	145	51.4 Å²	51.4	76%	0.759	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-15.9	176.5	-62.4	173.7	0	0	0	112.4	E181 V182	E181-L184 PolarHBondContact O-N 2.9Å; V182-L184 PolarHBondContact O-N 3.06Å
185	G	81.5	Confident	82.7	Confident	18 Å²	18	51.8 Å²	51.8	19%	0.186	28%	0.276	C	S	.	.	S	Bend	trans	-77.7	150.8	-178.3	0	0	0	0	0	113.5	V182 E187 F188	V182-G185 PolarHBondContact O-N 3.36Å; G185-E187 VanDerWaalsContact C-N 3.27Å; G185-E187 PolarHBondContact O-N 2.98Å; G185-F188 PolarHBondContact O-N 2.84Å
186	E	80	Confident	82.7	Confident	172 Å²	172	51.8 Å²	51.8	80%	0.804	28%	0.276	S	S	*	.	H	α-helix	trans	-64.2	-31.8	176.6	-65.4	-173.6	170.3	0	0	112.5	F188 L189 S190	E186-F188 PolarHBondContact O-N 3.36Å; E186-L189 PolarHBondContact O-N 2.95Å; E186-L189 VanDerWaalsContact O-N 3.08Å; E186-S190 PolarHBondContact O-N 3.38Å
187	E	83.3	Confident	82.8	Confident	62 Å²	62	51.8 Å²	51.8	29%	0.29	28%	0.278	S	S	.	.	H	α-helix	trans	-56.5	-37.1	176.7	-66.5	-164.9	162.6	0	0	111.7	N151 L153 G154 G185 L189 S190 L191	N151-E187 WeakPolarHBondContact CA-OE2 3.43Å; L153-E187 HydrophobicContact CB-CB 4.11Å; L153-E187 WeakPolarHBondContact CB-OE2 3.41Å; L153-E187 HydrophobicContact CD1-CB 4.12Å; L153-E187 PolarHBondContact N-OE2 3.3Å; G154-E187 PolarHBondContact N-OE2 3.42Å; G185-E187 VanDerWaalsContact C-N 3.27Å; G185-E187 PolarHBondContact O-N 2.98Å; E187-L189 PolarHBondContact O-N 2.81Å; E187-S190 PolarHBondContact O-N 3.34Å; E187-S190 PolarHBondContact O-OG 3.3Å; E187-L191 PolarHBondContact O-N 2.87Å
188	F	85.2	Confident	83	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.9	-40.4	178.2	-179.8	-100.5	0	0	0	112.3	L153 F179 M183 G185 E186 S190 L191 V196 L199 A216 W220	L153-F188 HydrophobicContact CD1-CB 3.83Å; L153-F188 HydrophobicContact CD1-CD2 4.26Å; F179-F188 HydrophobicContact CE2-CE2 4.18Å; M183-F188 HydrophobicContact CB-CD1 4.5Å; G185-F188 PolarHBondContact O-N 2.84Å; E186-F188 PolarHBondContact O-N 3.36Å; F188-S190 PolarHBondContact O-N 3.06Å; F188-L191 HydrophobicContact CD2-CD1 3.81Å; F188-L191 HydrophobicContact CE2-CD1 4.29Å; F188-L191 WeakPolarHBondContact O-CB 3.42Å; F188-L191 WeakPolarHBondContact O-CG 3.23Å; F188-L191 PolarHBondContact O-N 3.49Å; F188-V196 HydrophobicContact CZ-CG1 4.36Å; F188-L199 HydrophobicContact CD2-CD2 4.46Å; F188-L199 HydrophobicContact CE2-CD2 4.13Å; F188-A216 HydrophobicContact CE1-CB 4.16Å; F188-A216 HydrophobicContact CZ-CB 4.14Å; F188-W220 HydrophobicContact CE1-CB 4.01Å; F188-W220 VanDerWaalsContact O-CD1 3.31Å
189	L	82.4	Confident	83.2	Confident	31 Å²	31	50.3 Å²	50.3	16%	0.162	28%	0.279	C	S	.	.	H	α-helix	trans	-67.6	-25.5	179.5	-60.6	177.4	0	0	0	112.5	E186 E187 Y223 R228	E186-L189 PolarHBondContact O-N 2.95Å; E186-L189 VanDerWaalsContact O-N 3.08Å; E187-L189 PolarHBondContact O-N 2.81Å; L189-Y223 HydrophobicContact CB-CD1 4.27Å; L189-Y223 HydrophobicContact CB-CD2 4.16Å; L189-Y223 HydrophobicContact CB-CE2 4.49Å; L189-Y223 HydrophobicContact CB-CG 4.05Å; L189-Y223 HydrophobicContact CD1-CD2 3.85Å; L189-Y223 HydrophobicContact CD1-CE2 4.31Å; L189-Y223 HydrophobicContact CD1-CG 4.4Å; L189-R228 PolarHBondContact O-NH1 3.36Å; L189-R228 PolarHBondContact O-NH2 2.86Å; L189-R228 VanDerWaalsContact O-NH2 3.08Å
190	S	83.6	Confident	83.3	Confident	88 Å²	88	50.3 Å²	50.3	62%	0.615	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-9.8	178	77	0	0	0	0	114.8	E186 E187 F188	E186-S190 PolarHBondContact O-N 3.38Å; E187-S190 PolarHBondContact O-N 3.34Å; E187-S190 PolarHBondContact O-OG 3.3Å; F188-S190 PolarHBondContact O-N 3.06Å
191	L	83.8	Confident	83.5	Confident	10 Å²	10	50.6 Å²	50.6	5%	0.052	28%	0.282	C	S	.	.			trans	-65.3	150.9	-178.4	-68.1	179.1	0	0	0	113.1	L153 E187 F188 Q195 V196 W220	L153-L191 HydrophobicContact CB-CD2 4.46Å; L153-L191 HydrophobicContact CD1-CD1 3.88Å; L153-L191 HydrophobicContact CD1-CD2 4.48Å; L153-L191 HydrophobicContact CD1-CG 4.29Å; L153-L191 HydrophobicContact CD2-CD1 4.24Å; E187-L191 PolarHBondContact O-N 2.87Å; F188-L191 HydrophobicContact CD2-CD1 3.81Å; F188-L191 HydrophobicContact CE2-CD1 4.29Å; F188-L191 WeakPolarHBondContact O-CB 3.42Å; F188-L191 WeakPolarHBondContact O-CG 3.23Å; F188-L191 PolarHBondContact O-N 3.49Å; L191-Q195 HydrophobicContact CB-CB 4.36Å; L191-Q195 HydrophobicContact CD2-CB 4.39Å; L191-V196 HydrophobicContact CB-CG2 3.69Å; L191-V196 HydrophobicContact CD1-CG2 4.14Å; L191-W220 WeakPolarHBondContact O-CZ2 3.29Å; L191-W220 PolarHBondContact O-NE1 3.16Å; L191-W220 VanDerWaalsContact O-NE1 3.13Å
192	S	84.9	Confident	83.5	Confident	55 Å²	55	46.1 Å²	46.1	39%	0.385	26%	0.263	S	S	.	.			trans	-75	161.9	172.5	76.9	0	0	0	0	112.4	D194 Q195 V196	S192-D194 VanDerWaalsContact C-N 3.32Å; S192-D194 PolarHBondContact O-N 3.12Å; S192-Q195 VanDerWaalsContact N-OE1 3.16Å; S192-Q195 PolarHBondContact O-N 3.45Å; S192-Q195 WeakPolarHBondContact OG-CG 3.33Å; S192-Q195 PolarHBondContact OG-OE1 3.44Å; S192-V196 WeakPolarHBondContact O-CG2 3.17Å; S192-V196 PolarHBondContact O-N 3.42Å
193	L	82.5	Confident	82.9	Confident	26 Å²	26	48.7 Å²	48.7	14%	0.136	28%	0.277	C	S	.	.	H	α-helix	trans	-54.2	-47.2	178.8	-179.8	67.2	0	0	0	112.5	Q195 V196 C197 W220 H231 L235	L193-Q195 VanDerWaalsContact C-N 3.31Å; L193-Q195 PolarHBondContact O-N 3.34Å; L193-V196 PolarHBondContact O-N 2.83Å; L193-C197 WeakPolarHBondContact O-CB 3.43Å; L193-C197 PolarHBondContact O-N 3.23Å; L193-C197 PolarHBondContact O-SG 2.77Å; L193-W220 HydrophobicContact CB-CH2 4.4Å; L193-W220 HydrophobicContact CD1-CH2 4.12Å; L193-W220 HydrophobicContact CD1-CZ3 4.35Å; L193-H231 HydrophobicContact CD1-CB 3.59Å; L193-H231 HydrophobicContact CD2-CB 3.97Å; L193-H231 HydrophobicContact CG-CB 4.4Å; L193-L235 HydrophobicContact CD1-CD1 4.07Å; L193-L235 HydrophobicContact CD1-CD2 3.96Å; L193-L235 HydrophobicContact CD1-CG 3.9Å
194	D	83.1	Confident	82.3	Confident	125 Å²	125	53.2 Å²	53.2	67%	0.668	30%	0.296	S	S	*	.	H	α-helix	trans	-65.5	-36.6	-176.6	-65.2	-44.6	0	0	0	111.6	S192 S198	S192-D194 VanDerWaalsContact C-N 3.32Å; S192-D194 PolarHBondContact O-N 3.12Å; D194-S198 VanDerWaalsContact O-CB 3.27Å; D194-S198 WeakPolarHBondContact O-CB 3.26Å; D194-S198 PolarHBondContact O-N 2.93Å
195	Q	83.9	Confident	82.1	Confident	60 Å²	60	46.3 Å²	46.3	28%	0.28	26%	0.26	S	S	.	.	H	α-helix	trans	-68.4	-41.1	177	-71.3	174	-27.7	0	0	112	L191 S192 L193 L199	L191-Q195 HydrophobicContact CB-CB 4.36Å; L191-Q195 HydrophobicContact CD2-CB 4.39Å; S192-Q195 VanDerWaalsContact N-OE1 3.16Å; S192-Q195 PolarHBondContact O-N 3.45Å; S192-Q195 WeakPolarHBondContact OG-CG 3.33Å; S192-Q195 PolarHBondContact OG-OE1 3.44Å; L193-Q195 VanDerWaalsContact C-N 3.31Å; L193-Q195 PolarHBondContact O-N 3.34Å; Q195-L199 PolarHBondContact O-N 2.63Å; Q195-L199 VanDerWaalsContact O-N 3.12Å
196	V	86.1	Confident	81.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-48.4	175.8	178	0	0	0	0	110.1	F188 L191 S192 L193 S198 L199 I200 W220 L235	F188-V196 HydrophobicContact CZ-CG1 4.36Å; L191-V196 HydrophobicContact CB-CG2 3.69Å; L191-V196 HydrophobicContact CD1-CG2 4.14Å; S192-V196 WeakPolarHBondContact O-CG2 3.17Å; S192-V196 PolarHBondContact O-N 3.42Å; L193-V196 PolarHBondContact O-N 2.83Å; V196-S198 VanDerWaalsContact C-N 3.31Å; V196-S198 PolarHBondContact O-N 2.92Å; V196-L199 PolarHBondContact O-N 3.39Å; V196-L199 VanDerWaalsContact O-N 3.08Å; V196-I200 HydrophobicContact CG1-CG2 4.19Å; V196-I200 WeakPolarHBondContact O-CG1 3.31Å; V196-I200 PolarHBondContact O-N 3.24Å; V196-W220 HydrophobicContact CG2-CD2 4.29Å; V196-W220 HydrophobicContact CG2-CG 4.34Å; V196-W220 HydrophobicContact CG2-CZ2 4.31Å; V196-L235 HydrophobicContact CB-CD2 4.31Å; V196-L235 HydrophobicContact CG1-CD2 3.75Å
197	C	85.4	Confident	81.1	Confident	16 Å²	16	41 Å²	41	11%	0.108	24%	0.236	C	C	.	.	H	α-helix	trans	-55	-45	176	-75.4	0	0	0	0	111.9	L193 L199 S201	L193-C197 WeakPolarHBondContact O-CB 3.43Å; L193-C197 PolarHBondContact O-N 3.23Å; L193-C197 PolarHBondContact O-SG 2.77Å; C197-L199 VanDerWaalsContact C-N 3.33Å; C197-L199 PolarHBondContact O-N 2.87Å; C197-S201 WeakPolarHBondContact O-CB 3.45Å; C197-S201 PolarHBondContact O-N 2.92Å; C197-S201 PolarHBondContact O-OG 3.36Å
198	S	83.8	Confident	80.1	Confident	71 Å²	71	43.2 Å²	43.2	50%	0.497	26%	0.258	S	S	.	.	H	α-helix	trans	-59.8	-42.6	176.3	179.6	0	0	0	0	112	D194 V196 S201	D194-S198 VanDerWaalsContact O-CB 3.27Å; D194-S198 WeakPolarHBondContact O-CB 3.26Å; D194-S198 PolarHBondContact O-N 2.93Å; V196-S198 VanDerWaalsContact C-N 3.31Å; V196-S198 PolarHBondContact O-N 2.92Å; S198-S201 PolarHBondContact O-OG 2.89Å; S198-S201 VanDerWaalsContact O-OG 3.07Å
199	L	84	Confident	79.4	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-69.4	-50	179.5	-169.7	62.3	0	0	0	112	E176 F179 F188 Q195 V196 C197 S201 S202 L205	E176-L199 HydrophobicContact CG-CD1 4.19Å; F179-L199 HydrophobicContact CD2-CD2 3.92Å; F179-L199 HydrophobicContact CD2-CG 4.16Å; F179-L199 HydrophobicContact CE2-CD2 3.65Å; F179-L199 HydrophobicContact CE2-CG 3.97Å; F188-L199 HydrophobicContact CD2-CD2 4.46Å; F188-L199 HydrophobicContact CE2-CD2 4.13Å; Q195-L199 PolarHBondContact O-N 2.63Å; Q195-L199 VanDerWaalsContact O-N 3.12Å; V196-L199 PolarHBondContact O-N 3.39Å; V196-L199 VanDerWaalsContact O-N 3.08Å; C197-L199 VanDerWaalsContact C-N 3.33Å; C197-L199 PolarHBondContact O-N 2.87Å; L199-S201 VanDerWaalsContact C-N 3.32Å; L199-S201 PolarHBondContact O-N 3.4Å; L199-S202 WeakPolarHBondContact O-CB 3.38Å; L199-S202 PolarHBondContact O-N 3.41Å; L199-L205 HydrophobicContact CD1-CD1 4.32Å; L199-L205 HydrophobicContact CG-CD1 4.15Å; L199-L205 WeakPolarHBondContact O-CD1 3.29Å
200	I	85.4	Confident	79.3	Confident	0 Å²	0	44 Å²	44	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-73.4	-21.1	-177.1	68.1	176.1	0	0	0	113.4	V196 S202 V213 V217 L235 H238 R294	V196-I200 HydrophobicContact CG1-CG2 4.19Å; V196-I200 WeakPolarHBondContact O-CG1 3.31Å; V196-I200 PolarHBondContact O-N 3.24Å; I200-S202 VanDerWaalsContact C-N 3.32Å; I200-V213 HydrophobicContact CB-CG1 4.3Å; I200-V213 HydrophobicContact CG2-CG1 4.28Å; I200-V217 HydrophobicContact CD1-CG2 4.03Å; I200-V217 HydrophobicContact CG2-CG2 4.42Å; I200-L235 HydrophobicContact CD1-CB 4.3Å; I200-L235 HydrophobicContact CD1-CD2 3.69Å; I200-L235 WeakPolarHBondContact CD1-O 3.41Å; I200-H238 HydrophobicContact CD1-CB 3.77Å; I200-H238 HydrophobicContact CG1-CB 3.66Å; I200-R294 VanDerWaalsContact O-CZ 3.23Å; I200-R294 PolarHBondContact O-NH1 2.75Å; I200-R294 PolarHBondContact O-NH2 2.74Å
201	S	84.8	Confident	79.2	Confident	51 Å²	51	42.1 Å²	42.1	36%	0.357	25%	0.246	S	C	.	.	H	α-helix	trans	-77.8	-19.3	175	61.3	0	0	0	0	112.7	C197 S198 L199 D203	C197-S201 WeakPolarHBondContact O-CB 3.45Å; C197-S201 PolarHBondContact O-N 2.92Å; C197-S201 PolarHBondContact O-OG 3.36Å; S198-S201 PolarHBondContact O-OG 2.89Å; S198-S201 VanDerWaalsContact O-OG 3.07Å; L199-S201 VanDerWaalsContact C-N 3.32Å; L199-S201 PolarHBondContact O-N 3.4Å; S201-D203 PolarHBondContact O-N 2.86Å
202	S	80.6	Confident	79	Confident	20 Å²	20	44.6 Å²	44.6	14%	0.14	26%	0.256	C	S	.	.			trans	-63.2	123.1	-176.3	-173.7	0	0	0	0	112.9	E176 L199 I200 K204 L205 R294	E176-S202 VanDerWaalsContact OE1-CB 3.31Å; E176-S202 WeakPolarHBondContact OE1-CB 3.21Å; E176-S202 PolarHBondContact OE1-OG 3.42Å; L199-S202 WeakPolarHBondContact O-CB 3.38Å; L199-S202 PolarHBondContact O-N 3.41Å; I200-S202 VanDerWaalsContact C-N 3.32Å; S202-K204 PolarHBondContact O-N 3.06Å; S202-K204 VanDerWaalsContact O-N 3.16Å; S202-K204 PolarHBondContact OG-N 3.38Å; S202-L205 PolarHBondContact O-N 3.25Å; S202-R294 PolarHBondContact O-NH1 3Å
203	D	72.4	Confident	79	Confident	56 Å²	56	42 Å²	42	30%	0.299	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17	172.8	-89	-13.8	0	0	0	113	S201 R240 K292 T295	S201-D203 PolarHBondContact O-N 2.86Å; D203-R240 IonicContact OD1-CZ 3.02Å; D203-R240 VanDerWaalsContact OD1-CZ 3.23Å; D203-R240 IonicContact OD1-NH1 3.26Å; D203-R240 PolarHBondContact OD1-NH1 2.7Å; D203-R240 IonicContact OD1-NH2 2.7Å; D203-R240 PolarHBondContact OD1-NH2 3.29Å; D203-K292 IonicContact OD2-NZ 2.84Å; D203-K292 PolarHBondContact OD2-NZ 3.49Å; D203-T295 CarbonylContact O-C 3.54Å; D203-T295 VanDerWaalsContact O-C 3.22Å; D203-T295 PolarHBondContact O-N 2.97Å; D203-T295 VanDerWaalsContact O-O 3.07Å
204	K	70.6	Confident	79.1	Confident	111 Å²	111	40.9 Å²	40.9	48%	0.483	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-2.7	-172.3	-66.3	178.2	177.6	-178.1	0	114.6	E176 S202 T206 P296 V297	E176-K204 VanDerWaalsContact OE2-CB 3.3Å; E176-K204 WeakPolarHBondContact OE2-CB 3.29Å; S202-K204 PolarHBondContact O-N 3.06Å; S202-K204 VanDerWaalsContact O-N 3.16Å; S202-K204 PolarHBondContact OG-N 3.38Å; K204-T206 PolarHBondContact O-N 2.85Å; K204-P296 WeakPolarHBondContact O-CA 3.32Å; K204-V297 HydrophobicContact CB-CG2 4.1Å; K204-V297 HydrophobicContact CD-CG2 3.75Å; K204-V297 HydrophobicContact CG-CG2 3.9Å
205	L	75.9	Confident	79.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.217	C	C	.	.			trans	-63.4	124.9	-178.5	-162.2	116.5	0	0	0	110.8	F179 L199 S202 V207 V213	F179-L205 HydrophobicContact CB-CD1 4.24Å; F179-L205 HydrophobicContact CB-CD2 4.39Å; F179-L205 HydrophobicContact CB-CG 4.02Å; F179-L205 HydrophobicContact CD1-CD1 4.29Å; F179-L205 HydrophobicContact CD1-CD2 3.69Å; F179-L205 HydrophobicContact CD1-CG 4.17Å; F179-L205 HydrophobicContact CD2-CD1 3.52Å; F179-L205 HydrophobicContact CD2-CD2 4.42Å; F179-L205 HydrophobicContact CD2-CG 4.16Å; F179-L205 HydrophobicContact CE1-CD2 3.99Å; F179-L205 HydrophobicContact CE2-CD1 3.85Å; F179-L205 HydrophobicContact CG-CD1 3.74Å; F179-L205 HydrophobicContact CG-CD2 3.9Å; F179-L205 HydrophobicContact CG-CG 3.84Å; F179-L205 HydrophobicContact CZ-CD1 4.35Å; F179-L205 HydrophobicContact CZ-CD2 4.47Å; L199-L205 HydrophobicContact CD1-CD1 4.32Å; L199-L205 HydrophobicContact CG-CD1 4.15Å; L199-L205 WeakPolarHBondContact O-CD1 3.29Å; S202-L205 PolarHBondContact O-N 3.25Å; L205-V207 HydrophobicContact CD2-CB 4.3Å; L205-V207 HydrophobicContact CD2-CG1 3.35Å; L205-V207 HydrophobicContact CD2-CG2 4.02Å; L205-V207 HydrophobicContact CG-CG1 4.33Å; L205-V207 PolarHBondContact O-N 3.19Å; L205-V213 HydrophobicContact CD2-CG2 3.62Å
206	T	71	Confident	79.3	Confident	47 Å²	47	35.6 Å²	35.6	29%	0.288	20%	0.204	S	C	.	.			trans	-90.7	98.7	-177.8	-54.5	0	0	0	0	109.5	E176 Q177 K204 P296	E176-T206 PolarHBondContact O-N 2.81Å; Q177-T206 WeakPolarHBondContact O-CB 3.44Å; K204-T206 PolarHBondContact O-N 2.85Å; T206-P296 HydrophobicContact CG2-CB 4.28Å; T206-P296 VanDerWaalsContact OG1-CB 3.27Å; T206-P296 WeakPolarHBondContact OG1-CB 3.33Å
207	V	69.6	Low	79.3	Confident	32 Å²	32	35.7 Å²	35.7	19%	0.194	20%	0.204	C	C	.	.			trans	-130.3	143.4	178.6	-75.1	0	0	0	0	111	F179 L205 S209 K212 V213	F179-V207 HydrophobicContact CD1-CG1 3.65Å; F179-V207 HydrophobicContact CE1-CG1 4.35Å; F179-V207 HydrophobicContact CG-CG1 4.46Å; L205-V207 HydrophobicContact CD2-CB 4.3Å; L205-V207 HydrophobicContact CD2-CG1 3.35Å; L205-V207 HydrophobicContact CD2-CG2 4.02Å; L205-V207 HydrophobicContact CG-CG1 4.33Å; L205-V207 PolarHBondContact O-N 3.19Å; V207-S209 VanDerWaalsContact C-N 3.35Å; V207-K212 HydrophobicContact CG1-CB 4.48Å; V207-V213 HydrophobicContact CB-CG2 4.46Å; V207-V213 HydrophobicContact CG1-CG2 3.99Å; V207-V213 HydrophobicContact CG2-CG2 4.05Å
208	S	63.5	Low	79.3	Confident	108 Å²	108	35.6 Å²	35.6	76%	0.755	20%	0.203	S	C	*	.	S	Bend	trans	-68.7	-34.3	175.8	54.3	0	0	0	0	112.6
209	S	69.2	Low	79.4	Confident	33 Å²	33	34.7 Å²	34.7	23%	0.231	20%	0.196	C	C	.	.			trans	-152.1	154	176.9	59.3	0	0	0	0	109.6	V207 E211 K212	V207-S209 VanDerWaalsContact C-N 3.35Å; S209-E211 PolarHBondContact O-N 3.06Å; S209-E211 VanDerWaalsContact O-N 3.14Å; S209-E211 WeakPolarHBondContact OG-CB 3.29Å; S209-E211 PolarHBondContact OG-OE2 3.4Å; S209-K212 PolarHBondContact O-N 3.21Å
210	E	82	Confident	79.5	Confident	14 Å²	14	34.9 Å²	34.9	7%	0.065	20%	0.197	C	C	.	.	H	α-helix	trans	-63.3	-13.3	171.5	-79.3	-73.2	151.2	0	0	112.5	K212 V213 F214 R240 L243 L244 R294	E210-K212 PolarHBondContact O-N 2.56Å; E210-V213 PolarHBondContact O-N 3.11Å; E210-V213 VanDerWaalsContact O-N 3.15Å; E210-F214 PolarHBondContact O-N 3.23Å; E210-R240 HydrophobicContact CG-CB 3.99Å; E210-R240 IonicContact OE1-NE 2.94Å; E210-R240 PolarHBondContact OE2-N 2.81Å; E210-L243 HydrophobicContact CG-CB 4.28Å; E210-L244 VanDerWaalsContact C-CD2 3.49Å; E210-L244 HydrophobicContact CB-CD2 3.64Å; E210-L244 HydrophobicContact CB-CG 4.16Å; E210-R294 WeakPolarHBondContact OE1-CD 3.5Å; E210-R294 IonicContact OE1-CZ 2.8Å; E210-R294 IonicContact OE1-NE 3.25Å; E210-R294 PolarHBondContact OE1-NE 3.4Å; E210-R294 IonicContact OE1-NH2 2.91Å; E210-R294 IonicContact OE2-NE 3.27Å; E210-R294 IonicContact OE2-NH2 3.59Å
211	E	80.8	Confident	79.4	Confident	48 Å²	48	34.9 Å²	34.9	22%	0.224	20%	0.197	C	C	.	.	H	α-helix	trans	-57.6	-39.1	175.2	-57.8	164	168.6	0	0	110.4	S209 V213 F214 E215 L244 P245 Y248	S209-E211 PolarHBondContact O-N 3.06Å; S209-E211 VanDerWaalsContact O-N 3.14Å; S209-E211 WeakPolarHBondContact OG-CB 3.29Å; S209-E211 PolarHBondContact OG-OE2 3.4Å; E211-V213 PolarHBondContact O-N 3.2Å; E211-F214 WeakPolarHBondContact O-CB 3.41Å; E211-F214 PolarHBondContact O-N 2.98Å; E211-E215 WeakPolarHBondContact O-CB 3.34Å; E211-E215 WeakPolarHBondContact O-CG 3.47Å; E211-E215 PolarHBondContact O-N 2.82Å; E211-L244 HydrophobicContact CB-CD2 4.25Å; E211-L244 HydrophobicContact CG-CD2 3.61Å; E211-L244 VanDerWaalsContact N-CD2 3.28Å; E211-P245 WeakPolarHBondContact OE1-CG 3.49Å; E211-Y248 HydrophobicContact CB-CE1 4.12Å; E211-Y248 HydrophobicContact CB-CE2 4.37Å; E211-Y248 HydrophobicContact CG-CD1 3.95Å; E211-Y248 HydrophobicContact CG-CD2 4.17Å; E211-Y248 HydrophobicContact CG-CE1 3.94Å; E211-Y248 HydrophobicContact CG-CE2 4.17Å; E211-Y248 HydrophobicContact CG-CG 4.06Å
212	K	80.6	Confident	79.4	Confident	62 Å²	62	35.5 Å²	35.5	27%	0.27	20%	0.197	S	C	.	.	H	α-helix	trans	-67.1	-36.2	178.1	-64	-48.7	-173.5	-175.1	0	113.2	M183 V207 S209 E210 F214 E215 A216	M183-K212 HydrophobicContact CE-CB 4.18Å; M183-K212 HydrophobicContact CE-CD 3.84Å; M183-K212 HydrophobicContact CE-CG 4.34Å; M183-K212 HydrophobicContact SD-CB 4.28Å; V207-K212 HydrophobicContact CG1-CB 4.48Å; S209-K212 PolarHBondContact O-N 3.21Å; E210-K212 PolarHBondContact O-N 2.56Å; K212-F214 VanDerWaalsContact C-N 3.35Å; K212-E215 WeakPolarHBondContact CD-OE2 3.39Å; K212-E215 IonicContact NZ-OE1 2.72Å; K212-E215 IonicContact NZ-OE2 3.21Å; K212-E215 PolarHBondContact NZ-OE2 3Å; K212-A216 WeakPolarHBondContact O-CB 3.34Å; K212-A216 PolarHBondContact O-N 2.76Å
213	V	84.6	Confident	79.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.3	-41.4	174.6	-173.3	0	0	0	0	110.1	F179 I200 L205 V207 E210 E211 A216 V217 V239	F179-V213 HydrophobicContact CE1-CG2 4.43Å; I200-V213 HydrophobicContact CB-CG1 4.3Å; I200-V213 HydrophobicContact CG2-CG1 4.28Å; L205-V213 HydrophobicContact CD2-CG2 3.62Å; V207-V213 HydrophobicContact CB-CG2 4.46Å; V207-V213 HydrophobicContact CG1-CG2 3.99Å; V207-V213 HydrophobicContact CG2-CG2 4.05Å; E210-V213 PolarHBondContact O-N 3.11Å; E210-V213 VanDerWaalsContact O-N 3.15Å; E211-V213 PolarHBondContact O-N 3.2Å; V213-A216 PolarHBondContact O-N 2.8Å; V213-V217 WeakPolarHBondContact O-CG2 3.24Å; V213-V217 PolarHBondContact O-N 3.33Å; V213-V217 VanDerWaalsContact O-N 3.11Å; V213-V239 HydrophobicContact CG1-CG2 4.42Å
214	F	84.8	Confident	79.9	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-62.5	-50.3	175.2	179.2	-100.1	0	0	0	112.1	E210 E211 K212 A216 V217 I218 M236 V239 L241 Y248 V253 I259	E210-F214 PolarHBondContact O-N 3.23Å; E211-F214 WeakPolarHBondContact O-CB 3.41Å; E211-F214 PolarHBondContact O-N 2.98Å; K212-F214 VanDerWaalsContact C-N 3.35Å; F214-A216 VanDerWaalsContact C-N 3.29Å; F214-A216 PolarHBondContact O-N 2.8Å; F214-V217 PolarHBondContact O-N 2.96Å; F214-I218 HydrophobicContact CD1-CG1 4.27Å; F214-I218 HydrophobicContact CE1-CD1 4.47Å; F214-I218 HydrophobicContact CE1-CG1 3.81Å; F214-I218 HydrophobicContact CE2-CD1 4.14Å; F214-I218 HydrophobicContact CE2-CG1 4.08Å; F214-I218 HydrophobicContact CZ-CD1 3.89Å; F214-I218 HydrophobicContact CZ-CG1 3.71Å; F214-I218 WeakPolarHBondContact O-CG1 3.45Å; F214-I218 PolarHBondContact O-N 2.93Å; F214-M236 HydrophobicContact CD2-CE 4.16Å; F214-M236 HydrophobicContact CD2-SD 4.28Å; F214-M236 HydrophobicContact CE2-CE 3.89Å; F214-M236 HydrophobicContact CE2-SD 4.11Å; F214-V239 HydrophobicContact CB-CG1 4.25Å; F214-V239 HydrophobicContact CD2-CG1 4.43Å; F214-L241 HydrophobicContact CD2-CD2 4.42Å; F214-Y248 HydrophobicContact CD1-CE1 4.08Å; F214-V253 HydrophobicContact CD1-CG2 4.32Å; F214-V253 HydrophobicContact CE1-CG2 4Å; F214-V253 HydrophobicContact CE2-CG1 4.01Å; F214-V253 HydrophobicContact CE2-CG2 4.28Å; F214-V253 HydrophobicContact CZ-CB 4.3Å; F214-V253 HydrophobicContact CZ-CG1 4.04Å; F214-V253 HydrophobicContact CZ-CG2 3.98Å; F214-I259 HydrophobicContact CE2-CD1 3.61Å; F214-I259 HydrophobicContact CZ-CD1 3.64Å
215	E	84.4	Confident	80.2	Confident	72 Å²	72	43 Å²	43	34%	0.336	22%	0.223	S	C	.	.	H	α-helix	trans	-55.5	-43.2	175.8	-74.2	171.8	-169.8	0	0	111.7	E211 K212 I218 S219	E211-E215 WeakPolarHBondContact O-CB 3.34Å; E211-E215 WeakPolarHBondContact O-CG 3.47Å; E211-E215 PolarHBondContact O-N 2.82Å; K212-E215 WeakPolarHBondContact CD-OE2 3.39Å; K212-E215 IonicContact NZ-OE1 2.72Å; K212-E215 IonicContact NZ-OE2 3.21Å; K212-E215 PolarHBondContact NZ-OE2 3Å; E215-I218 PolarHBondContact O-N 3.3Å; E215-S219 WeakPolarHBondContact O-CB 3.49Å; E215-S219 PolarHBondContact O-N 2.82Å
216	A	84.9	Confident	80.1	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-45.1	177.7	0	0	0	0	0	112.4	F179 M183 F188 K212 V213 F214 I218 S219 W220	F179-A216 HydrophobicContact CE1-CB 4.08Å; F179-A216 HydrophobicContact CZ-CB 3.9Å; M183-A216 HydrophobicContact CB-CB 3.94Å; M183-A216 HydrophobicContact SD-CB 3.98Å; F188-A216 HydrophobicContact CE1-CB 4.16Å; F188-A216 HydrophobicContact CZ-CB 4.14Å; K212-A216 WeakPolarHBondContact O-CB 3.34Å; K212-A216 PolarHBondContact O-N 2.76Å; V213-A216 PolarHBondContact O-N 2.8Å; F214-A216 VanDerWaalsContact C-N 3.29Å; F214-A216 PolarHBondContact O-N 2.8Å; A216-I218 PolarHBondContact O-N 2.97Å; A216-S219 PolarHBondContact O-N 2.77Å; A216-W220 WeakPolarHBondContact O-CB 3.45Å; A216-W220 PolarHBondContact O-N 2.91Å
217	V	86.6	Confident	80.3	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-43.6	177.2	170.3	0	0	0	0	111	I200 V213 F214 W220 I221 L235 M236 V239	I200-V217 HydrophobicContact CD1-CG2 4.03Å; I200-V217 HydrophobicContact CG2-CG2 4.42Å; V213-V217 WeakPolarHBondContact O-CG2 3.24Å; V213-V217 PolarHBondContact O-N 3.33Å; V213-V217 VanDerWaalsContact O-N 3.11Å; F214-V217 PolarHBondContact O-N 2.96Å; V217-W220 PolarHBondContact O-N 3.49Å; V217-I221 HydrophobicContact CG1-CD1 3.9Å; V217-I221 WeakPolarHBondContact O-CG1 3.33Å; V217-I221 PolarHBondContact O-N 2.65Å; V217-L235 HydrophobicContact CG1-CB 3.87Å; V217-L235 HydrophobicContact CG1-CD1 4.33Å; V217-M236 HydrophobicContact CG1-SD 4.45Å; V217-V239 HydrophobicContact CG2-CG2 3.95Å
218	I	85.7	Confident	80.9	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-42.3	178.1	-63.8	-61.9	0	0	0	111.3	F214 E215 A216 W220 I221 N222 E256 L258	F214-I218 HydrophobicContact CD1-CG1 4.27Å; F214-I218 HydrophobicContact CE1-CD1 4.47Å; F214-I218 HydrophobicContact CE1-CG1 3.81Å; F214-I218 HydrophobicContact CE2-CD1 4.14Å; F214-I218 HydrophobicContact CE2-CG1 4.08Å; F214-I218 HydrophobicContact CZ-CD1 3.89Å; F214-I218 HydrophobicContact CZ-CG1 3.71Å; F214-I218 WeakPolarHBondContact O-CG1 3.45Å; F214-I218 PolarHBondContact O-N 2.93Å; E215-I218 PolarHBondContact O-N 3.3Å; A216-I218 PolarHBondContact O-N 2.97Å; I218-W220 PolarHBondContact O-N 3.05Å; I218-I221 PolarHBondContact O-N 2.84Å; I218-N222 WeakPolarHBondContact CG2-ND2 3.26Å; I218-N222 VanDerWaalsContact O-CB 3.32Å; I218-N222 WeakPolarHBondContact O-CB 3.27Å; I218-N222 VanDerWaalsContact O-CG 3.3Å; I218-N222 PolarHBondContact O-N 2.86Å; I218-N222 PolarHBondContact O-ND2 3.23Å; I218-E256 HydrophobicContact CD1-CG 4.13Å; I218-L258 HydrophobicContact CD1-CD1 4.11Å
219	S	85.1	Confident	81.6	Confident	52 Å²	52	51.4 Å²	51.4	36%	0.364	25%	0.252	S	S	.	.	H	α-helix	trans	-59.4	-45.7	175.9	-170	0	0	0	0	111.7	E215 A216 I221 N222 Y223	E215-S219 WeakPolarHBondContact O-CB 3.49Å; E215-S219 PolarHBondContact O-N 2.82Å; A216-S219 PolarHBondContact O-N 2.77Å; S219-I221 PolarHBondContact O-N 3.04Å; S219-N222 PolarHBondContact O-N 2.77Å; S219-Y223 PolarHBondContact O-N 2.74Å
220	W	87.1	Confident	82	Confident	5 Å²	5	57.8 Å²	57.8	2%	0.019	28%	0.278	C	S	.	.	H	α-helix	trans	-64.8	-38.7	179.2	-174.2	89.1	0	0	0	113.1	F188 L191 L193 V196 A216 V217 I218 R228 L235	F188-W220 HydrophobicContact CE1-CB 4.01Å; F188-W220 VanDerWaalsContact O-CD1 3.31Å; L191-W220 WeakPolarHBondContact O-CZ2 3.29Å; L191-W220 PolarHBondContact O-NE1 3.16Å; L191-W220 VanDerWaalsContact O-NE1 3.13Å; L193-W220 HydrophobicContact CB-CH2 4.4Å; L193-W220 HydrophobicContact CD1-CH2 4.12Å; L193-W220 HydrophobicContact CD1-CZ3 4.35Å; V196-W220 HydrophobicContact CG2-CD2 4.29Å; V196-W220 HydrophobicContact CG2-CG 4.34Å; V196-W220 HydrophobicContact CG2-CZ2 4.31Å; A216-W220 WeakPolarHBondContact O-CB 3.45Å; A216-W220 PolarHBondContact O-N 2.91Å; V217-W220 PolarHBondContact O-N 3.49Å; I218-W220 PolarHBondContact O-N 3.05Å; W220-R228 VanDerWaalsContact CE2-NH1 3.27Å; W220-R228 HydrophobicContact CE3-CB 4.45Å; W220-R228 HydrophobicContact CE3-CG 4.41Å; W220-R228 HydrophobicContact CH2-CB 4.37Å; W220-R228 HydrophobicContact CH2-CG 3.81Å; W220-R228 HydrophobicContact CZ2-CG 4.49Å; W220-R228 HydrophobicContact CZ3-CB 3.85Å; W220-R228 HydrophobicContact CZ3-CG 3.75Å; W220-R228 WeakPolarHBondContact O-CD 3.3Å; W220-R228 PolarHBondContact O-NH1 2.93Å; W220-L235 HydrophobicContact CE3-CD1 3.71Å; W220-L235 HydrophobicContact CZ3-CD1 3.56Å
221	I	84.3	Confident	81.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69.5	-39.9	175.4	-66.6	168.9	0	0	0	110.8	V217 I218 S219 Y223 E224 K225 M232 L235 L258	V217-I221 HydrophobicContact CG1-CD1 3.9Å; V217-I221 WeakPolarHBondContact O-CG1 3.33Å; V217-I221 PolarHBondContact O-N 2.65Å; I218-I221 PolarHBondContact O-N 2.84Å; S219-I221 PolarHBondContact O-N 3.04Å; I221-Y223 PolarHBondContact O-N 3.19Å; I221-E224 CarbonylContact O-C 3.59Å; I221-E224 PolarHBondContact O-N 2.84Å; I221-K225 WeakPolarHBondContact O-CA 3.22Å; I221-K225 PolarHBondContact O-N 2.8Å; I221-M232 HydrophobicContact CD1-CB 4.18Å; I221-M232 HydrophobicContact CD1-CG 4Å; I221-L235 HydrophobicContact CD1-CD1 4.23Å; I221-L235 HydrophobicContact CG1-CD1 4.18Å; I221-L258 HydrophobicContact CG2-CD1 4.15Å
222	N	84.1	Confident	81.8	Confident	65 Å²	65	58.1 Å²	58.1	35%	0.348	28%	0.279	S	S	.	.	H	α-helix	trans	-65.6	-22.1	-177.7	-82.5	-33.2	0	0	0	113.8	I218 S219 K225	I218-N222 WeakPolarHBondContact CG2-ND2 3.26Å; I218-N222 VanDerWaalsContact O-CB 3.32Å; I218-N222 WeakPolarHBondContact O-CB 3.27Å; I218-N222 VanDerWaalsContact O-CG 3.3Å; I218-N222 PolarHBondContact O-N 2.86Å; I218-N222 PolarHBondContact O-ND2 3.23Å; S219-N222 PolarHBondContact O-N 2.77Å; N222-K225 WeakPolarHBondContact OD1-CE 3.01Å
223	Y	83.3	Confident	81.8	Confident	142 Å²	142	56.3 Å²	56.3	56%	0.557	28%	0.276	S	S	*	.	H	α-helix	trans	-66.8	-44	177.3	-172.5	-104.1	0	0	0	112.8	L189 S219 I221	L189-Y223 HydrophobicContact CB-CD1 4.27Å; L189-Y223 HydrophobicContact CB-CD2 4.16Å; L189-Y223 HydrophobicContact CB-CE2 4.49Å; L189-Y223 HydrophobicContact CB-CG 4.05Å; L189-Y223 HydrophobicContact CD1-CD2 3.85Å; L189-Y223 HydrophobicContact CD1-CE2 4.31Å; L189-Y223 HydrophobicContact CD1-CG 4.4Å; S219-Y223 PolarHBondContact O-N 2.74Å; I221-Y223 PolarHBondContact O-N 3.19Å
224	E	79.7	Confident	81.7	Confident	89 Å²	89	62.5 Å²	62.5	42%	0.416	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	75.1	174.3	-66.4	171.1	173.3	0	0	110.7	I221 E226 T227 R228	I221-E224 CarbonylContact O-C 3.59Å; I221-E224 PolarHBondContact O-N 2.84Å; E224-E226 VanDerWaalsContact C-N 3.33Å; E224-E226 PolarHBondContact O-N 3.09Å; E224-T227 PolarHBondContact O-OG1 3.46Å; E224-R228 HydrophobicContact CB-CG 4.07Å; E224-R228 VanDerWaalsContact CD-NH2 3.26Å; E224-R228 VanDerWaalsContact O-CB 3.29Å; E224-R228 WeakPolarHBondContact O-CB 3.46Å; E224-R228 WeakPolarHBondContact O-CG 3.19Å; E224-R228 PolarHBondContact O-N 2.8Å; E224-R228 VanDerWaalsContact O-N 3.09Å; E224-R228 IonicContact OE1-NH2 2.77Å; E224-R228 IonicContact OE2-CZ 2.65Å; E224-R228 VanDerWaalsContact OE2-CZ 3.26Å; E224-R228 IonicContact OE2-NE 2.65Å; E224-R228 PolarHBondContact OE2-NE 2.98Å; E224-R228 IonicContact OE2-NH2 2.9Å; E224-R228 PolarHBondContact OE2-NH2 3.34Å
225	K	76.4	Confident	81.7	Confident	114 Å²	114	62.3 Å²	62.3	50%	0.496	30%	0.302	S	S	.	.	H	α-helix	trans	-56	-44.2	-173.1	-69.1	177.7	177.2	-176.8	0	113.2	I221 N222 T227 L229	I221-K225 WeakPolarHBondContact O-CA 3.22Å; I221-K225 PolarHBondContact O-N 2.8Å; N222-K225 WeakPolarHBondContact OD1-CE 3.01Å; K225-T227 PolarHBondContact O-N 3.09Å; K225-L229 WeakPolarHBondContact O-CB 3.46Å; K225-L229 WeakPolarHBondContact O-CD1 3.33Å; K225-L229 WeakPolarHBondContact O-CG 3.44Å; K225-L229 PolarHBondContact O-N 2.91Å
226	E	73.8	Confident	81.6	Confident	186 Å²	186	59 Å²	59	87%	0.869	29%	0.286	S	S	*	.	H	α-helix	trans	-67	-36.6	-170	-63.9	-172.5	166.9	0	0	113.5	E224	E224-E226 VanDerWaalsContact C-N 3.33Å; E224-E226 PolarHBondContact O-N 3.09Å
227	T	76.5	Confident	81.6	Confident	85 Å²	85	63.8 Å²	63.8	52%	0.521	31%	0.309	S	S	.	.	H	α-helix	trans	-92	-36	-178.6	52	0	0	0	0	112.4	E224 K225	E224-T227 PolarHBondContact O-OG1 3.46Å; K225-T227 PolarHBondContact O-N 3.09Å
228	R	81.6	Confident	81.5	Confident	15 Å²	15	66.8 Å²	66.8	6%	0.057	32%	0.322	C	S	.	.	H	α-helix	trans	-85.7	-14.2	-171.7	-61.4	177.5	-175.5	-169.5	-0.8	114	L189 W220 E224 E230 H231	L189-R228 PolarHBondContact O-NH1 3.36Å; L189-R228 PolarHBondContact O-NH2 2.86Å; L189-R228 VanDerWaalsContact O-NH2 3.08Å; W220-R228 VanDerWaalsContact CE2-NH1 3.27Å; W220-R228 HydrophobicContact CE3-CB 4.45Å; W220-R228 HydrophobicContact CE3-CG 4.41Å; W220-R228 HydrophobicContact CH2-CB 4.37Å; W220-R228 HydrophobicContact CH2-CG 3.81Å; W220-R228 HydrophobicContact CZ2-CG 4.49Å; W220-R228 HydrophobicContact CZ3-CB 3.85Å; W220-R228 HydrophobicContact CZ3-CG 3.75Å; W220-R228 WeakPolarHBondContact O-CD 3.3Å; W220-R228 PolarHBondContact O-NH1 2.93Å; E224-R228 HydrophobicContact CB-CG 4.07Å; E224-R228 VanDerWaalsContact CD-NH2 3.26Å; E224-R228 VanDerWaalsContact O-CB 3.29Å; E224-R228 WeakPolarHBondContact O-CB 3.46Å; E224-R228 WeakPolarHBondContact O-CG 3.19Å; E224-R228 PolarHBondContact O-N 2.8Å; E224-R228 VanDerWaalsContact O-N 3.09Å; E224-R228 IonicContact OE1-NH2 2.77Å; E224-R228 IonicContact OE2-CZ 2.65Å; E224-R228 VanDerWaalsContact OE2-CZ 3.26Å; E224-R228 IonicContact OE2-NE 2.65Å; E224-R228 PolarHBondContact OE2-NE 2.98Å; E224-R228 IonicContact OE2-NH2 2.9Å; E224-R228 PolarHBondContact OE2-NH2 3.34Å; R228-E230 VanDerWaalsContact C-N 3.25Å; R228-E230 PolarHBondContact O-N 3.46Å; R228-H231 PolarHBondContact O-N 2.96Å
229	L	77.3	Confident	81.4	Confident	76 Å²	76	66.1 Å²	66.1	40%	0.398	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-55.5	-38	175.7	-91.8	165.6	0	0	0	112.8	K225 H231 M232 L258	K225-L229 WeakPolarHBondContact O-CB 3.46Å; K225-L229 WeakPolarHBondContact O-CD1 3.33Å; K225-L229 WeakPolarHBondContact O-CG 3.44Å; K225-L229 PolarHBondContact O-N 2.91Å; L229-H231 PolarHBondContact O-N 3.08Å; L229-M232 VanDerWaalsContact O-CB 3.32Å; L229-M232 WeakPolarHBondContact O-CB 3.45Å; L229-M232 PolarHBondContact O-N 2.95Å; L229-L258 HydrophobicContact CD2-CD2 3.57Å
230	E	78.3	Confident	81.3	Confident	167 Å²	167	64.1 Å²	64.1	78%	0.78	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-66.5	-25.6	179.2	-62.7	-169.3	167.2	0	0	112.7	R228	R228-E230 VanDerWaalsContact C-N 3.25Å; R228-E230 PolarHBondContact O-N 3.46Å
231	H	78.9	Confident	81	Confident	69 Å²	69	64 Å²	64	32%	0.319	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-90.2	-4.5	-177.2	-58.8	-38	0	0	0	114	L193 R228 L229 A233 K234 L235	L193-H231 HydrophobicContact CD1-CB 3.59Å; L193-H231 HydrophobicContact CD2-CB 3.97Å; L193-H231 HydrophobicContact CG-CB 4.4Å; R228-H231 PolarHBondContact O-N 2.96Å; L229-H231 PolarHBondContact O-N 3.08Å; H231-A233 VanDerWaalsContact C-N 3.31Å; H231-A233 PolarHBondContact O-N 2.78Å; H231-K234 PolarHBondContact O-N 3.37Å; H231-L235 PolarHBondContact O-N 2.99Å
232	M	80	Confident	80.8	Confident	1 Å²	1	64 Å²	64	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-54.6	-43.8	-177	-175.6	-179.1	-170.8	0	0	113.1	I221 L229 K234 L235 M236 L258 I259	I221-M232 HydrophobicContact CD1-CB 4.18Å; I221-M232 HydrophobicContact CD1-CG 4Å; L229-M232 VanDerWaalsContact O-CB 3.32Å; L229-M232 WeakPolarHBondContact O-CB 3.45Å; L229-M232 PolarHBondContact O-N 2.95Å; M232-K234 VanDerWaalsContact C-N 3.33Å; M232-K234 PolarHBondContact O-N 3.47Å; M232-L235 PolarHBondContact O-N 3.22Å; M232-M236 HydrophobicContact CE-CG 4.36Å; M232-M236 HydrophobicContact CG-CG 4.13Å; M232-M236 WeakPolarHBondContact O-CB 3.41Å; M232-M236 VanDerWaalsContact O-CG 3.27Å; M232-M236 WeakPolarHBondContact O-CG 3.44Å; M232-M236 PolarHBondContact O-N 3.26Å; M232-L258 HydrophobicContact CE-CB 3.55Å; M232-L258 HydrophobicContact SD-CB 3.84Å; M232-I259 HydrophobicContact CE-CB 4.34Å; M232-I259 HydrophobicContact CE-CD1 4.45Å; M232-I259 HydrophobicContact CE-CG1 3.4Å
233	A	80.7	Confident	80.3	Confident	24 Å²	24	63.5 Å²	63.5	20%	0.198	30%	0.3	C	S	.	.	H	α-helix	trans	-62.9	-38.9	-177.4	0	0	0	0	0	112.4	H231 E237 T264	H231-A233 VanDerWaalsContact C-N 3.31Å; H231-A233 PolarHBondContact O-N 2.78Å; A233-E237 PolarHBondContact O-N 3.06Å; A233-T264 HydrophobicContact CB-CG2 4.31Å
234	K	83.1	Confident	80.1	Confident	130 Å²	130	56.9 Å²	56.9	57%	0.565	28%	0.275	S	S	*	.	H	α-helix	trans	-67.3	-41.6	176.5	-89.8	-178.9	173.1	-179.5	0	112.1	H231 M232 E237 H238	H231-K234 PolarHBondContact O-N 3.37Å; M232-K234 VanDerWaalsContact C-N 3.33Å; M232-K234 PolarHBondContact O-N 3.47Å; K234-E237 PolarHBondContact O-N 3.31Å; K234-H238 PolarHBondContact O-CD2 3.26Å
235	L	83.8	Confident	79.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-43	178.8	-70.3	166.3	0	0	0	111.5	L193 V196 I200 V217 W220 I221 H231 M232 E237 H238	L193-L235 HydrophobicContact CD1-CD1 4.07Å; L193-L235 HydrophobicContact CD1-CD2 3.96Å; L193-L235 HydrophobicContact CD1-CG 3.9Å; V196-L235 HydrophobicContact CB-CD2 4.31Å; V196-L235 HydrophobicContact CG1-CD2 3.75Å; I200-L235 HydrophobicContact CD1-CB 4.3Å; I200-L235 HydrophobicContact CD1-CD2 3.69Å; I200-L235 WeakPolarHBondContact CD1-O 3.41Å; V217-L235 HydrophobicContact CG1-CB 3.87Å; V217-L235 HydrophobicContact CG1-CD1 4.33Å; W220-L235 HydrophobicContact CE3-CD1 3.71Å; W220-L235 HydrophobicContact CZ3-CD1 3.56Å; I221-L235 HydrophobicContact CD1-CD1 4.23Å; I221-L235 HydrophobicContact CG1-CD1 4.18Å; H231-L235 PolarHBondContact O-N 2.99Å; M232-L235 PolarHBondContact O-N 3.22Å; L235-E237 PolarHBondContact O-N 3.12Å; L235-H238 PolarHBondContact O-N 3.17Å; L235-H238 VanDerWaalsContact O-N 3.11Å
236	M	83.1	Confident	79.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-66.6	-24.1	-179.6	-71.7	-61.3	-63.3	0	0	113.5	F214 V217 M232 H238 V239 L241 I259 F268	F214-M236 HydrophobicContact CD2-CE 4.16Å; F214-M236 HydrophobicContact CD2-SD 4.28Å; F214-M236 HydrophobicContact CE2-CE 3.89Å; F214-M236 HydrophobicContact CE2-SD 4.11Å; V217-M236 HydrophobicContact CG1-SD 4.45Å; M232-M236 HydrophobicContact CE-CG 4.36Å; M232-M236 HydrophobicContact CG-CG 4.13Å; M232-M236 WeakPolarHBondContact O-CB 3.41Å; M232-M236 VanDerWaalsContact O-CG 3.27Å; M232-M236 WeakPolarHBondContact O-CG 3.44Å; M232-M236 PolarHBondContact O-N 3.26Å; M236-H238 PolarHBondContact O-N 3.21Å; M236-V239 PolarHBondContact O-N 3.23Å; M236-V239 HydrophobicContact SD-CG2 4.27Å; M236-L241 HydrophobicContact CE-CD1 3.86Å; M236-L241 HydrophobicContact CE-CD2 3.94Å; M236-L241 HydrophobicContact CE-CG 4.24Å; M236-I259 HydrophobicContact CE-CD1 4.2Å; M236-F268 HydrophobicContact CB-CD2 4.15Å; M236-F268 HydrophobicContact CB-CE2 4.39Å
237	E	83.9	Confident	79.9	Confident	104 Å²	104	55.3 Å²	55.3	49%	0.486	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-28.4	173.3	-172.7	176.4	-179.9	0	0	112.4	A233 K234 L235 F268 R290	A233-E237 PolarHBondContact O-N 3.06Å; K234-E237 PolarHBondContact O-N 3.31Å; L235-E237 PolarHBondContact O-N 3.12Å; E237-F268 HydrophobicContact CB-CE2 4.16Å; E237-F268 HydrophobicContact CB-CZ 4.01Å; E237-F268 HydrophobicContact CG-CZ 4.22Å; E237-R290 VanDerWaalsContact O-CD 3.29Å; E237-R290 WeakPolarHBondContact O-CD 3.45Å; E237-R290 WeakPolarHBondContact O-CG 3.41Å
238	H	84.3	Confident	79.9	Confident	63 Å²	63	53 Å²	53	29%	0.292	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-6.5	-179.7	-60	-51.2	0	0	0	113.9	I200 K234 L235 M236 R294	I200-H238 HydrophobicContact CD1-CB 3.77Å; I200-H238 HydrophobicContact CG1-CB 3.66Å; K234-H238 PolarHBondContact O-CD2 3.26Å; L235-H238 PolarHBondContact O-N 3.17Å; L235-H238 VanDerWaalsContact O-N 3.11Å; M236-H238 PolarHBondContact O-N 3.21Å; H238-R294 PolarHBondContact O-NH2 3.29Å
239	V	83.9	Confident	79.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-85.9	128.6	173.1	-176.8	0	0	0	0	109.5	V213 F214 V217 M236 L241	V213-V239 HydrophobicContact CG1-CG2 4.42Å; F214-V239 HydrophobicContact CB-CG1 4.25Å; F214-V239 HydrophobicContact CD2-CG1 4.43Å; V217-V239 HydrophobicContact CG2-CG2 3.95Å; M236-V239 PolarHBondContact O-N 3.23Å; M236-V239 HydrophobicContact SD-CG2 4.27Å; V239-L241 VanDerWaalsContact C-N 3.25Å; V239-L241 HydrophobicContact CG1-CD2 3.94Å; V239-L241 HydrophobicContact CG1-CG 4.39Å; V239-L241 PolarHBondContact O-N 3.38Å
240	R	83.3	Confident	79.9	Confident	11 Å²	11	51.6 Å²	51.6	4%	0.042	25%	0.248	C	C	.	.			trans	-88.1	63.9	-174.5	-51.6	-178.7	-165.6	-158.2	-3.7	111	D203 E210 P242 L243 R290 K292 P293	D203-R240 IonicContact OD1-CZ 3.02Å; D203-R240 VanDerWaalsContact OD1-CZ 3.23Å; D203-R240 IonicContact OD1-NH1 3.26Å; D203-R240 PolarHBondContact OD1-NH1 2.7Å; D203-R240 IonicContact OD1-NH2 2.7Å; D203-R240 PolarHBondContact OD1-NH2 3.29Å; E210-R240 HydrophobicContact CG-CB 3.99Å; E210-R240 IonicContact OE1-NE 2.94Å; E210-R240 PolarHBondContact OE2-N 2.81Å; R240-P242 VanDerWaalsContact C-N 3.28Å; R240-P242 VanDerWaalsContact O-N 3.14Å; R240-L243 HydrophobicContact CB-CB 4.46Å; R240-L243 HydrophobicContact CB-CD1 3.79Å; R240-L243 HydrophobicContact CB-CG 4.15Å; R240-L243 HydrophobicContact CG-CD1 4.47Å; R240-L243 WeakPolarHBondContact O-CB 3.47Å; R240-L243 PolarHBondContact O-N 3.26Å; R240-R290 WeakPolarHBondContact CB-O 3.4Å; R240-K292 VanDerWaalsContact CD-O 3.26Å; R240-K292 WeakPolarHBondContact CD-O 3.39Å; R240-K292 PolarHBondContact NH1-O 3.47Å; R240-P293 VanDerWaalsContact NH1-C 3.33Å; R240-P293 PolarHBondContact NH1-O 2.83Å
241	L	81.8	Confident	80	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-47.9	-38.5	-180	-62.6	178.8	0	0	0	114.8	F214 M236 V239 L243 L244 L249 V253 F268 A272	F214-L241 HydrophobicContact CD2-CD2 4.42Å; M236-L241 HydrophobicContact CE-CD1 3.86Å; M236-L241 HydrophobicContact CE-CD2 3.94Å; M236-L241 HydrophobicContact CE-CG 4.24Å; V239-L241 VanDerWaalsContact C-N 3.25Å; V239-L241 HydrophobicContact CG1-CD2 3.94Å; V239-L241 HydrophobicContact CG1-CG 4.39Å; V239-L241 PolarHBondContact O-N 3.38Å; L241-L243 PolarHBondContact O-N 3.08Å; L241-L243 VanDerWaalsContact O-N 3.08Å; L241-L244 HydrophobicContact CD2-CD1 3.6Å; L241-L244 WeakPolarHBondContact O-CB 3.29Å; L241-L244 PolarHBondContact O-N 2.78Å; L241-L244 VanDerWaalsContact O-N 3.08Å; L241-L249 HydrophobicContact CB-CD2 4.43Å; L241-L249 HydrophobicContact CD2-CD2 4.41Å; L241-V253 HydrophobicContact CD2-CG1 4.28Å; L241-F268 HydrophobicContact CD1-CB 3.9Å; L241-A272 HydrophobicContact CB-CB 3.78Å
242	P	79.3	Confident	80	Confident	2 Å²	2	49 Å²	49	1%	0.013	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-61.6	-14.4	177.2	-24.1	34.9	0	0	0	115.5	R240 A272 Y275 H276 R290 T291	R240-P242 VanDerWaalsContact C-N 3.28Å; R240-P242 VanDerWaalsContact O-N 3.14Å; P242-A272 HydrophobicContact CB-CB 4.48Å; P242-A272 HydrophobicContact CG-CB 4.18Å; P242-Y275 HydrophobicContact CB-CD1 3.65Å; P242-Y275 HydrophobicContact CB-CE1 4.17Å; P242-Y275 HydrophobicContact CB-CG 3.85Å; P242-Y275 VanDerWaalsContact O-CD1 3.28Å; P242-Y275 WeakPolarHBondContact O-CD1 3.49Å; P242-Y275 WeakPolarHBondContact O-CE1 3.25Å; P242-H276 PolarHBondContact O-NE2 3.49Å; P242-R290 WeakPolarHBondContact CD-O 3.48Å; P242-R290 HydrophobicContact CG-CB 4.35Å; P242-T291 HydrophobicContact CB-CG2 4.06Å; P242-T291 HydrophobicContact CG-CG2 4.11Å
243	L	74.4	Confident	79.9	Confident	54 Å²	54	48.9 Å²	48.9	28%	0.283	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-97.8	-2.3	178.9	-56.6	179.3	0	0	0	113	E210 R240 L241 P293	E210-L243 HydrophobicContact CG-CB 4.28Å; R240-L243 HydrophobicContact CB-CB 4.46Å; R240-L243 HydrophobicContact CB-CD1 3.79Å; R240-L243 HydrophobicContact CB-CG 4.15Å; R240-L243 HydrophobicContact CG-CD1 4.47Å; R240-L243 WeakPolarHBondContact O-CB 3.47Å; R240-L243 PolarHBondContact O-N 3.26Å; L241-L243 PolarHBondContact O-N 3.08Å; L241-L243 VanDerWaalsContact O-N 3.08Å; L243-P293 HydrophobicContact CD1-CB 4.27Å; L243-P293 HydrophobicContact CD1-CG 4.35Å; L243-P293 HydrophobicContact CD2-CG 4.31Å
244	L	78.3	Confident	79.8	Confident	3 Å²	3	52 Å²	52	2%	0.016	25%	0.25	C	C	.	.	S	Bend	trans	-75.9	151	175	-70.2	172.4	0	0	0	111.3	E210 E211 L241 Y248 L249 V253 H276	E210-L244 VanDerWaalsContact C-CD2 3.49Å; E210-L244 HydrophobicContact CB-CD2 3.64Å; E210-L244 HydrophobicContact CB-CG 4.16Å; E211-L244 HydrophobicContact CB-CD2 4.25Å; E211-L244 HydrophobicContact CG-CD2 3.61Å; E211-L244 VanDerWaalsContact N-CD2 3.28Å; L241-L244 HydrophobicContact CD2-CD1 3.6Å; L241-L244 WeakPolarHBondContact O-CB 3.29Å; L241-L244 PolarHBondContact O-N 2.78Å; L241-L244 VanDerWaalsContact O-N 3.08Å; L244-Y248 HydrophobicContact CD1-CD1 4.34Å; L244-Y248 HydrophobicContact CD2-CD1 4.24Å; L244-L249 HydrophobicContact CB-CD1 4.37Å; L244-L249 HydrophobicContact CB-CD2 3.97Å; L244-L249 HydrophobicContact CB-CG 3.89Å; L244-L249 HydrophobicContact CD1-CD2 3.76Å; L244-L249 HydrophobicContact CG-CD2 4.49Å; L244-V253 HydrophobicContact CD1-CG2 4.17Å; L244-H276 PolarHBondContact O-CE1 2.91Å; L244-H276 PolarHBondContact O-NE2 3.38Å; L244-H276 VanDerWaalsContact O-NE2 3.08Å
245	P	74.2	Confident	79.5	Confident	62 Å²	62	51.9 Å²	51.9	40%	0.403	25%	0.251	S	S	.	.			trans	-60.3	143.7	170.3	-22.8	34.5	0	0	0	111.9	E211 D247 Y248 L249	E211-P245 WeakPolarHBondContact OE1-CG 3.49Å; P245-D247 VanDerWaalsContact C-N 3.27Å; P245-D247 PolarHBondContact O-N 3.01Å; P245-Y248 PolarHBondContact O-N 2.68Å; P245-Y248 VanDerWaalsContact O-N 3.16Å; P245-L249 PolarHBondContact O-N 2.93Å; P245-L249 VanDerWaalsContact O-N 3.1Å
246	R	75.3	Confident	79.3	Confident	180 Å²	180	54.2 Å²	54.2	68%	0.679	26%	0.262	S	S	*	.	H	α-helix	trans	-56.7	-41.4	-180	179.8	-178.3	170.8	-174	-3.1	112.3	Y248 L249 V250	R246-Y248 VanDerWaalsContact C-N 3.31Å; R246-Y248 PolarHBondContact O-N 2.7Å; R246-L249 PolarHBondContact O-N 2.9Å; R246-V250 PolarHBondContact O-N 2.86Å
247	D	75.6	Confident	78.8	Confident	113 Å²	113	58.4 Å²	58.4	60%	0.604	29%	0.288	S	S	*	.	H	α-helix	trans	-64.9	-39.4	-177.9	-61.5	-23	0	0	0	110.9	P245 V250 Q251	P245-D247 VanDerWaalsContact C-N 3.27Å; P245-D247 PolarHBondContact O-N 3.01Å; D247-V250 PolarHBondContact O-N 2.82Å; D247-Q251 VanDerWaalsContact O-CB 3.28Å; D247-Q251 WeakPolarHBondContact O-CB 3.4Å; D247-Q251 VanDerWaalsContact O-CG 3.31Å; D247-Q251 WeakPolarHBondContact O-CG 3.18Å; D247-Q251 PolarHBondContact O-N 2.71Å
248	Y	78.2	Confident	78.1	Confident	38 Å²	38	54.3 Å²	54.3	15%	0.149	27%	0.269	C	S	.	.	H	α-helix	trans	-68.1	-39.3	177.7	-166.4	-95	0	0	0	112.6	E211 F214 L244 P245 R246 V250 T252 V253	E211-Y248 HydrophobicContact CB-CE1 4.12Å; E211-Y248 HydrophobicContact CB-CE2 4.37Å; E211-Y248 HydrophobicContact CG-CD1 3.95Å; E211-Y248 HydrophobicContact CG-CD2 4.17Å; E211-Y248 HydrophobicContact CG-CE1 3.94Å; E211-Y248 HydrophobicContact CG-CE2 4.17Å; E211-Y248 HydrophobicContact CG-CG 4.06Å; F214-Y248 HydrophobicContact CD1-CE1 4.08Å; L244-Y248 HydrophobicContact CD1-CD1 4.34Å; L244-Y248 HydrophobicContact CD2-CD1 4.24Å; P245-Y248 PolarHBondContact O-N 2.68Å; P245-Y248 VanDerWaalsContact O-N 3.16Å; R246-Y248 VanDerWaalsContact C-N 3.31Å; R246-Y248 PolarHBondContact O-N 2.7Å; Y248-V250 VanDerWaalsContact C-N 3.33Å; Y248-V250 PolarHBondContact O-N 2.92Å; Y248-T252 HydrophobicContact CE1-CG2 4.32Å; Y248-T252 HydrophobicContact CE2-CG2 4.11Å; Y248-T252 WeakPolarHBondContact O-CB 3.26Å; Y248-T252 PolarHBondContact O-N 2.94Å; Y248-V253 HydrophobicContact CD1-CG2 3.9Å; Y248-V253 HydrophobicContact CE1-CG2 3.94Å; Y248-V253 PolarHBondContact O-N 3.43Å
249	L	79.5	Confident	77.6	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.016	26%	0.256	C	S	.	.	I	π-helix	trans	-60.3	-41.6	176.1	-74.8	171.5	0	0	0	112.3	L241 L244 P245 R246 V253 E254 L269 A272 H276	L241-L249 HydrophobicContact CB-CD2 4.43Å; L241-L249 HydrophobicContact CD2-CD2 4.41Å; L244-L249 HydrophobicContact CB-CD1 4.37Å; L244-L249 HydrophobicContact CB-CD2 3.97Å; L244-L249 HydrophobicContact CB-CG 3.89Å; L244-L249 HydrophobicContact CD1-CD2 3.76Å; L244-L249 HydrophobicContact CG-CD2 4.49Å; P245-L249 PolarHBondContact O-N 2.93Å; P245-L249 VanDerWaalsContact O-N 3.1Å; R246-L249 PolarHBondContact O-N 2.9Å; L249-V253 HydrophobicContact CD2-CB 4.31Å; L249-V253 HydrophobicContact CD2-CG1 4.47Å; L249-V253 HydrophobicContact CD2-CG2 4.16Å; L249-V253 WeakPolarHBondContact O-CB 3.44Å; L249-E254 WeakPolarHBondContact O-CB 3.48Å; L249-E254 PolarHBondContact O-N 2.93Å; L249-L269 HydrophobicContact CD2-CD1 4.1Å; L249-A272 HydrophobicContact CD1-CB 4.18Å; L249-H276 WeakPolarHBondContact CD1-NE2 3.39Å
250	V	79.1	Confident	77	Confident	58 Å²	58	56.3 Å²	56.3	35%	0.352	28%	0.277	S	S	.	.	I	π-helix	trans	-82.3	-41.7	-177	178.1	0	0	0	0	111.8	R246 D247 Y248	R246-V250 PolarHBondContact O-N 2.86Å; D247-V250 PolarHBondContact O-N 2.82Å; Y248-V250 VanDerWaalsContact C-N 3.33Å; Y248-V250 PolarHBondContact O-N 2.92Å
251	Q	79.6	Confident	76.6	Confident	128 Å²	128	62.4 Å²	62.4	60%	0.598	31%	0.31	S	S	*	.	I	π-helix	trans	-82.8	-27.6	-174.4	-66.5	179.1	0.3	0	0	113.5	D247 E255	D247-Q251 VanDerWaalsContact O-CB 3.28Å; D247-Q251 WeakPolarHBondContact O-CB 3.4Å; D247-Q251 VanDerWaalsContact O-CG 3.31Å; D247-Q251 WeakPolarHBondContact O-CG 3.18Å; D247-Q251 PolarHBondContact O-N 2.71Å; Q251-E255 WeakPolarHBondContact O-CG 3.39Å
252	T	78.3	Confident	76.4	Confident	52 Å²	52	64.1 Å²	64.1	32%	0.319	32%	0.319	S	S	.	.	I	π-helix	trans	-118.5	-55.3	-172.4	-50	0	0	0	0	111.3	Y248 E255 E256	Y248-T252 HydrophobicContact CE1-CG2 4.32Å; Y248-T252 HydrophobicContact CE2-CG2 4.11Å; Y248-T252 WeakPolarHBondContact O-CB 3.26Å; Y248-T252 PolarHBondContact O-N 2.94Å; T252-E255 PolarHBondContact O-N 3.09Å; T252-E256 PolarHBondContact O-N 2.83Å
253	V	79.8	Confident	76.5	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.349	C	S	.	.	I	π-helix	trans	-70.1	-41.7	-174.3	-174.1	0	0	0	0	111.7	F214 L241 L244 Y248 L249 I259 L269	F214-V253 HydrophobicContact CD1-CG2 4.32Å; F214-V253 HydrophobicContact CE1-CG2 4Å; F214-V253 HydrophobicContact CE2-CG1 4.01Å; F214-V253 HydrophobicContact CE2-CG2 4.28Å; F214-V253 HydrophobicContact CZ-CB 4.3Å; F214-V253 HydrophobicContact CZ-CG1 4.04Å; F214-V253 HydrophobicContact CZ-CG2 3.98Å; L241-V253 HydrophobicContact CD2-CG1 4.28Å; L244-V253 HydrophobicContact CD1-CG2 4.17Å; Y248-V253 HydrophobicContact CD1-CG2 3.9Å; Y248-V253 HydrophobicContact CE1-CG2 3.94Å; Y248-V253 PolarHBondContact O-N 3.43Å; L249-V253 HydrophobicContact CD2-CB 4.31Å; L249-V253 HydrophobicContact CD2-CG1 4.47Å; L249-V253 HydrophobicContact CD2-CG2 4.16Å; L249-V253 WeakPolarHBondContact O-CB 3.44Å; V253-I259 HydrophobicContact CB-CD1 4.47Å; V253-I259 HydrophobicContact CG1-CD1 3.42Å; V253-I259 VanDerWaalsContact CG1-CD1 3.42Å; V253-I259 WeakPolarHBondContact O-CD1 3.24Å; V253-L269 HydrophobicContact CB-CD1 4.27Å; V253-L269 HydrophobicContact CG1-CD1 3.75Å
254	E	76.5	Confident	76.8	Confident	89 Å²	89	70 Å²	70	42%	0.416	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-34.3	176.7	-176.7	174.9	-166.9	0	0	112.3	L249 E256 K260 L269	L249-E254 WeakPolarHBondContact O-CB 3.48Å; L249-E254 PolarHBondContact O-N 2.93Å; E254-E256 VanDerWaalsContact C-N 3.34Å; E254-K260 WeakPolarHBondContact O-CE 3.26Å; E254-L269 HydrophobicContact CB-CD2 4.23Å; E254-L269 HydrophobicContact CG-CD2 4.37Å
255	E	77.9	Confident	76.8	Confident	127 Å²	127	69.9 Å²	69.9	59%	0.593	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-26.4	-178.6	-66.9	-161	166.5	0	0	113.3	Q251 T252 T257 K260	Q251-E255 WeakPolarHBondContact O-CG 3.39Å; T252-E255 PolarHBondContact O-N 3.09Å; E255-T257 PolarHBondContact O-N 3.09Å; E255-K260 WeakPolarHBondContact O-CE 3.08Å; E255-K260 PolarHBondContact O-NZ 2.95Å; E255-K260 VanDerWaalsContact O-NZ 3.14Å
256	E	79.9	Confident	77.2	Confident	50 Å²	50	70.8 Å²	70.8	23%	0.234	35%	0.35	C	S	.	.			trans	-58.4	122.2	-176.3	-170.2	52.1	-109	0	0	112.5	I218 T252 E254 L258 I259 K260	I218-E256 HydrophobicContact CD1-CG 4.13Å; T252-E256 PolarHBondContact O-N 2.83Å; E254-E256 VanDerWaalsContact C-N 3.34Å; E256-L258 HydrophobicContact CG-CB 4.3Å; E256-L258 PolarHBondContact O-N 3.13Å; E256-I259 HydrophobicContact CB-CD1 4.24Å; E256-I259 HydrophobicContact CB-CG1 4.38Å; E256-I259 PolarHBondContact O-N 2.89Å; E256-I259 VanDerWaalsContact O-N 3.08Å; E256-K260 PolarHBondContact O-N 2.89Å
257	T	71.3	Confident	77.5	Confident	89 Å²	89	67.1 Å²	67.1	55%	0.546	34%	0.344	S	S	.	.	H	α-helix	trans	-62.1	-31.3	-172.8	58	0	0	0	0	112.9	E255 I259 N261	E255-T257 PolarHBondContact O-N 3.09Å; T257-I259 VanDerWaalsContact C-N 3.31Å; T257-I259 PolarHBondContact O-N 3.02Å; T257-N261 PolarHBondContact O-N 2.75Å; T257-N261 PolarHBondContact O-ND2 3.35Å
258	L	70.6	Confident	77.8	Confident	17 Å²	17	62.9 Å²	62.9	9%	0.089	32%	0.321	C	S	.	.	H	α-helix	trans	-65.4	-36.5	178.9	-59.5	172.1	0	0	0	111.2	I218 I221 L229 M232 E256	I218-L258 HydrophobicContact CD1-CD1 4.11Å; I221-L258 HydrophobicContact CG2-CD1 4.15Å; L229-L258 HydrophobicContact CD2-CD2 3.57Å; M232-L258 HydrophobicContact CE-CB 3.55Å; M232-L258 HydrophobicContact SD-CB 3.84Å; E256-L258 HydrophobicContact CG-CB 4.3Å; E256-L258 PolarHBondContact O-N 3.13Å
259	I	73.3	Confident	77.9	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-79.8	-36.2	-177.1	-64.5	178.4	0	0	0	110.9	F214 M232 M236 V253 E256 T257 N261 N262 C265	F214-I259 HydrophobicContact CE2-CD1 3.61Å; F214-I259 HydrophobicContact CZ-CD1 3.64Å; M232-I259 HydrophobicContact CE-CB 4.34Å; M232-I259 HydrophobicContact CE-CD1 4.45Å; M232-I259 HydrophobicContact CE-CG1 3.4Å; M236-I259 HydrophobicContact CE-CD1 4.2Å; V253-I259 HydrophobicContact CB-CD1 4.47Å; V253-I259 HydrophobicContact CG1-CD1 3.42Å; V253-I259 VanDerWaalsContact CG1-CD1 3.42Å; V253-I259 WeakPolarHBondContact O-CD1 3.24Å; E256-I259 HydrophobicContact CB-CD1 4.24Å; E256-I259 HydrophobicContact CB-CG1 4.38Å; E256-I259 PolarHBondContact O-N 2.89Å; E256-I259 VanDerWaalsContact O-N 3.08Å; T257-I259 VanDerWaalsContact C-N 3.31Å; T257-I259 PolarHBondContact O-N 3.02Å; I259-N261 PolarHBondContact O-N 2.82Å; I259-N262 PolarHBondContact O-N 2.98Å; I259-C265 HydrophobicContact CG2-CB 4.12Å
260	K	71.9	Confident	78	Confident	103 Å²	103	65.4 Å²	65.4	45%	0.448	34%	0.336	S	S	.	.	H	α-helix	trans	-61.1	-26.5	175.8	-71.9	-179.5	-176.9	165.4	0	113.4	E254 E255 E256 K266	E254-K260 WeakPolarHBondContact O-CE 3.26Å; E255-K260 WeakPolarHBondContact O-CE 3.08Å; E255-K260 PolarHBondContact O-NZ 2.95Å; E255-K260 VanDerWaalsContact O-NZ 3.14Å; E256-K260 PolarHBondContact O-N 2.89Å; K260-K266 WeakPolarHBondContact O-CE 3.33Å; K260-K266 PolarHBondContact O-NZ 3.17Å
261	N	74.6	Confident	78.1	Confident	138 Å²	138	65 Å²	65	74%	0.738	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-11.9	-175	-67.3	-17.7	0	0	0	114	T257 I259	T257-N261 PolarHBondContact O-N 2.75Å; T257-N261 PolarHBondContact O-ND2 3.35Å; I259-N261 PolarHBondContact O-N 2.82Å
262	N	77.8	Confident	78	Confident	37 Å²	37	58.9 Å²	58.9	20%	0.198	30%	0.302	C	S	.	.			trans	-114.7	119.5	-178	-166.4	-37.1	0	0	0	112.1	I259 T264 C265 K266	I259-N262 PolarHBondContact O-N 2.98Å; N262-T264 VanDerWaalsContact C-N 3.34Å; N262-T264 PolarHBondContact O-N 2.81Å; N262-T264 PolarHBondContact OD1-N 3.13Å; N262-T264 PolarHBondContact OD1-OG1 3.26Å; N262-C265 HydrophobicContact CB-CB 4.16Å; N262-C265 PolarHBondContact O-N 3.07Å; N262-K266 PolarHBondContact O-N 3.14Å
263	N	80.3	Confident	78.1	Confident	117 Å²	117	60.3 Å²	60.3	63%	0.626	31%	0.306	S	S	*	.	H	α-helix	trans	-64.1	-35.5	-178.1	-68.3	-20.2	0	0	0	113	K266 D267	N263-K266 WeakPolarHBondContact O-CB 3.49Å; N263-K266 PolarHBondContact O-N 2.66Å; N263-D267 PolarHBondContact O-N 3.02Å; N263-D267 VanDerWaalsContact O-N 3.12Å
264	T	80.4	Confident	78.1	Confident	63 Å²	63	66.6 Å²	66.6	39%	0.387	33%	0.333	S	S	.	.	H	α-helix	trans	-67.6	-39.1	179.9	-41.7	0	0	0	0	111.4	A233 N262 K266 D267 F268	A233-T264 HydrophobicContact CB-CG2 4.31Å; N262-T264 VanDerWaalsContact C-N 3.34Å; N262-T264 PolarHBondContact O-N 2.81Å; N262-T264 PolarHBondContact OD1-N 3.13Å; N262-T264 PolarHBondContact OD1-OG1 3.26Å; T264-K266 VanDerWaalsContact C-N 3.29Å; T264-K266 PolarHBondContact O-N 2.78Å; T264-D267 PolarHBondContact O-N 3.02Å; T264-F268 HydrophobicContact CG2-CE2 4.03Å; T264-F268 HydrophobicContact CG2-CZ 4.03Å; T264-F268 WeakPolarHBondContact O-CD2 3.46Å; T264-F268 PolarHBondContact O-N 3.14Å
265	C	79.7	Confident	77.9	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-33.6	176.3	-60.5	0	0	0	0	111.7	I259 N262 F268 L269	I259-C265 HydrophobicContact CG2-CB 4.12Å; N262-C265 HydrophobicContact CB-CB 4.16Å; N262-C265 PolarHBondContact O-N 3.07Å; C265-F268 PolarHBondContact O-N 2.83Å; C265-L269 PolarHBondContact O-N 2.63Å
266	K	80.9	Confident	77.7	Confident	81 Å²	81	60.4 Å²	60.4	35%	0.352	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-40.5	172.4	-68.9	176.8	-178.1	166.3	0	112	K260 N262 N263 T264 F268 L269 I270	K260-K266 WeakPolarHBondContact O-CE 3.33Å; K260-K266 PolarHBondContact O-NZ 3.17Å; N262-K266 PolarHBondContact O-N 3.14Å; N263-K266 WeakPolarHBondContact O-CB 3.49Å; N263-K266 PolarHBondContact O-N 2.66Å; T264-K266 VanDerWaalsContact C-N 3.29Å; T264-K266 PolarHBondContact O-N 2.78Å; K266-F268 VanDerWaalsContact C-N 3.29Å; K266-F268 PolarHBondContact O-N 2.91Å; K266-L269 WeakPolarHBondContact O-CB 3.33Å; K266-L269 PolarHBondContact O-N 3.35Å; K266-I270 VanDerWaalsContact O-CG1 3.24Å; K266-I270 WeakPolarHBondContact O-CG1 3.44Å; K266-I270 PolarHBondContact O-N 2.95Å
267	D	82.6	Confident	77.4	Confident	103 Å²	103	64.8 Å²	64.8	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-61.6	-40	176.3	-69.7	-24.6	0	0	0	111.4	N263 T264 I270 E271	N263-D267 PolarHBondContact O-N 3.02Å; N263-D267 VanDerWaalsContact O-N 3.12Å; T264-D267 PolarHBondContact O-N 3.02Å; D267-I270 PolarHBondContact O-N 2.92Å; D267-E271 PolarHBondContact O-N 2.81Å
268	F	81.8	Confident	77.4	Confident	24 Å²	24	63.1 Å²	63.1	11%	0.105	31%	0.314	C	S	.	.	H	α-helix	trans	-65.7	-38.5	174	-61.1	-33.9	0	0	0	113.3	M236 E237 L241 T264 C265 K266 E271 A272 R290	M236-F268 HydrophobicContact CB-CD2 4.15Å; M236-F268 HydrophobicContact CB-CE2 4.39Å; E237-F268 HydrophobicContact CB-CE2 4.16Å; E237-F268 HydrophobicContact CB-CZ 4.01Å; E237-F268 HydrophobicContact CG-CZ 4.22Å; L241-F268 HydrophobicContact CD1-CB 3.9Å; T264-F268 HydrophobicContact CG2-CE2 4.03Å; T264-F268 HydrophobicContact CG2-CZ 4.03Å; T264-F268 WeakPolarHBondContact O-CD2 3.46Å; T264-F268 PolarHBondContact O-N 3.14Å; C265-F268 PolarHBondContact O-N 2.83Å; K266-F268 VanDerWaalsContact C-N 3.29Å; K266-F268 PolarHBondContact O-N 2.91Å; F268-E271 PolarHBondContact O-N 3.35Å; F268-A272 PolarHBondContact O-N 3.17Å; F268-R290 VanDerWaalsContact CD1-CZ 3.42Å
269	L	80.9	Confident	76.9	Confident	16 Å²	16	65.8 Å²	65.8	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-63.7	-44.4	173.8	-170.9	77.5	0	0	0	111.1	L249 V253 E254 C265 K266 E271 A272 M273	L249-L269 HydrophobicContact CD2-CD1 4.1Å; V253-L269 HydrophobicContact CB-CD1 4.27Å; V253-L269 HydrophobicContact CG1-CD1 3.75Å; E254-L269 HydrophobicContact CB-CD2 4.23Å; E254-L269 HydrophobicContact CG-CD2 4.37Å; C265-L269 PolarHBondContact O-N 2.63Å; K266-L269 WeakPolarHBondContact O-CB 3.33Å; K266-L269 PolarHBondContact O-N 3.35Å; L269-E271 VanDerWaalsContact C-N 3.31Å; L269-E271 PolarHBondContact O-N 2.94Å; L269-A272 PolarHBondContact O-N 2.8Å; L269-M273 WeakPolarHBondContact O-CG 3.35Å; L269-M273 PolarHBondContact O-N 3.21Å
270	I	80.1	Confident	76	Confident	79 Å²	79	71.9 Å²	71.9	41%	0.405	37%	0.365	S	S	.	.	H	α-helix	trans	-61.9	-40.4	177.8	-68.5	163.8	0	0	0	110.7	K266 D267 M273 K274	K266-I270 VanDerWaalsContact O-CG1 3.24Å; K266-I270 WeakPolarHBondContact O-CG1 3.44Å; K266-I270 PolarHBondContact O-N 2.95Å; D267-I270 PolarHBondContact O-N 2.92Å; I270-M273 PolarHBondContact O-N 3.12Å; I270-K274 HydrophobicContact CG2-CD 4.17Å; I270-K274 HydrophobicContact CG2-CG 4.48Å; I270-K274 WeakPolarHBondContact O-CB 3.43Å; I270-K274 VanDerWaalsContact O-CG 3.3Å; I270-K274 WeakPolarHBondContact O-CG 3.27Å; I270-K274 PolarHBondContact O-N 3.42Å
271	E	81.6	Confident	75	Confident	49 Å²	49	73.3 Å²	73.3	23%	0.229	38%	0.377	C	S	.	.	H	α-helix	trans	-61.3	-46.1	173.7	-178.5	-178.6	166.4	0	0	112.2	D267 F268 L269 M273 K274 Y275 N288 R290	D267-E271 PolarHBondContact O-N 2.81Å; F268-E271 PolarHBondContact O-N 3.35Å; L269-E271 VanDerWaalsContact C-N 3.31Å; L269-E271 PolarHBondContact O-N 2.94Å; E271-M273 PolarHBondContact O-N 3.38Å; E271-K274 PolarHBondContact O-N 3.15Å; E271-Y275 WeakPolarHBondContact O-CB 3.49Å; E271-Y275 PolarHBondContact O-N 3.38Å; E271-N288 PolarHBondContact OE1-ND2 3.13Å; E271-R290 VanDerWaalsContact CD-NH1 3.33Å; E271-R290 IonicContact OE1-CZ 3.06Å; E271-R290 IonicContact OE1-NH1 2.73Å; E271-R290 IonicContact OE1-NH2 2.62Å; E271-R290 IonicContact OE2-CZ 2.79Å; E271-R290 IonicContact OE2-NH1 3.61Å; E271-R290 PolarHBondContact OE2-NH1 2.98Å; E271-R290 IonicContact OE2-NH2 2.75Å; E271-R290 PolarHBondContact OE2-NH2 3.41Å
272	A	78.9	Confident	74.2	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-60.5	-45.1	176.8	0	0	0	0	0	111.5	L241 P242 L249 F268 L269 K274 Y275 H276	L241-A272 HydrophobicContact CB-CB 3.78Å; P242-A272 HydrophobicContact CB-CB 4.48Å; P242-A272 HydrophobicContact CG-CB 4.18Å; L249-A272 HydrophobicContact CD1-CB 4.18Å; F268-A272 PolarHBondContact O-N 3.17Å; L269-A272 PolarHBondContact O-N 2.8Å; A272-K274 PolarHBondContact O-N 3.22Å; A272-Y275 WeakPolarHBondContact O-CB 3.31Å; A272-Y275 PolarHBondContact O-N 2.74Å; A272-H276 PolarHBondContact O-CD2 3.48Å; A272-H276 PolarHBondContact O-N 3.04Å; A272-H276 VanDerWaalsContact O-N 3.1Å
273	M	79.4	Confident	73.3	Confident	82 Å²	82	72.8 Å²	72.8	40%	0.404	37%	0.366	S	S	.	.	H	α-helix	trans	-62.1	-42.5	175.8	-67.6	-175.7	85.2	0	0	112.2	L269 I270 E271 Y275 H276 L277	L269-M273 WeakPolarHBondContact O-CG 3.35Å; L269-M273 PolarHBondContact O-N 3.21Å; I270-M273 PolarHBondContact O-N 3.12Å; E271-M273 PolarHBondContact O-N 3.38Å; M273-Y275 VanDerWaalsContact C-N 3.31Å; M273-Y275 PolarHBondContact O-N 2.98Å; M273-H276 PolarHBondContact O-N 3.13Å; M273-L277 WeakPolarHBondContact O-CG 3.37Å; M273-L277 PolarHBondContact O-N 2.86Å; M273-L277 VanDerWaalsContact O-N 3.13Å
274	K	79.1	Confident	71.9	Confident	132 Å²	132	74.1 Å²	74.1	57%	0.574	37%	0.373	S	S	*	.	H	α-helix	trans	-59.8	-41.3	173.6	-77.6	175	-178.9	174.6	0	111.7	I270 E271 A272 H276 L277 L278	I270-K274 HydrophobicContact CG2-CD 4.17Å; I270-K274 HydrophobicContact CG2-CG 4.48Å; I270-K274 WeakPolarHBondContact O-CB 3.43Å; I270-K274 VanDerWaalsContact O-CG 3.3Å; I270-K274 WeakPolarHBondContact O-CG 3.27Å; I270-K274 PolarHBondContact O-N 3.42Å; E271-K274 PolarHBondContact O-N 3.15Å; A272-K274 PolarHBondContact O-N 3.22Å; K274-H276 VanDerWaalsContact C-N 3.33Å; K274-H276 PolarHBondContact O-N 3.4Å; K274-L277 PolarHBondContact O-N 3.27Å; K274-L277 VanDerWaalsContact O-N 3.09Å; K274-L278 PolarHBondContact O-N 3.08Å
275	Y	74	Confident	70.7	Confident	35 Å²	35	77.7 Å²	77.7	14%	0.137	39%	0.389	C	S	.	.	H	α-helix	trans	-59.7	-41.7	176.3	-176	-100.3	0	0	0	112	P242 E271 A272 M273 L277 L278 R283 I286 T291	P242-Y275 HydrophobicContact CB-CD1 3.65Å; P242-Y275 HydrophobicContact CB-CE1 4.17Å; P242-Y275 HydrophobicContact CB-CG 3.85Å; P242-Y275 VanDerWaalsContact O-CD1 3.28Å; P242-Y275 WeakPolarHBondContact O-CD1 3.49Å; P242-Y275 WeakPolarHBondContact O-CE1 3.25Å; E271-Y275 WeakPolarHBondContact O-CB 3.49Å; E271-Y275 PolarHBondContact O-N 3.38Å; A272-Y275 WeakPolarHBondContact O-CB 3.31Å; A272-Y275 PolarHBondContact O-N 2.74Å; M273-Y275 VanDerWaalsContact C-N 3.31Å; M273-Y275 PolarHBondContact O-N 2.98Å; Y275-L277 VanDerWaalsContact C-N 3.3Å; Y275-L277 PolarHBondContact O-N 3.34Å; Y275-L278 PolarHBondContact O-N 3.39Å; Y275-R283 HydrophobicContact CD2-CG 4.34Å; Y275-R283 HydrophobicContact CE1-CG 4.46Å; Y275-R283 HydrophobicContact CE2-CB 3.8Å; Y275-R283 HydrophobicContact CE2-CG 3.97Å; Y275-R283 PolarHBondContact O-NE 3.46Å; Y275-I286 HydrophobicContact CD2-CD1 4.43Å; Y275-T291 HydrophobicContact CD2-CG2 3.72Å; Y275-T291 HydrophobicContact CE2-CG2 3.67Å; Y275-T291 HydrophobicContact CG-CG2 4.41Å
276	H	72.5	Confident	69.8	Low	50 Å²	50	80.4 Å²	80.4	23%	0.231	40%	0.403	C	S	.	.	H	α-helix	trans	-70.9	-18.8	174.6	-69.8	-70.3	0	0	0	114.8	P242 L244 L249 A272 M273 K274 R283	P242-H276 PolarHBondContact O-NE2 3.49Å; L244-H276 PolarHBondContact O-CE1 2.91Å; L244-H276 PolarHBondContact O-NE2 3.38Å; L244-H276 VanDerWaalsContact O-NE2 3.08Å; L249-H276 WeakPolarHBondContact CD1-NE2 3.39Å; A272-H276 PolarHBondContact O-CD2 3.48Å; A272-H276 PolarHBondContact O-N 3.04Å; A272-H276 VanDerWaalsContact O-N 3.1Å; M273-H276 PolarHBondContact O-N 3.13Å; K274-H276 VanDerWaalsContact C-N 3.33Å; K274-H276 PolarHBondContact O-N 3.4Å; H276-R283 PolarHBondContact O-NH2 2.78Å
277	L	74.4	Confident	68.6	Low	143 Å²	143	85.6 Å²	85.6	75%	0.749	43%	0.425	S	S	*	.	H	α-helix	trans	-82.5	-19	175.4	-69.6	168.5	0	0	0	112.9	M273 K274 Y275	M273-L277 WeakPolarHBondContact O-CG 3.37Å; M273-L277 PolarHBondContact O-N 2.86Å; M273-L277 VanDerWaalsContact O-N 3.13Å; K274-L277 PolarHBondContact O-N 3.27Å; K274-L277 VanDerWaalsContact O-N 3.09Å; Y275-L277 VanDerWaalsContact C-N 3.3Å; Y275-L277 PolarHBondContact O-N 3.34Å
278	L	70.3	Confident	67.9	Low	53 Å²	53	83.9 Å²	83.9	28%	0.277	42%	0.416	S	S	.	.	S	Bend	trans	-76.8	147.4	179.2	-69.4	169.7	0	0	0	112.1	K274 Y275 R283 I286	K274-L278 PolarHBondContact O-N 3.08Å; Y275-L278 PolarHBondContact O-N 3.39Å; L278-R283 HydrophobicContact CB-CG 4.12Å; L278-R283 PolarHBondContact O-NE 2.95Å; L278-R283 PolarHBondContact O-NH2 2.76Å; L278-I286 HydrophobicContact CD1-CD1 3.4Å
279	P	61.5	Low	67.1	Low	73 Å²	73	88.2 Å²	88.2	47%	0.474	45%	0.447	S	S	.	.			trans	-61.5	149.9	169.4	-19.2	31.4	0	0	0	112.2	D281 Q282 R283	P279-D281 VanDerWaalsContact C-N 3.26Å; P279-D281 PolarHBondContact O-N 2.94Å; P279-Q282 PolarHBondContact O-N 3.31Å; P279-R283 PolarHBondContact O-N 3.48Å
280	L	54.6	Low	66.7	Low	132 Å²	132	89.2 Å²	89.2	69%	0.691	45%	0.449	S	S	*	.	H	α-helix	trans	-52.3	-40.2	-177	-85.8	123.9	0	0	0	113.4	Q282 R283 L284	L280-Q282 VanDerWaalsContact C-N 3.29Å; L280-Q282 PolarHBondContact O-N 3.05Å; L280-R283 WeakPolarHBondContact O-CB 3.36Å; L280-R283 PolarHBondContact O-N 3.46Å; L280-L284 PolarHBondContact O-N 3.41Å
281	D	49.3	Very low	66.1	Low	132 Å²	132	85.9 Å²	85.9	71%	0.706	43%	0.433	S	S	*	.	H	α-helix	trans	-64.2	-32.2	-179	-53.2	-29.4	0	0	0	113.1	P279	P279-D281 VanDerWaalsContact C-N 3.26Å; P279-D281 PolarHBondContact O-N 2.94Å
282	Q	58.7	Low	65.3	Low	104 Å²	104	88.4 Å²	88.4	49%	0.486	44%	0.443	S	S	.	.	H	α-helix	trans	-83.5	-25.7	178.7	-68.2	-178.2	6	0	0	112.4	P279 L280 L284 L285	P279-Q282 PolarHBondContact O-N 3.31Å; L280-Q282 VanDerWaalsContact C-N 3.29Å; L280-Q282 PolarHBondContact O-N 3.05Å; Q282-L284 VanDerWaalsContact C-N 3.33Å; Q282-L284 PolarHBondContact O-N 2.86Å; Q282-L285 PolarHBondContact O-N 2.88Å
283	R	58.5	Low	64.4	Low	60 Å²	60	92.2 Å²	92.2	23%	0.226	47%	0.468	C	S	.	.	H	α-helix	trans	-64.3	-38.3	176.4	-67.4	-179.1	-166.3	173.1	4.3	112.1	Y275 H276 L278 P279 L280 L285 I286	Y275-R283 HydrophobicContact CD2-CG 4.34Å; Y275-R283 HydrophobicContact CE1-CG 4.46Å; Y275-R283 HydrophobicContact CE2-CB 3.8Å; Y275-R283 HydrophobicContact CE2-CG 3.97Å; Y275-R283 PolarHBondContact O-NE 3.46Å; H276-R283 PolarHBondContact O-NH2 2.78Å; L278-R283 HydrophobicContact CB-CG 4.12Å; L278-R283 PolarHBondContact O-NE 2.95Å; L278-R283 PolarHBondContact O-NH2 2.76Å; P279-R283 PolarHBondContact O-N 3.48Å; L280-R283 WeakPolarHBondContact O-CB 3.36Å; L280-R283 PolarHBondContact O-N 3.46Å; R283-L285 PolarHBondContact O-N 3.06Å; R283-I286 PolarHBondContact O-N 3.11Å
284	L	51.2	Low	63.9	Low	145 Å²	145	89.5 Å²	89.5	76%	0.759	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-18.4	178.6	-65.2	171.3	0	0	0	113.6	L280 Q282	L280-L284 PolarHBondContact O-N 3.41Å; Q282-L284 VanDerWaalsContact C-N 3.33Å; Q282-L284 PolarHBondContact O-N 2.86Å
285	L	54.1	Low	62.8	Low	138 Å²	138	87.4 Å²	87.4	72%	0.723	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-18.1	179	-65.4	168.8	0	0	0	112.9	Q282 R283 K287	Q282-L285 PolarHBondContact O-N 2.88Å; R283-L285 PolarHBondContact O-N 3.06Å; L285-K287 PolarHBondContact O-N 2.8Å
286	I	61.3	Low	61.9	Low	58 Å²	58	88 Å²	88	30%	0.297	46%	0.459	S	S	.	.			trans	-85.6	102.7	-180	-59.8	174.4	0	0	0	109.5	Y275 L278 R283 N288 T291	Y275-I286 HydrophobicContact CD2-CD1 4.43Å; L278-I286 HydrophobicContact CD1-CD1 3.4Å; R283-I286 PolarHBondContact O-N 3.11Å; I286-N288 HydrophobicContact CG2-CB 4.46Å; I286-N288 PolarHBondContact O-N 2.81Å; I286-T291 HydrophobicContact CG2-CG2 4.13Å; I286-T291 PolarHBondContact O-OG1 2.8Å
287	K	55.6	Low	60.8	Low	189 Å²	189	89.2 Å²	89.2	82%	0.822	47%	0.47	S	S	*	.			trans	-97.8	70.9	177.3	-62.4	-175.6	-179	-177.8	0	111.4	L285	L285-K287 PolarHBondContact O-N 2.8Å
288	N	68.9	Low	59.8	Low	68 Å²	68	84.9 Å²	84.9	36%	0.364	45%	0.452	S	S	.	.			trans	-98.8	149	168.2	-70.3	-4	0	0	0	109.4	E271 I286 R290 T291 K292	E271-N288 PolarHBondContact OE1-ND2 3.13Å; I286-N288 HydrophobicContact CG2-CB 4.46Å; I286-N288 PolarHBondContact O-N 2.81Å; N288-R290 PolarHBondContact O-N 2.81Å; N288-R290 VanDerWaalsContact O-N 3.11Å; N288-T291 HydrophobicContact CB-CG2 4.2Å; N288-T291 PolarHBondContact N-OG1 2.81Å; N288-T291 PolarHBondContact O-N 2.98Å; N288-T291 PolarHBondContact O-OG1 3.16Å; N288-K292 PolarHBondContact O-N 3.22Å
289	P	63.6	Low	59.3	Low	114 Å²	114	85.3 Å²	85.3	74%	0.74	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-31.6	174.7	-27	34.7	0	0	0	113.6
290	R	72.9	Confident	59.8	Low	37 Å²	37	83.3 Å²	83.3	14%	0.14	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-13.2	177.4	-73	-175	-80	129.4	5.1	115	E237 R240 P242 F268 E271 N288	E237-R290 VanDerWaalsContact O-CD 3.29Å; E237-R290 WeakPolarHBondContact O-CD 3.45Å; E237-R290 WeakPolarHBondContact O-CG 3.41Å; R240-R290 WeakPolarHBondContact CB-O 3.4Å; P242-R290 WeakPolarHBondContact CD-O 3.48Å; P242-R290 HydrophobicContact CG-CB 4.35Å; F268-R290 VanDerWaalsContact CD1-CZ 3.42Å; E271-R290 VanDerWaalsContact CD-NH1 3.33Å; E271-R290 IonicContact OE1-CZ 3.06Å; E271-R290 IonicContact OE1-NH1 2.73Å; E271-R290 IonicContact OE1-NH2 2.62Å; E271-R290 IonicContact OE2-CZ 2.79Å; E271-R290 IonicContact OE2-NH1 3.61Å; E271-R290 PolarHBondContact OE2-NH1 2.98Å; E271-R290 IonicContact OE2-NH2 2.75Å; E271-R290 PolarHBondContact OE2-NH2 3.41Å; N288-R290 PolarHBondContact O-N 2.81Å; N288-R290 VanDerWaalsContact O-N 3.11Å
291	T	67.1	Low	61.3	Low	10 Å²	10	80.1 Å²	80.1	6%	0.061	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-5.3	176.7	58.3	0	0	0	0	112.8	P242 Y275 I286 N288	P242-T291 HydrophobicContact CB-CG2 4.06Å; P242-T291 HydrophobicContact CG-CG2 4.11Å; Y275-T291 HydrophobicContact CD2-CG2 3.72Å; Y275-T291 HydrophobicContact CE2-CG2 3.67Å; Y275-T291 HydrophobicContact CG-CG2 4.41Å; I286-T291 HydrophobicContact CG2-CG2 4.13Å; I286-T291 PolarHBondContact O-OG1 2.8Å; N288-T291 HydrophobicContact CB-CG2 4.2Å; N288-T291 PolarHBondContact N-OG1 2.81Å; N288-T291 PolarHBondContact O-N 2.98Å; N288-T291 PolarHBondContact O-OG1 3.16Å
292	K	65.8	Low	63.4	Low	101 Å²	101	74.1 Å²	74.1	44%	0.439	39%	0.39	S	S	.	.	S	Bend	trans	-86.2	121.2	174.3	-173.3	-171.6	172.7	-162.2	0	110	D203 R240 N288	D203-K292 IonicContact OD2-NZ 2.84Å; D203-K292 PolarHBondContact OD2-NZ 3.49Å; R240-K292 VanDerWaalsContact CD-O 3.26Å; R240-K292 WeakPolarHBondContact CD-O 3.39Å; R240-K292 PolarHBondContact NH1-O 3.47Å; N288-K292 PolarHBondContact O-N 3.22Å
293	P	59.5	Low	65.2	Low	80 Å²	80	69.2 Å²	69.2	52%	0.519	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-57.6	146.7	171.8	-24.2	34.8	0	0	0	112.9	R240 L243 T295	R240-P293 VanDerWaalsContact NH1-C 3.33Å; R240-P293 PolarHBondContact NH1-O 2.83Å; L243-P293 HydrophobicContact CD1-CB 4.27Å; L243-P293 HydrophobicContact CD1-CG 4.35Å; L243-P293 HydrophobicContact CD2-CG 4.31Å; P293-T295 PolarHBondContact O-N 2.91Å
294	R	68.1	Low	67.1	Low	25 Å²	25	66.4 Å²	66.4	9%	0.094	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-61.9	136.1	169.4	-69.2	-170.7	-162.2	-96.2	-2.7	108.7	I200 S202 E210 H238 P296	I200-R294 VanDerWaalsContact O-CZ 3.23Å; I200-R294 PolarHBondContact O-NH1 2.75Å; I200-R294 PolarHBondContact O-NH2 2.74Å; S202-R294 PolarHBondContact O-NH1 3Å; E210-R294 WeakPolarHBondContact OE1-CD 3.5Å; E210-R294 IonicContact OE1-CZ 2.8Å; E210-R294 IonicContact OE1-NE 3.25Å; E210-R294 PolarHBondContact OE1-NE 3.4Å; E210-R294 IonicContact OE1-NH2 2.91Å; E210-R294 IonicContact OE2-NE 3.27Å; E210-R294 IonicContact OE2-NH2 3.59Å; H238-R294 PolarHBondContact O-NH2 3.29Å; R294-P296 VanDerWaalsContact C-CD 3.45Å; R294-P296 VanDerWaalsContact O-CD 3.27Å; R294-P296 WeakPolarHBondContact O-CD 3.43Å
295	T	57.9	Low	69.3	Low	88 Å²	88	59.5 Å²	59.5	54%	0.54	32%	0.32	S	S	.	.			trans	-112	83.1	171.6	50.1	0	0	0	0	105.2	D203 P293	D203-T295 CarbonylContact O-C 3.54Å; D203-T295 VanDerWaalsContact O-C 3.22Å; D203-T295 PolarHBondContact O-N 2.97Å; D203-T295 VanDerWaalsContact O-O 3.07Å; P293-T295 PolarHBondContact O-N 2.91Å
296	P	55.1	Low	71.4	Confident	47 Å²	47	53.2 Å²	53.2	31%	0.305	29%	0.288	S	S	.	.			trans	-50.4	153.8	174.2	18.6	-29.2	0	0	0	109.8	K204 T206 R294 S298	K204-P296 WeakPolarHBondContact O-CA 3.32Å; T206-P296 HydrophobicContact CG2-CB 4.28Å; T206-P296 VanDerWaalsContact OG1-CB 3.27Å; T206-P296 WeakPolarHBondContact OG1-CB 3.33Å; R294-P296 VanDerWaalsContact C-CD 3.45Å; R294-P296 VanDerWaalsContact O-CD 3.27Å; R294-P296 WeakPolarHBondContact O-CD 3.43Å; P296-S298 PolarHBondContact O-N 2.77Å
297	V	48.7	Very low	73.2	Confident	76 Å²	76	50.4 Å²	50.4	46%	0.461	27%	0.273	S	S	.	.			trans	-60.5	90.6	162.7	179.8	0	0	0	0	104.5	K204 L299	K204-V297 HydrophobicContact CB-CG2 4.1Å; K204-V297 HydrophobicContact CD-CG2 3.75Å; K204-V297 HydrophobicContact CG-CG2 3.9Å; V297-L299 PolarHBondContact O-N 3.18Å; V297-L299 VanDerWaalsContact O-N 3.14Å
298	S	53.3	Low	75.2	Confident	53 Å²	53	41.4 Å²	41.4	37%	0.371	23%	0.234	S	C	.	.			trans	-59	127.5	-175.1	57.3	0	0	0	0	105.3	P296 P300	P296-S298 PolarHBondContact O-N 2.77Å; S298-P300 VanDerWaalsContact O-N 3.16Å
299	L	59.4	Low	76.5	Confident	61 Å²	61	40.4 Å²	40.4	32%	0.319	23%	0.227	S	C	.	.			trans	-37.7	128.4	165.7	-75.3	173	0	0	0	107.9	V297 K301 H584 L587	V297-L299 PolarHBondContact O-N 3.18Å; V297-L299 VanDerWaalsContact O-N 3.14Å; L299-K301 PolarHBondContact O-N 2.72Å; L299-H584 HydrophobicContact CB-CB 3.85Å; L299-H584 HydrophobicContact CD1-CB 4.16Å; L299-H584 PolarHBondContact O-ND1 3.42Å; L299-L587 HydrophobicContact CD2-CD1 3.78Å; L299-L587 HydrophobicContact CD2-CD2 3.96Å; L299-L587 HydrophobicContact CD2-CG 3.56Å
300	P	73	Confident	78	Confident	31 Å²	31	36.2 Å²	36.2	20%	0.201	20%	0.203	C	C	.	.			trans	-42.6	123.2	-175.4	-29.5	33.1	0	0	0	108.5	S298 E323 K585	S298-P300 VanDerWaalsContact O-N 3.16Å; P300-E323 HydrophobicContact CB-CG 4.28Å; P300-E323 WeakPolarHBondContact CG-OE1 3.4Å; P300-K585 HydrophobicContact CB-CB 4.11Å; P300-K585 HydrophobicContact CB-CD 4.17Å; P300-K585 WeakPolarHBondContact O-CA 3.3Å; P300-K585 WeakPolarHBondContact O-CB 3.41Å; P300-K585 PolarHBondContact O-N 3.38Å
301	K	85.9	Confident	78.7	Confident	66 Å²	66	39.4 Å²	39.4	29%	0.287	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	146.4	178.8	-71.6	177	-177.1	173.7	0	107.5	L299 F322 V535 V582 I583	L299-K301 PolarHBondContact O-N 2.72Å; K301-F322 WeakPolarHBondContact O-CD2 3.45Å; K301-V535 HydrophobicContact CB-CG2 4.08Å; K301-V535 HydrophobicContact CD-CG2 3.6Å; K301-V535 HydrophobicContact CG-CG2 4.5Å; K301-V582 HydrophobicContact CB-CG1 3.86Å; K301-V582 HydrophobicContact CD-CG1 4.09Å; K301-V582 HydrophobicContact CG-CG1 4.25Å; K301-I583 CarbonylContact C-O 3.42Å; K301-I583 VanDerWaalsContact CA-O 3.3Å; K301-I583 WeakPolarHBondContact CA-O 3.49Å
302	V	93.2	Very high	80.1	Confident	6 Å²	6	46.5 Å²	46.5	4%	0.036	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	149.3	172.5	-62.2	0	0	0	0	109.4	C319 Y320 V582 I583 K585	V302-C319 VanDerWaalsContact CB-SG 3.52Å; V302-C319 VanDerWaalsContact CG2-SG 3.51Å; V302-Y320 WeakPolarHBondContact CA-O 3.3Å; V302-Y320 WeakPolarHBondContact CB-O 3.37Å; V302-V582 WeakPolarHBondContact O-CA 3.34Å; V302-I583 HydrophobicContact CG2-CD1 4.13Å; V302-I583 HydrophobicContact CG2-CG1 3.47Å; V302-I583 VanDerWaalsContact CG2-CG1 3.47Å; V302-I583 PolarHBondContact N-O 3.4Å; V302-I583 PolarHBondContact O-N 3.49Å; V302-K585 HydrophobicContact CG1-CB 3.96Å; V302-K585 HydrophobicContact CG1-CD 4.25Å; V302-K585 HydrophobicContact CG1-CG 4.21Å
303	M	96.8	Very high	81.5	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.9	-179	174.4	177.1	62.3	0	0	109.8	C319 Y320 F322 W327 V542 V554 V580	M303-C319 CarbonylContact O-C 3.57Å; M303-C319 WeakPolarHBondContact O-CA 3.26Å; M303-Y320 HydrophobicContact CE-CD1 4.01Å; M303-Y320 HydrophobicContact CE-CG 4.19Å; M303-Y320 PolarHBondContact N-O 3.36Å; M303-Y320 PolarHBondContact O-N 3.44Å; M303-F322 HydrophobicContact CB-CE2 3.65Å; M303-F322 HydrophobicContact CB-CZ 3.68Å; M303-F322 HydrophobicContact SD-CZ 4.48Å; M303-W327 HydrophobicContact CE-CH2 3.82Å; M303-W327 HydrophobicContact CE-CZ2 4.18Å; M303-V542 HydrophobicContact CE-CG2 3.95Å; M303-V542 HydrophobicContact SD-CG2 3.51Å; M303-V542 VanDerWaalsContact SD-CG2 3.51Å; M303-V554 HydrophobicContact CE-CG1 4.34Å; M303-V580 HydrophobicContact CG-CG1 3.56Å; M303-V580 HydrophobicContact SD-CG1 3.91Å
304	I	97.4	Very high	83.4	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	134.2	179.5	-61.3	-179.3	0	0	0	109.9	V306 V317 E318 C319 I330 Y367 V580 A581 I583	I304-V306 HydrophobicContact CG2-CG2 3.71Å; I304-V317 HydrophobicContact CG2-CG1 3.38Å; I304-E318 CarbonylContact C-O 3.59Å; I304-E318 WeakPolarHBondContact CA-O 3.41Å; I304-C319 HydrophobicContact CG1-CB 4.44Å; I304-I330 HydrophobicContact CD1-CD1 3.75Å; I304-I330 HydrophobicContact CG1-CD1 4.09Å; I304-I330 HydrophobicContact CG2-CD1 3.88Å; I304-Y367 HydrophobicContact CD1-CD1 4.14Å; I304-Y367 HydrophobicContact CD1-CE1 3.7Å; I304-V580 VanDerWaalsContact O-CA 3.26Å; I304-V580 WeakPolarHBondContact O-CA 3.24Å; I304-A581 PolarHBondContact N-O 3.35Å; I304-A581 PolarHBondContact O-N 3.16Å; I304-I583 HydrophobicContact CD1-CD1 3.32Å; I304-I583 HydrophobicContact CD1-CG1 3.62Å; I304-I583 HydrophobicContact CD1-CG2 4.17Å; I304-I583 HydrophobicContact CG1-CD1 4.33Å; I304-I583 HydrophobicContact CG1-CG1 4.17Å
305	V	98.3	Very high	84.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.3	176.4	-171.6	0	0	0	0	109.3	V317 E318 W327 V542 M571 A578 V580	V305-V317 WeakPolarHBondContact O-CA 3.4Å; V305-E318 PolarHBondContact N-O 3.08Å; V305-E318 PolarHBondContact O-N 2.89Å; V305-W327 HydrophobicContact CB-CZ3 4.41Å; V305-W327 HydrophobicContact CG2-CH2 3.7Å; V305-W327 HydrophobicContact CG2-CZ3 3.54Å; V305-V542 HydrophobicContact CG1-CG1 4.27Å; V305-V542 HydrophobicContact CG2-CG1 3.73Å; V305-M571 HydrophobicContact CB-SD 4.43Å; V305-M571 HydrophobicContact CG1-SD 4Å; V305-M571 HydrophobicContact CG2-SD 4.18Å; V305-A578 HydrophobicContact CG1-CB 3.76Å; V305-V580 HydrophobicContact CG1-CG2 4.29Å; V305-V580 HydrophobicContact CG2-CG2 4.18Å
306	V	98.4	Very high	86.7	Confident	6 Å²	6	40.3 Å²	40.3	4%	0.036	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114.9	-167.8	-178.9	0	0	0	0	111	I304 V317 L333 V342 V349 A351 W374 G579	I304-V306 HydrophobicContact CG2-CG2 3.71Å; V306-V317 HydrophobicContact CG1-CG2 4.37Å; V306-V317 HydrophobicContact CG2-CG1 4.14Å; V306-L333 HydrophobicContact CG1-CD1 3.84Å; V306-L333 HydrophobicContact CG1-CD2 3.85Å; V306-L333 HydrophobicContact CG1-CG 4.06Å; V306-V342 HydrophobicContact CB-CG1 4.37Å; V306-V342 HydrophobicContact CB-CG2 4.1Å; V306-V342 HydrophobicContact CG1-CG2 4.35Å; V306-V342 HydrophobicContact CG2-CG1 4.03Å; V306-V349 HydrophobicContact CG2-CG1 4.24Å; V306-A351 HydrophobicContact CG1-CB 4.14Å; V306-W374 HydrophobicContact CG1-CH2 3.7Å; V306-W374 HydrophobicContact CG1-CZ2 4.05Å; V306-W374 HydrophobicContact CG2-CH2 4.14Å; V306-W374 HydrophobicContact CG2-CZ2 4.36Å; V306-G579 PolarHBondContact N-O 2.97Å; V306-G579 PolarHBondContact O-N 3.32Å
307	G	97.8	Very high	88.7	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.			trans	62	-138	173.6	0	0	0	0	0	112.9	S316 R575 A578	G307-S316 WeakPolarHBondContact CA-O 3.23Å; G307-S316 PolarHBondContact N-O 3.4Å; G307-S316 VanDerWaalsContact N-O 3.11Å; G307-R575 PolarHBondContact O-NH1 3.48Å; G307-A578 WeakPolarHBondContact O-CB 3.42Å
308	G	97.6	Very high	91	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.183	C	C	.	.			trans	110.3	-166.7	-179.9	0	0	0	0	0	113.3	A313 I314 R337 C338 S576	G308-A313 WeakPolarHBondContact O-CA 3.38Å; G308-I314 WeakPolarHBondContact O-CG1 3.43Å; G308-I314 PolarHBondContact O-N 2.75Å; G308-R337 PolarHBondContact N-O 3.5Å; G308-C338 VanDerWaalsContact C-CB 3.43Å; G308-C338 VanDerWaalsContact O-CB 3.29Å; G308-C338 WeakPolarHBondContact O-CB 3.41Å; G308-S576 CarbonylContact C-O 3.58Å; G308-S576 WeakPolarHBondContact CA-O 3.37Å
309	Q	97.2	Very high	93.1	Very high	46 Å²	46	32.9 Å²	32.9	22%	0.215	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-118	122.5	-174.6	-176.2	178.4	-31.4	0	0	109.9	P311 K312 C338 N550 R575 S576	Q309-P311 VanDerWaalsContact CD-O 3.28Å; Q309-P311 WeakPolarHBondContact CG-O 3.41Å; Q309-P311 PolarHBondContact NE2-O 2.7Å; Q309-K312 CarbonylContact C-O 3.59Å; Q309-K312 WeakPolarHBondContact CA-O 3.06Å; Q309-C338 HydrophobicContact CB-CB 4.38Å; Q309-N550 PolarHBondContact O-ND2 3.37Å; Q309-R575 WeakPolarHBondContact O-CA 3.35Å; Q309-S576 WeakPolarHBondContact CB-O 3.44Å; Q309-S576 PolarHBondContact N-O 3.2Å; Q309-S576 PolarHBondContact O-N 2.91Å
310	A	94.1	Very high	94.8	Very high	27 Å²	27	30.6 Å²	30.6	22%	0.223	16%	0.157	C	C	.	.	S	Bend	trans	-153.5	79.5	178	0	0	0	0	0	113.8	K312 I314 T573 G574	A310-K312 PolarHBondContact N-O 3.26Å; A310-I314 HydrophobicContact CB-CD1 4.3Å; A310-I314 HydrophobicContact CB-CG2 4.25Å; A310-T573 HydrophobicContact CB-CG2 3.67Å; A310-G574 WeakPolarHBondContact CB-O 3.36Å
311	P	88.9	Confident	95.6	Very high	103 Å²	103	29.4 Å²	29.4	67%	0.669	15%	0.149	S	C	*	.	S	Bend	cis	-81.2	1.7	-25.4	37	-35.4	0	0	0	111.9	Q309	Q309-P311 VanDerWaalsContact CD-O 3.28Å; Q309-P311 WeakPolarHBondContact CG-O 3.41Å; Q309-P311 PolarHBondContact NE2-O 2.7Å
312	K	94.9	Very high	95.7	Very high	160 Å²	160	28.4 Å²	28.4	70%	0.696	15%	0.145	S	C	*	.	S	Bend	trans	-106	169.8	170.9	-65.8	-176.5	-179.9	178.7	0	109.8	Q309 A310 I314	Q309-K312 CarbonylContact C-O 3.59Å; Q309-K312 WeakPolarHBondContact CA-O 3.06Å; A310-K312 PolarHBondContact N-O 3.26Å; K312-I314 WeakPolarHBondContact O-CG2 3.39Å; K312-I314 PolarHBondContact O-N 3.07Å
313	A	97.1	Very high	95.3	Very high	6 Å²	6	34.8 Å²	34.8	5%	0.05	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-58.1	132.2	176.1	0	0	0	0	0	111.3	G308 R336 C338	G308-A313 WeakPolarHBondContact O-CA 3.38Å; A313-R336 HydrophobicContact CB-CB 4.09Å; A313-R336 WeakPolarHBondContact O-CD 3.43Å; A313-C338 HydrophobicContact CB-CB 4.27Å
314	I	97.6	Very high	94.8	Very high	33 Å²	33	38.9 Å²	38.9	17%	0.169	19%	0.194	C	C	.	.			trans	-115	166.5	-178.9	63.6	-179.8	0	0	0	112.1	G308 A310 K312 R336 R337	G308-I314 WeakPolarHBondContact O-CG1 3.43Å; G308-I314 PolarHBondContact O-N 2.75Å; A310-I314 HydrophobicContact CB-CD1 4.3Å; A310-I314 HydrophobicContact CB-CG2 4.25Å; K312-I314 WeakPolarHBondContact O-CG2 3.39Å; K312-I314 PolarHBondContact O-N 3.07Å; I314-R336 WeakPolarHBondContact O-CA 3.4Å; I314-R337 PolarHBondContact O-N 3.4Å
315	R	97.9	Very high	94.2	Very high	103 Å²	103	41.6 Å²	41.6	39%	0.389	21%	0.208	S	C	.	.			trans	-100.1	-22.5	173.8	-60.4	179.6	65.7	175.3	-5.4	113.3	V317 E332 L333 P334 R336	R315-V317 PolarHBondContact O-N 2.93Å; R315-E332 HydrophobicContact CB-CB 4.18Å; R315-E332 IonicContact NE-OE2 3.23Å; R315-L333 VanDerWaalsContact CZ-O 3.23Å; R315-L333 PolarHBondContact NE-O 2.87Å; R315-L333 PolarHBondContact NH2-O 2.98Å; R315-L333 PolarHBondContact O-N 2.8Å; R315-P334 PolarHBondContact NH2-O 3.49Å; R315-R336 HydrophobicContact CG-CB 4.32Å; R315-R336 HydrophobicContact CG-CG 3.63Å
316	S	97.8	Very high	93.9	Very high	21 Å²	21	46.9 Å²	46.9	15%	0.147	23%	0.228	C	C	.	.			trans	-55.2	135	-174.3	159.6	0	0	0	0	111.6	G307 R575	G307-S316 WeakPolarHBondContact CA-O 3.23Å; G307-S316 PolarHBondContact N-O 3.4Å; G307-S316 VanDerWaalsContact N-O 3.11Å; S316-R575 PolarHBondContact O-NH1 3.46Å; S316-R575 PolarHBondContact OG-NH2 2.9Å
317	V	98.1	Very high	93.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.8	172.3	-174.8	0	0	0	0	106.7	I304 V305 V306 R315 I330 L333 W374	I304-V317 HydrophobicContact CG2-CG1 3.38Å; V305-V317 WeakPolarHBondContact O-CA 3.4Å; V306-V317 HydrophobicContact CG1-CG2 4.37Å; V306-V317 HydrophobicContact CG2-CG1 4.14Å; R315-V317 PolarHBondContact O-N 2.93Å; V317-I330 HydrophobicContact CB-CD1 4.48Å; V317-I330 HydrophobicContact CB-CG1 3.92Å; V317-I330 HydrophobicContact CG1-CD1 3.64Å; V317-I330 HydrophobicContact CG1-CG1 3.6Å; V317-I330 PolarHBondContact O-N 3.42Å; V317-L333 HydrophobicContact CG2-CD1 4.47Å; V317-L333 HydrophobicContact CG2-CG 3.94Å; V317-W374 HydrophobicContact CG1-CZ2 4.45Å; V317-W374 HydrophobicContact CG2-CZ2 3.91Å
318	E	97.2	Very high	93.6	Very high	5 Å²	5	51.5 Å²	51.5	2%	0.023	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.3	177.9	-63.3	-175.9	-105.6	0	0	109.3	I304 V305 W327 D328 S572 R575	I304-E318 CarbonylContact C-O 3.59Å; I304-E318 WeakPolarHBondContact CA-O 3.41Å; V305-E318 PolarHBondContact N-O 3.08Å; V305-E318 PolarHBondContact O-N 2.89Å; E318-W327 HydrophobicContact CB-CE3 3.79Å; E318-W327 HydrophobicContact CB-CZ3 4.11Å; E318-D328 CarbonylContact C-O 3.56Å; E318-D328 WeakPolarHBondContact CA-O 3.3Å; E318-S572 PolarHBondContact OE1-OG 3.24Å; E318-S572 VanDerWaalsContact OE2-CB 3.29Å; E318-S572 WeakPolarHBondContact OE2-CB 3.5Å; E318-S572 PolarHBondContact OE2-N 3.43Å; E318-S572 PolarHBondContact OE2-OG 3.1Å; E318-R575 IonicContact OE1-CZ 3.56Å; E318-R575 IonicContact OE1-NE 3.96Å; E318-R575 PolarHBondContact OE1-NE 3.27Å; E318-R575 IonicContact OE1-NH2 3.48Å; E318-R575 PolarHBondContact OE1-NH2 3.45Å
319	C	95.9	Very high	93.5	Very high	16 Å²	16	57.4 Å²	57.4	11%	0.108	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	127.9	177.5	-171.2	0	0	0	0	108.6	V302 M303 I304 W327 D328 I330	V302-C319 VanDerWaalsContact CB-SG 3.52Å; V302-C319 VanDerWaalsContact CG2-SG 3.51Å; M303-C319 CarbonylContact O-C 3.57Å; M303-C319 WeakPolarHBondContact O-CA 3.26Å; I304-C319 HydrophobicContact CG1-CB 4.44Å; C319-W327 CarbonylContact O-C 3.52Å; C319-W327 WeakPolarHBondContact O-CA 3.31Å; C319-D328 PolarHBondContact N-O 3.17Å; C319-D328 PolarHBondContact O-N 3.32Å; C319-I330 HydrophobicContact CB-CD1 4.31Å; C319-I330 HydrophobicContact CB-CG2 3.7Å
320	Y	96.3	Very high	93.4	Very high	12 Å²	12	56.6 Å²	56.6	5%	0.047	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	122.3	173.8	178.7	-104.2	0	0	0	110.1	V302 M303 F322 D325 R326 W327 L567 T569	V302-Y320 WeakPolarHBondContact CA-O 3.3Å; V302-Y320 WeakPolarHBondContact CB-O 3.37Å; M303-Y320 HydrophobicContact CE-CD1 4.01Å; M303-Y320 HydrophobicContact CE-CG 4.19Å; M303-Y320 PolarHBondContact N-O 3.36Å; M303-Y320 PolarHBondContact O-N 3.44Å; Y320-F322 AromaticContact CD1-CD1 3.97Å; Y320-F322 HydrophobicContact CD1-CD1 3.97Å; Y320-F322 HydrophobicContact CD1-CD2 4.24Å; Y320-F322 AromaticContact CD1-CE1 3.94Å; Y320-F322 HydrophobicContact CD1-CE1 3.94Å; Y320-F322 HydrophobicContact CD1-CE2 4.29Å; Y320-F322 HydrophobicContact CD1-CG 4.13Å; Y320-F322 HydrophobicContact CD1-CZ 4.12Å; Y320-F322 HydrophobicContact CE1-CB 4.42Å; Y320-F322 AromaticContact CE1-CD1 3.57Å; Y320-F322 HydrophobicContact CE1-CD1 3.57Å; Y320-F322 HydrophobicContact CE1-CD2 4.5Å; Y320-F322 AromaticContact CE1-CE1 3.86Å; Y320-F322 HydrophobicContact CE1-CE1 3.86Å; Y320-F322 AromaticContact CE1-CG 3.93Å; Y320-F322 HydrophobicContact CE1-CG 3.93Å; Y320-F322 HydrophobicContact CE1-CZ 4.49Å; Y320-D325 WeakPolarHBondContact CE2-OD1 3.27Å; Y320-D325 PolarHBondContact OH-OD1 3.11Å; Y320-R326 WeakPolarHBondContact CA-O 3.35Å; Y320-R326 WeakPolarHBondContact CD2-O 3.3Å; Y320-W327 AromaticContact CD2-CD1 3.81Å; Y320-W327 AromaticContact CD2-CD2 3.92Å; Y320-W327 HydrophobicContact CD2-CD2 3.92Å; Y320-W327 AromaticContact CD2-CE2 3.54Å; Y320-W327 HydrophobicContact CD2-CG 4.1Å; Y320-W327 HydrophobicContact CD2-CZ2 4Å; Y320-W327 AromaticContact CD2-NE1 3.45Å; Y320-W327 AromaticContact CE2-NE1 3.99Å; Y320-W327 HydrophobicContact CG-CD2 4.35Å; Y320-W327 AromaticContact CG-CE2 4Å; Y320-W327 HydrophobicContact CG-CH2 4.4Å; Y320-W327 HydrophobicContact CG-CZ2 4.04Å; Y320-L567 HydrophobicContact CD1-CD1 4.26Å; Y320-L567 HydrophobicContact CD2-CD2 4.4Å; Y320-L567 HydrophobicContact CE1-CD1 3.7Å; Y320-L567 HydrophobicContact CE1-CD2 4.26Å; Y320-L567 HydrophobicContact CE1-CG 4.44Å; Y320-L567 HydrophobicContact CE2-CD1 4.37Å; Y320-L567 HydrophobicContact CE2-CD2 3.53Å; Y320-L567 VanDerWaalsContact CZ-CD2 3.44Å; Y320-L567 VanDerWaalsContact OH-CD2 3.3Å; Y320-L567 WeakPolarHBondContact OH-CD2 3.41Å; Y320-T569 WeakPolarHBondContact CE2-OG1 3.34Å
321	D	90.3	Very high	93.5	Very high	6 Å²	6	56.4 Å²	56.4	3%	0.032	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	119	173.3	-165.7	-51.7	0	0	0	110.1	E323 E324 D325 R326 K585	D321-E323 VanDerWaalsContact C-N 3.34Å; D321-E323 WeakPolarHBondContact OD1-CA 3.33Å; D321-E323 WeakPolarHBondContact OD1-CB 3.45Å; D321-E323 PolarHBondContact OD1-N 2.9Å; D321-E324 HydrophobicContact CB-CB 4.11Å; D321-E324 PolarHBondContact OD1-N 2.89Å; D321-D325 VanDerWaalsContact O-CA 3.29Å; D321-D325 WeakPolarHBondContact O-CA 3.37Å; D321-D325 PolarHBondContact O-N 2.95Å; D321-R326 PolarHBondContact N-O 2.83Å; D321-R326 PolarHBondContact O-N 3.36Å; D321-K585 VanDerWaalsContact OD2-CE 3.29Å; D321-K585 WeakPolarHBondContact OD2-CE 3.48Å; D321-K585 IonicContact OD2-NZ 3.1Å; D321-K585 PolarHBondContact OD2-NZ 3.12Å
322	F	87.2	Confident	93.9	Very high	46 Å²	46	55.6 Å²	55.6	20%	0.202	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.6	-178.8	-67.8	-89.1	0	0	0	113.5	K301 M303 Y320 V535 Y540	K301-F322 WeakPolarHBondContact O-CD2 3.45Å; M303-F322 HydrophobicContact CB-CE2 3.65Å; M303-F322 HydrophobicContact CB-CZ 3.68Å; M303-F322 HydrophobicContact SD-CZ 4.48Å; Y320-F322 AromaticContact CD1-CD1 3.97Å; Y320-F322 HydrophobicContact CD1-CD1 3.97Å; Y320-F322 HydrophobicContact CD1-CD2 4.24Å; Y320-F322 AromaticContact CD1-CE1 3.94Å; Y320-F322 HydrophobicContact CD1-CE1 3.94Å; Y320-F322 HydrophobicContact CD1-CE2 4.29Å; Y320-F322 HydrophobicContact CD1-CG 4.13Å; Y320-F322 HydrophobicContact CD1-CZ 4.12Å; Y320-F322 HydrophobicContact CE1-CB 4.42Å; Y320-F322 AromaticContact CE1-CD1 3.57Å; Y320-F322 HydrophobicContact CE1-CD1 3.57Å; Y320-F322 HydrophobicContact CE1-CD2 4.5Å; Y320-F322 AromaticContact CE1-CE1 3.86Å; Y320-F322 HydrophobicContact CE1-CE1 3.86Å; Y320-F322 AromaticContact CE1-CG 3.93Å; Y320-F322 HydrophobicContact CE1-CG 3.93Å; Y320-F322 HydrophobicContact CE1-CZ 4.49Å; F322-V535 HydrophobicContact CE1-CG1 3.94Å; F322-V535 HydrophobicContact CE2-CG1 4.22Å; F322-V535 HydrophobicContact CZ-CG1 3.56Å; F322-Y540 HydrophobicContact CE1-CD1 4.33Å; F322-Y540 AromaticContact CE1-CE1 3.68Å; F322-Y540 HydrophobicContact CE1-CE1 3.68Å; F322-Y540 HydrophobicContact CE1-CE2 4.13Å; F322-Y540 AromaticContact CE1-CZ 3.56Å
323	E	85.5	Confident	94.1	Very high	139 Å²	139	48 Å²	48	65%	0.65	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-42.1	178.4	-62	-171.3	161.7	0	0	110.9	P300 D321	P300-E323 HydrophobicContact CB-CG 4.28Å; P300-E323 WeakPolarHBondContact CG-OE1 3.4Å; D321-E323 VanDerWaalsContact C-N 3.34Å; D321-E323 WeakPolarHBondContact OD1-CA 3.33Å; D321-E323 WeakPolarHBondContact OD1-CB 3.45Å; D321-E323 PolarHBondContact OD1-N 2.9Å
324	E	84.3	Confident	94.1	Very high	87 Å²	87	50.4 Å²	50.4	41%	0.407	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-8.3	-178.5	-58.5	-171.4	-135.5	0	0	113.2	D321 R326 K585	D321-E324 HydrophobicContact CB-CB 4.11Å; D321-E324 PolarHBondContact OD1-N 2.89Å; E324-R326 VanDerWaalsContact C-N 3.27Å; E324-R326 HydrophobicContact CB-CG 4.04Å; E324-R326 PolarHBondContact O-N 3.3Å; E324-R326 IonicContact OE1-NH2 2.79Å; E324-R326 PolarHBondContact OE1-NH2 2.98Å; E324-R326 IonicContact OE2-CZ 2.77Å; E324-R326 IonicContact OE2-NE 3.51Å; E324-R326 IonicContact OE2-NH1 2.69Å; E324-R326 PolarHBondContact OE2-NH1 3.49Å; E324-R326 IonicContact OE2-NH2 3.93Å; E324-R326 PolarHBondContact OE2-NH2 3.33Å; E324-K585 IonicContact OE1-NZ 2.58Å; E324-K585 PolarHBondContact OE1-NZ 2.76Å
325	D	86.8	Confident	94	Very high	57 Å²	57	51.1 Å²	51.1	31%	0.305	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	46.5	-177	-173	22.8	0	0	0	112.6	Y320 D321 P568 T569	Y320-D325 WeakPolarHBondContact CE2-OD1 3.27Å; Y320-D325 PolarHBondContact OH-OD1 3.11Å; D321-D325 VanDerWaalsContact O-CA 3.29Å; D321-D325 WeakPolarHBondContact O-CA 3.37Å; D321-D325 PolarHBondContact O-N 2.95Å; D325-P568 WeakPolarHBondContact OD2-CG 3.25Å; D325-T569 VanDerWaalsContact O-CG2 3.28Å; D325-T569 WeakPolarHBondContact O-CG2 3.46Å; D325-T569 PolarHBondContact O-OG1 3.4Å; D325-T569 PolarHBondContact OD1-OG1 3.09Å
326	R	91.7	Very high	94	Very high	112 Å²	112	53.2 Å²	53.2	42%	0.423	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157	-177.6	78.6	175.8	-167.7	-137.9	-19.9	113.1	Y320 D321 E324 D328	Y320-R326 WeakPolarHBondContact CA-O 3.35Å; Y320-R326 WeakPolarHBondContact CD2-O 3.3Å; D321-R326 PolarHBondContact N-O 2.83Å; D321-R326 PolarHBondContact O-N 3.36Å; E324-R326 VanDerWaalsContact C-N 3.27Å; E324-R326 HydrophobicContact CB-CG 4.04Å; E324-R326 PolarHBondContact O-N 3.3Å; E324-R326 IonicContact OE1-NH2 2.79Å; E324-R326 PolarHBondContact OE1-NH2 2.98Å; E324-R326 IonicContact OE2-CZ 2.77Å; E324-R326 IonicContact OE2-NE 3.51Å; E324-R326 IonicContact OE2-NH1 2.69Å; E324-R326 PolarHBondContact OE2-NH1 3.49Å; E324-R326 IonicContact OE2-NH2 3.93Å; E324-R326 PolarHBondContact OE2-NH2 3.33Å; R326-D328 IonicContact CZ-OD2 3.6Å; R326-D328 IonicContact NE-OD1 3.31Å; R326-D328 PolarHBondContact NE-OD1 3.45Å; R326-D328 IonicContact NE-OD2 2.81Å; R326-D328 PolarHBondContact NE-OD2 3.15Å; R326-D328 IonicContact NH2-OD2 3.16Å
327	W	95.6	Very high	94	Very high	37 Å²	37	52.4 Å²	52.4	14%	0.14	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.1	175.1	-69.5	89.7	0	0	0	110.1	M303 V305 E318 C319 Y320 V554 T569 N570 M571	M303-W327 HydrophobicContact CE-CH2 3.82Å; M303-W327 HydrophobicContact CE-CZ2 4.18Å; V305-W327 HydrophobicContact CB-CZ3 4.41Å; V305-W327 HydrophobicContact CG2-CH2 3.7Å; V305-W327 HydrophobicContact CG2-CZ3 3.54Å; E318-W327 HydrophobicContact CB-CE3 3.79Å; E318-W327 HydrophobicContact CB-CZ3 4.11Å; C319-W327 CarbonylContact O-C 3.52Å; C319-W327 WeakPolarHBondContact O-CA 3.31Å; Y320-W327 AromaticContact CD2-CD1 3.81Å; Y320-W327 AromaticContact CD2-CD2 3.92Å; Y320-W327 HydrophobicContact CD2-CD2 3.92Å; Y320-W327 AromaticContact CD2-CE2 3.54Å; Y320-W327 HydrophobicContact CD2-CG 4.1Å; Y320-W327 HydrophobicContact CD2-CZ2 4Å; Y320-W327 AromaticContact CD2-NE1 3.45Å; Y320-W327 AromaticContact CE2-NE1 3.99Å; Y320-W327 HydrophobicContact CG-CD2 4.35Å; Y320-W327 AromaticContact CG-CE2 4Å; Y320-W327 HydrophobicContact CG-CH2 4.4Å; Y320-W327 HydrophobicContact CG-CZ2 4.04Å; W327-V554 HydrophobicContact CH2-CG2 4.23Å; W327-V554 HydrophobicContact CZ2-CG2 3.75Å; W327-T569 PolarHBondContact NE1-O 3.03Å; W327-N570 PolarHBondContact NE1-O 3.13Å; W327-M571 HydrophobicContact CD2-CG 4.05Å; W327-M571 HydrophobicContact CE3-CG 4.02Å; W327-M571 HydrophobicContact CH2-CG 3.43Å; W327-M571 VanDerWaalsContact CH2-CG 3.43Å; W327-M571 HydrophobicContact CH2-SD 4.08Å; W327-M571 HydrophobicContact CZ2-CG 3.5Å; W327-M571 VanDerWaalsContact CZ2-CG 3.5Å; W327-M571 HydrophobicContact CZ3-CG 3.71Å; W327-M571 HydrophobicContact CZ3-SD 4.35Å
328	D	93.4	Very high	94	Very high	66 Å²	66	52.6 Å²	52.6	35%	0.353	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146	175.8	-67.9	-52.9	0	0	0	110.2	E318 C319 R326	E318-D328 CarbonylContact C-O 3.56Å; E318-D328 WeakPolarHBondContact CA-O 3.3Å; C319-D328 PolarHBondContact N-O 3.17Å; C319-D328 PolarHBondContact O-N 3.32Å; R326-D328 IonicContact CZ-OD2 3.6Å; R326-D328 IonicContact NE-OD1 3.31Å; R326-D328 PolarHBondContact NE-OD1 3.45Å; R326-D328 IonicContact NE-OD2 2.81Å; R326-D328 PolarHBondContact NE-OD2 3.15Å; R326-D328 IonicContact NH2-OD2 3.16Å
329	Q	95.1	Very high	94	Very high	123 Å²	123	55.3 Å²	55.3	58%	0.575	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	129.4	172.9	-174.7	167.6	-12.7	0	0	109.6	E332	Q329-E332 PolarHBondContact NE2-OE1 3.34Å
330	I	95.1	Very high	94.2	Very high	29 Å²	29	55.3 Å²	55.3	15%	0.149	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-175.9	177.2	64.9	173.9	0	0	0	110.4	I304 V317 C319 E332 Y367	I304-I330 HydrophobicContact CD1-CD1 3.75Å; I304-I330 HydrophobicContact CG1-CD1 4.09Å; I304-I330 HydrophobicContact CG2-CD1 3.88Å; V317-I330 HydrophobicContact CB-CD1 4.48Å; V317-I330 HydrophobicContact CB-CG1 3.92Å; V317-I330 HydrophobicContact CG1-CD1 3.64Å; V317-I330 HydrophobicContact CG1-CG1 3.6Å; V317-I330 PolarHBondContact O-N 3.42Å; C319-I330 HydrophobicContact CB-CD1 4.31Å; C319-I330 HydrophobicContact CB-CG2 3.7Å; I330-E332 PolarHBondContact O-N 3.35Å; I330-Y367 HydrophobicContact CD1-CE1 4.03Å; I330-Y367 HydrophobicContact CD1-CE2 4.37Å
331	A	96.4	Very high	94.3	Very high	23 Å²	23	55 Å²	55	19%	0.19	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-51	128.1	-178.6	0	0	0	0	0	112.6	Y367 D372 W374	A331-Y367 HydrophobicContact CB-CE2 4.2Å; A331-D372 WeakPolarHBondContact CB-O 3.32Å; A331-D372 WeakPolarHBondContact CB-OD1 3.43Å; A331-D372 PolarHBondContact N-OD1 3.5Å; A331-W374 PolarHBondContact O-NE1 2.72Å
332	E	97.9	Very high	94.7	Very high	87 Å²	87	55.6 Å²	55.6	41%	0.407	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-73.8	151.7	-179.5	-63.1	-167.4	168.4	0	0	112	R315 Q329 I330	R315-E332 HydrophobicContact CB-CB 4.18Å; R315-E332 IonicContact NE-OE2 3.23Å; Q329-E332 PolarHBondContact NE2-OE1 3.34Å; I330-E332 PolarHBondContact O-N 3.35Å
333	L	98	Very high	95.2	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-55.2	146.5	171.7	-74.2	162	0	0	0	111.4	V306 R315 V317 S335 R337 A351 W374	V306-L333 HydrophobicContact CG1-CD1 3.84Å; V306-L333 HydrophobicContact CG1-CD2 3.85Å; V306-L333 HydrophobicContact CG1-CG 4.06Å; R315-L333 VanDerWaalsContact CZ-O 3.23Å; R315-L333 PolarHBondContact NE-O 2.87Å; R315-L333 PolarHBondContact NH2-O 2.98Å; R315-L333 PolarHBondContact O-N 2.8Å; V317-L333 HydrophobicContact CG2-CD1 4.47Å; V317-L333 HydrophobicContact CG2-CG 3.94Å; L333-S335 WeakPolarHBondContact CB-O 3.23Å; L333-S335 PolarHBondContact O-N 3.4Å; L333-S335 VanDerWaalsContact O-N 3.17Å; L333-R337 HydrophobicContact CD1-CB 3.94Å; L333-A351 HydrophobicContact CD2-CB 4.18Å; L333-W374 HydrophobicContact CD2-CD2 3.95Å; L333-W374 HydrophobicContact CD2-CE3 3.83Å; L333-W374 HydrophobicContact CD2-CH2 3.64Å; L333-W374 HydrophobicContact CD2-CZ2 3.75Å; L333-W374 HydrophobicContact CD2-CZ3 3.67Å; L333-W374 HydrophobicContact CG-CZ2 4.27Å
334	P	97.3	Very high	95.7	Very high	55 Å²	55	51.2 Å²	51.2	36%	0.357	25%	0.248	S	C	.	.	S	Bend	trans	-59.7	-29.5	177.1	-25.7	35.3	0	0	0	113.6	R315 D365 W374	R315-P334 PolarHBondContact NH2-O 3.49Å; P334-D365 HydrophobicContact CG-CB 4.48Å; P334-W374 HydrophobicContact CG-CB 3.69Å; P334-W374 HydrophobicContact CG-CG 4.47Å
335	S	95.8	Very high	96.2	Very high	48 Å²	48	47.4 Å²	47.4	34%	0.336	23%	0.23	S	C	.	.	S	Bend	trans	-141.3	160	176.8	67.8	0	0	0	0	111.1	L333 R337	L333-S335 WeakPolarHBondContact CB-O 3.23Å; L333-S335 PolarHBondContact O-N 3.4Å; L333-S335 VanDerWaalsContact O-N 3.17Å; S335-R337 PolarHBondContact O-N 3.2Å
336	R	97.6	Very high	96.1	Very high	148 Å²	148	47.3 Å²	47.3	56%	0.558	24%	0.237	S	C	*	.			trans	-60.6	133.9	177.4	-67.3	171.9	-173.2	-161.6	2.9	109.1	A313 I314 R315 N356	A313-R336 HydrophobicContact CB-CB 4.09Å; A313-R336 WeakPolarHBondContact O-CD 3.43Å; I314-R336 WeakPolarHBondContact O-CA 3.4Å; R315-R336 HydrophobicContact CG-CB 4.32Å; R315-R336 HydrophobicContact CG-CG 3.63Å; R336-N356 WeakPolarHBondContact O-CA 3.45Å; R336-N356 VanDerWaalsContact O-CB 3.23Å; R336-N356 WeakPolarHBondContact O-CB 3.49Å
337	R	98.1	Very high	95.8	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.015	24%	0.241	C	C	.	.			trans	-149.2	134.1	-179	-171.9	176.5	-79.2	166.2	-5.2	111.4	G308 I314 L333 S335 A340 A351 G353 T363 D365	G308-R337 PolarHBondContact N-O 3.5Å; I314-R337 PolarHBondContact O-N 3.4Å; L333-R337 HydrophobicContact CD1-CB 3.94Å; S335-R337 PolarHBondContact O-N 3.2Å; R337-A340 HydrophobicContact CG-CB 3.77Å; R337-A351 VanDerWaalsContact NH1-CB 3.26Å; R337-A351 PolarHBondContact NH1-O 3.06Å; R337-G353 VanDerWaalsContact CD-O 3.24Å; R337-G353 WeakPolarHBondContact CD-O 3.41Å; R337-G353 PolarHBondContact NE-O 3.37Å; R337-G353 VanDerWaalsContact NE-O 3.09Å; R337-T363 PolarHBondContact NH2-O 3.46Å; R337-T363 PolarHBondContact NH2-OG1 2.87Å; R337-D365 IonicContact CZ-OD2 3Å; R337-D365 IonicContact NH1-OD2 3.54Å; R337-D365 PolarHBondContact NH1-OD2 2.75Å; R337-D365 IonicContact NH2-OD2 3.87Å; R337-D365 PolarHBondContact NH2-OD2 3.06Å
338	C	98.1	Very high	95.7	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.02	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-140	170.1	167.3	66.5	0	0	0	0	109.2	G308 Q309 A313 A340 G354 F355	G308-C338 VanDerWaalsContact C-CB 3.43Å; G308-C338 VanDerWaalsContact O-CB 3.29Å; G308-C338 WeakPolarHBondContact O-CB 3.41Å; Q309-C338 HydrophobicContact CB-CB 4.38Å; A313-C338 HydrophobicContact CB-CB 4.27Å; C338-A340 PolarHBondContact O-N 2.85Å; C338-A340 VanDerWaalsContact O-N 3.13Å; C338-G354 CarbonylContact O-C 3.58Å; C338-G354 VanDerWaalsContact O-CA 3.23Å; C338-G354 WeakPolarHBondContact O-CA 3.31Å; C338-F355 PolarHBondContact N-O 3.38Å; C338-F355 PolarHBondContact O-N 2.89Å; C338-F355 PolarHBondContact SG-O 3.29Å; C338-F355 VanDerWaalsContact SG-O 3.33Å
339	R	98.4	Very high	95.9	Very high	62 Å²	62	42.2 Å²	42.2	23%	0.234	23%	0.231	C	C	.	.	S	Bend	trans	59.5	25.2	176.9	-52.1	173.7	178.3	-136.9	-1.3	112.8	G354 T386 Y577	R339-G354 WeakPolarHBondContact O-CA 3.45Å; R339-T386 HydrophobicContact CB-CG2 3.81Å; R339-T386 HydrophobicContact CG-CG2 3.91Å; R339-T386 PolarHBondContact O-N 3.22Å; R339-Y577 HydrophobicContact CB-CD1 4.25Å; R339-Y577 HydrophobicContact CG-CD1 3.52Å; R339-Y577 HydrophobicContact CG-CD2 4.28Å; R339-Y577 HydrophobicContact CG-CE1 4.07Å; R339-Y577 HydrophobicContact CG-CG 3.61Å; R339-Y577 PolarHBondContact N-O 3.27Å
340	A	98.4	Very high	96.1	Very high	17 Å²	17	37 Å²	37	14%	0.14	21%	0.206	C	C	.	.			trans	-91.4	154.7	177.9	0	0	0	0	0	109.8	R337 C338 V352	R337-A340 HydrophobicContact CG-CB 3.77Å; C338-A340 PolarHBondContact O-N 2.85Å; C338-A340 VanDerWaalsContact O-N 3.13Å; A340-V352 WeakPolarHBondContact CA-O 3.41Å; A340-V352 WeakPolarHBondContact CB-O 3.36Å
341	G	98.5	Very high	96.3	Very high	5 Å²	5	35.6 Å²	35.6	5%	0.052	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	137	163.3	0	0	0	0	0	109	V352	G341-V352 PolarHBondContact N-O 2.93Å; G341-V352 PolarHBondContact O-N 3.33Å
342	V	98.7	Very high	96.4	Very high	19 Å²	19	34.5 Å²	34.5	12%	0.115	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127.6	176.8	176.6	0	0	0	0	109.1	V306 V349 Y350 A351 A581	V306-V342 HydrophobicContact CB-CG1 4.37Å; V306-V342 HydrophobicContact CB-CG2 4.1Å; V306-V342 HydrophobicContact CG1-CG2 4.35Å; V306-V342 HydrophobicContact CG2-CG1 4.03Å; V342-V349 HydrophobicContact CG1-CG1 3.64Å; V342-Y350 VanDerWaalsContact CA-O 3.26Å; V342-Y350 WeakPolarHBondContact CA-O 3.35Å; V342-A351 HydrophobicContact CG2-CB 4.4Å; V342-A581 HydrophobicContact CG1-CB 4.15Å
343	V	98.3	Very high	96.4	Very high	14 Å²	14	30.4 Å²	30.4	9%	0.085	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	153.6	-178.4	-63.7	0	0	0	0	111.2	V349 Y350 A389 V391 L396	V343-V349 WeakPolarHBondContact O-CA 3.37Å; V343-Y350 PolarHBondContact N-O 3.4Å; V343-Y350 VanDerWaalsContact N-O 3.14Å; V343-Y350 PolarHBondContact O-N 3Å; V343-A389 HydrophobicContact CG1-CB 3.71Å; V343-A389 VanDerWaalsContact CG1-O 3.27Å; V343-A389 WeakPolarHBondContact CG1-O 3.35Å; V343-V391 HydrophobicContact CB-CG2 3.97Å; V343-V391 HydrophobicContact CG2-CG2 3.94Å; V343-L396 HydrophobicContact CG2-CD1 3.61Å; V343-L396 HydrophobicContact CG2-CG 3.87Å
344	F	96.6	Very high	96.4	Very high	78 Å²	78	30.3 Å²	30.3	34%	0.342	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	129.7	169.2	177.7	-104.2	0	0	0	110	G347 H348 V349 A581 I583	F344-G347 VanDerWaalsContact CE2-C 3.41Å; F344-H348 WeakPolarHBondContact CA-O 3.47Å; F344-H348 WeakPolarHBondContact CD2-O 3.49Å; F344-V349 HydrophobicContact CD2-CG2 4.23Å; F344-A581 HydrophobicContact CB-CB 4.37Å; F344-I583 HydrophobicContact CD2-CG2 3.62Å; F344-I583 HydrophobicContact CE2-CB 4.29Å; F344-I583 HydrophobicContact CE2-CG2 3.82Å
345	M	94.2	Very high	96.5	Very high	7 Å²	7	29.3 Å²	29.3	3%	0.034	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	134.6	177.6	178.4	-166.4	-95.3	0	0	109.8	G347 H348 Y350 V391 D394 L396 Y416	M345-G347 VanDerWaalsContact C-N 3.26Å; M345-G347 PolarHBondContact O-N 3.24Å; M345-G347 VanDerWaalsContact O-N 3.15Å; M345-H348 PolarHBondContact N-O 3.28Å; M345-H348 PolarHBondContact O-N 3.47Å; M345-Y350 HydrophobicContact CB-CD2 4.04Å; M345-Y350 HydrophobicContact CB-CE2 3.77Å; M345-Y350 HydrophobicContact CG-CE2 4.44Å; M345-Y350 HydrophobicContact SD-CE2 4.4Å; M345-V391 HydrophobicContact CB-CG2 3.94Å; M345-V391 HydrophobicContact CE-CB 4.35Å; M345-V391 HydrophobicContact CE-CG1 3.59Å; M345-V391 HydrophobicContact CE-CG2 4Å; M345-V391 HydrophobicContact CG-CG1 4.27Å; M345-V391 HydrophobicContact CG-CG2 4.48Å; M345-D394 WeakPolarHBondContact CE-O 3.19Å; M345-L396 HydrophobicContact CE-CB 3.59Å; M345-L396 HydrophobicContact SD-CB 4.37Å; M345-Y416 HydrophobicContact SD-CD1 3.68Å; M345-Y416 HydrophobicContact SD-CE1 4.37Å; M345-Y416 HydrophobicContact SD-CG 4.42Å
346	A	85.8	Confident	96.5	Very high	55 Å²	55	29.7 Å²	29.7	46%	0.455	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	44.5	171.5	0	0	0	0	0	113.6	H348 Y416	A346-H348 VanDerWaalsContact C-N 3.3Å; A346-H348 PolarHBondContact O-N 3.09Å; A346-H348 PolarHBondContact O-ND1 3.16Å; A346-Y416 HydrophobicContact CB-CE1 4.44Å; A346-Y416 HydrophobicContact CB-CE2 4.45Å
347	G	85.1	Confident	96.2	Very high	48 Å²	48	24.5 Å²	24.5	50%	0.495	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-1.7	178.8	0	0	0	0	0	115.7	F344 M345	F344-G347 VanDerWaalsContact CE2-C 3.41Å; M345-G347 VanDerWaalsContact C-N 3.26Å; M345-G347 PolarHBondContact O-N 3.24Å; M345-G347 VanDerWaalsContact O-N 3.15Å
348	H	92.9	Very high	96	Very high	60 Å²	60	28.9 Å²	28.9	28%	0.278	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	154.6	-173.4	-59.4	81.2	0	0	0	112.3	F344 M345 A346 Y350 V366 Y367	F344-H348 WeakPolarHBondContact CA-O 3.47Å; F344-H348 WeakPolarHBondContact CD2-O 3.49Å; M345-H348 PolarHBondContact N-O 3.28Å; M345-H348 PolarHBondContact O-N 3.47Å; A346-H348 VanDerWaalsContact C-N 3.3Å; A346-H348 PolarHBondContact O-N 3.09Å; A346-H348 PolarHBondContact O-ND1 3.16Å; H348-Y350 HydrophobicContact CB-CD2 4.45Å; H348-Y350 HydrophobicContact CB-CE2 3.84Å; H348-V366 HydrophobicContact CB-CG1 3.51Å; H348-Y367 WeakPolarHBondContact CA-O 3.34Å; H348-Y367 WeakPolarHBondContact CB-O 3.18Å
349	V	98.3	Very high	95.9	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.9	173.7	-179.4	0	0	0	0	109.8	V306 V342 V343 F344 V366 Y367 A581 I583	V306-V349 HydrophobicContact CG2-CG1 4.24Å; V342-V349 HydrophobicContact CG1-CG1 3.64Å; V343-V349 WeakPolarHBondContact O-CA 3.37Å; F344-V349 HydrophobicContact CD2-CG2 4.23Å; V349-V366 CarbonylContact O-C 3.55Å; V349-V366 WeakPolarHBondContact O-CA 3.42Å; V349-Y367 HydrophobicContact CB-CD1 4.38Å; V349-Y367 HydrophobicContact CG2-CD1 4.38Å; V349-Y367 PolarHBondContact N-O 2.92Å; V349-Y367 VanDerWaalsContact N-O 3.09Å; V349-Y367 PolarHBondContact O-N 2.79Å; V349-A581 HydrophobicContact CG1-CB 3.82Å; V349-A581 HydrophobicContact CG2-CB 3.9Å; V349-I583 HydrophobicContact CG2-CG2 3.36Å
350	Y	98.7	Very high	95.9	Very high	13 Å²	13	34.1 Å²	34.1	5%	0.051	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.3	-179.3	-68.9	-109.6	0	0	0	109.5	V342 V343 M345 H348 V364 V366 I377 L396 Y414	V342-Y350 VanDerWaalsContact CA-O 3.26Å; V342-Y350 WeakPolarHBondContact CA-O 3.35Å; V343-Y350 PolarHBondContact N-O 3.4Å; V343-Y350 VanDerWaalsContact N-O 3.14Å; V343-Y350 PolarHBondContact O-N 3Å; M345-Y350 HydrophobicContact CB-CD2 4.04Å; M345-Y350 HydrophobicContact CB-CE2 3.77Å; M345-Y350 HydrophobicContact CG-CE2 4.44Å; M345-Y350 HydrophobicContact SD-CE2 4.4Å; H348-Y350 HydrophobicContact CB-CD2 4.45Å; H348-Y350 HydrophobicContact CB-CE2 3.84Å; Y350-V364 HydrophobicContact CD1-CG1 4.36Å; Y350-V366 HydrophobicContact CD1-CG1 4.49Å; Y350-V366 HydrophobicContact CD1-CG2 3.45Å; Y350-V366 VanDerWaalsContact CD1-CG2 3.45Å; Y350-V366 HydrophobicContact CD2-CG1 4.44Å; Y350-V366 HydrophobicContact CE1-CB 4.48Å; Y350-V366 HydrophobicContact CE1-CG1 4.2Å; Y350-V366 HydrophobicContact CE1-CG2 3.43Å; Y350-V366 VanDerWaalsContact CE1-CG2 3.43Å; Y350-V366 HydrophobicContact CE2-CG1 4.13Å; Y350-V366 HydrophobicContact CG-CG2 4.13Å; Y350-I377 HydrophobicContact CD1-CD1 4.03Å; Y350-I377 HydrophobicContact CE1-CD1 3.84Å; Y350-L396 HydrophobicContact CD1-CD1 3.72Å; Y350-L396 HydrophobicContact CD2-CD1 4.47Å; Y350-L396 HydrophobicContact CG-CD1 3.7Å; Y350-Y414 HydrophobicContact CE1-CD1 4.43Å; Y350-Y414 AromaticContact CE1-CE1 3.88Å; Y350-Y414 HydrophobicContact CE1-CE1 3.88Å
351	A	98.7	Very high	95.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	112.4	169.4	0	0	0	0	0	109.3	V306 L333 R337 V342 V364 D365 W374	V306-A351 HydrophobicContact CG1-CB 4.14Å; L333-A351 HydrophobicContact CD2-CB 4.18Å; R337-A351 VanDerWaalsContact NH1-CB 3.26Å; R337-A351 PolarHBondContact NH1-O 3.06Å; V342-A351 HydrophobicContact CG2-CB 4.4Å; A351-V364 WeakPolarHBondContact O-CA 3.3Å; A351-D365 PolarHBondContact N-O 3.34Å; A351-D365 PolarHBondContact O-N 2.84Å; A351-W374 HydrophobicContact CB-CH2 4.21Å; A351-W374 HydrophobicContact CB-CZ3 3.89Å
352	V	98.8	Very high	95.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	116.8	-163.2	-173.4	0	0	0	0	110.3	A340 G341 V364 M380 L387 L396 A398 W421	A340-V352 WeakPolarHBondContact CA-O 3.41Å; A340-V352 WeakPolarHBondContact CB-O 3.36Å; G341-V352 PolarHBondContact N-O 2.93Å; G341-V352 PolarHBondContact O-N 3.33Å; V352-V364 HydrophobicContact CG1-CG2 4.1Å; V352-V364 HydrophobicContact CG2-CG1 4.06Å; V352-M380 HydrophobicContact CG1-CE 3.99Å; V352-M380 HydrophobicContact CG1-CG 4.38Å; V352-M380 HydrophobicContact CG1-SD 3.5Å; V352-M380 VanDerWaalsContact CG1-SD 3.5Å; V352-L387 HydrophobicContact CG1-CD1 4.15Å; V352-L396 HydrophobicContact CG1-CD2 4.47Å; V352-L396 HydrophobicContact CG2-CD1 3.84Å; V352-L396 HydrophobicContact CG2-CD2 4.05Å; V352-A398 HydrophobicContact CG1-CB 4.33Å; V352-W421 HydrophobicContact CG1-CH2 3.86Å; V352-W421 HydrophobicContact CG1-CZ2 4.35Å
353	G	98.6	Very high	95.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.238	C	C	.	.	S	Bend	trans	64.7	-138.9	177.5	0	0	0	0	0	113.5	R337 V361 T363	R337-G353 VanDerWaalsContact CD-O 3.24Å; R337-G353 WeakPolarHBondContact CD-O 3.41Å; R337-G353 PolarHBondContact NE-O 3.37Å; R337-G353 VanDerWaalsContact NE-O 3.09Å; G353-V361 VanDerWaalsContact C-CG2 3.5Å; G353-V361 WeakPolarHBondContact CA-O 3.5Å; G353-V361 WeakPolarHBondContact O-CG2 3.44Å; G353-T363 PolarHBondContact N-O 2.85Å
354	G	98.4	Very high	95.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.			trans	101.7	-153.7	177	0	0	0	0	0	114.7	C338 R339 R360 V361 R384	C338-G354 CarbonylContact O-C 3.58Å; C338-G354 VanDerWaalsContact O-CA 3.23Å; C338-G354 WeakPolarHBondContact O-CA 3.31Å; R339-G354 WeakPolarHBondContact O-CA 3.45Å; G354-R360 WeakPolarHBondContact O-CA 3.44Å; G354-V361 PolarHBondContact O-N 2.81Å; G354-R384 PolarHBondContact N-O 2.86Å
355	F	98.3	Very high	95.9	Very high	34 Å²	34	37.3 Å²	37.3	15%	0.149	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-136.1	126.8	-175.7	176.4	-121.2	0	0	0	110.2	C338 G357 S358 L359 R360	C338-F355 PolarHBondContact N-O 3.38Å; C338-F355 PolarHBondContact O-N 2.89Å; C338-F355 PolarHBondContact SG-O 3.29Å; C338-F355 VanDerWaalsContact SG-O 3.33Å; F355-G357 VanDerWaalsContact CZ-CA 3.49Å; F355-G357 WeakPolarHBondContact CZ-O 3.34Å; F355-S358 WeakPolarHBondContact CE2-O 3.49Å; F355-L359 VanDerWaalsContact CD2-O 3.26Å; F355-L359 WeakPolarHBondContact CD2-O 3.48Å; F355-R360 VanDerWaalsContact CD2-CD 3.42Å
356	N	95.1	Very high	96.1	Very high	55 Å²	55	37.2 Å²	37.2	29%	0.294	22%	0.219	S	C	.	.			trans	-93.3	9.8	-176.6	70.2	5.4	0	0	0	114.6	R336 S358 L359 V361	R336-N356 WeakPolarHBondContact O-CA 3.45Å; R336-N356 VanDerWaalsContact O-CB 3.23Å; R336-N356 WeakPolarHBondContact O-CB 3.49Å; N356-S358 PolarHBondContact OD1-N 2.98Å; N356-L359 PolarHBondContact N-O 3.49Å; N356-L359 PolarHBondContact OD1-N 2.82Å; N356-L359 PolarHBondContact OD1-O 3.41Å; N356-V361 HydrophobicContact CB-CG1 4.35Å
357	G	93.1	Very high	96.7	Very high	39 Å²	39	35 Å²	35	40%	0.402	20%	0.199	S	C	.	.	S	Bend	trans	97.9	-17.5	-173.6	0	0	0	0	0	113.9	F355	F355-G357 VanDerWaalsContact CZ-CA 3.49Å; F355-G357 WeakPolarHBondContact CZ-O 3.34Å
358	S	93.4	Very high	96.9	Very high	97 Å²	97	33.8 Å²	33.8	68%	0.678	18%	0.181	S	C	*	.	S	Bend	trans	-126.1	-48.7	176.8	-58.2	0	0	0	0	112.8	F355 N356	F355-S358 WeakPolarHBondContact CE2-O 3.49Å; N356-S358 PolarHBondContact OD1-N 2.98Å
359	L	95.3	Very high	96.6	Very high	112 Å²	112	31.5 Å²	31.5	59%	0.586	17%	0.174	S	C	*	.	S	Bend	trans	-125.7	150.4	-173.5	-63.8	174.9	0	0	0	111.7	F355 N356	F355-L359 VanDerWaalsContact CD2-O 3.26Å; F355-L359 WeakPolarHBondContact CD2-O 3.48Å; N356-L359 PolarHBondContact N-O 3.49Å; N356-L359 PolarHBondContact OD1-N 2.82Å; N356-L359 PolarHBondContact OD1-O 3.41Å
360	R	97.9	Very high	95.7	Very high	63 Å²	63	37.4 Å²	37.4	24%	0.238	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-76.6	134.9	168.1	-50.5	-35.1	-175.8	-94.2	7.4	107	G354 F355 R383 S385	G354-R360 WeakPolarHBondContact O-CA 3.44Å; F355-R360 VanDerWaalsContact CD2-CD 3.42Å; R360-R383 HydrophobicContact CB-CB 4.34Å; R360-R383 WeakPolarHBondContact O-CD 3.42Å; R360-S385 WeakPolarHBondContact CD-OG 3.14Å
361	V	98.2	Very high	95	Very high	20 Å²	20	43.1 Å²	43.1	12%	0.121	23%	0.234	C	C	.	.			trans	-114.5	158.1	-171.9	-58.9	0	0	0	0	111.1	G353 G354 N356 T363 R384	G353-V361 VanDerWaalsContact C-CG2 3.5Å; G353-V361 WeakPolarHBondContact CA-O 3.5Å; G353-V361 WeakPolarHBondContact O-CG2 3.44Å; G354-V361 PolarHBondContact O-N 2.81Å; N356-V361 HydrophobicContact CB-CG1 4.35Å; V361-T363 WeakPolarHBondContact CG2-OG1 3.22Å; V361-R384 PolarHBondContact O-N 3.45Å; V361-R384 VanDerWaalsContact O-N 3.17Å
362	R	98.3	Very high	94.5	Very high	122 Å²	122	46.5 Å²	46.5	46%	0.46	25%	0.252	S	S	.	.			trans	-110.6	-0.9	172.3	62.5	179.2	-171.5	-151.1	0.6	112.4	S379 M380 E382 R383	R362-S379 WeakPolarHBondContact O-CA 3.27Å; R362-S379 WeakPolarHBondContact O-CB 3.38Å; R362-M380 HydrophobicContact CB-CB 4.21Å; R362-M380 VanDerWaalsContact CD-O 3.3Å; R362-M380 WeakPolarHBondContact CD-O 3.46Å; R362-M380 PolarHBondContact O-N 2.9Å; R362-E382 VanDerWaalsContact CB-O 3.23Å; R362-E382 WeakPolarHBondContact CB-O 3.32Å; R362-R383 HydrophobicContact CB-CG 4.21Å
363	T	98.4	Very high	94.3	Very high	52 Å²	52	51.9 Å²	51.9	32%	0.319	28%	0.278	S	S	.	.			trans	-70.3	147.1	-176	50.6	0	0	0	0	110.5	R337 G353 V361	R337-T363 PolarHBondContact NH2-O 3.46Å; R337-T363 PolarHBondContact NH2-OG1 2.87Å; G353-T363 PolarHBondContact N-O 2.85Å; V361-T363 WeakPolarHBondContact CG2-OG1 3.22Å
364	V	98.6	Very high	94.3	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	126.9	179.8	-173.7	0	0	0	0	107.6	Y350 A351 V352 I377 M380 W421	Y350-V364 HydrophobicContact CD1-CG1 4.36Å; A351-V364 WeakPolarHBondContact O-CA 3.3Å; V352-V364 HydrophobicContact CG1-CG2 4.1Å; V352-V364 HydrophobicContact CG2-CG1 4.06Å; V364-I377 HydrophobicContact CB-CD1 4.16Å; V364-I377 HydrophobicContact CB-CG1 3.81Å; V364-I377 HydrophobicContact CG1-CD1 3.77Å; V364-I377 HydrophobicContact CG1-CG1 3.85Å; V364-I377 PolarHBondContact O-N 2.84Å; V364-I377 VanDerWaalsContact O-N 3.08Å; V364-M380 HydrophobicContact CG2-CG 4.22Å; V364-W421 HydrophobicContact CG2-CZ2 3.79Å
365	D	98.6	Very high	94.2	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	141.3	175.8	-58.2	-57.9	0	0	0	108.7	P334 R337 A351 W374 T375 S376	P334-D365 HydrophobicContact CG-CB 4.48Å; R337-D365 IonicContact CZ-OD2 3Å; R337-D365 IonicContact NH1-OD2 3.54Å; R337-D365 PolarHBondContact NH1-OD2 2.75Å; R337-D365 IonicContact NH2-OD2 3.87Å; R337-D365 PolarHBondContact NH2-OD2 3.06Å; A351-D365 PolarHBondContact N-O 3.34Å; A351-D365 PolarHBondContact O-N 2.84Å; D365-W374 HydrophobicContact CB-CE3 3.75Å; D365-W374 HydrophobicContact CB-CZ3 4.25Å; D365-T375 CarbonylContact C-O 3.22Å; D365-T375 WeakPolarHBondContact CA-O 3.33Å; D365-S376 WeakPolarHBondContact OD1-CB 3.24Å; D365-S376 PolarHBondContact OD1-OG 2.96Å
366	V	98.4	Very high	94.2	Very high	6 Å²	6	59.7 Å²	59.7	4%	0.036	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.9	-175.9	-176	0	0	0	0	108.7	H348 V349 Y350 W374 T375 I377	H348-V366 HydrophobicContact CB-CG1 3.51Å; V349-V366 CarbonylContact O-C 3.55Å; V349-V366 WeakPolarHBondContact O-CA 3.42Å; Y350-V366 HydrophobicContact CD1-CG1 4.49Å; Y350-V366 HydrophobicContact CD1-CG2 3.45Å; Y350-V366 VanDerWaalsContact CD1-CG2 3.45Å; Y350-V366 HydrophobicContact CD2-CG1 4.44Å; Y350-V366 HydrophobicContact CE1-CB 4.48Å; Y350-V366 HydrophobicContact CE1-CG1 4.2Å; Y350-V366 HydrophobicContact CE1-CG2 3.43Å; Y350-V366 VanDerWaalsContact CE1-CG2 3.43Å; Y350-V366 HydrophobicContact CE2-CG1 4.13Å; Y350-V366 HydrophobicContact CG-CG2 4.13Å; V366-W374 CarbonylContact O-C 3.48Å; V366-W374 WeakPolarHBondContact O-CA 3.23Å; V366-T375 PolarHBondContact N-O 2.85Å; V366-T375 PolarHBondContact O-N 3.26Å; V366-T375 PolarHBondContact O-OG1 3.34Å; V366-I377 HydrophobicContact CB-CG2 4.37Å; V366-I377 HydrophobicContact CG2-CB 4.34Å; V366-I377 HydrophobicContact CG2-CD1 3.69Å; V366-I377 HydrophobicContact CG2-CG1 3.81Å; V366-I377 HydrophobicContact CG2-CG2 3.62Å
367	Y	98.2	Very high	94.2	Very high	9 Å²	9	59 Å²	59	4%	0.035	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.7	178.1	176.7	-109	0	0	0	110.6	I304 I330 A331 H348 V349 D372 Q373 W374 I583	I304-Y367 HydrophobicContact CD1-CD1 4.14Å; I304-Y367 HydrophobicContact CD1-CE1 3.7Å; I330-Y367 HydrophobicContact CD1-CE1 4.03Å; I330-Y367 HydrophobicContact CD1-CE2 4.37Å; A331-Y367 HydrophobicContact CB-CE2 4.2Å; H348-Y367 WeakPolarHBondContact CA-O 3.34Å; H348-Y367 WeakPolarHBondContact CB-O 3.18Å; V349-Y367 HydrophobicContact CB-CD1 4.38Å; V349-Y367 HydrophobicContact CG2-CD1 4.38Å; V349-Y367 PolarHBondContact N-O 2.92Å; V349-Y367 VanDerWaalsContact N-O 3.09Å; V349-Y367 PolarHBondContact O-N 2.79Å; Y367-D372 WeakPolarHBondContact CE2-OD1 3.28Å; Y367-D372 PolarHBondContact OH-OD1 2.82Å; Y367-Q373 WeakPolarHBondContact CA-O 3.44Å; Y367-W374 AromaticContact CD2-CD1 3.87Å; Y367-W374 HydrophobicContact CD2-CD2 4.08Å; Y367-W374 AromaticContact CD2-CE2 3.68Å; Y367-W374 HydrophobicContact CD2-CG 4.2Å; Y367-W374 HydrophobicContact CD2-CZ2 4.14Å; Y367-W374 AromaticContact CD2-NE1 3.53Å; Y367-W374 HydrophobicContact CG-CD2 4.36Å; Y367-W374 AromaticContact CG-CE2 3.97Å; Y367-W374 HydrophobicContact CG-CH2 4.41Å; Y367-W374 HydrophobicContact CG-CZ2 4.01Å; Y367-I583 HydrophobicContact CE1-CD1 4.33Å
368	D	88.9	Confident	94.5	Very high	22 Å²	22	58.4 Å²	58.4	12%	0.118	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	106.8	170.3	-178.5	-20.8	0	0	0	108.2	V370 K371 D372 Q373	D368-V370 VanDerWaalsContact C-N 3.25Å; D368-V370 PolarHBondContact O-N 3.16Å; D368-V370 WeakPolarHBondContact OD1-CB 3.47Å; D368-V370 PolarHBondContact OD1-N 3.47Å; D368-K371 HydrophobicContact CB-CB 4.39Å; D368-K371 PolarHBondContact O-N 2.9Å; D368-K371 PolarHBondContact OD1-N 2.75Å; D368-K371 VanDerWaalsContact OD2-CD 3.29Å; D368-K371 WeakPolarHBondContact OD2-CD 3.29Å; D368-K371 WeakPolarHBondContact OD2-CE 3.42Å; D368-K371 WeakPolarHBondContact OD2-CG 3.29Å; D368-K371 IonicContact OD2-NZ 2.62Å; D368-K371 PolarHBondContact OD2-NZ 2.88Å; D368-D372 WeakPolarHBondContact O-CA 3.34Å; D368-D372 PolarHBondContact O-N 3.3Å; D368-Q373 PolarHBondContact N-O 2.78Å; D368-Q373 PolarHBondContact O-N 3.07Å
369	G	86.1	Confident	94.7	Very high	12 Å²	12	56.2 Å²	56.2	12%	0.124	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-17.1	-177.7	0	0	0	0	0	114.4	S586	G369-S586 PolarHBondContact O-OG 3.31Å
370	V	81	Confident	94.9	Very high	124 Å²	124	51 Å²	51	75%	0.752	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-38.2	175.5	-179.2	0	0	0	0	110.1	D368	D368-V370 VanDerWaalsContact C-N 3.25Å; D368-V370 PolarHBondContact O-N 3.16Å; D368-V370 WeakPolarHBondContact OD1-CB 3.47Å; D368-V370 PolarHBondContact OD1-N 3.47Å
371	K	82.1	Confident	94.9	Very high	133 Å²	133	52.8 Å²	52.8	58%	0.578	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-7.9	-178.8	-62.4	-178.9	-164.5	123.6	0	114.3	D368 Q373	D368-K371 HydrophobicContact CB-CB 4.39Å; D368-K371 PolarHBondContact O-N 2.9Å; D368-K371 PolarHBondContact OD1-N 2.75Å; D368-K371 VanDerWaalsContact OD2-CD 3.29Å; D368-K371 WeakPolarHBondContact OD2-CD 3.29Å; D368-K371 WeakPolarHBondContact OD2-CE 3.42Å; D368-K371 WeakPolarHBondContact OD2-CG 3.29Å; D368-K371 IonicContact OD2-NZ 2.62Å; D368-K371 PolarHBondContact OD2-NZ 2.88Å; K371-Q373 VanDerWaalsContact C-N 3.33Å; K371-Q373 HydrophobicContact CB-CB 4.27Å; K371-Q373 HydrophobicContact CB-CG 4.45Å; K371-Q373 WeakPolarHBondContact O-CG 3.19Å; K371-Q373 PolarHBondContact O-N 3.02Å
372	D	88.7	Confident	94.8	Very high	71 Å²	71	54.9 Å²	54.9	38%	0.38	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	52.8	-169.2	-172.9	31.7	0	0	0	111.6	A331 Y367 D368	A331-D372 WeakPolarHBondContact CB-O 3.32Å; A331-D372 WeakPolarHBondContact CB-OD1 3.43Å; A331-D372 PolarHBondContact N-OD1 3.5Å; Y367-D372 WeakPolarHBondContact CE2-OD1 3.28Å; Y367-D372 PolarHBondContact OH-OD1 2.82Å; D368-D372 WeakPolarHBondContact O-CA 3.34Å; D368-D372 PolarHBondContact O-N 3.3Å
373	Q	94.1	Very high	94.8	Very high	114 Å²	114	55.6 Å²	55.6	53%	0.533	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.7	-174.1	-78.3	178.6	31.3	0	0	113.6	Y367 D368 K371	Y367-Q373 WeakPolarHBondContact CA-O 3.44Å; D368-Q373 PolarHBondContact N-O 2.78Å; D368-Q373 PolarHBondContact O-N 3.07Å; K371-Q373 VanDerWaalsContact C-N 3.33Å; K371-Q373 HydrophobicContact CB-CB 4.27Å; K371-Q373 HydrophobicContact CB-CG 4.45Å; K371-Q373 WeakPolarHBondContact O-CG 3.19Å; K371-Q373 PolarHBondContact O-N 3.02Å
374	W	98.3	Very high	94.8	Very high	30 Å²	30	53.1 Å²	53.1	11%	0.114	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137	172.8	-69.6	89.8	0	0	0	111.6	V306 V317 A331 L333 P334 A351 D365 V366 Y367	V306-W374 HydrophobicContact CG1-CH2 3.7Å; V306-W374 HydrophobicContact CG1-CZ2 4.05Å; V306-W374 HydrophobicContact CG2-CH2 4.14Å; V306-W374 HydrophobicContact CG2-CZ2 4.36Å; V317-W374 HydrophobicContact CG1-CZ2 4.45Å; V317-W374 HydrophobicContact CG2-CZ2 3.91Å; A331-W374 PolarHBondContact O-NE1 2.72Å; L333-W374 HydrophobicContact CD2-CD2 3.95Å; L333-W374 HydrophobicContact CD2-CE3 3.83Å; L333-W374 HydrophobicContact CD2-CH2 3.64Å; L333-W374 HydrophobicContact CD2-CZ2 3.75Å; L333-W374 HydrophobicContact CD2-CZ3 3.67Å; L333-W374 HydrophobicContact CG-CZ2 4.27Å; P334-W374 HydrophobicContact CG-CB 3.69Å; P334-W374 HydrophobicContact CG-CG 4.47Å; A351-W374 HydrophobicContact CB-CH2 4.21Å; A351-W374 HydrophobicContact CB-CZ3 3.89Å; D365-W374 HydrophobicContact CB-CE3 3.75Å; D365-W374 HydrophobicContact CB-CZ3 4.25Å; V366-W374 CarbonylContact O-C 3.48Å; V366-W374 WeakPolarHBondContact O-CA 3.23Å; Y367-W374 AromaticContact CD2-CD1 3.87Å; Y367-W374 HydrophobicContact CD2-CD2 4.08Å; Y367-W374 AromaticContact CD2-CE2 3.68Å; Y367-W374 HydrophobicContact CD2-CG 4.2Å; Y367-W374 HydrophobicContact CD2-CZ2 4.14Å; Y367-W374 AromaticContact CD2-NE1 3.53Å; Y367-W374 HydrophobicContact CG-CD2 4.36Å; Y367-W374 AromaticContact CG-CE2 3.97Å; Y367-W374 HydrophobicContact CG-CH2 4.41Å; Y367-W374 HydrophobicContact CG-CZ2 4.01Å
375	T	97.1	Very high	94.8	Very high	79 Å²	79	53 Å²	53	49%	0.485	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.5	174.8	54.8	0	0	0	0	110.7	D365 V366	D365-T375 CarbonylContact C-O 3.22Å; D365-T375 WeakPolarHBondContact CA-O 3.33Å; V366-T375 PolarHBondContact N-O 2.85Å; V366-T375 PolarHBondContact O-N 3.26Å; V366-T375 PolarHBondContact O-OG1 3.34Å
376	S	97.8	Very high	94.8	Very high	89 Å²	89	53.4 Å²	53.4	62%	0.622	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	136.3	176	-58	0	0	0	0	110.5	D365	D365-S376 WeakPolarHBondContact OD1-CB 3.24Å; D365-S376 PolarHBondContact OD1-OG 2.96Å
377	I	96.9	Very high	94.8	Very high	39 Å²	39	53.7 Å²	53.7	20%	0.2	28%	0.283	C	S	.	.			trans	-115.3	-170.7	178.5	62.8	159.2	0	0	0	111.4	Y350 V364 V366 S379 Y414	Y350-I377 HydrophobicContact CD1-CD1 4.03Å; Y350-I377 HydrophobicContact CE1-CD1 3.84Å; V364-I377 HydrophobicContact CB-CD1 4.16Å; V364-I377 HydrophobicContact CB-CG1 3.81Å; V364-I377 HydrophobicContact CG1-CD1 3.77Å; V364-I377 HydrophobicContact CG1-CG1 3.85Å; V364-I377 PolarHBondContact O-N 2.84Å; V364-I377 VanDerWaalsContact O-N 3.08Å; V366-I377 HydrophobicContact CB-CG2 4.37Å; V366-I377 HydrophobicContact CG2-CB 4.34Å; V366-I377 HydrophobicContact CG2-CD1 3.69Å; V366-I377 HydrophobicContact CG2-CG1 3.81Å; V366-I377 HydrophobicContact CG2-CG2 3.62Å; I377-S379 PolarHBondContact O-N 2.83Å; I377-Y414 HydrophobicContact CD1-CE1 3.81Å; I377-Y414 HydrophobicContact CD1-CE2 4.03Å; I377-Y414 VanDerWaalsContact CD1-CZ 3.5Å; I377-Y414 WeakPolarHBondContact CD1-OH 3.27Å
378	A	97.8	Very high	94.8	Very high	28 Å²	28	53.5 Å²	53.5	23%	0.231	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-53.1	131.6	174.6	0	0	0	0	0	111.2	Y414 N419 W421	A378-Y414 HydrophobicContact CB-CE2 4.39Å; A378-N419 WeakPolarHBondContact CB-O 3.34Å; A378-N419 WeakPolarHBondContact CB-OD1 3.4Å; A378-N419 PolarHBondContact N-OD1 3.18Å; A378-W421 PolarHBondContact O-NE1 3.05Å
379	S	98.4	Very high	95.3	Very high	51 Å²	51	53.3 Å²	53.3	36%	0.357	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-77.5	150.8	176.5	-67.7	0	0	0	0	111.2	R362 I377	R362-S379 WeakPolarHBondContact O-CA 3.27Å; R362-S379 WeakPolarHBondContact O-CB 3.38Å; I377-S379 PolarHBondContact O-N 2.83Å
380	M	98.5	Very high	95.9	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.015	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-57.8	162	168.3	-64.7	-179.3	-64.5	0	0	111	V352 R362 V364 E382 R384 L387 A398 W421	V352-M380 HydrophobicContact CG1-CE 3.99Å; V352-M380 HydrophobicContact CG1-CG 4.38Å; V352-M380 HydrophobicContact CG1-SD 3.5Å; V352-M380 VanDerWaalsContact CG1-SD 3.5Å; R362-M380 HydrophobicContact CB-CB 4.21Å; R362-M380 VanDerWaalsContact CD-O 3.3Å; R362-M380 WeakPolarHBondContact CD-O 3.46Å; R362-M380 PolarHBondContact O-N 2.9Å; V364-M380 HydrophobicContact CG2-CG 4.22Å; M380-E382 WeakPolarHBondContact CB-O 3.48Å; M380-R384 HydrophobicContact CE-CB 3.98Å; M380-R384 HydrophobicContact CE-CG 4.12Å; M380-R384 HydrophobicContact SD-CG 4.33Å; M380-L387 HydrophobicContact SD-CD1 4.38Å; M380-A398 HydrophobicContact SD-CB 3.59Å; M380-A398 VanDerWaalsContact SD-CB 3.59Å; M380-W421 HydrophobicContact CB-CD2 4.34Å; M380-W421 HydrophobicContact CG-CD2 3.77Å; M380-W421 HydrophobicContact CG-CE3 3.8Å; M380-W421 HydrophobicContact CG-CH2 3.59Å; M380-W421 HydrophobicContact CG-CZ2 3.6Å; M380-W421 HydrophobicContact CG-CZ3 3.71Å; M380-W421 HydrophobicContact SD-CH2 4.03Å; M380-W421 HydrophobicContact SD-CZ3 4.16Å
381	Q	98	Very high	96.7	Very high	100 Å²	100	49.4 Å²	49.4	47%	0.467	26%	0.261	S	S	.	.	S	Bend	trans	-73.6	-41.2	175	-51.2	-167.5	27.2	0	0	110.4	E412 W421 F423	Q381-E412 WeakPolarHBondContact CA-OE2 3.27Å; Q381-E412 WeakPolarHBondContact CB-OE2 3.35Å; Q381-E412 WeakPolarHBondContact CG-OE2 3.25Å; Q381-E412 PolarHBondContact N-OE2 2.94Å; Q381-W421 HydrophobicContact CG-CB 4.44Å; Q381-W421 PolarHBondContact NE2-O 3.03Å; Q381-F423 HydrophobicContact CB-CE2 4.11Å; Q381-F423 HydrophobicContact CB-CZ 4Å; Q381-F423 HydrophobicContact CG-CE2 4.33Å
382	E	96.3	Very high	97.4	Very high	63 Å²	63	43.3 Å²	43.3	29%	0.294	24%	0.235	S	C	.	.	S	Bend	trans	-102.8	152.6	178.5	-65.9	-175.9	151.7	0	0	113.1	R362 M380 R384 S410 E412 F423	R362-E382 VanDerWaalsContact CB-O 3.23Å; R362-E382 WeakPolarHBondContact CB-O 3.32Å; M380-E382 WeakPolarHBondContact CB-O 3.48Å; E382-R384 IonicContact OE2-CZ 2.89Å; E382-R384 IonicContact OE2-NH1 3.96Å; E382-R384 IonicContact OE2-NH2 2.9Å; E382-R384 PolarHBondContact OE2-NH2 3.07Å; E382-S410 WeakPolarHBondContact OE2-CB 3.29Å; E382-S410 PolarHBondContact OE2-OG 3.2Å; E382-E412 PolarHBondContact N-OE1 3.1Å; E382-F423 HydrophobicContact CG-CE1 4.37Å; E382-F423 HydrophobicContact CG-CZ 4.03Å
383	R	98.1	Very high	97.5	Very high	137 Å²	137	45.1 Å²	45.1	52%	0.517	24%	0.244	S	C	.	.			trans	-77.5	131.9	169.3	-64.5	168.5	-176.4	160.7	2.3	108	R360 R362 D403	R360-R383 HydrophobicContact CB-CB 4.34Å; R360-R383 WeakPolarHBondContact O-CD 3.42Å; R362-R383 HydrophobicContact CB-CG 4.21Å; R383-D403 VanDerWaalsContact O-CA 3.28Å; R383-D403 WeakPolarHBondContact O-CA 3.21Å; R383-D403 WeakPolarHBondContact O-CB 3.32Å
384	R	98.4	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.242	C	C	.	.			trans	-136.8	125.6	-178.2	-57.1	-177	-178.5	-81.5	-15.3	109.9	G354 V361 M380 E382 L387 G400 L408 S410 E412	G354-R384 PolarHBondContact N-O 2.86Å; V361-R384 PolarHBondContact O-N 3.45Å; V361-R384 VanDerWaalsContact O-N 3.17Å; M380-R384 HydrophobicContact CE-CB 3.98Å; M380-R384 HydrophobicContact CE-CG 4.12Å; M380-R384 HydrophobicContact SD-CG 4.33Å; E382-R384 IonicContact OE2-CZ 2.89Å; E382-R384 IonicContact OE2-NH1 3.96Å; E382-R384 IonicContact OE2-NH2 2.9Å; E382-R384 PolarHBondContact OE2-NH2 3.07Å; R384-L387 HydrophobicContact CB-CB 4.16Å; R384-L387 HydrophobicContact CB-CD1 3.88Å; R384-L387 HydrophobicContact CB-CD2 4.24Å; R384-L387 HydrophobicContact CB-CG 4.32Å; R384-G400 PolarHBondContact NH1-O 2.79Å; R384-L408 HydrophobicContact CG-CD1 3.89Å; R384-S410 PolarHBondContact NH1-O 2.9Å; R384-S410 PolarHBondContact NH1-OG 3.37Å; R384-S410 VanDerWaalsContact NH1-OG 3.16Å; R384-S410 PolarHBondContact NH2-OG 3.3Å; R384-E412 IonicContact CZ-OE1 2.68Å; R384-E412 IonicContact NE-OE1 3Å; R384-E412 PolarHBondContact NE-OE1 2.76Å; R384-E412 VanDerWaalsContact NH2-CG 3.33Å; R384-E412 IonicContact NH2-OE1 3.63Å; R384-E412 PolarHBondContact NH2-OE1 2.57Å
385	S	98.5	Very high	97.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-123.4	153	165.1	64.6	0	0	0	0	109.8	R360 L387 G401 F402	R360-S385 WeakPolarHBondContact CD-OG 3.14Å; S385-L387 PolarHBondContact O-N 3.16Å; S385-G401 CarbonylContact O-C 3.47Å; S385-G401 VanDerWaalsContact O-CA 3.23Å; S385-G401 WeakPolarHBondContact O-CA 3.33Å; S385-F402 PolarHBondContact N-O 3.07Å; S385-F402 PolarHBondContact O-N 2.81Å; S385-F402 PolarHBondContact OG-O 2.79Å
386	T	98.3	Very high	97.3	Very high	12 Å²	12	40.7 Å²	40.7	7%	0.074	22%	0.223	C	C	.	.	S	Bend	trans	55	30.9	-175.7	66.5	0	0	0	0	112.9	R339 S433 V434 Y577	R339-T386 HydrophobicContact CB-CG2 3.81Å; R339-T386 HydrophobicContact CG-CG2 3.91Å; R339-T386 PolarHBondContact O-N 3.22Å; T386-S433 VanDerWaalsContact O-CA 3.32Å; T386-S433 WeakPolarHBondContact O-CA 3.38Å; T386-S433 PolarHBondContact O-N 2.75Å; T386-S433 PolarHBondContact OG1-N 2.88Å; T386-V434 PolarHBondContact O-N 3.1Å; T386-Y577 HydrophobicContact CG2-CD1 4.38Å; T386-Y577 HydrophobicContact CG2-CE1 3.94Å
387	L	98.7	Very high	97.3	Very high	11 Å²	11	36.8 Å²	36.8	6%	0.058	20%	0.195	C	C	.	.			trans	-78.3	160.8	171.6	72.3	167.8	0	0	0	110.7	V352 M380 R384 S385 A398	V352-L387 HydrophobicContact CG1-CD1 4.15Å; M380-L387 HydrophobicContact SD-CD1 4.38Å; R384-L387 HydrophobicContact CB-CB 4.16Å; R384-L387 HydrophobicContact CB-CD1 3.88Å; R384-L387 HydrophobicContact CB-CD2 4.24Å; R384-L387 HydrophobicContact CB-CG 4.32Å; S385-L387 PolarHBondContact O-N 3.16Å; L387-A398 HydrophobicContact CD1-CB 3.79Å
388	G	98.6	Very high	97.4	Very high	6 Å²	6	34.9 Å²	34.9	6%	0.062	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	148.6	159.2	0	0	0	0	0	110.5	V399	G388-V399 PolarHBondContact N-O 3.03Å; G388-V399 VanDerWaalsContact N-O 3.1Å; G388-V399 PolarHBondContact O-N 3.11Å
389	A	98.7	Very high	97.5	Very high	17 Å²	17	33.6 Å²	33.6	14%	0.14	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.9	168.7	0	0	0	0	0	109.8	V343 Y397	V343-A389 HydrophobicContact CG1-CB 3.71Å; V343-A389 VanDerWaalsContact CG1-O 3.27Å; V343-A389 WeakPolarHBondContact CG1-O 3.35Å; A389-Y397 VanDerWaalsContact CA-O 3.24Å; A389-Y397 WeakPolarHBondContact CA-O 3.35Å
390	A	98.6	Very high	97.5	Very high	9 Å²	9	31.1 Å²	31.1	7%	0.074	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	163.9	175.1	0	0	0	0	0	111.2	Y397 V436 V438 L443	A390-Y397 PolarHBondContact N-O 2.62Å; A390-Y397 PolarHBondContact O-N 3.36Å; A390-V436 HydrophobicContact CB-CG1 3.64Å; A390-V438 HydrophobicContact CB-CG2 3.8Å; A390-L443 HydrophobicContact CB-CD1 3.62Å
391	V	98.5	Very high	97.5	Very high	45 Å²	45	31 Å²	31	27%	0.273	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.4	-180	-179.8	0	0	0	0	109.5	V343 M345 L395	V343-V391 HydrophobicContact CB-CG2 3.97Å; V343-V391 HydrophobicContact CG2-CG2 3.94Å; M345-V391 HydrophobicContact CB-CG2 3.94Å; M345-V391 HydrophobicContact CE-CB 4.35Å; M345-V391 HydrophobicContact CE-CG1 3.59Å; M345-V391 HydrophobicContact CE-CG2 4Å; M345-V391 HydrophobicContact CG-CG1 4.27Å; M345-V391 HydrophobicContact CG-CG2 4.48Å; V391-L395 WeakPolarHBondContact CA-O 3.35Å
392	L	97	Very high	97.5	Very high	6 Å²	6	28.9 Å²	28.9	3%	0.031	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	125.4	177.4	171	62.1	0	0	0	109.3	D394 L395 Y397 V438 G441 L443 P465	L392-D394 PolarHBondContact O-N 3.22Å; L392-L395 PolarHBondContact N-O 2.79Å; L392-L395 PolarHBondContact O-N 2.84Å; L392-Y397 HydrophobicContact CB-CD2 4.09Å; L392-Y397 HydrophobicContact CB-CE2 3.74Å; L392-Y397 HydrophobicContact CD2-CE2 4.46Å; L392-Y397 HydrophobicContact CG-CE2 4.34Å; L392-Y397 WeakPolarHBondContact O-CE2 3.33Å; L392-V438 HydrophobicContact CB-CG1 4.31Å; L392-V438 HydrophobicContact CB-CG2 4.16Å; L392-V438 HydrophobicContact CD1-CG1 3.82Å; L392-G441 WeakPolarHBondContact CD1-O 3.38Å; L392-L443 HydrophobicContact CD2-CB 3.93Å; L392-P465 HydrophobicContact CD2-CB 4.37Å; L392-P465 HydrophobicContact CD2-CG 3.89Å; L392-P465 HydrophobicContact CG-CG 4.47Å
393	N	90.5	Very high	97.5	Very high	109 Å²	109	28.1 Å²	28.1	58%	0.583	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	53.6	178.7	-56.6	-19.5	0	0	0	112.8	L395	N393-L395 PolarHBondContact O-N 2.94Å; N393-L395 VanDerWaalsContact O-N 3.07Å
394	D	90	Very high	97.4	Very high	92 Å²	92	23.4 Å²	23.4	49%	0.492	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	10.4	-178.1	-68.1	-20.9	0	0	0	116.2	M345 L392 Y416 K417	M345-D394 WeakPolarHBondContact CE-O 3.19Å; L392-D394 PolarHBondContact O-N 3.22Å; D394-Y416 HydrophobicContact CB-CE1 4.14Å; D394-K417 IonicContact OD2-NZ 2.73Å
395	L	96.1	Very high	97.2	Very high	38 Å²	38	28.3 Å²	28.3	20%	0.199	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	141.7	177	-62.5	173.3	0	0	0	111.2	V391 L392 N393 Y397 Y414 F422	V391-L395 WeakPolarHBondContact CA-O 3.35Å; L392-L395 PolarHBondContact N-O 2.79Å; L392-L395 PolarHBondContact O-N 2.84Å; N393-L395 PolarHBondContact O-N 2.94Å; N393-L395 VanDerWaalsContact O-N 3.07Å; L395-Y397 HydrophobicContact CB-CD2 4.33Å; L395-Y397 HydrophobicContact CB-CE2 3.66Å; L395-Y397 WeakPolarHBondContact O-CD2 3.34Å; L395-Y414 WeakPolarHBondContact CA-O 3.36Å; L395-Y414 WeakPolarHBondContact CD2-O 3.31Å; L395-F422 HydrophobicContact CD1-CZ 4.04Å; L395-F422 HydrophobicContact CD2-CE1 4.42Å; L395-F422 HydrophobicContact CD2-CZ 4.34Å
396	L	98.8	Very high	97.1	Very high	0 Å²	0	32 Å²	32	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	119.6	176.9	178.1	170.5	0	0	0	107.1	V343 M345 Y350 V352 A413 Y414 W421	V343-L396 HydrophobicContact CG2-CD1 3.61Å; V343-L396 HydrophobicContact CG2-CG 3.87Å; M345-L396 HydrophobicContact CE-CB 3.59Å; M345-L396 HydrophobicContact SD-CB 4.37Å; Y350-L396 HydrophobicContact CD1-CD1 3.72Å; Y350-L396 HydrophobicContact CD2-CD1 4.47Å; Y350-L396 HydrophobicContact CG-CD1 3.7Å; V352-L396 HydrophobicContact CG1-CD2 4.47Å; V352-L396 HydrophobicContact CG2-CD1 3.84Å; V352-L396 HydrophobicContact CG2-CD2 4.05Å; L396-A413 CarbonylContact O-C 3.43Å; L396-A413 VanDerWaalsContact O-CA 3.29Å; L396-A413 WeakPolarHBondContact O-CA 3.14Å; L396-Y414 HydrophobicContact CB-CD1 4.39Å; L396-Y414 PolarHBondContact N-O 3.47Å; L396-Y414 PolarHBondContact O-N 3.27Å; L396-W421 HydrophobicContact CD2-CH2 3.49Å; L396-W421 VanDerWaalsContact CD2-CH2 3.49Å; L396-W421 HydrophobicContact CD2-CZ2 4.41Å; L396-W421 HydrophobicContact CD2-CZ3 4.08Å
397	Y	98.9	Very high	97	Very high	6 Å²	6	31.9 Å²	31.9	2%	0.024	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.1	179.9	-69.5	-99.7	0	0	0	110.5	A389 A390 L392 L395 V411 E412 A413 V424 L443 Y463	A389-Y397 VanDerWaalsContact CA-O 3.24Å; A389-Y397 WeakPolarHBondContact CA-O 3.35Å; A390-Y397 PolarHBondContact N-O 2.62Å; A390-Y397 PolarHBondContact O-N 3.36Å; L392-Y397 HydrophobicContact CB-CD2 4.09Å; L392-Y397 HydrophobicContact CB-CE2 3.74Å; L392-Y397 HydrophobicContact CD2-CE2 4.46Å; L392-Y397 HydrophobicContact CG-CE2 4.34Å; L392-Y397 WeakPolarHBondContact O-CE2 3.33Å; L395-Y397 HydrophobicContact CB-CD2 4.33Å; L395-Y397 HydrophobicContact CB-CE2 3.66Å; L395-Y397 WeakPolarHBondContact O-CD2 3.34Å; Y397-V411 HydrophobicContact CD1-CG1 4.18Å; Y397-E412 CarbonylContact C-O 3.59Å; Y397-E412 WeakPolarHBondContact CA-O 3.44Å; Y397-A413 HydrophobicContact CD1-CB 4.05Å; Y397-A413 HydrophobicContact CE1-CB 3.9Å; Y397-V424 HydrophobicContact CD1-CG2 4.33Å; Y397-V424 HydrophobicContact CE1-CG1 4.28Å; Y397-V424 HydrophobicContact CE1-CG2 4.25Å; Y397-L443 HydrophobicContact CD1-CD2 4.02Å; Y397-L443 HydrophobicContact CG-CD2 3.93Å; Y397-Y463 HydrophobicContact CE1-CD1 4.37Å; Y397-Y463 AromaticContact CE1-CE1 3.68Å; Y397-Y463 HydrophobicContact CE1-CE1 3.68Å
398	A	98.9	Very high	97	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	107.5	169.4	0	0	0	0	0	109.1	V352 M380 L387 V411 E412 W421	V352-A398 HydrophobicContact CG1-CB 4.33Å; M380-A398 HydrophobicContact SD-CB 3.59Å; M380-A398 VanDerWaalsContact SD-CB 3.59Å; L387-A398 HydrophobicContact CD1-CB 3.79Å; A398-V411 WeakPolarHBondContact O-CA 3.32Å; A398-E412 PolarHBondContact N-O 3Å; A398-E412 PolarHBondContact O-N 2.77Å; A398-E412 VanDerWaalsContact O-N 3.11Å; A398-W421 HydrophobicContact CB-CH2 4.16Å; A398-W421 HydrophobicContact CB-CZ3 3.73Å
399	V	98.9	Very high	97	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	114.7	-166.5	-174.7	0	0	0	0	110.7	G388 V411 M427 V434 V436 L443 A445 W470	G388-V399 PolarHBondContact N-O 3.03Å; G388-V399 VanDerWaalsContact N-O 3.1Å; G388-V399 PolarHBondContact O-N 3.11Å; V399-V411 HydrophobicContact CG1-CG2 4.09Å; V399-V411 HydrophobicContact CG2-CG1 4.03Å; V399-M427 HydrophobicContact CG1-CE 3.84Å; V399-M427 HydrophobicContact CG1-SD 3.51Å; V399-M427 VanDerWaalsContact CG1-SD 3.51Å; V399-V434 WeakPolarHBondContact O-CG1 3.45Å; V399-V436 HydrophobicContact CB-CG2 3.91Å; V399-V436 HydrophobicContact CG1-CG2 4.09Å; V399-V436 HydrophobicContact CG2-CG1 4.27Å; V399-V436 HydrophobicContact CG2-CG2 4.14Å; V399-L443 HydrophobicContact CG2-CD2 3.92Å; V399-A445 HydrophobicContact CG1-CB 4.2Å; V399-W470 HydrophobicContact CG1-CH2 4.09Å; V399-W470 HydrophobicContact CG1-CZ2 4.33Å
400	G	98.6	Very high	97	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.203	C	C	.	.			trans	62.3	-136	174.3	0	0	0	0	0	113.5	R384 L408 S410	R384-G400 PolarHBondContact NH1-O 2.79Å; G400-L408 WeakPolarHBondContact CA-O 3.32Å; G400-S410 PolarHBondContact N-O 2.71Å; G400-S410 VanDerWaalsContact N-O 3.1Å
401	G	98.5	Very high	97	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.199	C	C	.	.			trans	100.7	-158	-177.3	0	0	0	0	0	113.6	S385 G407 L408 R431	S385-G401 CarbonylContact O-C 3.47Å; S385-G401 VanDerWaalsContact O-CA 3.23Å; S385-G401 WeakPolarHBondContact O-CA 3.33Å; G401-G407 WeakPolarHBondContact O-CA 3.48Å; G401-L408 PolarHBondContact O-N 2.68Å; G401-R431 PolarHBondContact N-O 3.48Å
402	F	98.4	Very high	97	Very high	56 Å²	56	30.4 Å²	30.4	25%	0.246	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-138.8	125.1	-177.9	179.9	-108	0	0	0	110.1	S385 G404 T406	S385-F402 PolarHBondContact N-O 3.07Å; S385-F402 PolarHBondContact O-N 2.81Å; S385-F402 PolarHBondContact OG-O 2.79Å; F402-G404 VanDerWaalsContact CE1-C 3.48Å; F402-G404 WeakPolarHBondContact CZ-O 3.33Å; F402-T406 VanDerWaalsContact CD2-C 3.44Å; F402-T406 WeakPolarHBondContact CD2-O 3.45Å
403	D	97.1	Very high	97.1	Very high	47 Å²	47	30.1 Å²	30.1	25%	0.251	19%	0.185	S	C	.	.			trans	-86.3	-9.5	-174.3	67.9	-3.3	0	0	0	114.2	R383 S405 T406 L408	R383-D403 VanDerWaalsContact O-CA 3.28Å; R383-D403 WeakPolarHBondContact O-CA 3.21Å; R383-D403 WeakPolarHBondContact O-CB 3.32Å; D403-S405 WeakPolarHBondContact OD1-CA 3.38Å; D403-S405 PolarHBondContact OD1-N 3.07Å; D403-T406 PolarHBondContact N-O 3.07Å; D403-T406 PolarHBondContact OD1-N 3.42Å; D403-T406 VanDerWaalsContact OD1-O 3.1Å; D403-L408 HydrophobicContact CB-CD1 4.24Å; D403-L408 HydrophobicContact CB-CD2 4.25Å; D403-L408 HydrophobicContact CB-CG 4.46Å
404	G	95.1	Very high	97.5	Very high	38 Å²	38	25.2 Å²	25.2	39%	0.392	16%	0.158	S	C	.	.	S	Bend	trans	116.1	-19.8	-172.5	0	0	0	0	0	113.6	F402	F402-G404 VanDerWaalsContact CE1-C 3.48Å; F402-G404 WeakPolarHBondContact CZ-O 3.33Å
405	S	94.7	Very high	97.8	Very high	103 Å²	103	21.7 Å²	21.7	72%	0.72	14%	0.141	S	C	*	.	S	Bend	trans	-123.4	-46.4	-178.4	-51	0	0	0	0	111.9	D403	D403-S405 WeakPolarHBondContact OD1-CA 3.38Å; D403-S405 PolarHBondContact OD1-N 3.07Å
406	T	95.9	Very high	97.7	Very high	77 Å²	77	23.8 Å²	23.8	47%	0.472	15%	0.147	S	C	.	.	S	Bend	trans	-134.9	151.1	-173.9	65.9	0	0	0	0	112.4	F402 D403	F402-T406 VanDerWaalsContact CD2-C 3.44Å; F402-T406 WeakPolarHBondContact CD2-O 3.45Å; D403-T406 PolarHBondContact N-O 3.07Å; D403-T406 PolarHBondContact OD1-N 3.42Å; D403-T406 VanDerWaalsContact OD1-O 3.1Å
407	G	97.1	Very high	97.3	Very high	9 Å²	9	30.7 Å²	30.7	9%	0.093	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-73.1	138.9	168	0	0	0	0	0	110.1	G401 R430	G401-G407 WeakPolarHBondContact O-CA 3.48Å; G407-R430 WeakPolarHBondContact O-CD 3.48Å
408	L	98.4	Very high	97	Very high	11 Å²	11	34.3 Å²	34.3	6%	0.058	20%	0.2	C	C	.	.			trans	-99.3	138.8	-172.4	-59.3	175.6	0	0	0	111.6	R384 G400 G401 D403 R430 R431	R384-L408 HydrophobicContact CG-CD1 3.89Å; G400-L408 WeakPolarHBondContact CA-O 3.32Å; G401-L408 PolarHBondContact O-N 2.68Å; D403-L408 HydrophobicContact CB-CD1 4.24Å; D403-L408 HydrophobicContact CB-CD2 4.25Å; D403-L408 HydrophobicContact CB-CG 4.46Å; L408-R430 WeakPolarHBondContact O-CA 3.38Å; L408-R431 PolarHBondContact O-N 3.23Å
409	A	98.5	Very high	96.8	Very high	25 Å²	25	37.9 Å²	37.9	21%	0.207	22%	0.219	C	C	.	.			trans	-101.8	-16.2	164.2	0	0	0	0	0	111.9	P426 M427 R430	A409-P426 CarbonylContact O-C 3.54Å; A409-P426 WeakPolarHBondContact O-CA 3.41Å; A409-P426 WeakPolarHBondContact O-CB 3.45Å; A409-M427 PolarHBondContact O-N 3.27Å; A409-R430 HydrophobicContact CB-CB 4.05Å
410	S	98.8	Very high	96.7	Very high	21 Å²	21	43.8 Å²	43.8	15%	0.147	25%	0.246	C	C	.	.			trans	-60	147.2	178.4	52.3	0	0	0	0	111.4	E382 R384 G400	E382-S410 WeakPolarHBondContact OE2-CB 3.29Å; E382-S410 PolarHBondContact OE2-OG 3.2Å; R384-S410 PolarHBondContact NH1-O 2.9Å; R384-S410 PolarHBondContact NH1-OG 3.37Å; R384-S410 VanDerWaalsContact NH1-OG 3.16Å; R384-S410 PolarHBondContact NH2-OG 3.3Å; G400-S410 PolarHBondContact N-O 2.71Å; G400-S410 VanDerWaalsContact N-O 3.1Å
411	V	98.9	Very high	96.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.1	177.2	-175.6	0	0	0	0	108.2	Y397 A398 V399 V424 M427 W470	Y397-V411 HydrophobicContact CD1-CG1 4.18Å; A398-V411 WeakPolarHBondContact O-CA 3.32Å; V399-V411 HydrophobicContact CG1-CG2 4.09Å; V399-V411 HydrophobicContact CG2-CG1 4.03Å; V411-V424 HydrophobicContact CB-CG2 3.68Å; V411-V424 HydrophobicContact CG1-CG2 3.56Å; V411-V424 PolarHBondContact O-N 2.94Å; V411-M427 HydrophobicContact CG2-CE 4.47Å; V411-M427 HydrophobicContact CG2-CG 4.12Å; V411-W470 HydrophobicContact CG1-CZ2 4.43Å; V411-W470 HydrophobicContact CG2-CZ2 3.86Å
412	E	98.6	Very high	96.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	141.9	177.6	-52.8	175.6	-104.8	0	0	109	Q381 E382 R384 Y397 A398 W421 F422 F423	Q381-E412 WeakPolarHBondContact CA-OE2 3.27Å; Q381-E412 WeakPolarHBondContact CB-OE2 3.35Å; Q381-E412 WeakPolarHBondContact CG-OE2 3.25Å; Q381-E412 PolarHBondContact N-OE2 2.94Å; E382-E412 PolarHBondContact N-OE1 3.1Å; R384-E412 IonicContact CZ-OE1 2.68Å; R384-E412 IonicContact NE-OE1 3Å; R384-E412 PolarHBondContact NE-OE1 2.76Å; R384-E412 VanDerWaalsContact NH2-CG 3.33Å; R384-E412 IonicContact NH2-OE1 3.63Å; R384-E412 PolarHBondContact NH2-OE1 2.57Å; Y397-E412 CarbonylContact C-O 3.59Å; Y397-E412 WeakPolarHBondContact CA-O 3.44Å; A398-E412 PolarHBondContact N-O 3Å; A398-E412 PolarHBondContact O-N 2.77Å; A398-E412 VanDerWaalsContact O-N 3.11Å; E412-W421 HydrophobicContact CB-CE3 3.74Å; E412-W421 HydrophobicContact CB-CZ3 4.16Å; E412-F422 CarbonylContact C-O 3.54Å; E412-F422 WeakPolarHBondContact CA-O 3.48Å; E412-F423 HydrophobicContact CG-CD1 3.58Å; E412-F423 HydrophobicContact CG-CE1 3.47Å; E412-F423 VanDerWaalsContact CG-CE1 3.47Å; E412-F423 HydrophobicContact CG-CG 4.44Å; E412-F423 HydrophobicContact CG-CZ 4.28Å
413	A	98.8	Very high	96.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	143.7	172	0	0	0	0	0	110.2	L396 Y397 W421 F422 V424	L396-A413 CarbonylContact O-C 3.43Å; L396-A413 VanDerWaalsContact O-CA 3.29Å; L396-A413 WeakPolarHBondContact O-CA 3.14Å; Y397-A413 HydrophobicContact CD1-CB 4.05Å; Y397-A413 HydrophobicContact CE1-CB 3.9Å; A413-W421 WeakPolarHBondContact O-CA 3.45Å; A413-F422 HydrophobicContact CB-CD2 4.37Å; A413-F422 HydrophobicContact CB-CE1 4.19Å; A413-F422 HydrophobicContact CB-CE2 3.79Å; A413-F422 HydrophobicContact CB-CZ 3.69Å; A413-F422 PolarHBondContact N-O 3.31Å; A413-F422 WeakPolarHBondContact O-CD1 3.32Å; A413-F422 PolarHBondContact O-N 3.32Å; A413-V424 HydrophobicContact CB-CG1 3.99Å
414	Y	98.8	Very high	96.8	Very high	7 Å²	7	49.2 Å²	49.2	3%	0.027	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.1	176.5	173.2	-104	0	0	0	110.9	Y350 I377 A378 L395 L396 Y416 N419 E420 W421	Y350-Y414 HydrophobicContact CE1-CD1 4.43Å; Y350-Y414 AromaticContact CE1-CE1 3.88Å; Y350-Y414 HydrophobicContact CE1-CE1 3.88Å; I377-Y414 HydrophobicContact CD1-CE1 3.81Å; I377-Y414 HydrophobicContact CD1-CE2 4.03Å; I377-Y414 VanDerWaalsContact CD1-CZ 3.5Å; I377-Y414 WeakPolarHBondContact CD1-OH 3.27Å; A378-Y414 HydrophobicContact CB-CE2 4.39Å; L395-Y414 WeakPolarHBondContact CA-O 3.36Å; L395-Y414 WeakPolarHBondContact CD2-O 3.31Å; L396-Y414 HydrophobicContact CB-CD1 4.39Å; L396-Y414 PolarHBondContact N-O 3.47Å; L396-Y414 PolarHBondContact O-N 3.27Å; Y414-Y416 VanDerWaalsContact CE1-CA 3.5Å; Y414-N419 PolarHBondContact OH-OD1 3.26Å; Y414-E420 WeakPolarHBondContact CA-O 3.23Å; Y414-E420 WeakPolarHBondContact CD2-O 3.46Å; Y414-W421 AromaticContact CD2-CD1 3.66Å; Y414-W421 HydrophobicContact CD2-CD2 4.02Å; Y414-W421 AromaticContact CD2-CE2 3.6Å; Y414-W421 HydrophobicContact CD2-CG 4.05Å; Y414-W421 HydrophobicContact CD2-CZ2 4.13Å; Y414-W421 AromaticContact CD2-NE1 3.37Å; Y414-W421 AromaticContact CE2-NE1 3.96Å; Y414-W421 HydrophobicContact CG-CD2 4.26Å; Y414-W421 AromaticContact CG-CE2 3.83Å; Y414-W421 HydrophobicContact CG-CH2 4.48Å; Y414-W421 AromaticContact CG-CZ2 3.92Å; Y414-W421 HydrophobicContact CG-CZ2 3.92Å
415	S	96.4	Very high	97	Very high	18 Å²	18	48.2 Å²	48.2	13%	0.126	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.2	171.2	168.3	0	0	0	0	109.5	K417 T418 N419 E420	S415-K417 PolarHBondContact O-N 3.14Å; S415-K417 PolarHBondContact OG-N 3.11Å; S415-T418 WeakPolarHBondContact CB-OG1 3.49Å; S415-T418 PolarHBondContact O-N 3.02Å; S415-T418 PolarHBondContact OG-N 3.31Å; S415-T418 PolarHBondContact OG-OG1 3.28Å; S415-N419 WeakPolarHBondContact O-CA 3.5Å; S415-N419 PolarHBondContact O-N 3.26Å; S415-E420 PolarHBondContact N-O 2.83Å; S415-E420 VanDerWaalsContact N-O 3.11Å; S415-E420 PolarHBondContact O-N 3.43Å
416	Y	92.9	Very high	97.2	Very high	81 Å²	81	47.1 Å²	47.1	32%	0.318	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.3	175.9	72.4	-90.4	0	0	0	112.6	M345 A346 D394 Y414	M345-Y416 HydrophobicContact SD-CD1 3.68Å; M345-Y416 HydrophobicContact SD-CE1 4.37Å; M345-Y416 HydrophobicContact SD-CG 4.42Å; A346-Y416 HydrophobicContact CB-CE1 4.44Å; A346-Y416 HydrophobicContact CB-CE2 4.45Å; D394-Y416 HydrophobicContact CB-CE1 4.14Å; Y414-Y416 VanDerWaalsContact CE1-CA 3.5Å
417	K	91.4	Very high	97.3	Very high	145 Å²	145	43.8 Å²	43.8	63%	0.63	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-34.5	178.7	-63.4	178.6	-176.6	169.9	0	112.3	D394 S415	D394-K417 IonicContact OD2-NZ 2.73Å; S415-K417 PolarHBondContact O-N 3.14Å; S415-K417 PolarHBondContact OG-N 3.11Å
418	T	92.6	Very high	97.4	Very high	83 Å²	83	47.9 Å²	47.9	51%	0.509	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	-12.2	179.7	57.2	0	0	0	0	112.9	S415 E420	S415-T418 WeakPolarHBondContact CB-OG1 3.49Å; S415-T418 PolarHBondContact O-N 3.02Å; S415-T418 PolarHBondContact OG-N 3.31Å; S415-T418 PolarHBondContact OG-OG1 3.28Å; T418-E420 VanDerWaalsContact C-N 3.29Å; T418-E420 PolarHBondContact O-N 3.2Å
419	N	94.4	Very high	97.4	Very high	74 Å²	74	48.5 Å²	48.5	40%	0.396	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	41	-172.9	-169.5	36.4	0	0	0	112.9	A378 Y414 S415	A378-N419 WeakPolarHBondContact CB-O 3.34Å; A378-N419 WeakPolarHBondContact CB-OD1 3.4Å; A378-N419 PolarHBondContact N-OD1 3.18Å; Y414-N419 PolarHBondContact OH-OD1 3.26Å; S415-N419 WeakPolarHBondContact O-CA 3.5Å; S415-N419 PolarHBondContact O-N 3.26Å
420	E	97.3	Very high	97.3	Very high	125 Å²	125	52.1 Å²	52.1	58%	0.584	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.5	-176.3	-71.1	-177.2	154.1	0	0	112.6	Y414 S415 T418	Y414-E420 WeakPolarHBondContact CA-O 3.23Å; Y414-E420 WeakPolarHBondContact CD2-O 3.46Å; S415-E420 PolarHBondContact N-O 2.83Å; S415-E420 VanDerWaalsContact N-O 3.11Å; S415-E420 PolarHBondContact O-N 3.43Å; T418-E420 VanDerWaalsContact C-N 3.29Å; T418-E420 PolarHBondContact O-N 3.2Å
421	W	98.7	Very high	97.3	Very high	20 Å²	20	51.1 Å²	51.1	8%	0.076	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.7	173.9	-72.4	88.9	0	0	0	110.3	V352 V364 A378 M380 Q381 L396 A398 E412 A413 Y414	V352-W421 HydrophobicContact CG1-CH2 3.86Å; V352-W421 HydrophobicContact CG1-CZ2 4.35Å; V364-W421 HydrophobicContact CG2-CZ2 3.79Å; A378-W421 PolarHBondContact O-NE1 3.05Å; M380-W421 HydrophobicContact CB-CD2 4.34Å; M380-W421 HydrophobicContact CG-CD2 3.77Å; M380-W421 HydrophobicContact CG-CE3 3.8Å; M380-W421 HydrophobicContact CG-CH2 3.59Å; M380-W421 HydrophobicContact CG-CZ2 3.6Å; M380-W421 HydrophobicContact CG-CZ3 3.71Å; M380-W421 HydrophobicContact SD-CH2 4.03Å; M380-W421 HydrophobicContact SD-CZ3 4.16Å; Q381-W421 HydrophobicContact CG-CB 4.44Å; Q381-W421 PolarHBondContact NE2-O 3.03Å; L396-W421 HydrophobicContact CD2-CH2 3.49Å; L396-W421 VanDerWaalsContact CD2-CH2 3.49Å; L396-W421 HydrophobicContact CD2-CZ2 4.41Å; L396-W421 HydrophobicContact CD2-CZ3 4.08Å; A398-W421 HydrophobicContact CB-CH2 4.16Å; A398-W421 HydrophobicContact CB-CZ3 3.73Å; E412-W421 HydrophobicContact CB-CE3 3.74Å; E412-W421 HydrophobicContact CB-CZ3 4.16Å; A413-W421 WeakPolarHBondContact O-CA 3.45Å; Y414-W421 AromaticContact CD2-CD1 3.66Å; Y414-W421 HydrophobicContact CD2-CD2 4.02Å; Y414-W421 AromaticContact CD2-CE2 3.6Å; Y414-W421 HydrophobicContact CD2-CG 4.05Å; Y414-W421 HydrophobicContact CD2-CZ2 4.13Å; Y414-W421 AromaticContact CD2-NE1 3.37Å; Y414-W421 AromaticContact CE2-NE1 3.96Å; Y414-W421 HydrophobicContact CG-CD2 4.26Å; Y414-W421 AromaticContact CG-CE2 3.83Å; Y414-W421 HydrophobicContact CG-CH2 4.48Å; Y414-W421 AromaticContact CG-CZ2 3.92Å; Y414-W421 HydrophobicContact CG-CZ2 3.92Å
422	F	98.5	Very high	97.3	Very high	87 Å²	87	51.8 Å²	51.8	38%	0.382	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	150	175.5	59	-87.2	0	0	0	111.1	L395 E412 A413 V424	L395-F422 HydrophobicContact CD1-CZ 4.04Å; L395-F422 HydrophobicContact CD2-CE1 4.42Å; L395-F422 HydrophobicContact CD2-CZ 4.34Å; E412-F422 CarbonylContact C-O 3.54Å; E412-F422 WeakPolarHBondContact CA-O 3.48Å; A413-F422 HydrophobicContact CB-CD2 4.37Å; A413-F422 HydrophobicContact CB-CE1 4.19Å; A413-F422 HydrophobicContact CB-CE2 3.79Å; A413-F422 HydrophobicContact CB-CZ 3.69Å; A413-F422 PolarHBondContact N-O 3.31Å; A413-F422 WeakPolarHBondContact O-CD1 3.32Å; A413-F422 PolarHBondContact O-N 3.32Å; F422-V424 HydrophobicContact CD2-CG1 4.22Å; F422-V424 HydrophobicContact CE2-CG1 3.92Å
423	F	98.8	Very high	97.3	Very high	90 Å²	90	52.7 Å²	52.7	40%	0.395	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	142.8	176.1	-72.2	-73.9	0	0	0	111.4	Q381 E382 E412	Q381-F423 HydrophobicContact CB-CE2 4.11Å; Q381-F423 HydrophobicContact CB-CZ 4Å; Q381-F423 HydrophobicContact CG-CE2 4.33Å; E382-F423 HydrophobicContact CG-CE1 4.37Å; E382-F423 HydrophobicContact CG-CZ 4.03Å; E412-F423 HydrophobicContact CG-CD1 3.58Å; E412-F423 HydrophobicContact CG-CE1 3.47Å; E412-F423 VanDerWaalsContact CG-CE1 3.47Å; E412-F423 HydrophobicContact CG-CG 4.44Å; E412-F423 HydrophobicContact CG-CZ 4.28Å
424	V	98.7	Very high	97.3	Very high	19 Å²	19	53.1 Å²	53.1	12%	0.115	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-177.6	165.2	-60.5	0	0	0	0	109.1	Y397 V411 A413 F422	Y397-V424 HydrophobicContact CD1-CG2 4.33Å; Y397-V424 HydrophobicContact CE1-CG1 4.28Å; Y397-V424 HydrophobicContact CE1-CG2 4.25Å; V411-V424 HydrophobicContact CB-CG2 3.68Å; V411-V424 HydrophobicContact CG1-CG2 3.56Å; V411-V424 PolarHBondContact O-N 2.94Å; A413-V424 HydrophobicContact CB-CG1 3.99Å; F422-V424 HydrophobicContact CD2-CG1 4.22Å; F422-V424 HydrophobicContact CE2-CG1 3.92Å
425	A	98.7	Very high	97.3	Very high	18 Å²	18	53.1 Å²	53.1	15%	0.149	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-56.1	134.9	178.2	0	0	0	0	0	111.4	Y463 N468 W470	A425-Y463 HydrophobicContact CB-CE2 4.44Å; A425-N468 WeakPolarHBondContact CB-O 3.37Å; A425-N468 WeakPolarHBondContact CB-OD1 3.37Å; A425-N468 PolarHBondContact N-OD1 3.29Å; A425-W470 VanDerWaalsContact O-CD1 3.28Å; A425-W470 PolarHBondContact O-NE1 2.88Å
426	P	98.8	Very high	97.4	Very high	79 Å²	79	53 Å²	53	51%	0.513	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-72.5	154.9	175.8	32	-35	0	0	0	110.6	A409 W470	A409-P426 CarbonylContact O-C 3.54Å; A409-P426 WeakPolarHBondContact O-CA 3.41Å; A409-P426 WeakPolarHBondContact O-CB 3.45Å; P426-W470 VanDerWaalsContact C-CD1 3.48Å
427	M	98.7	Very high	97.6	Very high	8 Å²	8	49.5 Å²	49.5	4%	0.039	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-62.1	157	168	-65.2	176	-65.6	0	0	110.7	V399 A409 V411 T429 R431 A445 W470	V399-M427 HydrophobicContact CG1-CE 3.84Å; V399-M427 HydrophobicContact CG1-SD 3.51Å; V399-M427 VanDerWaalsContact CG1-SD 3.51Å; A409-M427 PolarHBondContact O-N 3.27Å; V411-M427 HydrophobicContact CG2-CE 4.47Å; V411-M427 HydrophobicContact CG2-CG 4.12Å; M427-T429 VanDerWaalsContact C-N 3.34Å; M427-T429 WeakPolarHBondContact CB-O 3.15Å; M427-R431 HydrophobicContact CE-CB 4.13Å; M427-R431 HydrophobicContact CE-CG 4.21Å; M427-R431 HydrophobicContact SD-CG 4.25Å; M427-A445 HydrophobicContact SD-CB 3.57Å; M427-A445 VanDerWaalsContact SD-CB 3.57Å; M427-W470 HydrophobicContact CB-CD2 4.49Å; M427-W470 HydrophobicContact CG-CD2 3.73Å; M427-W470 HydrophobicContact CG-CE3 4.01Å; M427-W470 HydrophobicContact CG-CG 4.29Å; M427-W470 HydrophobicContact CG-CH2 4.13Å; M427-W470 HydrophobicContact CG-CZ2 3.88Å; M427-W470 HydrophobicContact CG-CZ3 4.2Å; M427-W470 HydrophobicContact SD-CH2 4.43Å
428	N	98.4	Very high	98	Very high	94 Å²	94	44.5 Å²	44.5	50%	0.503	24%	0.236	S	C	.	.	S	Bend	trans	-70.2	-34.6	175.3	-60.9	-83.6	0	0	0	111.4	E461 W470 Y472	N428-E461 VanDerWaalsContact CB-OE2 3.23Å; N428-E461 WeakPolarHBondContact CB-OE2 3.23Å; N428-E461 PolarHBondContact N-OE2 3.29Å; N428-E461 PolarHBondContact ND2-OE2 3.3Å; N428-W470 PolarHBondContact ND2-O 3.43Å; N428-Y472 HydrophobicContact CB-CE2 3.72Å; N428-Y472 WeakPolarHBondContact CB-OH 3.32Å
429	T	98.2	Very high	98.1	Very high	25 Å²	25	40.7 Å²	40.7	15%	0.153	21%	0.213	C	C	.	.	S	Bend	trans	-115	141.2	176	-62.7	0	0	0	0	110.5	M427 R431 D450 L457 E461 Y472	M427-T429 VanDerWaalsContact C-N 3.34Å; M427-T429 WeakPolarHBondContact CB-O 3.15Å; T429-R431 WeakPolarHBondContact O-CG 3.47Å; T429-D450 HydrophobicContact CG2-CB 4.1Å; T429-L457 HydrophobicContact CG2-CD1 3.71Å; T429-L457 HydrophobicContact CG2-CD2 4.33Å; T429-E461 PolarHBondContact N-OE1 3.02Å; T429-Y472 PolarHBondContact OG1-OH 2.95Å
430	R	97.9	Very high	97.9	Very high	101 Å²	101	44.2 Å²	44.2	38%	0.381	23%	0.227	S	C	.	.			trans	-72.1	135.2	172.3	80.1	-167.2	94.2	-113.7	-1.1	110	G407 L408 A409 D450 A452	G407-R430 WeakPolarHBondContact O-CD 3.48Å; L408-R430 WeakPolarHBondContact O-CA 3.38Å; A409-R430 HydrophobicContact CB-CB 4.05Å; R430-D450 WeakPolarHBondContact CD-OD1 3.49Å; R430-D450 HydrophobicContact CG-CB 4.31Å; R430-D450 WeakPolarHBondContact CG-OD1 3.29Å; R430-D450 IonicContact CZ-OD1 3.52Å; R430-D450 IonicContact NE-OD1 3.73Å; R430-D450 PolarHBondContact NE-OD1 2.76Å; R430-A452 VanDerWaalsContact NE-CB 3.27Å
431	R	98.4	Very high	97.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.216	C	C	.	.			trans	-135.6	112.8	-174.9	-52.9	178.3	177.8	-95.2	-3.2	110.6	G401 L408 M427 T429 V434 G447 L457 T459 E461	G401-R431 PolarHBondContact N-O 3.48Å; L408-R431 PolarHBondContact O-N 3.23Å; M427-R431 HydrophobicContact CE-CB 4.13Å; M427-R431 HydrophobicContact CE-CG 4.21Å; M427-R431 HydrophobicContact SD-CG 4.25Å; T429-R431 WeakPolarHBondContact O-CG 3.47Å; R431-V434 HydrophobicContact CB-CB 3.71Å; R431-V434 HydrophobicContact CB-CG1 4.24Å; R431-V434 HydrophobicContact CB-CG2 3.85Å; R431-V434 HydrophobicContact CG-CG2 4.47Å; R431-G447 WeakPolarHBondContact CD-O 3.39Å; R431-G447 PolarHBondContact NH1-O 2.86Å; R431-L457 HydrophobicContact CG-CD1 3.91Å; R431-T459 PolarHBondContact NH1-O 2.83Å; R431-T459 PolarHBondContact NH1-OG1 3.04Å; R431-T459 PolarHBondContact NH2-OG1 3Å; R431-E461 IonicContact CZ-OE1 2.85Å; R431-E461 VanDerWaalsContact CZ-OE1 3.25Å; R431-E461 IonicContact NE-OE1 3.51Å; R431-E461 PolarHBondContact NE-OE1 3.3Å; R431-E461 IonicContact NH2-OE1 2.76Å; R431-E461 PolarHBondContact NH2-OE1 3.02Å
432	S	98.3	Very high	97.5	Very high	13 Å²	13	42.1 Å²	42.1	9%	0.091	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-101	155.4	163.7	63.3	0	0	0	0	110.3	V434 G448 Y449	S432-V434 PolarHBondContact O-N 2.95Å; S432-G448 CarbonylContact O-C 3.6Å; S432-G448 VanDerWaalsContact O-CA 3.23Å; S432-G448 WeakPolarHBondContact O-CA 3.4Å; S432-Y449 PolarHBondContact N-O 3.19Å; S432-Y449 PolarHBondContact O-N 2.83Å; S432-Y449 PolarHBondContact OG-O 2.83Å; S432-Y449 VanDerWaalsContact OG-O 3.07Å
433	S	98.3	Very high	97.6	Very high	19 Å²	19	38 Å²	38	13%	0.133	21%	0.208	C	C	.	.	S	Bend	trans	50.1	42.8	-172	-50.5	0	0	0	0	112.1	T386 G448 S481 G482	T386-S433 VanDerWaalsContact O-CA 3.32Å; T386-S433 WeakPolarHBondContact O-CA 3.38Å; T386-S433 PolarHBondContact O-N 2.75Å; T386-S433 PolarHBondContact OG1-N 2.88Å; S433-G448 WeakPolarHBondContact O-CA 3.34Å; S433-S481 WeakPolarHBondContact CB-OG 3.47Å; S433-G482 PolarHBondContact O-N 3.42Å
434	V	98.7	Very high	97.6	Very high	9 Å²	9	33.8 Å²	33.8	6%	0.055	19%	0.19	C	C	.	.			trans	-89	136.1	-177.8	61.2	0	0	0	0	110.1	T386 V399 R431 S432 V436 A445	T386-V434 PolarHBondContact O-N 3.1Å; V399-V434 WeakPolarHBondContact O-CG1 3.45Å; R431-V434 HydrophobicContact CB-CB 3.71Å; R431-V434 HydrophobicContact CB-CG1 4.24Å; R431-V434 HydrophobicContact CB-CG2 3.85Å; R431-V434 HydrophobicContact CG-CG2 4.47Å; S432-V434 PolarHBondContact O-N 2.95Å; V434-V436 HydrophobicContact CG2-CG2 4.39Å; V434-A445 HydrophobicContact CG2-CB 4.11Å
435	G	98.6	Very high	97.6	Very high	8 Å²	8	32.9 Å²	32.9	8%	0.082	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	146.2	169.8	0	0	0	0	0	110.5	V446	G435-V446 PolarHBondContact N-O 3.46Å; G435-V446 PolarHBondContact O-N 3.36Å
436	V	98.8	Very high	97.6	Very high	16 Å²	16	32 Å²	32	10%	0.097	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	141.8	-174.3	175.9	0	0	0	0	110.4	A390 V399 V434 L443 Y444	A390-V436 HydrophobicContact CB-CG1 3.64Å; V399-V436 HydrophobicContact CB-CG2 3.91Å; V399-V436 HydrophobicContact CG1-CG2 4.09Å; V399-V436 HydrophobicContact CG2-CG1 4.27Å; V399-V436 HydrophobicContact CG2-CG2 4.14Å; V434-V436 HydrophobicContact CG2-CG2 4.39Å; V436-L443 HydrophobicContact CG1-CD1 3.26Å; V436-L443 HydrophobicContact CG1-CG 4.09Å; V436-Y444 VanDerWaalsContact CA-O 3.22Å; V436-Y444 WeakPolarHBondContact CA-O 3.39Å; V436-Y444 WeakPolarHBondContact CG1-O 3.43Å
437	G	98.4	Very high	97.6	Very high	6 Å²	6	28.2 Å²	28.2	6%	0.062	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	160.3	174.2	0	0	0	0	0	111.7	Y444	G437-Y444 PolarHBondContact N-O 3.25Å; G437-Y444 VanDerWaalsContact N-O 3.17Å; G437-Y444 PolarHBondContact O-N 3.08Å
438	V	98.4	Very high	97.6	Very high	40 Å²	40	27.9 Å²	27.9	24%	0.242	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	122.8	-179.7	173.8	0	0	0	0	109.4	A390 L392 K442 L443	A390-V438 HydrophobicContact CB-CG2 3.8Å; L392-V438 HydrophobicContact CB-CG1 4.31Å; L392-V438 HydrophobicContact CB-CG2 4.16Å; L392-V438 HydrophobicContact CD1-CG1 3.82Å; V438-K442 CarbonylContact C-O 3.55Å; V438-K442 VanDerWaalsContact CA-O 3.29Å; V438-K442 WeakPolarHBondContact CA-O 3.45Å; V438-L443 HydrophobicContact CG2-CB 4.37Å; V438-L443 HydrophobicContact CG2-CD1 3.52Å
439	V	95.3	Very high	97.6	Very high	4 Å²	4	27 Å²	27	2%	0.024	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	128.2	-179.2	-174.7	0	0	0	0	108.2	G441 K442 Y444 V487 G490 L492 P512	V439-G441 VanDerWaalsContact C-N 3.29Å; V439-G441 PolarHBondContact O-N 2.97Å; V439-K442 PolarHBondContact N-O 3.44Å; V439-K442 PolarHBondContact O-N 3.4Å; V439-Y444 HydrophobicContact CB-CD2 4.37Å; V439-Y444 HydrophobicContact CB-CE2 3.76Å; V439-Y444 HydrophobicContact CG2-CD2 4.48Å; V439-Y444 HydrophobicContact CG2-CE2 4.3Å; V439-V487 HydrophobicContact CG2-CB 4.41Å; V439-V487 HydrophobicContact CG2-CG1 3.8Å; V439-V487 HydrophobicContact CG2-CG2 3.68Å; V439-G490 WeakPolarHBondContact CG1-O 3.26Å; V439-L492 HydrophobicContact CG2-CB 4.13Å; V439-L492 HydrophobicContact CG2-CD1 4.46Å; V439-P512 HydrophobicContact CG1-CG 3.83Å
440	E	90.8	Very high	97.5	Very high	147 Å²	147	26.8 Å²	26.8	69%	0.687	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	44.1	175.1	-64	175.4	176.2	0	0	113.7	K442	E440-K442 PolarHBondContact O-N 2.72Å
441	G	91.1	Very high	97.3	Very high	35 Å²	35	23.6 Å²	23.6	36%	0.361	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	8.2	178.2	0	0	0	0	0	115.1	L392 V439	L392-G441 WeakPolarHBondContact CD1-O 3.38Å; V439-G441 VanDerWaalsContact C-N 3.29Å; V439-G441 PolarHBondContact O-N 2.97Å
442	K	97	Very high	97	Very high	67 Å²	67	26.6 Å²	26.6	29%	0.291	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	146.4	173.3	-77.4	129.1	166.1	-104.2	0	111.1	V438 V439 E440 Y444 Q462	V438-K442 CarbonylContact C-O 3.55Å; V438-K442 VanDerWaalsContact CA-O 3.29Å; V438-K442 WeakPolarHBondContact CA-O 3.45Å; V439-K442 PolarHBondContact N-O 3.44Å; V439-K442 PolarHBondContact O-N 3.4Å; E440-K442 PolarHBondContact O-N 2.72Å; K442-Y444 HydrophobicContact CB-CE2 3.75Å; K442-Q462 HydrophobicContact CB-CG 3.79Å; K442-Q462 HydrophobicContact CD-CG 4.5Å; K442-Q462 HydrophobicContact CG-CG 3.94Å; K442-Q462 VanDerWaalsContact NZ-CD 3.35Å
443	L	98.7	Very high	96.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	134.9	177.3	174.7	76	0	0	0	109.2	A390 L392 Y397 V399 V436 V438 Q462 Y463 W470	A390-L443 HydrophobicContact CB-CD1 3.62Å; L392-L443 HydrophobicContact CD2-CB 3.93Å; Y397-L443 HydrophobicContact CD1-CD2 4.02Å; Y397-L443 HydrophobicContact CG-CD2 3.93Å; V399-L443 HydrophobicContact CG2-CD2 3.92Å; V436-L443 HydrophobicContact CG1-CD1 3.26Å; V436-L443 HydrophobicContact CG1-CG 4.09Å; V438-L443 HydrophobicContact CG2-CB 4.37Å; V438-L443 HydrophobicContact CG2-CD1 3.52Å; L443-Q462 CarbonylContact O-C 3.5Å; L443-Q462 WeakPolarHBondContact O-CA 3.38Å; L443-Y463 HydrophobicContact CB-CD1 4.21Å; L443-Y463 HydrophobicContact CD2-CD1 4.19Å; L443-Y463 PolarHBondContact N-O 2.89Å; L443-Y463 PolarHBondContact O-N 3.31Å; L443-W470 HydrophobicContact CD2-CH2 3.82Å; L443-W470 HydrophobicContact CD2-CZ2 4.07Å; L443-W470 HydrophobicContact CG-CH2 4.12Å
444	Y	98.9	Very high	96.6	Very high	1 Å²	1	37 Å²	37	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	129.8	-177.2	-63.8	-101.5	0	0	0	110.5	V436 G437 V439 K442 E461 Q462 L492 Y510 P512	V436-Y444 VanDerWaalsContact CA-O 3.22Å; V436-Y444 WeakPolarHBondContact CA-O 3.39Å; V436-Y444 WeakPolarHBondContact CG1-O 3.43Å; G437-Y444 PolarHBondContact N-O 3.25Å; G437-Y444 VanDerWaalsContact N-O 3.17Å; G437-Y444 PolarHBondContact O-N 3.08Å; V439-Y444 HydrophobicContact CB-CD2 4.37Å; V439-Y444 HydrophobicContact CB-CE2 3.76Å; V439-Y444 HydrophobicContact CG2-CD2 4.48Å; V439-Y444 HydrophobicContact CG2-CE2 4.3Å; K442-Y444 HydrophobicContact CB-CE2 3.75Å; Y444-E461 CarbonylContact C-O 3.52Å; Y444-E461 VanDerWaalsContact CA-O 3.3Å; Y444-E461 WeakPolarHBondContact CA-O 3.22Å; Y444-Q462 HydrophobicContact CD1-CB 3.99Å; Y444-Q462 HydrophobicContact CD1-CG 4.18Å; Y444-Q462 HydrophobicContact CE1-CB 3.89Å; Y444-Q462 HydrophobicContact CE1-CG 3.77Å; Y444-Q462 HydrophobicContact CE2-CG 4.47Å; Y444-Q462 PolarHBondContact OH-NE2 2.85Å; Y444-L492 HydrophobicContact CD1-CD2 4.27Å; Y444-L492 HydrophobicContact CG-CD2 3.91Å; Y444-Y510 HydrophobicContact CD1-CE1 4.3Å; Y444-Y510 HydrophobicContact CE1-CD1 4.43Å; Y444-Y510 AromaticContact CE1-CE1 3.67Å; Y444-Y510 HydrophobicContact CE1-CE1 3.67Å; Y444-P512 WeakPolarHBondContact OH-CB 3.3Å
445	A	98.9	Very high	96.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	113.4	172.1	0	0	0	0	0	109.3	V399 M427 V434 V460 E461 W470	V399-A445 HydrophobicContact CG1-CB 4.2Å; M427-A445 HydrophobicContact SD-CB 3.57Å; M427-A445 VanDerWaalsContact SD-CB 3.57Å; V434-A445 HydrophobicContact CG2-CB 4.11Å; A445-V460 WeakPolarHBondContact O-CA 3.41Å; A445-E461 PolarHBondContact N-O 2.8Å; A445-E461 PolarHBondContact O-N 3Å; A445-W470 HydrophobicContact CB-CH2 4.01Å; A445-W470 HydrophobicContact CB-CZ3 3.67Å
446	V	98.9	Very high	96.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.1	-167.2	-175	0	0	0	0	110.1	G435 V460 M476 V485 L492 A494 W517	G435-V446 PolarHBondContact N-O 3.46Å; G435-V446 PolarHBondContact O-N 3.36Å; V446-V460 HydrophobicContact CG1-CG2 4.12Å; V446-V460 HydrophobicContact CG2-CG1 4.01Å; V446-M476 HydrophobicContact CG1-CE 3.82Å; V446-M476 HydrophobicContact CG1-SD 3.48Å; V446-M476 WeakPolarHBondContact CG1-SD 3.28Å; V446-V485 HydrophobicContact CB-CG2 3.97Å; V446-V485 HydrophobicContact CG1-CG2 4.21Å; V446-V485 HydrophobicContact CG2-CG1 4.11Å; V446-V485 HydrophobicContact CG2-CG2 4.37Å; V446-L492 HydrophobicContact CG2-CD2 3.54Å; V446-L492 HydrophobicContact CG2-CG 4.32Å; V446-A494 HydrophobicContact CG1-CB 4.15Å; V446-W517 HydrophobicContact CG1-CH2 4.07Å; V446-W517 HydrophobicContact CG1-CZ2 4.36Å
447	G	98.6	Very high	96.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.22	C	C	.	.			trans	61	-137.6	174.7	0	0	0	0	0	113.4	R431 L457 T459 R480	R431-G447 WeakPolarHBondContact CD-O 3.39Å; R431-G447 PolarHBondContact NH1-O 2.86Å; G447-L457 WeakPolarHBondContact CA-O 3.43Å; G447-T459 PolarHBondContact N-O 2.86Å; G447-R480 WeakPolarHBondContact CA-O 3.33Å
448	G	98.4	Very high	96.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.			trans	99.1	-161.4	-175	0	0	0	0	0	113.1	S432 S433 C456 L457 R480	S432-G448 CarbonylContact O-C 3.6Å; S432-G448 VanDerWaalsContact O-CA 3.23Å; S432-G448 WeakPolarHBondContact O-CA 3.4Å; S433-G448 WeakPolarHBondContact O-CA 3.34Å; G448-C456 CarbonylContact O-C 3.59Å; G448-C456 WeakPolarHBondContact O-CA 3.47Å; G448-L457 PolarHBondContact O-N 3.18Å; G448-R480 PolarHBondContact N-O 3.08Å
449	Y	98.5	Very high	96.5	Very high	77 Å²	77	40.6 Å²	40.6	30%	0.302	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.1	-178.9	177.5	-97.6	0	0	0	110.7	S432 R454 Q455	S432-Y449 PolarHBondContact N-O 3.19Å; S432-Y449 PolarHBondContact O-N 2.83Å; S432-Y449 PolarHBondContact OG-O 2.83Å; S432-Y449 VanDerWaalsContact OG-O 3.07Å; Y449-R454 WeakPolarHBondContact OH-CA 3.34Å; Y449-Q455 WeakPolarHBondContact CD2-O 3.14Å
450	D	97.6	Very high	96.7	Very high	19 Å²	19	40.4 Å²	40.4	10%	0.102	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	111.2	172.5	170.1	24.1	0	0	0	109.9	T429 R430 A452 S453 R454 Q455 L457	T429-D450 HydrophobicContact CG2-CB 4.1Å; R430-D450 WeakPolarHBondContact CD-OD1 3.49Å; R430-D450 HydrophobicContact CG-CB 4.31Å; R430-D450 WeakPolarHBondContact CG-OD1 3.29Å; R430-D450 IonicContact CZ-OD1 3.52Å; R430-D450 IonicContact NE-OD1 3.73Å; R430-D450 PolarHBondContact NE-OD1 2.76Å; D450-A452 VanDerWaalsContact C-N 3.25Å; D450-A452 PolarHBondContact O-N 3.12Å; D450-A452 WeakPolarHBondContact OD1-CB 3.49Å; D450-A452 PolarHBondContact OD1-N 2.87Å; D450-S453 VanDerWaalsContact CG-OG 3.29Å; D450-S453 VanDerWaalsContact OD2-CB 3.26Å; D450-S453 WeakPolarHBondContact OD2-CB 3.44Å; D450-S453 PolarHBondContact OD2-N 3.32Å; D450-S453 VanDerWaalsContact OD2-N 3.12Å; D450-S453 PolarHBondContact OD2-OG 2.8Å; D450-R454 VanDerWaalsContact O-CA 3.26Å; D450-R454 WeakPolarHBondContact O-CA 3.4Å; D450-R454 PolarHBondContact O-N 2.79Å; D450-Q455 PolarHBondContact N-O 2.8Å; D450-Q455 PolarHBondContact O-N 3.39Å; D450-L457 HydrophobicContact CB-CD1 4.19Å; D450-L457 HydrophobicContact CB-CD2 4.05Å; D450-L457 HydrophobicContact CB-CG 4.37Å
451	G	92.3	Very high	97	Very high	34 Å²	34	33.4 Å²	33.4	35%	0.351	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-18	179.1	0	0	0	0	0	115
452	A	92.4	Very high	97.4	Very high	64 Å²	64	32.8 Å²	32.8	53%	0.529	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-49	177.7	0	0	0	0	0	112	R430 D450 R454	R430-A452 VanDerWaalsContact NE-CB 3.27Å; D450-A452 VanDerWaalsContact C-N 3.25Å; D450-A452 PolarHBondContact O-N 3.12Å; D450-A452 WeakPolarHBondContact OD1-CB 3.49Å; D450-A452 PolarHBondContact OD1-N 2.87Å; A452-R454 VanDerWaalsContact C-N 3.29Å
453	S	94.3	Very high	97.5	Very high	60 Å²	60	29.9 Å²	29.9	42%	0.42	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-14.5	172.5	60.4	0	0	0	0	113.3	D450 Q455	D450-S453 VanDerWaalsContact CG-OG 3.29Å; D450-S453 VanDerWaalsContact OD2-CB 3.26Å; D450-S453 WeakPolarHBondContact OD2-CB 3.44Å; D450-S453 PolarHBondContact OD2-N 3.32Å; D450-S453 VanDerWaalsContact OD2-N 3.12Å; D450-S453 PolarHBondContact OD2-OG 2.8Å; S453-Q455 VanDerWaalsContact C-N 3.34Å
454	R	94.6	Very high	97.5	Very high	191 Å²	191	32.2 Å²	32.2	72%	0.721	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	42.1	-174.4	-56.5	-178.2	177.4	-174.3	-0.5	112.6	Y449 D450 A452	Y449-R454 WeakPolarHBondContact OH-CA 3.34Å; D450-R454 VanDerWaalsContact O-CA 3.26Å; D450-R454 WeakPolarHBondContact O-CA 3.4Å; D450-R454 PolarHBondContact O-N 2.79Å; A452-R454 VanDerWaalsContact C-N 3.29Å
455	Q	96.4	Very high	97.3	Very high	89 Å²	89	33.8 Å²	33.8	42%	0.416	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	143.6	-175.2	-67.5	-66.6	-33.4	0	0	111.9	Y449 D450 S453	Y449-Q455 WeakPolarHBondContact CD2-O 3.14Å; D450-Q455 PolarHBondContact N-O 2.8Å; D450-Q455 PolarHBondContact O-N 3.39Å; S453-Q455 VanDerWaalsContact C-N 3.34Å
456	C	98	Very high	97.1	Very high	6 Å²	6	38.1 Å²	38.1	4%	0.041	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	146.1	160.4	-64	0	0	0	0	109.1	G448 R479	G448-C456 CarbonylContact O-C 3.59Å; G448-C456 WeakPolarHBondContact O-CA 3.47Å; C456-R479 HydrophobicContact CB-CB 4Å; C456-R479 VanDerWaalsContact O-CD 3.22Å; C456-R479 WeakPolarHBondContact O-CD 3.49Å; C456-R479 WeakPolarHBondContact O-CG 3.2Å; C456-R479 PolarHBondContact O-NH1 2.91Å
457	L	98.5	Very high	97	Very high	13 Å²	13	41.7 Å²	41.7	7%	0.068	24%	0.241	C	C	.	.			trans	-105.1	139.5	-172.2	-59.1	173	0	0	0	111.2	T429 R431 G447 G448 D450 R480	T429-L457 HydrophobicContact CG2-CD1 3.71Å; T429-L457 HydrophobicContact CG2-CD2 4.33Å; R431-L457 HydrophobicContact CG-CD1 3.91Å; G447-L457 WeakPolarHBondContact CA-O 3.43Å; G448-L457 PolarHBondContact O-N 3.18Å; D450-L457 HydrophobicContact CB-CD1 4.19Å; D450-L457 HydrophobicContact CB-CD2 4.05Å; D450-L457 HydrophobicContact CB-CG 4.37Å; L457-R480 PolarHBondContact O-N 3.48Å
458	S	98.4	Very high	97	Very high	16 Å²	16	45.1 Å²	45.1	11%	0.112	26%	0.26	C	S	.	.			trans	-95.9	-18.4	162.4	50.8	0	0	0	0	112	D475 M476	S458-D475 PolarHBondContact OG-OD2 3.02Å; S458-M476 WeakPolarHBondContact O-CE 3.26Å; S458-M476 PolarHBondContact O-N 3.08Å
459	T	98.8	Very high	97	Very high	30 Å²	30	50.6 Å²	50.6	18%	0.184	29%	0.285	C	S	.	.			trans	-68.5	149.7	-174.6	61.5	0	0	0	0	111.4	R431 G447 D475	R431-T459 PolarHBondContact NH1-O 2.83Å; R431-T459 PolarHBondContact NH1-OG1 3.04Å; R431-T459 PolarHBondContact NH2-OG1 3Å; G447-T459 PolarHBondContact N-O 2.86Å; T459-D475 WeakPolarHBondContact CA-OD1 3.41Å; T459-D475 WeakPolarHBondContact CG2-OD2 3.47Å
460	V	98.9	Very high	97	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.6	179.9	-175.4	0	0	0	0	108.5	A445 V446 V473 M476 W517	A445-V460 WeakPolarHBondContact O-CA 3.41Å; V446-V460 HydrophobicContact CG1-CG2 4.12Å; V446-V460 HydrophobicContact CG2-CG1 4.01Å; V460-V473 HydrophobicContact CB-CG2 3.66Å; V460-V473 HydrophobicContact CG1-CG2 3.56Å; V460-V473 PolarHBondContact O-N 3.07Å; V460-M476 HydrophobicContact CG2-CE 4.42Å; V460-M476 HydrophobicContact CG2-CG 4.09Å; V460-W517 HydrophobicContact CG1-CZ2 4.49Å; V460-W517 HydrophobicContact CG2-CZ2 3.79Å
461	E	98.8	Very high	97.1	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.7	178.3	-65.7	175.5	-112.4	0	0	110.2	N428 T429 R431 Y444 A445 W470 T471 Y472	N428-E461 VanDerWaalsContact CB-OE2 3.23Å; N428-E461 WeakPolarHBondContact CB-OE2 3.23Å; N428-E461 PolarHBondContact N-OE2 3.29Å; N428-E461 PolarHBondContact ND2-OE2 3.3Å; T429-E461 PolarHBondContact N-OE1 3.02Å; R431-E461 IonicContact CZ-OE1 2.85Å; R431-E461 VanDerWaalsContact CZ-OE1 3.25Å; R431-E461 IonicContact NE-OE1 3.51Å; R431-E461 PolarHBondContact NE-OE1 3.3Å; R431-E461 IonicContact NH2-OE1 2.76Å; R431-E461 PolarHBondContact NH2-OE1 3.02Å; Y444-E461 CarbonylContact C-O 3.52Å; Y444-E461 VanDerWaalsContact CA-O 3.3Å; Y444-E461 WeakPolarHBondContact CA-O 3.22Å; A445-E461 PolarHBondContact N-O 2.8Å; A445-E461 PolarHBondContact O-N 3Å; E461-W470 HydrophobicContact CB-CE3 3.66Å; E461-W470 HydrophobicContact CB-CZ3 4.22Å; E461-T471 CarbonylContact C-O 3.56Å; E461-T471 VanDerWaalsContact CA-O 3.27Å; E461-T471 WeakPolarHBondContact CA-O 3.44Å; E461-Y472 HydrophobicContact CG-CD1 3.57Å; E461-Y472 HydrophobicContact CG-CE1 3.56Å; E461-Y472 HydrophobicContact CG-CG 4.36Å
462	Q	98.8	Very high	97.4	Very high	22 Å²	22	54 Å²	54	10%	0.103	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.5	175.9	-179.4	-170.7	74.9	0	0	109.1	K442 L443 Y444 W470 T471 V473	K442-Q462 HydrophobicContact CB-CG 3.79Å; K442-Q462 HydrophobicContact CD-CG 4.5Å; K442-Q462 HydrophobicContact CG-CG 3.94Å; K442-Q462 VanDerWaalsContact NZ-CD 3.35Å; L443-Q462 CarbonylContact O-C 3.5Å; L443-Q462 WeakPolarHBondContact O-CA 3.38Å; Y444-Q462 HydrophobicContact CD1-CB 3.99Å; Y444-Q462 HydrophobicContact CD1-CG 4.18Å; Y444-Q462 HydrophobicContact CE1-CB 3.89Å; Y444-Q462 HydrophobicContact CE1-CG 3.77Å; Y444-Q462 HydrophobicContact CE2-CG 4.47Å; Y444-Q462 PolarHBondContact OH-NE2 2.85Å; Q462-W470 CarbonylContact O-C 3.55Å; Q462-W470 VanDerWaalsContact O-CA 3.32Å; Q462-W470 WeakPolarHBondContact O-CA 3.03Å; Q462-T471 PolarHBondContact N-O 2.82Å; Q462-T471 PolarHBondContact O-N 3.17Å; Q462-V473 HydrophobicContact CB-CG1 3.7Å
463	Y	98.9	Very high	97.7	Very high	6 Å²	6	51.8 Å²	51.8	2%	0.024	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.2	172	176.5	-109.9	0	0	0	110.9	Y397 A425 L443 P465 N468 E469 W470	Y397-Y463 HydrophobicContact CE1-CD1 4.37Å; Y397-Y463 AromaticContact CE1-CE1 3.68Å; Y397-Y463 HydrophobicContact CE1-CE1 3.68Å; A425-Y463 HydrophobicContact CB-CE2 4.44Å; L443-Y463 HydrophobicContact CB-CD1 4.21Å; L443-Y463 HydrophobicContact CD2-CD1 4.19Å; L443-Y463 PolarHBondContact N-O 2.89Å; L443-Y463 PolarHBondContact O-N 3.31Å; Y463-P465 HydrophobicContact CE1-CB 3.9Å; Y463-N468 PolarHBondContact OH-OD1 2.82Å; Y463-E469 WeakPolarHBondContact CA-O 3.14Å; Y463-E469 WeakPolarHBondContact CD2-O 3.34Å; Y463-W470 AromaticContact CD2-CD1 3.7Å; Y463-W470 HydrophobicContact CD2-CD2 4.1Å; Y463-W470 AromaticContact CD2-CE2 3.7Å; Y463-W470 HydrophobicContact CD2-CG 4.11Å; Y463-W470 HydrophobicContact CD2-CZ2 4.24Å; Y463-W470 AromaticContact CD2-NE1 3.43Å; Y463-W470 HydrophobicContact CG-CD2 4.26Å; Y463-W470 AromaticContact CG-CE2 3.85Å; Y463-W470 HydrophobicContact CG-CH2 4.48Å; Y463-W470 AromaticContact CG-CZ2 3.97Å; Y463-W470 HydrophobicContact CG-CZ2 3.97Å
464	N	97.6	Very high	97.9	Very high	48 Å²	48	50.2 Å²	50.2	26%	0.257	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.3	171.1	-177.5	-6.4	0	0	0	109.6	A466 T467 N468 E469	N464-A466 PolarHBondContact O-N 2.87Å; N464-A466 WeakPolarHBondContact OD1-CB 3.37Å; N464-A466 PolarHBondContact OD1-N 3.19Å; N464-T467 WeakPolarHBondContact CB-OG1 3.32Å; N464-T467 PolarHBondContact O-N 2.96Å; N464-N468 WeakPolarHBondContact O-CA 3.04Å; N464-N468 PolarHBondContact O-N 3.27Å; N464-E469 PolarHBondContact N-O 3.11Å
465	P	95.4	Very high	98.1	Very high	35 Å²	35	44.9 Å²	44.9	23%	0.227	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-21.3	-179.6	29.2	-37.1	0	0	0	113.3	L392 Y463	L392-P465 HydrophobicContact CD2-CB 4.37Å; L392-P465 HydrophobicContact CD2-CG 3.89Å; L392-P465 HydrophobicContact CG-CG 4.47Å; Y463-P465 HydrophobicContact CE1-CB 3.9Å
466	A	95.3	Very high	98.2	Very high	91 Å²	91	40.9 Å²	40.9	75%	0.752	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-32.9	179.4	0	0	0	0	0	112.8	N464	N464-A466 PolarHBondContact O-N 2.87Å; N464-A466 WeakPolarHBondContact OD1-CB 3.37Å; N464-A466 PolarHBondContact OD1-N 3.19Å
467	T	97.2	Very high	98.1	Very high	74 Å²	74	44.7 Å²	44.7	45%	0.454	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-14	176.7	60.1	0	0	0	0	112.4	N464 E469	N464-T467 WeakPolarHBondContact CB-OG1 3.32Å; N464-T467 PolarHBondContact O-N 2.96Å; T467-E469 VanDerWaalsContact C-N 3.33Å
468	N	97.9	Very high	98	Very high	73 Å²	73	45.9 Å²	45.9	39%	0.39	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	50.3	-172	-174.7	35.4	0	0	0	111.2	A425 Y463 N464	A425-N468 WeakPolarHBondContact CB-O 3.37Å; A425-N468 WeakPolarHBondContact CB-OD1 3.37Å; A425-N468 PolarHBondContact N-OD1 3.29Å; Y463-N468 PolarHBondContact OH-OD1 2.82Å; N464-N468 WeakPolarHBondContact O-CA 3.04Å; N464-N468 PolarHBondContact O-N 3.27Å
469	E	98.5	Very high	98	Very high	115 Å²	115	49.7 Å²	49.7	54%	0.537	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.5	-177.6	-71.2	176.9	166.6	0	0	111.7	Y463 N464 T467	Y463-E469 WeakPolarHBondContact CA-O 3.14Å; Y463-E469 WeakPolarHBondContact CD2-O 3.34Å; N464-E469 PolarHBondContact N-O 3.11Å; T467-E469 VanDerWaalsContact C-N 3.33Å
470	W	98.8	Very high	98	Very high	15 Å²	15	48.3 Å²	48.3	6%	0.057	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.1	172.4	-71.5	88.8	0	0	0	110.7	V399 V411 A425 P426 M427 N428 L443 A445 E461 Q462 Y463	V399-W470 HydrophobicContact CG1-CH2 4.09Å; V399-W470 HydrophobicContact CG1-CZ2 4.33Å; V411-W470 HydrophobicContact CG1-CZ2 4.43Å; V411-W470 HydrophobicContact CG2-CZ2 3.86Å; A425-W470 VanDerWaalsContact O-CD1 3.28Å; A425-W470 PolarHBondContact O-NE1 2.88Å; P426-W470 VanDerWaalsContact C-CD1 3.48Å; M427-W470 HydrophobicContact CB-CD2 4.49Å; M427-W470 HydrophobicContact CG-CD2 3.73Å; M427-W470 HydrophobicContact CG-CE3 4.01Å; M427-W470 HydrophobicContact CG-CG 4.29Å; M427-W470 HydrophobicContact CG-CH2 4.13Å; M427-W470 HydrophobicContact CG-CZ2 3.88Å; M427-W470 HydrophobicContact CG-CZ3 4.2Å; M427-W470 HydrophobicContact SD-CH2 4.43Å; N428-W470 PolarHBondContact ND2-O 3.43Å; L443-W470 HydrophobicContact CD2-CH2 3.82Å; L443-W470 HydrophobicContact CD2-CZ2 4.07Å; L443-W470 HydrophobicContact CG-CH2 4.12Å; A445-W470 HydrophobicContact CB-CH2 4.01Å; A445-W470 HydrophobicContact CB-CZ3 3.67Å; E461-W470 HydrophobicContact CB-CE3 3.66Å; E461-W470 HydrophobicContact CB-CZ3 4.22Å; Q462-W470 CarbonylContact O-C 3.55Å; Q462-W470 VanDerWaalsContact O-CA 3.32Å; Q462-W470 WeakPolarHBondContact O-CA 3.03Å; Y463-W470 AromaticContact CD2-CD1 3.7Å; Y463-W470 HydrophobicContact CD2-CD2 4.1Å; Y463-W470 AromaticContact CD2-CE2 3.7Å; Y463-W470 HydrophobicContact CD2-CG 4.11Å; Y463-W470 HydrophobicContact CD2-CZ2 4.24Å; Y463-W470 AromaticContact CD2-NE1 3.43Å; Y463-W470 HydrophobicContact CG-CD2 4.26Å; Y463-W470 AromaticContact CG-CE2 3.85Å; Y463-W470 HydrophobicContact CG-CH2 4.48Å; Y463-W470 AromaticContact CG-CZ2 3.97Å; Y463-W470 HydrophobicContact CG-CZ2 3.97Å
471	T	98.6	Very high	97.9	Very high	69 Å²	69	48.4 Å²	48.4	42%	0.423	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.9	175.9	56.8	0	0	0	0	111.1	E461 Q462	E461-T471 CarbonylContact C-O 3.56Å; E461-T471 VanDerWaalsContact CA-O 3.27Å; E461-T471 WeakPolarHBondContact CA-O 3.44Å; Q462-T471 PolarHBondContact N-O 2.82Å; Q462-T471 PolarHBondContact O-N 3.17Å
472	Y	98.8	Very high	97.9	Very high	116 Å²	116	48.7 Å²	48.7	46%	0.455	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	138.8	172.8	-68.4	-75.9	0	0	0	110.7	N428 T429 E461	N428-Y472 HydrophobicContact CB-CE2 3.72Å; N428-Y472 WeakPolarHBondContact CB-OH 3.32Å; T429-Y472 PolarHBondContact OG1-OH 2.95Å; E461-Y472 HydrophobicContact CG-CD1 3.57Å; E461-Y472 HydrophobicContact CG-CE1 3.56Å; E461-Y472 HydrophobicContact CG-CG 4.36Å
473	V	98.7	Very high	97.9	Very high	19 Å²	19	48.1 Å²	48.1	12%	0.115	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-174.9	169.7	-61.6	0	0	0	0	109.4	V460 Q462 D475 Y510 N515	V460-V473 HydrophobicContact CB-CG2 3.66Å; V460-V473 HydrophobicContact CG1-CG2 3.56Å; V460-V473 PolarHBondContact O-N 3.07Å; Q462-V473 HydrophobicContact CB-CG1 3.7Å; V473-D475 PolarHBondContact O-N 2.93Å; V473-Y510 HydrophobicContact CG2-CE2 4.48Å; V473-N515 WeakPolarHBondContact CB-OD1 3.37Å
474	A	98.6	Very high	97.9	Very high	26 Å²	26	48 Å²	48	22%	0.215	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-55.3	135.4	-179.9	0	0	0	0	0	112.1	Y510 N515 W517	A474-Y510 HydrophobicContact CB-CE2 4.28Å; A474-N515 WeakPolarHBondContact CB-O 3.38Å; A474-N515 WeakPolarHBondContact CB-OD1 3.45Å; A474-N515 PolarHBondContact N-OD1 2.95Å; A474-W517 PolarHBondContact O-NE1 3.23Å
475	D	98.7	Very high	97.9	Very high	79 Å²	79	46.5 Å²	46.5	42%	0.422	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-69.2	146.1	174.5	-83.8	27.1	0	0	0	111	S458 T459 V473	S458-D475 PolarHBondContact OG-OD2 3.02Å; T459-D475 WeakPolarHBondContact CA-OD1 3.41Å; T459-D475 WeakPolarHBondContact CG2-OD2 3.47Å; V473-D475 PolarHBondContact O-N 2.93Å
476	M	98.6	Very high	98.1	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.03	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-63.5	155.7	166.1	-64.9	177.8	-68	0	0	110.3	V446 S458 V460 T478 R480 A494 W517	V446-M476 HydrophobicContact CG1-CE 3.82Å; V446-M476 HydrophobicContact CG1-SD 3.48Å; V446-M476 WeakPolarHBondContact CG1-SD 3.28Å; S458-M476 WeakPolarHBondContact O-CE 3.26Å; S458-M476 PolarHBondContact O-N 3.08Å; V460-M476 HydrophobicContact CG2-CE 4.42Å; V460-M476 HydrophobicContact CG2-CG 4.09Å; M476-T478 PolarHBondContact O-N 3.31Å; M476-R480 HydrophobicContact CE-CB 4.19Å; M476-R480 HydrophobicContact CE-CG 4.38Å; M476-R480 HydrophobicContact SD-CG 4.43Å; M476-A494 HydrophobicContact SD-CB 3.76Å; M476-W517 HydrophobicContact CG-CD2 3.83Å; M476-W517 HydrophobicContact CG-CE3 4.11Å; M476-W517 HydrophobicContact CG-CG 4.49Å; M476-W517 HydrophobicContact CG-CH2 3.98Å; M476-W517 HydrophobicContact CG-CZ2 3.7Å; M476-W517 HydrophobicContact CG-CZ3 4.17Å; M476-W517 HydrophobicContact SD-CH2 4.25Å; M476-W517 HydrophobicContact SD-CZ2 4.42Å
477	S	97.4	Very high	98.2	Very high	86 Å²	86	43 Å²	43	60%	0.601	24%	0.236	S	C	*	.	S	Bend	trans	-66.8	-22.1	177.8	67.7	0	0	0	0	113.1	E508	S477-E508 WeakPolarHBondContact CB-OE2 3.38Å; S477-E508 PolarHBondContact N-OE2 2.97Å; S477-E508 PolarHBondContact OG-OE1 2.74Å; S477-E508 PolarHBondContact OG-OE2 3.25Å
478	T	95.4	Very high	98.1	Very high	37 Å²	37	40 Å²	40	23%	0.227	22%	0.216	C	C	.	.	S	Bend	trans	-136.8	153.3	-179.9	61.2	0	0	0	0	112.4	M476 R480 E508	M476-T478 PolarHBondContact O-N 3.31Å; T478-R480 PolarHBondContact OG1-NE 3.26Å; T478-R480 PolarHBondContact OG1-NH2 3.39Å; T478-E508 PolarHBondContact OG1-OE1 3.11Å
479	R	98.3	Very high	97.6	Very high	96 Å²	96	41 Å²	41	36%	0.362	23%	0.229	S	C	.	.			trans	-70.6	135.1	174	-65.2	171	-174.7	-80.2	-5.3	110.3	C456 D499 R504	C456-R479 HydrophobicContact CB-CB 4Å; C456-R479 VanDerWaalsContact O-CD 3.22Å; C456-R479 WeakPolarHBondContact O-CD 3.49Å; C456-R479 WeakPolarHBondContact O-CG 3.2Å; C456-R479 PolarHBondContact O-NH1 2.91Å; R479-D499 HydrophobicContact CB-CB 4.36Å; R479-R504 PolarHBondContact O-NE 2.82Å
480	R	98.2	Very high	97.2	Very high	1 Å²	1	37.2 Å²	37.2	0%	0.004	22%	0.221	C	C	.	.			trans	-141.9	111.5	-179	-54.4	177.5	-179.6	-95.2	1	110.9	G447 G448 L457 M476 T478 A483 G496 S506 E508	G447-R480 WeakPolarHBondContact CA-O 3.33Å; G448-R480 PolarHBondContact N-O 3.08Å; L457-R480 PolarHBondContact O-N 3.48Å; M476-R480 HydrophobicContact CE-CB 4.19Å; M476-R480 HydrophobicContact CE-CG 4.38Å; M476-R480 HydrophobicContact SD-CG 4.43Å; T478-R480 PolarHBondContact OG1-NE 3.26Å; T478-R480 PolarHBondContact OG1-NH2 3.39Å; R480-A483 HydrophobicContact CB-CB 4Å; R480-G496 PolarHBondContact NH1-O 2.53Å; R480-S506 PolarHBondContact NH1-O 2.73Å; R480-S506 PolarHBondContact NH1-OG 3.27Å; R480-S506 PolarHBondContact NH2-OG 2.74Å; R480-E508 IonicContact CZ-OE1 2.76Å; R480-E508 IonicContact NE-OE1 2.72Å; R480-E508 PolarHBondContact NE-OE1 2.95Å; R480-E508 IonicContact NH2-OE1 2.72Å; R480-E508 PolarHBondContact NH2-OE1 3.47Å
481	S	98.5	Very high	97	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.021	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-100.6	144	162.4	-170.8	0	0	0	0	109.9	S433 A483 G497 H498	S433-S481 WeakPolarHBondContact CB-OG 3.47Å; S481-A483 PolarHBondContact O-N 3.16Å; S481-G497 CarbonylContact O-C 3.56Å; S481-G497 VanDerWaalsContact O-CA 3.23Å; S481-G497 WeakPolarHBondContact O-CA 3.47Å; S481-H498 PolarHBondContact N-O 2.86Å; S481-H498 PolarHBondContact O-CD2 2.6Å; S481-H498 PolarHBondContact O-N 2.84Å
482	G	98.1	Very high	97	Very high	5 Å²	5	36.2 Å²	36.2	5%	0.052	21%	0.212	C	C	.	.	S	Bend	trans	62.1	30.8	-177.1	0	0	0	0	0	113.2	S433 N529	S433-G482 PolarHBondContact O-N 3.42Å; G482-N529 PolarHBondContact O-N 3.42Å
483	A	98.4	Very high	97	Very high	10 Å²	10	30.9 Å²	30.9	8%	0.083	19%	0.191	C	C	.	.			trans	-67.3	140.4	172.8	0	0	0	0	0	110.1	R480 S481 V485	R480-A483 HydrophobicContact CB-CB 4Å; S481-A483 PolarHBondContact O-N 3.16Å; A483-V485 HydrophobicContact CB-CG2 4.3Å; A483-V485 PolarHBondContact O-N 3.19Å
484	G	98.4	Very high	97	Very high	4 Å²	4	30 Å²	30	4%	0.041	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	118.6	166.4	0	0	0	0	0	109	T495	G484-T495 WeakPolarHBondContact CA-OG1 3.45Å; G484-T495 PolarHBondContact N-O 3.34Å; G484-T495 PolarHBondContact O-N 3.32Å; G484-T495 PolarHBondContact O-OG1 3.23Å
485	V	98.7	Very high	97	Very high	17 Å²	17	28.9 Å²	28.9	10%	0.103	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.5	-177.2	176.3	0	0	0	0	109.9	V446 A483 L492 Y493	V446-V485 HydrophobicContact CB-CG2 3.97Å; V446-V485 HydrophobicContact CG1-CG2 4.21Å; V446-V485 HydrophobicContact CG2-CG1 4.11Å; V446-V485 HydrophobicContact CG2-CG2 4.37Å; A483-V485 HydrophobicContact CB-CG2 4.3Å; A483-V485 PolarHBondContact O-N 3.19Å; V485-L492 HydrophobicContact CG1-CD1 3.57Å; V485-L492 HydrophobicContact CG1-CG 4.25Å; V485-Y493 VanDerWaalsContact CA-O 3.3Å; V485-Y493 WeakPolarHBondContact CA-O 3.48Å
486	G	98	Very high	97	Very high	8 Å²	8	25.1 Å²	25.1	8%	0.082	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	165.4	178.2	0	0	0	0	0	111.7	Y493	G486-Y493 PolarHBondContact N-O 3.2Å; G486-Y493 PolarHBondContact O-N 3.46Å
487	V	97.6	Very high	96.9	Very high	45 Å²	45	24.8 Å²	24.8	27%	0.273	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.8	-177	176.2	0	0	0	0	108.9	V439 Q491 L492 A534	V439-V487 HydrophobicContact CG2-CB 4.41Å; V439-V487 HydrophobicContact CG2-CG1 3.8Å; V439-V487 HydrophobicContact CG2-CG2 3.68Å; V487-Q491 WeakPolarHBondContact CA-O 3.43Å; V487-L492 HydrophobicContact CG2-CD1 3.71Å; V487-A534 WeakPolarHBondContact O-CB 3.5Å
488	L	95.1	Very high	97	Very high	9 Å²	9	22.2 Å²	22.2	5%	0.047	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	126.1	177.4	177.8	66.3	0	0	0	109.4	G490 Q491 Y493 A534 G537 L539 P559	L488-G490 VanDerWaalsContact C-N 3.32Å; L488-G490 PolarHBondContact O-N 2.99Å; L488-Q491 PolarHBondContact N-O 3.41Å; L488-Q491 PolarHBondContact O-N 3.34Å; L488-Q491 VanDerWaalsContact O-N 3.07Å; L488-Y493 HydrophobicContact CB-CD2 4.1Å; L488-Y493 HydrophobicContact CB-CE2 3.7Å; L488-A534 HydrophobicContact CD1-CB 4.29Å; L488-G537 VanDerWaalsContact CD1-C 3.48Å; L488-L539 HydrophobicContact CD2-CB 4.03Å; L488-P559 HydrophobicContact CD2-CB 4.29Å; L488-P559 HydrophobicContact CD2-CG 3.69Å
489	S	88.4	Confident	97.1	Very high	95 Å²	95	23 Å²	23	66%	0.664	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	46	178	-55.8	0	0	0	0	113.7	Q491	S489-Q491 PolarHBondContact O-N 3.18Å
490	G	89.8	Confident	96.9	Very high	35 Å²	35	20.3 Å²	20.3	36%	0.361	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	9.8	178.4	0	0	0	0	0	114.9	V439 L488	V439-G490 WeakPolarHBondContact CG1-O 3.26Å; L488-G490 VanDerWaalsContact C-N 3.32Å; L488-G490 PolarHBondContact O-N 2.99Å
491	Q	94.1	Very high	96.6	Very high	63 Å²	63	26.2 Å²	26.2	29%	0.294	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.7	178.3	-68.2	176.9	84.7	0	0	111.2	V487 L488 S489 Y493 V509	V487-Q491 WeakPolarHBondContact CA-O 3.43Å; L488-Q491 PolarHBondContact N-O 3.41Å; L488-Q491 PolarHBondContact O-N 3.34Å; L488-Q491 VanDerWaalsContact O-N 3.07Å; S489-Q491 PolarHBondContact O-N 3.18Å; Q491-Y493 HydrophobicContact CB-CE2 3.93Å; Q491-V509 HydrophobicContact CB-CG2 3.59Å; Q491-V509 HydrophobicContact CG-CG2 4.29Å
492	L	98.3	Very high	96.5	Very high	0 Å²	0	31 Å²	31	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.4	-177.4	-176.8	72.1	0	0	0	110	V439 Y444 V446 V485 V487 V509 Y510 W517	V439-L492 HydrophobicContact CG2-CB 4.13Å; V439-L492 HydrophobicContact CG2-CD1 4.46Å; Y444-L492 HydrophobicContact CD1-CD2 4.27Å; Y444-L492 HydrophobicContact CG-CD2 3.91Å; V446-L492 HydrophobicContact CG2-CD2 3.54Å; V446-L492 HydrophobicContact CG2-CG 4.32Å; V485-L492 HydrophobicContact CG1-CD1 3.57Å; V485-L492 HydrophobicContact CG1-CG 4.25Å; V487-L492 HydrophobicContact CG2-CD1 3.71Å; L492-V509 CarbonylContact O-C 3.53Å; L492-V509 WeakPolarHBondContact O-CA 3.42Å; L492-Y510 HydrophobicContact CB-CD1 4.32Å; L492-Y510 HydrophobicContact CD2-CD1 4.42Å; L492-Y510 PolarHBondContact N-O 2.76Å; L492-Y510 VanDerWaalsContact N-O 3.1Å; L492-Y510 PolarHBondContact O-N 3.08Å; L492-W517 HydrophobicContact CD2-CH2 4.39Å
493	Y	98.8	Very high	96.6	Very high	5 Å²	5	31.4 Å²	31.4	2%	0.02	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.9	-178.1	-70.2	-103.1	0	0	0	110.3	V485 G486 L488 Q491 V507 E508 V509 L539 Y557	V485-Y493 VanDerWaalsContact CA-O 3.3Å; V485-Y493 WeakPolarHBondContact CA-O 3.48Å; G486-Y493 PolarHBondContact N-O 3.2Å; G486-Y493 PolarHBondContact O-N 3.46Å; L488-Y493 HydrophobicContact CB-CD2 4.1Å; L488-Y493 HydrophobicContact CB-CE2 3.7Å; Q491-Y493 HydrophobicContact CB-CE2 3.93Å; Y493-V507 HydrophobicContact CD1-CG1 4.38Å; Y493-E508 WeakPolarHBondContact CA-O 3.06Å; Y493-V509 HydrophobicContact CD1-CB 3.93Å; Y493-V509 HydrophobicContact CD1-CG2 3.99Å; Y493-V509 HydrophobicContact CD2-CG2 4.01Å; Y493-V509 HydrophobicContact CE1-CB 3.78Å; Y493-V509 HydrophobicContact CE1-CG2 3.67Å; Y493-V509 HydrophobicContact CE2-CG2 3.66Å; Y493-V509 HydrophobicContact CG-CB 4.43Å; Y493-V509 HydrophobicContact CG-CG2 4.15Å; Y493-L539 HydrophobicContact CD1-CD2 4.06Å; Y493-L539 HydrophobicContact CD2-CD2 4.34Å; Y493-L539 HydrophobicContact CG-CD2 3.74Å; Y493-Y557 HydrophobicContact CD1-CE1 4.42Å; Y493-Y557 AromaticContact CE1-CD1 3.98Å; Y493-Y557 HydrophobicContact CE1-CD1 3.98Å; Y493-Y557 AromaticContact CE1-CE1 3.53Å; Y493-Y557 HydrophobicContact CE1-CE1 3.53Å
494	A	98.8	Very high	96.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	105.1	171.5	0	0	0	0	0	109.3	V446 M476 V507 E508 W517	V446-A494 HydrophobicContact CG1-CB 4.15Å; M476-A494 HydrophobicContact SD-CB 3.76Å; A494-V507 WeakPolarHBondContact O-CA 3.41Å; A494-E508 PolarHBondContact N-O 2.79Å; A494-E508 PolarHBondContact O-N 2.84Å; A494-E508 VanDerWaalsContact O-N 3.08Å; A494-W517 HydrophobicContact CB-CH2 3.96Å; A494-W517 HydrophobicContact CB-CZ3 3.72Å
495	T	98.7	Very high	96.5	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.3	-175.5	64.7	0	0	0	0	110.8	G484 G497 V507 L539 V541 W564	G484-T495 WeakPolarHBondContact CA-OG1 3.45Å; G484-T495 PolarHBondContact N-O 3.34Å; G484-T495 PolarHBondContact O-N 3.32Å; G484-T495 PolarHBondContact O-OG1 3.23Å; T495-G497 PolarHBondContact O-N 2.88Å; T495-V507 HydrophobicContact CG2-CG1 3.7Å; T495-V507 HydrophobicContact CG2-CG2 4.11Å; T495-L539 HydrophobicContact CG2-CD2 4.07Å; T495-V541 HydrophobicContact CG2-CG2 4.02Å; T495-W564 HydrophobicContact CG2-CH2 3.95Å; T495-W564 HydrophobicContact CG2-CZ2 4.15Å
496	G	98.5	Very high	96.5	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.224	C	C	.	.			trans	57.2	-127.9	172.9	0	0	0	0	0	114.2	R480 R504 S506 R527	R480-G496 PolarHBondContact NH1-O 2.53Å; G496-R504 VanDerWaalsContact CA-O 3.31Å; G496-R504 WeakPolarHBondContact CA-O 3.4Å; G496-S506 PolarHBondContact N-O 3.02Å; G496-R527 CarbonylContact C-O 3.55Å; G496-R527 WeakPolarHBondContact CA-O 3.35Å
497	G	98.5	Very high	96.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.22	C	C	.	.			trans	82.7	-169.4	-170.7	0	0	0	0	0	112.1	S481 T495 R504 R527	S481-G497 CarbonylContact O-C 3.56Å; S481-G497 VanDerWaalsContact O-CA 3.23Å; S481-G497 WeakPolarHBondContact O-CA 3.47Å; T495-G497 PolarHBondContact O-N 2.88Å; G497-R504 WeakPolarHBondContact O-CB 3.3Å; G497-R504 PolarHBondContact O-N 3.1Å; G497-R527 PolarHBondContact N-O 3.09Å
498	H	98.5	Very high	96.6	Very high	32 Å²	32	34.6 Å²	34.6	15%	0.148	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	161.2	-178.2	75.3	98.8	0	0	0	113.5	S481 G500 L502 V503 R528	S481-H498 PolarHBondContact N-O 2.86Å; S481-H498 PolarHBondContact O-CD2 2.6Å; S481-H498 PolarHBondContact O-N 2.84Å; H498-G500 PolarHBondContact ND1-O 3.22Å; H498-L502 CarbonylContact C-O 3.54Å; H498-L502 WeakPolarHBondContact CA-O 3.48Å; H498-L502 VanDerWaalsContact CB-O 3.25Å; H498-L502 WeakPolarHBondContact CB-O 3.5Å; H498-V503 HydrophobicContact CB-CG2 4.26Å; H498-R528 HydrophobicContact CB-CB 4.48Å; H498-R528 VanDerWaalsContact CD2-CD 3.44Å; H498-R528 WeakPolarHBondContact CD2-CD 3.32Å
499	D	97.5	Very high	96.8	Very high	53 Å²	53	34.6 Å²	34.6	28%	0.283	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	103	168.6	-172	11.4	0	0	0	108.6	R479 L502 R504	R479-D499 HydrophobicContact CB-CB 4.36Å; D499-L502 PolarHBondContact N-O 3.04Å; D499-L502 PolarHBondContact O-N 2.82Å; D499-L502 VanDerWaalsContact O-N 3.16Å; D499-R504 IonicContact OD2-NH2 3.77Å
500	G	93.1	Very high	97.3	Very high	40 Å²	40	30.2 Å²	30.2	41%	0.412	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	-125.5	-166.7	0	0	0	0	0	111.4	H498 L502	H498-G500 PolarHBondContact ND1-O 3.22Å; G500-L502 VanDerWaalsContact C-N 3.35Å
501	P	93.4	Very high	97.6	Very high	125 Å²	125	31.1 Å²	31.1	81%	0.812	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-16.8	179.5	31.7	-34.8	0	0	0	114.2	V503	P501-V503 PolarHBondContact O-N 2.96Å
502	L	96.8	Very high	97.6	Very high	102 Å²	102	29.2 Å²	29.2	53%	0.534	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	109.1	-174.4	179.3	65.9	0	0	0	111	H498 D499 G500	H498-L502 CarbonylContact C-O 3.54Å; H498-L502 WeakPolarHBondContact CA-O 3.48Å; H498-L502 VanDerWaalsContact CB-O 3.25Å; H498-L502 WeakPolarHBondContact CB-O 3.5Å; D499-L502 PolarHBondContact N-O 3.04Å; D499-L502 PolarHBondContact O-N 2.82Å; D499-L502 VanDerWaalsContact O-N 3.16Å; G500-L502 VanDerWaalsContact C-N 3.35Å
503	V	98.3	Very high	97.4	Very high	14 Å²	14	32.4 Å²	32.4	9%	0.085	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	136.1	172.1	-171.6	0	0	0	0	110.3	H498 P501 C526 R528 D546	H498-V503 HydrophobicContact CB-CG2 4.26Å; P501-V503 PolarHBondContact O-N 2.96Å; V503-C526 HydrophobicContact CB-CB 4.27Å; V503-C526 HydrophobicContact CG1-CB 3.94Å; V503-R528 HydrophobicContact CG1-CB 4.13Å; V503-R528 HydrophobicContact CG1-CG 4.03Å; V503-R528 HydrophobicContact CG2-CG 4.28Å; V503-D546 WeakPolarHBondContact CG2-O 3.39Å
504	R	97.9	Very high	97.2	Very high	40 Å²	40	36 Å²	36	15%	0.151	22%	0.222	C	C	.	.			trans	-102.4	149.9	-172.9	-60.1	178.2	-176	-75.3	-4.7	111.1	R479 G496 G497 D499 R527	R479-R504 PolarHBondContact O-NE 2.82Å; G496-R504 VanDerWaalsContact CA-O 3.31Å; G496-R504 WeakPolarHBondContact CA-O 3.4Å; G497-R504 WeakPolarHBondContact O-CB 3.3Å; G497-R504 PolarHBondContact O-N 3.1Å; D499-R504 IonicContact OD2-NH2 3.77Å; R504-R527 PolarHBondContact O-N 3.11Å
505	K	98.3	Very high	97.2	Very high	90 Å²	90	39.5 Å²	39.5	39%	0.391	24%	0.241	S	C	.	.			trans	-110.9	-10.9	163.3	64.6	177.4	-170.8	166.7	0	112.9	D522 M523 M525	K505-D522 HydrophobicContact CD-CB 4.3Å; K505-D522 WeakPolarHBondContact CE-OD2 3.29Å; K505-D522 HydrophobicContact CG-CB 4.14Å; K505-M523 HydrophobicContact CB-CB 4.29Å; K505-M523 WeakPolarHBondContact O-CB 3.47Å; K505-M523 PolarHBondContact O-N 2.88Å; K505-M525 WeakPolarHBondContact CB-O 3.37Å
506	S	98.6	Very high	97.1	Very high	18 Å²	18	42.9 Å²	42.9	13%	0.126	26%	0.261	C	S	.	.			trans	-67.7	151.5	-179.1	62.2	0	0	0	0	111.5	R480 G496 D522	R480-S506 PolarHBondContact NH1-O 2.73Å; R480-S506 PolarHBondContact NH1-OG 3.27Å; R480-S506 PolarHBondContact NH2-OG 2.74Å; G496-S506 PolarHBondContact N-O 3.02Å; S506-D522 VanDerWaalsContact CA-OD1 3.28Å; S506-D522 WeakPolarHBondContact CA-OD1 3.47Å; S506-D522 WeakPolarHBondContact CB-OD1 3.43Å
507	V	98.8	Very high	97.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	137.7	-176.3	-175.4	0	0	0	0	109.2	Y493 A494 T495 Q519 V520 M523 W564	Y493-V507 HydrophobicContact CD1-CG1 4.38Å; A494-V507 WeakPolarHBondContact O-CA 3.41Å; T495-V507 HydrophobicContact CG2-CG1 3.7Å; T495-V507 HydrophobicContact CG2-CG2 4.11Å; V507-Q519 WeakPolarHBondContact O-CA 3.5Å; V507-V520 HydrophobicContact CB-CG2 3.67Å; V507-V520 HydrophobicContact CG1-CG2 3.54Å; V507-V520 PolarHBondContact O-N 2.86Å; V507-M523 HydrophobicContact CG2-CG 3.79Å; V507-M523 HydrophobicContact CG2-SD 4.46Å; V507-W564 HydrophobicContact CB-CZ2 4.45Å; V507-W564 HydrophobicContact CG1-CZ2 4.25Å; V507-W564 HydrophobicContact CG2-CZ2 3.7Å
508	E	98.6	Very high	97.1	Very high	3 Å²	3	51.7 Å²	51.7	1%	0.014	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	142.7	175.8	-56.4	173.7	-106.8	0	0	108.8	S477 T478 R480 Y493 A494 W517 K518	S477-E508 WeakPolarHBondContact CB-OE2 3.38Å; S477-E508 PolarHBondContact N-OE2 2.97Å; S477-E508 PolarHBondContact OG-OE1 2.74Å; S477-E508 PolarHBondContact OG-OE2 3.25Å; T478-E508 PolarHBondContact OG1-OE1 3.11Å; R480-E508 IonicContact CZ-OE1 2.76Å; R480-E508 IonicContact NE-OE1 2.72Å; R480-E508 PolarHBondContact NE-OE1 2.95Å; R480-E508 IonicContact NH2-OE1 2.72Å; R480-E508 PolarHBondContact NH2-OE1 3.47Å; Y493-E508 WeakPolarHBondContact CA-O 3.06Å; A494-E508 PolarHBondContact N-O 2.79Å; A494-E508 PolarHBondContact O-N 2.84Å; A494-E508 VanDerWaalsContact O-N 3.08Å; E508-W517 HydrophobicContact CB-CE3 3.62Å; E508-W517 HydrophobicContact CB-CZ3 4.13Å; E508-K518 CarbonylContact C-O 3.53Å; E508-K518 WeakPolarHBondContact CA-O 3.08Å
509	V	98.7	Very high	97.1	Very high	9 Å²	9	55.5 Å²	55.5	6%	0.055	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.6	174.8	66	0	0	0	0	109.3	Q491 L492 Y493 W517 K518 V520	Q491-V509 HydrophobicContact CB-CG2 3.59Å; Q491-V509 HydrophobicContact CG-CG2 4.29Å; L492-V509 CarbonylContact O-C 3.53Å; L492-V509 WeakPolarHBondContact O-CA 3.42Å; Y493-V509 HydrophobicContact CD1-CB 3.93Å; Y493-V509 HydrophobicContact CD1-CG2 3.99Å; Y493-V509 HydrophobicContact CD2-CG2 4.01Å; Y493-V509 HydrophobicContact CE1-CB 3.78Å; Y493-V509 HydrophobicContact CE1-CG2 3.67Å; Y493-V509 HydrophobicContact CE2-CG2 3.66Å; Y493-V509 HydrophobicContact CG-CB 4.43Å; Y493-V509 HydrophobicContact CG-CG2 4.15Å; V509-W517 CarbonylContact O-C 3.56Å; V509-W517 WeakPolarHBondContact O-CA 3.49Å; V509-K518 HydrophobicContact CG1-CB 4.27Å; V509-K518 PolarHBondContact N-O 2.96Å; V509-K518 PolarHBondContact O-N 2.99Å; V509-V520 HydrophobicContact CB-CG1 4.27Å; V509-V520 HydrophobicContact CG1-CG1 3.65Å
510	Y	98.8	Very high	97.2	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.016	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	129.5	176.4	176.1	-104.7	0	0	0	110.6	Y444 V473 A474 L492 P512 N515 T516 W517	Y444-Y510 HydrophobicContact CD1-CE1 4.3Å; Y444-Y510 HydrophobicContact CE1-CD1 4.43Å; Y444-Y510 AromaticContact CE1-CE1 3.67Å; Y444-Y510 HydrophobicContact CE1-CE1 3.67Å; V473-Y510 HydrophobicContact CG2-CE2 4.48Å; A474-Y510 HydrophobicContact CB-CE2 4.28Å; L492-Y510 HydrophobicContact CB-CD1 4.32Å; L492-Y510 HydrophobicContact CD2-CD1 4.42Å; L492-Y510 PolarHBondContact N-O 2.76Å; L492-Y510 VanDerWaalsContact N-O 3.1Å; L492-Y510 PolarHBondContact O-N 3.08Å; Y510-P512 HydrophobicContact CE1-CB 3.95Å; Y510-N515 WeakPolarHBondContact CE2-OD1 3.26Å; Y510-N515 PolarHBondContact OH-OD1 3.33Å; Y510-T516 WeakPolarHBondContact CA-O 3.49Å; Y510-T516 WeakPolarHBondContact CD2-O 3.4Å; Y510-W517 AromaticContact CD2-CD1 3.74Å; Y510-W517 HydrophobicContact CD2-CD2 4.05Å; Y510-W517 AromaticContact CD2-CE2 3.63Å; Y510-W517 HydrophobicContact CD2-CG 4.1Å; Y510-W517 HydrophobicContact CD2-CZ2 4.12Å; Y510-W517 AromaticContact CD2-NE1 3.42Å; Y510-W517 HydrophobicContact CG-CD2 4.3Å; Y510-W517 AromaticContact CG-CE2 3.87Å; Y510-W517 HydrophobicContact CG-CH2 4.43Å; Y510-W517 AromaticContact CG-CZ2 3.92Å; Y510-W517 HydrophobicContact CG-CZ2 3.92Å
511	D	96.7	Very high	97.4	Very high	53 Å²	53	53.2 Å²	53.2	28%	0.283	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	113.1	171.6	172.4	8.1	0	0	0	109.1	G513 T514 N515 T516	D511-G513 VanDerWaalsContact C-N 3.27Å; D511-G513 PolarHBondContact O-N 3.21Å; D511-G513 PolarHBondContact OD1-N 2.8Å; D511-T514 WeakPolarHBondContact CB-OG1 3.29Å; D511-T514 VanDerWaalsContact OD2-CG2 3.25Å; D511-T514 WeakPolarHBondContact OD2-CG2 3.37Å; D511-T514 PolarHBondContact OD2-OG1 3.44Å; D511-N515 WeakPolarHBondContact O-CA 3.5Å; D511-N515 PolarHBondContact O-N 3Å; D511-T516 PolarHBondContact N-O 2.98Å; D511-T516 PolarHBondContact O-N 2.84Å
512	P	93.6	Very high	97.7	Very high	24 Å²	24	50.3 Å²	50.3	16%	0.156	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-25.9	179.5	31.4	-38	0	0	0	113.2	V439 Y444 Y510	V439-P512 HydrophobicContact CG1-CG 3.83Å; Y444-P512 WeakPolarHBondContact OH-CB 3.3Å; Y510-P512 HydrophobicContact CE1-CB 3.95Å
513	G	93.9	Very high	97.8	Very high	67 Å²	67	45.6 Å²	45.6	69%	0.691	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-36	-179.4	0	0	0	0	0	112.2	D511	D511-G513 VanDerWaalsContact C-N 3.27Å; D511-G513 PolarHBondContact O-N 3.21Å; D511-G513 PolarHBondContact OD1-N 2.8Å
514	T	95.9	Very high	97.7	Very high	81 Å²	81	49 Å²	49	50%	0.497	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-12.2	176.5	58.3	0	0	0	0	113.6	D511 T516	D511-T514 WeakPolarHBondContact CB-OG1 3.29Å; D511-T514 VanDerWaalsContact OD2-CG2 3.25Å; D511-T514 WeakPolarHBondContact OD2-CG2 3.37Å; D511-T514 PolarHBondContact OD2-OG1 3.44Å; T514-T516 VanDerWaalsContact C-N 3.31Å; T514-T516 WeakPolarHBondContact O-CG2 3.44Å; T514-T516 PolarHBondContact O-N 3.04Å; T514-T516 PolarHBondContact OG1-OG1 2.87Å
515	N	97.7	Very high	97.6	Very high	72 Å²	72	50.1 Å²	50.1	39%	0.385	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	48.4	-171.2	-173.5	35.8	0	0	0	111.7	V473 A474 Y510 D511	V473-N515 WeakPolarHBondContact CB-OD1 3.37Å; A474-N515 WeakPolarHBondContact CB-O 3.38Å; A474-N515 WeakPolarHBondContact CB-OD1 3.45Å; A474-N515 PolarHBondContact N-OD1 2.95Å; Y510-N515 WeakPolarHBondContact CE2-OD1 3.26Å; Y510-N515 PolarHBondContact OH-OD1 3.33Å; D511-N515 WeakPolarHBondContact O-CA 3.5Å; D511-N515 PolarHBondContact O-N 3Å
516	T	98.3	Very high	97.6	Very high	73 Å²	73	48 Å²	48	45%	0.448	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	149.7	-179.8	64.5	0	0	0	0	112.6	Y510 D511 T514	Y510-T516 WeakPolarHBondContact CA-O 3.49Å; Y510-T516 WeakPolarHBondContact CD2-O 3.4Å; D511-T516 PolarHBondContact N-O 2.98Å; D511-T516 PolarHBondContact O-N 2.84Å; T514-T516 VanDerWaalsContact C-N 3.31Å; T514-T516 WeakPolarHBondContact O-CG2 3.44Å; T514-T516 PolarHBondContact O-N 3.04Å; T514-T516 PolarHBondContact OG1-OG1 2.87Å
517	W	98.8	Very high	97.6	Very high	37 Å²	37	47.2 Å²	47.2	14%	0.14	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	140.7	170.3	-71.8	90.4	0	0	0	110.3	V446 V460 A474 M476 L492 A494 E508 V509 Y510	V446-W517 HydrophobicContact CG1-CH2 4.07Å; V446-W517 HydrophobicContact CG1-CZ2 4.36Å; V460-W517 HydrophobicContact CG1-CZ2 4.49Å; V460-W517 HydrophobicContact CG2-CZ2 3.79Å; A474-W517 PolarHBondContact O-NE1 3.23Å; M476-W517 HydrophobicContact CG-CD2 3.83Å; M476-W517 HydrophobicContact CG-CE3 4.11Å; M476-W517 HydrophobicContact CG-CG 4.49Å; M476-W517 HydrophobicContact CG-CH2 3.98Å; M476-W517 HydrophobicContact CG-CZ2 3.7Å; M476-W517 HydrophobicContact CG-CZ3 4.17Å; M476-W517 HydrophobicContact SD-CH2 4.25Å; M476-W517 HydrophobicContact SD-CZ2 4.42Å; L492-W517 HydrophobicContact CD2-CH2 4.39Å; A494-W517 HydrophobicContact CB-CH2 3.96Å; A494-W517 HydrophobicContact CB-CZ3 3.72Å; E508-W517 HydrophobicContact CB-CE3 3.62Å; E508-W517 HydrophobicContact CB-CZ3 4.13Å; V509-W517 CarbonylContact O-C 3.56Å; V509-W517 WeakPolarHBondContact O-CA 3.49Å; Y510-W517 AromaticContact CD2-CD1 3.74Å; Y510-W517 HydrophobicContact CD2-CD2 4.05Å; Y510-W517 AromaticContact CD2-CE2 3.63Å; Y510-W517 HydrophobicContact CD2-CG 4.1Å; Y510-W517 HydrophobicContact CD2-CZ2 4.12Å; Y510-W517 AromaticContact CD2-NE1 3.42Å; Y510-W517 HydrophobicContact CG-CD2 4.3Å; Y510-W517 AromaticContact CG-CE2 3.87Å; Y510-W517 HydrophobicContact CG-CH2 4.43Å; Y510-W517 AromaticContact CG-CZ2 3.92Å; Y510-W517 HydrophobicContact CG-CZ2 3.92Å
518	K	98.1	Very high	97.6	Very high	149 Å²	149	49.4 Å²	49.4	65%	0.648	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.5	136.3	173.6	-176.4	-175	171.3	-170.6	0	110	E508 V509	E508-K518 CarbonylContact C-O 3.53Å; E508-K518 WeakPolarHBondContact CA-O 3.08Å; V509-K518 HydrophobicContact CG1-CB 4.27Å; V509-K518 PolarHBondContact N-O 2.96Å; V509-K518 PolarHBondContact O-N 2.99Å
519	Q	98.3	Very high	97.6	Very high	112 Å²	112	49.8 Å²	49.8	52%	0.523	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	136.7	171.2	-171.9	170.3	0.6	0	0	110.5	V507 D522	V507-Q519 WeakPolarHBondContact O-CA 3.5Å; Q519-D522 PolarHBondContact NE2-OD1 3.31Å
520	V	98.4	Very high	97.6	Very high	17 Å²	17	50 Å²	50	10%	0.103	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	-178.6	171.5	-61.1	0	0	0	0	109.2	V507 V509 D522 Y557	V507-V520 HydrophobicContact CB-CG2 3.67Å; V507-V520 HydrophobicContact CG1-CG2 3.54Å; V507-V520 PolarHBondContact O-N 2.86Å; V509-V520 HydrophobicContact CB-CG1 4.27Å; V509-V520 HydrophobicContact CG1-CG1 3.65Å; V520-D522 PolarHBondContact O-N 2.97Å; V520-Y557 HydrophobicContact CB-CE2 4.45Å; V520-Y557 HydrophobicContact CG2-CE2 4.37Å
521	A	98.4	Very high	97.6	Very high	27 Å²	27	50.1 Å²	50.1	22%	0.223	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-51.5	138.2	179.1	0	0	0	0	0	112.4	D562 W564	A521-D562 WeakPolarHBondContact CB-O 3.47Å; A521-D562 VanDerWaalsContact CB-OD1 3.26Å; A521-D562 WeakPolarHBondContact CB-OD1 3.48Å; A521-D562 PolarHBondContact N-OD1 3.23Å; A521-W564 PolarHBondContact O-NE1 3.24Å
522	D	98.8	Very high	97.6	Very high	65 Å²	65	48.7 Å²	48.7	35%	0.348	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-66.4	144.1	173.9	-77.7	5.2	0	0	0	110.6	K505 S506 Q519 V520 W564	K505-D522 HydrophobicContact CD-CB 4.3Å; K505-D522 WeakPolarHBondContact CE-OD2 3.29Å; K505-D522 HydrophobicContact CG-CB 4.14Å; S506-D522 VanDerWaalsContact CA-OD1 3.28Å; S506-D522 WeakPolarHBondContact CA-OD1 3.47Å; S506-D522 WeakPolarHBondContact CB-OD1 3.43Å; Q519-D522 PolarHBondContact NE2-OD1 3.31Å; V520-D522 PolarHBondContact O-N 2.97Å; D522-W564 VanDerWaalsContact C-CD1 3.47Å
523	M	98.6	Very high	97.8	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.015	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-59	159.5	167.9	-69.7	-177.9	-60.4	0	0	111.2	K505 V507 M525 R527 V541 E555 W564	K505-M523 HydrophobicContact CB-CB 4.29Å; K505-M523 WeakPolarHBondContact O-CB 3.47Å; K505-M523 PolarHBondContact O-N 2.88Å; V507-M523 HydrophobicContact CG2-CG 3.79Å; V507-M523 HydrophobicContact CG2-SD 4.46Å; M523-M525 VanDerWaalsContact C-N 3.28Å; M523-M525 WeakPolarHBondContact CB-O 3.48Å; M523-M525 PolarHBondContact O-N 2.62Å; M523-R527 HydrophobicContact CE-CB 3.99Å; M523-R527 HydrophobicContact CE-CG 4.28Å; M523-R527 HydrophobicContact SD-CG 4.5Å; M523-V541 HydrophobicContact SD-CB 4.3Å; M523-V541 HydrophobicContact SD-CG1 4.06Å; M523-V541 HydrophobicContact SD-CG2 4.1Å; M523-E555 WeakPolarHBondContact CA-OE2 3.39Å; M523-E555 WeakPolarHBondContact CB-OE2 3.43Å; M523-W564 HydrophobicContact CB-CD2 4.44Å; M523-W564 HydrophobicContact CG-CD2 3.79Å; M523-W564 HydrophobicContact CG-CE3 4.04Å; M523-W564 HydrophobicContact CG-CG 4.43Å; M523-W564 HydrophobicContact CG-CH2 3.94Å; M523-W564 HydrophobicContact CG-CZ2 3.69Å; M523-W564 HydrophobicContact CG-CZ3 4.11Å; M523-W564 HydrophobicContact SD-CH2 4.26Å; M523-W564 HydrophobicContact SD-CZ2 4.47Å; M523-W564 HydrophobicContact SD-CZ3 4.47Å
524	N	97.8	Very high	97.9	Very high	85 Å²	85	47 Å²	47	46%	0.455	26%	0.257	S	S	.	.	S	Bend	trans	-65.7	-35	174.5	-65.2	-78.8	0	0	0	111.4	E555 W564	N524-E555 WeakPolarHBondContact CB-OE2 3.27Å; N524-E555 PolarHBondContact N-OE2 2.88Å; N524-E555 PolarHBondContact ND2-OE2 3.41Å; N524-W564 VanDerWaalsContact ND2-CB 3.32Å; N524-W564 WeakPolarHBondContact ND2-CB 3.41Å; N524-W564 PolarHBondContact ND2-O 3.47Å
525	M	95.4	Very high	97.7	Very high	64 Å²	64	43.4 Å²	43.4	32%	0.315	24%	0.235	S	C	.	.	S	Bend	trans	-123.7	151.1	-176.5	-55.5	-170.6	78.2	0	0	112	K505 M523 R527 L551 S553 E555	K505-M525 WeakPolarHBondContact CB-O 3.37Å; M523-M525 VanDerWaalsContact C-N 3.28Å; M523-M525 WeakPolarHBondContact CB-O 3.48Å; M523-M525 PolarHBondContact O-N 2.62Å; M525-R527 HydrophobicContact CB-CG 4.44Å; M525-R527 PolarHBondContact O-N 3.08Å; M525-L551 HydrophobicContact CB-CD1 4.45Å; M525-L551 HydrophobicContact CE-CD1 4.49Å; M525-L551 HydrophobicContact CE-CD2 3.7Å; M525-L551 HydrophobicContact SD-CD2 4.46Å; M525-S553 PolarHBondContact SD-OG 3.49Å; M525-S553 VanDerWaalsContact SD-OG 3.38Å; M525-E555 PolarHBondContact N-OE1 2.73Å
526	C	98.2	Very high	97.1	Very high	44 Å²	44	45.3 Å²	45.3	30%	0.297	25%	0.245	S	C	.	.			trans	-68.2	128.9	166.1	-69.5	0	0	0	0	109	V503 D546	V503-C526 HydrophobicContact CB-CB 4.27Å; V503-C526 HydrophobicContact CG1-CB 3.94Å; C526-D546 HydrophobicContact CB-CB 4.39Å; C526-D546 WeakPolarHBondContact O-CA 3.46Å; C526-D546 WeakPolarHBondContact O-CB 3.43Å
527	R	98.4	Very high	96.6	Very high	3 Å²	3	43.8 Å²	43.8	1%	0.011	24%	0.244	C	C	.	.			trans	-139.3	130.7	-179.1	-58.3	-175.6	-177.6	-102.8	2	110.3	G496 G497 R504 M523 M525 A530 G543 L551 S553 E555	G496-R527 CarbonylContact C-O 3.55Å; G496-R527 WeakPolarHBondContact CA-O 3.35Å; G497-R527 PolarHBondContact N-O 3.09Å; R504-R527 PolarHBondContact O-N 3.11Å; M523-R527 HydrophobicContact CE-CB 3.99Å; M523-R527 HydrophobicContact CE-CG 4.28Å; M523-R527 HydrophobicContact SD-CG 4.5Å; M525-R527 HydrophobicContact CB-CG 4.44Å; M525-R527 PolarHBondContact O-N 3.08Å; R527-A530 HydrophobicContact CB-CB 4.34Å; R527-G543 PolarHBondContact NH1-O 2.87Å; R527-L551 HydrophobicContact CG-CD1 3.85Å; R527-S553 PolarHBondContact NH1-O 3.2Å; R527-S553 PolarHBondContact NH2-OG 3.36Å; R527-E555 IonicContact CZ-OE1 3.73Å; R527-E555 VanDerWaalsContact CZ-OE1 3.27Å; R527-E555 IonicContact NE-OE1 3.8Å; R527-E555 PolarHBondContact NE-OE1 2.69Å; R527-E555 IonicContact NH2-OE1 3.28Å; R527-E555 PolarHBondContact NH2-OE1 3.02Å
528	R	98.2	Very high	96.4	Very high	45 Å²	45	43.5 Å²	43.5	17%	0.17	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-124.6	159.7	158.1	59.7	169.8	-173.7	-126.1	-4.7	109.4	H498 V503 A530 G544 D545	H498-R528 HydrophobicContact CB-CB 4.48Å; H498-R528 VanDerWaalsContact CD2-CD 3.44Å; H498-R528 WeakPolarHBondContact CD2-CD 3.32Å; V503-R528 HydrophobicContact CG1-CB 4.13Å; V503-R528 HydrophobicContact CG1-CG 4.03Å; V503-R528 HydrophobicContact CG2-CG 4.28Å; R528-A530 PolarHBondContact O-N 3.06Å; R528-A530 VanDerWaalsContact O-N 3.11Å; R528-G544 CarbonylContact O-C 3.38Å; R528-G544 VanDerWaalsContact O-CA 3.24Å; R528-G544 WeakPolarHBondContact O-CA 3.18Å; R528-D545 WeakPolarHBondContact CG-O 3.26Å; R528-D545 IonicContact CZ-OD1 3.56Å; R528-D545 PolarHBondContact N-O 3.04Å; R528-D545 IonicContact NE-OD1 3.92Å; R528-D545 PolarHBondContact NE-OD1 3.4Å; R528-D545 IonicContact NE-OD2 3.57Å; R528-D545 IonicContact NH2-OD1 2.68Å; R528-D545 PolarHBondContact NH2-OD1 2.92Å; R528-D545 PolarHBondContact O-N 3.36Å
529	N	98.4	Very high	96.4	Very high	12 Å²	12	36.4 Å²	36.4	6%	0.064	21%	0.214	C	C	.	.	S	Bend	trans	55.4	28.8	177.2	-45.5	-55.7	0	0	0	113.4	G482 D545 S576 Y577	G482-N529 PolarHBondContact O-N 3.42Å; N529-D545 PolarHBondContact ND2-OD2 3.26Å; N529-S576 WeakPolarHBondContact CB-OG 3.24Å; N529-Y577 HydrophobicContact CB-CD1 3.62Å; N529-Y577 HydrophobicContact CB-CD2 3.98Å; N529-Y577 HydrophobicContact CB-CE1 3.66Å; N529-Y577 HydrophobicContact CB-CE2 4Å; N529-Y577 HydrophobicContact CB-CG 3.81Å; N529-Y577 WeakPolarHBondContact ND2-CE2 2.93Å; N529-Y577 PolarHBondContact ND2-OH 2.88Å; N529-Y577 VanDerWaalsContact ND2-OH 3.13Å; N529-Y577 PolarHBondContact O-N 2.98Å; N529-Y577 WeakPolarHBondContact OD1-CE1 3.41Å; N529-Y577 VanDerWaalsContact OD1-CZ 3.3Å; N529-Y577 PolarHBondContact OD1-OH 3.37Å
530	A	98.5	Very high	96.4	Very high	14 Å²	14	31.8 Å²	31.8	12%	0.116	19%	0.192	C	C	.	.			trans	-81.3	151.3	175.4	0	0	0	0	0	110.4	R527 R528 V541	R527-A530 HydrophobicContact CB-CB 4.34Å; R528-A530 PolarHBondContact O-N 3.06Å; R528-A530 VanDerWaalsContact O-N 3.11Å; A530-V541 HydrophobicContact CB-CG1 3.59Å
531	G	98.4	Very high	96.4	Very high	6 Å²	6	31 Å²	31	6%	0.062	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	145.8	168.3	0	0	0	0	0	110.4	V541 V542	G531-V541 WeakPolarHBondContact O-CA 3.42Å; G531-V542 PolarHBondContact N-O 3.1Å; G531-V542 PolarHBondContact O-N 3.37Å
532	V	98.6	Very high	96.4	Very high	23 Å²	23	29.9 Å²	29.9	14%	0.139	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	134.1	179.5	-179.5	0	0	0	0	110	L539 Y540 V541	V532-L539 HydrophobicContact CG1-CD1 3.58Å; V532-L539 HydrophobicContact CG1-CD2 4.42Å; V532-L539 HydrophobicContact CG1-CG 3.98Å; V532-Y540 VanDerWaalsContact CA-O 3.29Å; V532-Y540 WeakPolarHBondContact CA-O 3.41Å; V532-V541 HydrophobicContact CG2-CG1 4.33Å; V532-V541 HydrophobicContact CG2-CG2 4.12Å
533	C	97.6	Very high	96.4	Very high	13 Å²	13	26.9 Å²	26.9	9%	0.088	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	160.3	172.7	68	0	0	0	0	110.7	Y540 V580 V582	C533-Y540 PolarHBondContact N-O 3.25Å; C533-Y540 VanDerWaalsContact N-O 3.13Å; C533-Y540 PolarHBondContact O-N 3.28Å; C533-V580 HydrophobicContact CB-CG1 3.91Å; C533-V582 HydrophobicContact CB-CG2 3.84Å
534	A	95.5	Very high	96.4	Very high	42 Å²	42	26.8 Å²	26.8	35%	0.347	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.2	176.2	0	0	0	0	0	110	V487 L488 L538 L539	V487-A534 WeakPolarHBondContact O-CB 3.5Å; L488-A534 HydrophobicContact CD1-CB 4.29Å; A534-L538 VanDerWaalsContact CA-O 3.29Å; A534-L538 WeakPolarHBondContact CA-O 3.22Å; A534-L539 HydrophobicContact CB-CD1 4.23Å
535	V	91.9	Very high	96.4	Very high	5 Å²	5	23.3 Å²	23.3	3%	0.03	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	139.6	177.7	60.3	0	0	0	0	109.8	K301 F322 G537 L538 Y540 V582	K301-V535 HydrophobicContact CB-CG2 4.08Å; K301-V535 HydrophobicContact CD-CG2 3.6Å; K301-V535 HydrophobicContact CG-CG2 4.5Å; F322-V535 HydrophobicContact CE1-CG1 3.94Å; F322-V535 HydrophobicContact CE2-CG1 4.22Å; F322-V535 HydrophobicContact CZ-CG1 3.56Å; V535-G537 PolarHBondContact O-N 3.42Å; V535-G537 VanDerWaalsContact O-N 3.16Å; V535-L538 PolarHBondContact N-O 3.44Å; V535-L538 PolarHBondContact O-N 3.17Å; V535-Y540 HydrophobicContact CG1-CD2 3.59Å; V535-Y540 HydrophobicContact CG1-CE2 3.26Å; V535-V582 HydrophobicContact CB-CG1 4.27Å; V535-V582 HydrophobicContact CB-CG2 4.22Å; V535-V582 HydrophobicContact CG2-CG1 4.07Å
536	N	85.3	Confident	96.5	Very high	112 Å²	112	22.7 Å²	22.7	60%	0.599	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	38.4	177	-58.2	-15.1	0	0	0	114.3	L538	N536-L538 VanDerWaalsContact C-N 3.27Å; N536-L538 PolarHBondContact O-N 3.22Å
537	G	86.4	Confident	96.3	Very high	41 Å²	41	22.3 Å²	22.3	42%	0.423	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	9.1	178.9	0	0	0	0	0	114.7	L488 V535 P559	L488-G537 VanDerWaalsContact CD1-C 3.48Å; V535-G537 PolarHBondContact O-N 3.42Å; V535-G537 VanDerWaalsContact O-N 3.16Å; G537-P559 WeakPolarHBondContact O-CD 3.28Å
538	L	95	Very high	96	Very high	31 Å²	31	27.7 Å²	27.7	16%	0.162	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151	179.6	-57.7	173	0	0	0	110.4	A534 V535 N536 Y540 Y556 Y557 N558	A534-L538 VanDerWaalsContact CA-O 3.29Å; A534-L538 WeakPolarHBondContact CA-O 3.22Å; V535-L538 PolarHBondContact N-O 3.44Å; V535-L538 PolarHBondContact O-N 3.17Å; N536-L538 VanDerWaalsContact C-N 3.27Å; N536-L538 PolarHBondContact O-N 3.22Å; L538-Y540 HydrophobicContact CB-CD2 4.36Å; L538-Y540 HydrophobicContact CB-CE2 3.67Å; L538-Y540 HydrophobicContact CD1-CE2 4.44Å; L538-Y556 HydrophobicContact CB-CD2 4.36Å; L538-Y556 HydrophobicContact CD1-CD2 3.76Å; L538-Y556 HydrophobicContact CD1-CE2 3.92Å; L538-Y556 HydrophobicContact CD1-CG 4.48Å; L538-Y556 HydrophobicContact CD2-CD2 4.14Å; L538-Y556 HydrophobicContact CD2-CE2 4.44Å; L538-Y556 HydrophobicContact CG-CD2 4.31Å; L538-Y557 WeakPolarHBondContact CA-O 3.42Å; L538-N558 HydrophobicContact CD2-CB 3.7Å
539	L	98.4	Very high	95.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.1	176.4	-175.7	77.4	0	0	0	109.6	L488 Y493 T495 V532 A534 Y556 Y557 W564	L488-L539 HydrophobicContact CD2-CB 4.03Å; Y493-L539 HydrophobicContact CD1-CD2 4.06Å; Y493-L539 HydrophobicContact CD2-CD2 4.34Å; Y493-L539 HydrophobicContact CG-CD2 3.74Å; T495-L539 HydrophobicContact CG2-CD2 4.07Å; V532-L539 HydrophobicContact CG1-CD1 3.58Å; V532-L539 HydrophobicContact CG1-CD2 4.42Å; V532-L539 HydrophobicContact CG1-CG 3.98Å; A534-L539 HydrophobicContact CB-CD1 4.23Å; L539-Y556 CarbonylContact O-C 3.55Å; L539-Y556 WeakPolarHBondContact O-CA 3Å; L539-Y557 PolarHBondContact N-O 2.96Å; L539-Y557 VanDerWaalsContact N-O 3.16Å; L539-Y557 PolarHBondContact O-N 2.87Å; L539-W564 HydrophobicContact CD2-CH2 4.44Å
540	Y	98.6	Very high	95.8	Very high	16 Å²	16	30.2 Å²	30.2	6%	0.063	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	137	-178.6	-68	-103.6	0	0	0	110.6	F322 V532 C533 V535 L538 V554 Y556 L567	F322-Y540 HydrophobicContact CE1-CD1 4.33Å; F322-Y540 AromaticContact CE1-CE1 3.68Å; F322-Y540 HydrophobicContact CE1-CE1 3.68Å; F322-Y540 HydrophobicContact CE1-CE2 4.13Å; F322-Y540 AromaticContact CE1-CZ 3.56Å; V532-Y540 VanDerWaalsContact CA-O 3.29Å; V532-Y540 WeakPolarHBondContact CA-O 3.41Å; C533-Y540 PolarHBondContact N-O 3.25Å; C533-Y540 VanDerWaalsContact N-O 3.13Å; C533-Y540 PolarHBondContact O-N 3.28Å; V535-Y540 HydrophobicContact CG1-CD2 3.59Å; V535-Y540 HydrophobicContact CG1-CE2 3.26Å; L538-Y540 HydrophobicContact CB-CD2 4.36Å; L538-Y540 HydrophobicContact CB-CE2 3.67Å; L538-Y540 HydrophobicContact CD1-CE2 4.44Å; Y540-V554 HydrophobicContact CD1-CG1 4.12Å; Y540-Y556 HydrophobicContact CD1-CD1 4.46Å; Y540-Y556 HydrophobicContact CD1-CG 4.39Å; Y540-Y556 AromaticContact CE1-CD1 3.86Å; Y540-Y556 HydrophobicContact CE1-CD1 3.86Å; Y540-Y556 AromaticContact CE1-CG 3.92Å; Y540-Y556 HydrophobicContact CE1-CG 3.92Å; Y540-L567 HydrophobicContact CD1-CD1 4.34Å; Y540-L567 HydrophobicContact CE1-CD1 4.16Å
541	V	98.7	Very high	95.8	Very high	0 Å²	0	30 Å²	30	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	115.4	174.2	-175.4	0	0	0	0	108.4	T495 M523 A530 G531 V532 V554 E555 W564	T495-V541 HydrophobicContact CG2-CG2 4.02Å; M523-V541 HydrophobicContact SD-CB 4.3Å; M523-V541 HydrophobicContact SD-CG1 4.06Å; M523-V541 HydrophobicContact SD-CG2 4.1Å; A530-V541 HydrophobicContact CB-CG1 3.59Å; G531-V541 WeakPolarHBondContact O-CA 3.42Å; V532-V541 HydrophobicContact CG2-CG1 4.33Å; V532-V541 HydrophobicContact CG2-CG2 4.12Å; V541-V554 WeakPolarHBondContact O-CA 3.32Å; V541-E555 HydrophobicContact CB-CG 4.46Å; V541-E555 PolarHBondContact N-O 2.96Å; V541-E555 PolarHBondContact O-N 2.77Å; V541-E555 VanDerWaalsContact O-N 3.09Å; V541-W564 HydrophobicContact CB-CZ3 4.26Å; V541-W564 HydrophobicContact CG2-CH2 3.52Å; V541-W564 HydrophobicContact CG2-CZ3 3.58Å
542	V	98.7	Very high	95.8	Very high	4 Å²	4	31 Å²	31	2%	0.024	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.1	-166	-179.7	0	0	0	0	110.4	M303 V305 G531 G544 V554 M571 V580	M303-V542 HydrophobicContact CE-CG2 3.95Å; M303-V542 HydrophobicContact SD-CG2 3.51Å; M303-V542 VanDerWaalsContact SD-CG2 3.51Å; V305-V542 HydrophobicContact CG1-CG1 4.27Å; V305-V542 HydrophobicContact CG2-CG1 3.73Å; G531-V542 PolarHBondContact N-O 3.1Å; G531-V542 PolarHBondContact O-N 3.37Å; V542-G544 PolarHBondContact O-N 3.25Å; V542-V554 HydrophobicContact CB-CG2 4.19Å; V542-V554 HydrophobicContact CG1-CG2 3.83Å; V542-V554 HydrophobicContact CG2-CG1 3.83Å; V542-V554 HydrophobicContact CG2-CG2 4.13Å; V542-M571 HydrophobicContact CG1-CE 3.93Å; V542-M571 HydrophobicContact CG1-SD 3.72Å; V542-V580 HydrophobicContact CB-CG2 3.89Å; V542-V580 HydrophobicContact CG1-CG2 4.12Å; V542-V580 HydrophobicContact CG2-CG1 4.32Å; V542-V580 HydrophobicContact CG2-CG2 4.08Å
543	G	98.3	Very high	95.7	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.01	21%	0.206	C	C	.	.			trans	59.7	-131.1	175.9	0	0	0	0	0	113	R527 L551 S553	R527-G543 PolarHBondContact NH1-O 2.87Å; G543-L551 WeakPolarHBondContact CA-O 3.38Å; G543-S553 PolarHBondContact N-O 3.44Å; G543-S553 VanDerWaalsContact N-O 3.09Å
544	G	98.3	Very high	95.8	Very high	1 Å²	1	30 Å²	30	1%	0.01	20%	0.202	C	C	.	.			trans	88.8	-166	-170.9	0	0	0	0	0	111.8	R528 V542 N550 L551 R575	R528-G544 CarbonylContact O-C 3.38Å; R528-G544 VanDerWaalsContact O-CA 3.24Å; R528-G544 WeakPolarHBondContact O-CA 3.18Å; V542-G544 PolarHBondContact O-N 3.25Å; G544-N550 WeakPolarHBondContact O-CA 3.23Å; G544-L551 PolarHBondContact O-N 2.88Å; G544-R575 PolarHBondContact N-O 3.26Å
545	D	97.7	Very high	95.9	Very high	13 Å²	13	28 Å²	28	7%	0.07	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-135.5	149.1	173.3	67.9	102.3	0	0	0	111.9	R528 N529 C549 S576	R528-D545 WeakPolarHBondContact CG-O 3.26Å; R528-D545 IonicContact CZ-OD1 3.56Å; R528-D545 PolarHBondContact N-O 3.04Å; R528-D545 IonicContact NE-OD1 3.92Å; R528-D545 PolarHBondContact NE-OD1 3.4Å; R528-D545 IonicContact NE-OD2 3.57Å; R528-D545 IonicContact NH2-OD1 2.68Å; R528-D545 PolarHBondContact NH2-OD1 2.92Å; R528-D545 PolarHBondContact O-N 3.36Å; N529-D545 PolarHBondContact ND2-OD2 3.26Å; D545-C549 WeakPolarHBondContact CA-O 3.07Å; D545-C549 VanDerWaalsContact CB-O 3.27Å; D545-C549 WeakPolarHBondContact CB-O 3.18Å; D545-S576 PolarHBondContact OD2-OG 3.35Å
546	D	96.8	Very high	96.2	Very high	50 Å²	50	30.7 Å²	30.7	27%	0.267	20%	0.196	S	C	.	.			trans	-93.3	3.4	-175.9	67.8	-2.2	0	0	0	113.5	V503 C526 S548 C549 L551	V503-D546 WeakPolarHBondContact CG2-O 3.39Å; C526-D546 HydrophobicContact CB-CB 4.39Å; C526-D546 WeakPolarHBondContact O-CA 3.46Å; C526-D546 WeakPolarHBondContact O-CB 3.43Å; D546-S548 WeakPolarHBondContact OD1-CA 3.41Å; D546-S548 WeakPolarHBondContact OD1-CB 3.34Å; D546-S548 PolarHBondContact OD1-N 3.21Å; D546-C549 PolarHBondContact N-O 3.14Å; D546-C549 PolarHBondContact OD1-N 3.48Å; D546-C549 PolarHBondContact OD2-SG 3.26Å; D546-C549 VanDerWaalsContact OD2-SG 3.4Å; D546-L551 HydrophobicContact CB-CD1 4.5Å; D546-L551 HydrophobicContact CB-CD2 4.49Å
547	G	94	Very high	96.9	Very high	36 Å²	36	25.7 Å²	25.7	37%	0.371	17%	0.169	S	C	.	.	S	Bend	trans	107.7	-23.8	-170.3	0	0	0	0	0	113.7
548	S	93.1	Very high	97.2	Very high	117 Å²	117	25.9 Å²	25.9	82%	0.818	16%	0.16	S	C	*	.	S	Bend	trans	-122.8	-42.9	-174.7	-54.2	0	0	0	0	112.6	D546	D546-S548 WeakPolarHBondContact OD1-CA 3.41Å; D546-S548 WeakPolarHBondContact OD1-CB 3.34Å; D546-S548 PolarHBondContact OD1-N 3.21Å
549	C	94.6	Very high	97	Very high	63 Å²	63	26.4 Å²	26.4	43%	0.426	17%	0.165	S	C	.	.	S	Bend	trans	-136.1	153.1	-174.9	70.5	0	0	0	0	112.5	D545 D546	D545-C549 WeakPolarHBondContact CA-O 3.07Å; D545-C549 VanDerWaalsContact CB-O 3.27Å; D545-C549 WeakPolarHBondContact CB-O 3.18Å; D546-C549 PolarHBondContact N-O 3.14Å; D546-C549 PolarHBondContact OD1-N 3.48Å; D546-C549 PolarHBondContact OD2-SG 3.26Å; D546-C549 VanDerWaalsContact OD2-SG 3.4Å
550	N	97.7	Very high	96.7	Very high	46 Å²	46	32.8 Å²	32.8	25%	0.246	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-79.2	131.6	170.8	-63.7	-19.7	0	0	0	109.2	Q309 G544 G574	Q309-N550 PolarHBondContact O-ND2 3.37Å; G544-N550 WeakPolarHBondContact O-CA 3.23Å; N550-G574 WeakPolarHBondContact CB-O 3.5Å
551	L	98.1	Very high	96.3	Very high	10 Å²	10	35.7 Å²	35.7	5%	0.052	22%	0.223	C	C	.	.			trans	-89.6	138.6	-175	-58.2	175.1	0	0	0	110.9	M525 R527 G543 G544 D546 G574 R575	M525-L551 HydrophobicContact CB-CD1 4.45Å; M525-L551 HydrophobicContact CE-CD1 4.49Å; M525-L551 HydrophobicContact CE-CD2 3.7Å; M525-L551 HydrophobicContact SD-CD2 4.46Å; R527-L551 HydrophobicContact CG-CD1 3.85Å; G543-L551 WeakPolarHBondContact CA-O 3.38Å; G544-L551 PolarHBondContact O-N 2.88Å; D546-L551 HydrophobicContact CB-CD1 4.5Å; D546-L551 HydrophobicContact CB-CD2 4.49Å; L551-G574 VanDerWaalsContact C-CA 3.5Å; L551-G574 WeakPolarHBondContact O-CA 3.34Å; L551-R575 PolarHBondContact O-N 2.88Å
552	A	97.8	Very high	96.1	Very high	28 Å²	28	39.2 Å²	39.2	23%	0.231	24%	0.242	C	C	.	.			trans	-93.8	-14.8	170.1	0	0	0	0	0	112.6	N570 M571	A552-N570 HydrophobicContact CB-CB 4.12Å; A552-M571 WeakPolarHBondContact O-CE 3.27Å; A552-M571 PolarHBondContact O-N 3.34Å
553	S	98.1	Very high	96	Very high	14 Å²	14	45.5 Å²	45.5	10%	0.098	27%	0.269	C	S	.	.			trans	-76.9	151.7	-174.8	61.5	0	0	0	0	112.6	M525 R527 G543 N570	M525-S553 PolarHBondContact SD-OG 3.49Å; M525-S553 VanDerWaalsContact SD-OG 3.38Å; R527-S553 PolarHBondContact NH1-O 3.2Å; R527-S553 PolarHBondContact NH2-OG 3.36Å; G543-S553 PolarHBondContact N-O 3.44Å; G543-S553 VanDerWaalsContact N-O 3.09Å; S553-N570 VanDerWaalsContact CA-OD1 3.26Å; S553-N570 WeakPolarHBondContact CA-OD1 3.46Å
554	V	98.5	Very high	96	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.3	170.1	-177.7	0	0	0	0	108	M303 W327 Y540 V541 V542 L567	M303-V554 HydrophobicContact CE-CG1 4.34Å; W327-V554 HydrophobicContact CH2-CG2 4.23Å; W327-V554 HydrophobicContact CZ2-CG2 3.75Å; Y540-V554 HydrophobicContact CD1-CG1 4.12Å; V541-V554 WeakPolarHBondContact O-CA 3.32Å; V542-V554 HydrophobicContact CB-CG2 4.19Å; V542-V554 HydrophobicContact CG1-CG2 3.83Å; V542-V554 HydrophobicContact CG2-CG1 3.83Å; V542-V554 HydrophobicContact CG2-CG2 4.13Å; V554-L567 HydrophobicContact CB-CB 3.96Å; V554-L567 HydrophobicContact CB-CD1 4.14Å; V554-L567 HydrophobicContact CG1-CB 4.4Å; V554-L567 HydrophobicContact CG1-CD1 3.98Å; V554-L567 WeakPolarHBondContact O-CB 3.44Å; V554-L567 PolarHBondContact O-N 2.79Å
555	E	98.5	Very high	96	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	150.5	169.4	59.8	-170.8	109.7	0	0	110.6	M523 N524 M525 R527 V541 W564 T565 L566	M523-E555 WeakPolarHBondContact CA-OE2 3.39Å; M523-E555 WeakPolarHBondContact CB-OE2 3.43Å; N524-E555 WeakPolarHBondContact CB-OE2 3.27Å; N524-E555 PolarHBondContact N-OE2 2.88Å; N524-E555 PolarHBondContact ND2-OE2 3.41Å; M525-E555 PolarHBondContact N-OE1 2.73Å; R527-E555 IonicContact CZ-OE1 3.73Å; R527-E555 VanDerWaalsContact CZ-OE1 3.27Å; R527-E555 IonicContact NE-OE1 3.8Å; R527-E555 PolarHBondContact NE-OE1 2.69Å; R527-E555 IonicContact NH2-OE1 3.28Å; R527-E555 PolarHBondContact NH2-OE1 3.02Å; V541-E555 HydrophobicContact CB-CG 4.46Å; V541-E555 PolarHBondContact N-O 2.96Å; V541-E555 PolarHBondContact O-N 2.77Å; V541-E555 VanDerWaalsContact O-N 3.09Å; E555-W564 HydrophobicContact CB-CE3 4.21Å; E555-W564 HydrophobicContact CG-CE3 3.73Å; E555-W564 HydrophobicContact CG-CZ3 4.07Å; E555-T565 CarbonylContact C-O 3.56Å; E555-T565 WeakPolarHBondContact CA-O 3.42Å; E555-T565 WeakPolarHBondContact CB-O 3.39Å; E555-L566 HydrophobicContact CB-CD2 4.09Å
556	Y	98.4	Very high	96	Very high	61 Å²	61	52.4 Å²	52.4	24%	0.239	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.5	178.2	67.3	-93.6	0	0	0	112	L538 L539 Y540 W564 T565	L538-Y556 HydrophobicContact CB-CD2 4.36Å; L538-Y556 HydrophobicContact CD1-CD2 3.76Å; L538-Y556 HydrophobicContact CD1-CE2 3.92Å; L538-Y556 HydrophobicContact CD1-CG 4.48Å; L538-Y556 HydrophobicContact CD2-CD2 4.14Å; L538-Y556 HydrophobicContact CD2-CE2 4.44Å; L538-Y556 HydrophobicContact CG-CD2 4.31Å; L539-Y556 CarbonylContact O-C 3.55Å; L539-Y556 WeakPolarHBondContact O-CA 3Å; Y540-Y556 HydrophobicContact CD1-CD1 4.46Å; Y540-Y556 HydrophobicContact CD1-CG 4.39Å; Y540-Y556 AromaticContact CE1-CD1 3.86Å; Y540-Y556 HydrophobicContact CE1-CD1 3.86Å; Y540-Y556 AromaticContact CE1-CG 3.92Å; Y540-Y556 HydrophobicContact CE1-CG 3.92Å; Y556-W564 VanDerWaalsContact C-CE3 3.48Å; Y556-W564 CarbonylContact O-C 3.48Å; Y556-W564 WeakPolarHBondContact O-CA 2.92Å; Y556-T565 WeakPolarHBondContact CD1-O 3.18Å; Y556-T565 HydrophobicContact CE1-CG2 3.94Å; Y556-T565 VanDerWaalsContact CZ-CB 3.46Å; Y556-T565 PolarHBondContact N-O 2.81Å; Y556-T565 PolarHBondContact O-N 3.2Å; Y556-T565 WeakPolarHBondContact OH-CG2 3.49Å
557	Y	98.7	Very high	95.9	Very high	7 Å²	7	50.5 Å²	50.5	3%	0.027	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.3	178.1	176.7	-109.6	0	0	0	111	Y493 V520 L538 L539 P559 D562 K563 W564	Y493-Y557 HydrophobicContact CD1-CE1 4.42Å; Y493-Y557 AromaticContact CE1-CD1 3.98Å; Y493-Y557 HydrophobicContact CE1-CD1 3.98Å; Y493-Y557 AromaticContact CE1-CE1 3.53Å; Y493-Y557 HydrophobicContact CE1-CE1 3.53Å; V520-Y557 HydrophobicContact CB-CE2 4.45Å; V520-Y557 HydrophobicContact CG2-CE2 4.37Å; L538-Y557 WeakPolarHBondContact CA-O 3.42Å; L539-Y557 PolarHBondContact N-O 2.96Å; L539-Y557 VanDerWaalsContact N-O 3.16Å; L539-Y557 PolarHBondContact O-N 2.87Å; Y557-P559 HydrophobicContact CD1-CB 4.41Å; Y557-P559 VanDerWaalsContact CE1-CA 3.44Å; Y557-P559 HydrophobicContact CE1-CB 3.75Å; Y557-D562 WeakPolarHBondContact CE2-OD1 3.31Å; Y557-D562 PolarHBondContact OH-OD1 3.28Å; Y557-K563 WeakPolarHBondContact CA-O 3.28Å; Y557-W564 AromaticContact CD2-CD1 3.91Å; Y557-W564 HydrophobicContact CD2-CD2 4.12Å; Y557-W564 AromaticContact CD2-CE2 3.66Å; Y557-W564 HydrophobicContact CD2-CG 4.27Å; Y557-W564 HydrophobicContact CD2-CZ2 4.07Å; Y557-W564 AromaticContact CD2-NE1 3.52Å; Y557-W564 HydrophobicContact CG-CD2 4.4Å; Y557-W564 AromaticContact CG-CE2 3.95Å; Y557-W564 HydrophobicContact CG-CH2 4.39Å; Y557-W564 AromaticContact CG-CZ2 3.93Å; Y557-W564 HydrophobicContact CG-CZ2 3.93Å
558	N	93.6	Very high	95.6	Very high	46 Å²	46	53.4 Å²	53.4	25%	0.246	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	111.6	169.7	-177.3	-23.8	0	0	0	109.7	L538 V560 T561 D562 K563	L538-N558 HydrophobicContact CD2-CB 3.7Å; N558-V560 PolarHBondContact O-N 3.5Å; N558-V560 VanDerWaalsContact OD1-CB 3.32Å; N558-V560 WeakPolarHBondContact OD1-CB 3.42Å; N558-V560 PolarHBondContact OD1-N 3.49Å; N558-T561 WeakPolarHBondContact CB-OG1 3.5Å; N558-T561 PolarHBondContact O-N 3.33Å; N558-T561 PolarHBondContact OD1-N 3.04Å; N558-D562 WeakPolarHBondContact O-CA 3.49Å; N558-D562 PolarHBondContact O-N 3.22Å; N558-K563 PolarHBondContact N-O 3.22Å; N558-K563 PolarHBondContact O-N 3.23Å
559	P	90.4	Very high	95.6	Very high	42 Å²	42	49.9 Å²	49.9	27%	0.273	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-20	-177.6	30.5	-38	0	0	0	113.8	L488 G537 Y557	L488-P559 HydrophobicContact CD2-CB 4.29Å; L488-P559 HydrophobicContact CD2-CG 3.69Å; G537-P559 WeakPolarHBondContact O-CD 3.28Å; Y557-P559 HydrophobicContact CD1-CB 4.41Å; Y557-P559 VanDerWaalsContact CE1-CA 3.44Å; Y557-P559 HydrophobicContact CE1-CB 3.75Å
560	V	91.2	Very high	95.7	Very high	134 Å²	134	51.2 Å²	51.2	81%	0.812	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-39.7	178.7	-178.5	0	0	0	0	110.6	N558	N558-V560 PolarHBondContact O-N 3.5Å; N558-V560 VanDerWaalsContact OD1-CB 3.32Å; N558-V560 WeakPolarHBondContact OD1-CB 3.42Å; N558-V560 PolarHBondContact OD1-N 3.49Å
561	T	91.1	Very high	95.6	Very high	76 Å²	76	49.3 Å²	49.3	47%	0.466	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-9.3	-177.8	59.5	0	0	0	0	113.7	N558 K563	N558-T561 WeakPolarHBondContact CB-OG1 3.5Å; N558-T561 PolarHBondContact O-N 3.33Å; N558-T561 PolarHBondContact OD1-N 3.04Å; T561-K563 PolarHBondContact O-N 3.18Å
562	D	94.3	Very high	95.4	Very high	74 Å²	74	53 Å²	53	40%	0.396	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	53.3	-171.9	-168.8	21.7	0	0	0	111.7	A521 Y557 N558	A521-D562 WeakPolarHBondContact CB-O 3.47Å; A521-D562 VanDerWaalsContact CB-OD1 3.26Å; A521-D562 WeakPolarHBondContact CB-OD1 3.48Å; A521-D562 PolarHBondContact N-OD1 3.23Å; Y557-D562 WeakPolarHBondContact CE2-OD1 3.31Å; Y557-D562 PolarHBondContact OH-OD1 3.28Å; N558-D562 WeakPolarHBondContact O-CA 3.49Å; N558-D562 PolarHBondContact O-N 3.22Å
563	K	96.7	Very high	95.1	Very high	137 Å²	137	54.7 Å²	54.7	60%	0.596	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.8	145.6	-176	-74.5	-177	-178.3	-177.4	0	112.4	Y557 N558 T561	Y557-K563 WeakPolarHBondContact CA-O 3.28Å; N558-K563 PolarHBondContact N-O 3.22Å; N558-K563 PolarHBondContact O-N 3.23Å; T561-K563 PolarHBondContact O-N 3.18Å
564	W	98.5	Very high	95	Very high	20 Å²	20	55 Å²	55	8%	0.076	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.1	172	-70.4	91.5	0	0	0	111.1	T495 V507 A521 D522 M523 N524 L539 V541 E555 Y556 Y557	T495-W564 HydrophobicContact CG2-CH2 3.95Å; T495-W564 HydrophobicContact CG2-CZ2 4.15Å; V507-W564 HydrophobicContact CB-CZ2 4.45Å; V507-W564 HydrophobicContact CG1-CZ2 4.25Å; V507-W564 HydrophobicContact CG2-CZ2 3.7Å; A521-W564 PolarHBondContact O-NE1 3.24Å; D522-W564 VanDerWaalsContact C-CD1 3.47Å; M523-W564 HydrophobicContact CB-CD2 4.44Å; M523-W564 HydrophobicContact CG-CD2 3.79Å; M523-W564 HydrophobicContact CG-CE3 4.04Å; M523-W564 HydrophobicContact CG-CG 4.43Å; M523-W564 HydrophobicContact CG-CH2 3.94Å; M523-W564 HydrophobicContact CG-CZ2 3.69Å; M523-W564 HydrophobicContact CG-CZ3 4.11Å; M523-W564 HydrophobicContact SD-CH2 4.26Å; M523-W564 HydrophobicContact SD-CZ2 4.47Å; M523-W564 HydrophobicContact SD-CZ3 4.47Å; N524-W564 VanDerWaalsContact ND2-CB 3.32Å; N524-W564 WeakPolarHBondContact ND2-CB 3.41Å; N524-W564 PolarHBondContact ND2-O 3.47Å; L539-W564 HydrophobicContact CD2-CH2 4.44Å; V541-W564 HydrophobicContact CB-CZ3 4.26Å; V541-W564 HydrophobicContact CG2-CH2 3.52Å; V541-W564 HydrophobicContact CG2-CZ3 3.58Å; E555-W564 HydrophobicContact CB-CE3 4.21Å; E555-W564 HydrophobicContact CG-CE3 3.73Å; E555-W564 HydrophobicContact CG-CZ3 4.07Å; Y556-W564 VanDerWaalsContact C-CE3 3.48Å; Y556-W564 CarbonylContact O-C 3.48Å; Y556-W564 WeakPolarHBondContact O-CA 2.92Å; Y557-W564 AromaticContact CD2-CD1 3.91Å; Y557-W564 HydrophobicContact CD2-CD2 4.12Å; Y557-W564 AromaticContact CD2-CE2 3.66Å; Y557-W564 HydrophobicContact CD2-CG 4.27Å; Y557-W564 HydrophobicContact CD2-CZ2 4.07Å; Y557-W564 AromaticContact CD2-NE1 3.52Å; Y557-W564 HydrophobicContact CG-CD2 4.4Å; Y557-W564 AromaticContact CG-CE2 3.95Å; Y557-W564 HydrophobicContact CG-CH2 4.39Å; Y557-W564 AromaticContact CG-CZ2 3.93Å; Y557-W564 HydrophobicContact CG-CZ2 3.93Å
565	T	97.9	Very high	94.9	Very high	60 Å²	60	55 Å²	55	37%	0.368	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.5	177.4	-51.6	0	0	0	0	109.5	E555 Y556	E555-T565 CarbonylContact C-O 3.56Å; E555-T565 WeakPolarHBondContact CA-O 3.42Å; E555-T565 WeakPolarHBondContact CB-O 3.39Å; Y556-T565 WeakPolarHBondContact CD1-O 3.18Å; Y556-T565 HydrophobicContact CE1-CG2 3.94Å; Y556-T565 VanDerWaalsContact CZ-CB 3.46Å; Y556-T565 PolarHBondContact N-O 2.81Å; Y556-T565 PolarHBondContact O-N 3.2Å; Y556-T565 WeakPolarHBondContact OH-CG2 3.49Å
566	L	97.1	Very high	94.9	Very high	80 Å²	80	55.1 Å²	55.1	42%	0.419	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	138.1	172.6	-80	164.2	0	0	0	109.9	E555	E555-L566 HydrophobicContact CB-CD2 4.09Å
567	L	94.6	Very high	94.9	Very high	9 Å²	9	54.1 Å²	54.1	5%	0.047	31%	0.31	C	S	.	.			trans	-69.5	136.1	169.7	-154.1	149.9	0	0	0	108.2	Y320 Y540 V554 T569	Y320-L567 HydrophobicContact CD1-CD1 4.26Å; Y320-L567 HydrophobicContact CD2-CD2 4.4Å; Y320-L567 HydrophobicContact CE1-CD1 3.7Å; Y320-L567 HydrophobicContact CE1-CD2 4.26Å; Y320-L567 HydrophobicContact CE1-CG 4.44Å; Y320-L567 HydrophobicContact CE2-CD1 4.37Å; Y320-L567 HydrophobicContact CE2-CD2 3.53Å; Y320-L567 VanDerWaalsContact CZ-CD2 3.44Å; Y320-L567 VanDerWaalsContact OH-CD2 3.3Å; Y320-L567 WeakPolarHBondContact OH-CD2 3.41Å; Y540-L567 HydrophobicContact CD1-CD1 4.34Å; Y540-L567 HydrophobicContact CE1-CD1 4.16Å; V554-L567 HydrophobicContact CB-CB 3.96Å; V554-L567 HydrophobicContact CB-CD1 4.14Å; V554-L567 HydrophobicContact CG1-CB 4.4Å; V554-L567 HydrophobicContact CG1-CD1 3.98Å; V554-L567 WeakPolarHBondContact O-CB 3.44Å; V554-L567 PolarHBondContact O-N 2.79Å; L567-T569 VanDerWaalsContact C-N 3.31Å; L567-T569 WeakPolarHBondContact CD2-O 3.39Å; L567-T569 VanDerWaalsContact CD2-OG1 3.29Å; L567-T569 WeakPolarHBondContact CD2-OG1 3.44Å; L567-T569 PolarHBondContact O-N 2.82Å
568	P	88.2	Confident	94.8	Very high	98 Å²	98	54.3 Å²	54.3	64%	0.636	31%	0.313	S	S	*	.	S	Bend	trans	-66.3	-32	-173.6	26.4	-37	0	0	0	113	D325	D325-P568 WeakPolarHBondContact OD2-CG 3.25Å
569	T	94.1	Very high	95	Very high	42 Å²	42	52.6 Å²	52.6	26%	0.258	31%	0.306	S	S	.	.	S	Bend	trans	-105.1	129.4	179.4	57.9	0	0	0	0	111.9	Y320 D325 W327 L567	Y320-T569 WeakPolarHBondContact CE2-OG1 3.34Å; D325-T569 VanDerWaalsContact O-CG2 3.28Å; D325-T569 WeakPolarHBondContact O-CG2 3.46Å; D325-T569 PolarHBondContact O-OG1 3.4Å; D325-T569 PolarHBondContact OD1-OG1 3.09Å; W327-T569 PolarHBondContact NE1-O 3.03Å; L567-T569 VanDerWaalsContact C-N 3.31Å; L567-T569 WeakPolarHBondContact CD2-O 3.39Å; L567-T569 VanDerWaalsContact CD2-OG1 3.29Å; L567-T569 WeakPolarHBondContact CD2-OG1 3.44Å; L567-T569 PolarHBondContact O-N 2.82Å
570	N	95.7	Very high	95.4	Very high	91 Å²	91	51.2 Å²	51.2	49%	0.487	30%	0.297	S	S	.	.			trans	-89.2	155.9	177.5	-66.3	-42.8	0	0	0	110.7	W327 A552 S553	W327-N570 PolarHBondContact NE1-O 3.13Å; A552-N570 HydrophobicContact CB-CB 4.12Å; S553-N570 VanDerWaalsContact CA-OD1 3.26Å; S553-N570 WeakPolarHBondContact CA-OD1 3.46Å
571	M	96.6	Very high	95.7	Very high	6 Å²	6	45 Å²	45	3%	0.03	26%	0.26	C	S	.	.			trans	-55.3	150.8	165.6	-68	-179.7	-68.4	0	0	110.3	V305 W327 V542 A552 T573 R575	V305-M571 HydrophobicContact CB-SD 4.43Å; V305-M571 HydrophobicContact CG1-SD 4Å; V305-M571 HydrophobicContact CG2-SD 4.18Å; W327-M571 HydrophobicContact CD2-CG 4.05Å; W327-M571 HydrophobicContact CE3-CG 4.02Å; W327-M571 HydrophobicContact CH2-CG 3.43Å; W327-M571 VanDerWaalsContact CH2-CG 3.43Å; W327-M571 HydrophobicContact CH2-SD 4.08Å; W327-M571 HydrophobicContact CZ2-CG 3.5Å; W327-M571 VanDerWaalsContact CZ2-CG 3.5Å; W327-M571 HydrophobicContact CZ3-CG 3.71Å; W327-M571 HydrophobicContact CZ3-SD 4.35Å; V542-M571 HydrophobicContact CG1-CE 3.93Å; V542-M571 HydrophobicContact CG1-SD 3.72Å; A552-M571 WeakPolarHBondContact O-CE 3.27Å; A552-M571 PolarHBondContact O-N 3.34Å; M571-T573 PolarHBondContact O-N 3.44Å; M571-R575 HydrophobicContact CE-CG 3.82Å; M571-R575 HydrophobicContact SD-CG 3.91Å
572	S	92.8	Very high	95.9	Very high	87 Å²	87	42.7 Å²	42.7	61%	0.608	25%	0.246	S	C	*	.	S	Bend	trans	-60.3	-32.7	178.5	62.3	0	0	0	0	112.5	E318	E318-S572 PolarHBondContact OE1-OG 3.24Å; E318-S572 VanDerWaalsContact OE2-CB 3.29Å; E318-S572 WeakPolarHBondContact OE2-CB 3.5Å; E318-S572 PolarHBondContact OE2-N 3.43Å; E318-S572 PolarHBondContact OE2-OG 3.1Å
573	T	91.9	Very high	95.7	Very high	64 Å²	64	39.9 Å²	39.9	39%	0.393	23%	0.231	S	C	.	.	S	Bend	trans	-133.8	129.4	-179.8	-56.9	0	0	0	0	111.4	A310 M571 R575	A310-T573 HydrophobicContact CB-CG2 3.67Å; M571-T573 PolarHBondContact O-N 3.44Å; T573-R575 PolarHBondContact O-N 3.18Å
574	G	95.7	Very high	95.1	Very high	20 Å²	20	37.4 Å²	37.4	21%	0.206	22%	0.221	C	C	.	.			trans	-62.8	122.7	173.1	0	0	0	0	0	112.2	A310 N550 L551	A310-G574 WeakPolarHBondContact CB-O 3.36Å; N550-G574 WeakPolarHBondContact CB-O 3.5Å; L551-G574 VanDerWaalsContact C-CA 3.5Å; L551-G574 WeakPolarHBondContact O-CA 3.34Å
575	R	97.2	Very high	94	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.008	23%	0.23	C	C	.	.			trans	-139.5	139.2	-171.5	59.2	-179.1	72.6	-158	3	112.6	G307 Q309 S316 E318 G544 L551 M571 T573 A578	G307-R575 PolarHBondContact O-NH1 3.48Å; Q309-R575 WeakPolarHBondContact O-CA 3.35Å; S316-R575 PolarHBondContact O-NH1 3.46Å; S316-R575 PolarHBondContact OG-NH2 2.9Å; E318-R575 IonicContact OE1-CZ 3.56Å; E318-R575 IonicContact OE1-NE 3.96Å; E318-R575 PolarHBondContact OE1-NE 3.27Å; E318-R575 IonicContact OE1-NH2 3.48Å; E318-R575 PolarHBondContact OE1-NH2 3.45Å; G544-R575 PolarHBondContact N-O 3.26Å; L551-R575 PolarHBondContact O-N 2.88Å; M571-R575 HydrophobicContact CE-CG 3.82Å; M571-R575 HydrophobicContact SD-CG 3.91Å; T573-R575 PolarHBondContact O-N 3.18Å; R575-A578 HydrophobicContact CG-CB 4.21Å
576	S	97.9	Very high	92.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-116.7	161.2	174	-179.6	0	0	0	0	110.4	G308 Q309 N529 D545 A578	G308-S576 CarbonylContact C-O 3.58Å; G308-S576 WeakPolarHBondContact CA-O 3.37Å; Q309-S576 WeakPolarHBondContact CB-O 3.44Å; Q309-S576 PolarHBondContact N-O 3.2Å; Q309-S576 PolarHBondContact O-N 2.91Å; N529-S576 WeakPolarHBondContact CB-OG 3.24Å; D545-S576 PolarHBondContact OD2-OG 3.35Å; S576-A578 PolarHBondContact O-N 3.42Å; S576-A578 VanDerWaalsContact O-N 3.11Å
577	Y	98.3	Very high	89.9	Confident	41 Å²	41	44.1 Å²	44.1	16%	0.161	26%	0.257	C	S	.	.	S	Bend	trans	53.9	28.6	-177.1	-63.1	-81.5	0	0	0	114.1	R339 T386 N529	R339-Y577 HydrophobicContact CB-CD1 4.25Å; R339-Y577 HydrophobicContact CG-CD1 3.52Å; R339-Y577 HydrophobicContact CG-CD2 4.28Å; R339-Y577 HydrophobicContact CG-CE1 4.07Å; R339-Y577 HydrophobicContact CG-CG 3.61Å; R339-Y577 PolarHBondContact N-O 3.27Å; T386-Y577 HydrophobicContact CG2-CD1 4.38Å; T386-Y577 HydrophobicContact CG2-CE1 3.94Å; N529-Y577 HydrophobicContact CB-CD1 3.62Å; N529-Y577 HydrophobicContact CB-CD2 3.98Å; N529-Y577 HydrophobicContact CB-CE1 3.66Å; N529-Y577 HydrophobicContact CB-CE2 4Å; N529-Y577 HydrophobicContact CB-CG 3.81Å; N529-Y577 WeakPolarHBondContact ND2-CE2 2.93Å; N529-Y577 PolarHBondContact ND2-OH 2.88Å; N529-Y577 VanDerWaalsContact ND2-OH 3.13Å; N529-Y577 PolarHBondContact O-N 2.98Å; N529-Y577 WeakPolarHBondContact OD1-CE1 3.41Å; N529-Y577 VanDerWaalsContact OD1-CZ 3.3Å; N529-Y577 PolarHBondContact OD1-OH 3.37Å
578	A	97.8	Very high	89.6	Confident	11 Å²	11	45.9 Å²	45.9	9%	0.091	27%	0.268	C	S	.	.			trans	-87.3	140.7	170.2	0	0	0	0	0	108.7	V305 G307 R575 S576	V305-A578 HydrophobicContact CG1-CB 3.76Å; G307-A578 WeakPolarHBondContact O-CB 3.42Å; R575-A578 HydrophobicContact CG-CB 4.21Å; S576-A578 PolarHBondContact O-N 3.42Å; S576-A578 VanDerWaalsContact O-N 3.11Å
579	G	97.5	Very high	89.7	Confident	9 Å²	9	43.2 Å²	43.2	9%	0.093	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	154.7	172.1	0	0	0	0	0	110.8	V306	V306-G579 PolarHBondContact N-O 2.97Å; V306-G579 PolarHBondContact O-N 3.32Å
580	V	98.1	Very high	89.5	Confident	13 Å²	13	43.2 Å²	43.2	8%	0.079	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139	-175.6	179.3	0	0	0	0	109.7	M303 I304 V305 C533 V542	M303-V580 HydrophobicContact CG-CG1 3.56Å; M303-V580 HydrophobicContact SD-CG1 3.91Å; I304-V580 VanDerWaalsContact O-CA 3.26Å; I304-V580 WeakPolarHBondContact O-CA 3.24Å; V305-V580 HydrophobicContact CG1-CG2 4.29Å; V305-V580 HydrophobicContact CG2-CG2 4.18Å; C533-V580 HydrophobicContact CB-CG1 3.91Å; V542-V580 HydrophobicContact CB-CG2 3.89Å; V542-V580 HydrophobicContact CG1-CG2 4.12Å; V542-V580 HydrophobicContact CG2-CG1 4.32Å; V542-V580 HydrophobicContact CG2-CG2 4.08Å
581	A	97.2	Very high	89.1	Confident	5 Å²	5	40.4 Å²	40.4	4%	0.041	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.4	172.8	0	0	0	0	0	109.8	I304 V342 F344 V349	I304-A581 PolarHBondContact N-O 3.35Å; I304-A581 PolarHBondContact O-N 3.16Å; V342-A581 HydrophobicContact CG1-CB 4.15Å; F344-A581 HydrophobicContact CB-CB 4.37Å; V349-A581 HydrophobicContact CG1-CB 3.82Å; V349-A581 HydrophobicContact CG2-CB 3.9Å
582	V	94.9	Very high	88.6	Confident	27 Å²	27	42.6 Å²	42.6	16%	0.164	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.2	172.4	178.1	0	0	0	0	107.3	K301 V302 C533 V535	K301-V582 HydrophobicContact CB-CG1 3.86Å; K301-V582 HydrophobicContact CD-CG1 4.09Å; K301-V582 HydrophobicContact CG-CG1 4.25Å; V302-V582 WeakPolarHBondContact O-CA 3.34Å; C533-V582 HydrophobicContact CB-CG2 3.84Å; V535-V582 HydrophobicContact CB-CG1 4.27Å; V535-V582 HydrophobicContact CB-CG2 4.22Å; V535-V582 HydrophobicContact CG2-CG1 4.07Å
583	I	91	Very high	88.3	Confident	15 Å²	15	39.6 Å²	39.6	8%	0.077	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	169.7	176	70.3	161.1	0	0	0	110.1	K301 V302 I304 F344 V349 Y367	K301-I583 CarbonylContact C-O 3.42Å; K301-I583 VanDerWaalsContact CA-O 3.3Å; K301-I583 WeakPolarHBondContact CA-O 3.49Å; V302-I583 HydrophobicContact CG2-CD1 4.13Å; V302-I583 HydrophobicContact CG2-CG1 3.47Å; V302-I583 VanDerWaalsContact CG2-CG1 3.47Å; V302-I583 PolarHBondContact N-O 3.4Å; V302-I583 PolarHBondContact O-N 3.49Å; I304-I583 HydrophobicContact CD1-CD1 3.32Å; I304-I583 HydrophobicContact CD1-CG1 3.62Å; I304-I583 HydrophobicContact CD1-CG2 4.17Å; I304-I583 HydrophobicContact CG1-CD1 4.33Å; I304-I583 HydrophobicContact CG1-CG1 4.17Å; F344-I583 HydrophobicContact CD2-CG2 3.62Å; F344-I583 HydrophobicContact CE2-CB 4.29Å; F344-I583 HydrophobicContact CE2-CG2 3.82Å; V349-I583 HydrophobicContact CG2-CG2 3.36Å; Y367-I583 HydrophobicContact CE1-CD1 4.33Å
584	H	83.1	Confident	88.1	Confident	84 Å²	84	37.9 Å²	37.9	39%	0.389	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	137.9	166.2	-66.2	-68.2	0	0	0	109.6	L299 S586	L299-H584 HydrophobicContact CB-CB 3.85Å; L299-H584 HydrophobicContact CD1-CB 4.16Å; L299-H584 PolarHBondContact O-ND1 3.42Å; H584-S586 PolarHBondContact O-N 3.3Å
585	K	75.6	Confident	87.5	Confident	62 Å²	62	39.2 Å²	39.2	27%	0.27	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-62.3	122.9	168.8	-166	171	-179.6	176.6	0	107.3	P300 V302 D321 E324	P300-K585 HydrophobicContact CB-CB 4.11Å; P300-K585 HydrophobicContact CB-CD 4.17Å; P300-K585 WeakPolarHBondContact O-CA 3.3Å; P300-K585 WeakPolarHBondContact O-CB 3.41Å; P300-K585 PolarHBondContact O-N 3.38Å; V302-K585 HydrophobicContact CG1-CB 3.96Å; V302-K585 HydrophobicContact CG1-CD 4.25Å; V302-K585 HydrophobicContact CG1-CG 4.21Å; D321-K585 VanDerWaalsContact OD2-CE 3.29Å; D321-K585 WeakPolarHBondContact OD2-CE 3.48Å; D321-K585 IonicContact OD2-NZ 3.1Å; D321-K585 PolarHBondContact OD2-NZ 3.12Å; E324-K585 IonicContact OE1-NZ 2.58Å; E324-K585 PolarHBondContact OE1-NZ 2.76Å
586	S	63.1	Low	86.7	Confident	60 Å²	60	42.3 Å²	42.3	42%	0.42	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-62.7	133	168.5	11.1	0	0	0	0	108.2	G369 H584	G369-S586 PolarHBondContact O-OG 3.31Å; H584-S586 PolarHBondContact O-N 3.3Å
587	L	45.9	Very low	85.7	Confident	180 Å²	180	46.1 Å²	46.1	94%	0.942	25%	0.248	S	C	*	.			trans	-66.4	0	173.2	-76.7	168.1	0	0	0	111.2	L299	L299-L587 HydrophobicContact CD2-CD1 3.78Å; L299-L587 HydrophobicContact CD2-CD2 3.96Å; L299-L587 HydrophobicContact CD2-CG 3.56Å

Retrieved 587 of 587 residues in 233.4 ms (Link to these results)

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