A0A087Y2I9_POEFO Loading...

RuvB-like helicase

Proposed core component of the chromatin remodeling Ino80 complex which exhibits DNA- and nucleosome-activated ATPase activity and catalyzes ATP-dependent nucleosome sliding.

AlphaFold DB (A0A3B3VV41), UniProt , Accession A0A087Y2I9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 459 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.2	Very low	32.8	Very low	252 Å²	252	154.5 Å²	154.5	100%	1.241	85%	0.845	S	S	*	*				0	96.2	0	-70.7	-179	-175.3	0	0	107.7
2	A	32.4	Very low	33	Very low	97 Å²	97	155.1 Å²	155.1	80%	0.802	84%	0.844	S	S	*	*			trans	-94.7	118	173.2	0	0	0	0	0	107.1	T4	A2-T4 PolarHBondContact O-N 2.66Å; A2-T4 VanDerWaalsContact O-N 3.14Å
3	A	34.1	Very low	33.2	Very low	102 Å²	102	152.6 Å²	152.6	84%	0.843	84%	0.837	S	S	*	*			trans	-66	110.3	177.2	0	0	0	0	0	109.1	K5	A3-K5 PolarHBondContact O-N 3.09Å; A3-K5 VanDerWaalsContact O-N 3.11Å
4	T	34.4	Very low	33.9	Very low	137 Å²	137	156.5 Å²	156.5	84%	0.84	83%	0.833	S	S	*	*			trans	-65.3	107.8	175.1	-25.5	0	0	0	0	107.9	A2 V6	A2-T4 PolarHBondContact O-N 2.66Å; A2-T4 VanDerWaalsContact O-N 3.14Å; T4-V6 PolarHBondContact O-N 3.25Å
5	K	31.1	Very low	34.9	Very low	199 Å²	199	157.6 Å²	157.6	87%	0.865	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-60.8	117.1	172.5	-85	-177.8	171.8	-176	0	108.5	A3	A3-K5 PolarHBondContact O-N 3.09Å; A3-K5 VanDerWaalsContact O-N 3.11Å
6	V	32.1	Very low	36.1	Very low	125 Å²	125	158.1 Å²	158.1	76%	0.758	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-55.6	126.7	167	-178	0	0	0	0	107.3	T4 E8	T4-V6 PolarHBondContact O-N 3.25Å; V6-E8 PolarHBondContact O-N 2.91Å
7	P	31.6	Very low	38.1	Very low	110 Å²	110	162.5 Å²	162.5	71%	0.714	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-63.3	122.7	174.6	24.4	-29.4	0	0	0	108.2	V9	P7-V9 PolarHBondContact O-N 3.09Å; P7-V9 VanDerWaalsContact O-N 3.1Å
8	E	31.1	Very low	40.1	Very low	186 Å²	186	158.9 Å²	158.9	87%	0.869	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-50.7	118.7	170.8	-78.9	174.4	162.8	0	0	108.2	V6 R10	V6-E8 PolarHBondContact O-N 2.91Å; E8-R10 PolarHBondContact O-N 3.23Å
9	V	31.8	Very low	42.2	Very low	122 Å²	122	152.3 Å²	152.3	74%	0.739	79%	0.791	S	S	*	*			trans	-56.7	107.1	170.5	177.4	0	0	0	0	105.4	P7 D11	P7-V9 PolarHBondContact O-N 3.09Å; P7-V9 VanDerWaalsContact O-N 3.1Å; V9-D11 PolarHBondContact O-N 3.25Å
10	R	33.7	Very low	44	Very low	225 Å²	225	148 Å²	148	85%	0.849	78%	0.779	S	S	*	*			trans	-56	115.5	168.2	-79.3	-178.5	173	178.7	-2.4	106	E8 I12	E8-R10 PolarHBondContact O-N 3.23Å; R10-I12 PolarHBondContact O-N 3.09Å
11	D	33.8	Very low	46	Very low	144 Å²	144	143.4 Å²	143.4	77%	0.77	75%	0.754	S	S	*	*			trans	-48	116.4	170.8	-74.3	-43.5	0	0	0	107.4	V9 T13	V9-D11 PolarHBondContact O-N 3.25Å; D11-T13 PolarHBondContact O-N 2.99Å
12	I	35.8	Very low	48.4	Very low	162 Å²	162	133.7 Å²	133.7	83%	0.831	71%	0.71	S	S	*	*			trans	-69	84.8	172.7	-57.7	164.6	0	0	0	104	R10 R14	R10-I12 PolarHBondContact O-N 3.09Å; I12-R14 PolarHBondContact O-N 3.41Å
13	T	35.8	Very low	51.1	Low	123 Å²	123	130.1 Å²	130.1	76%	0.755	68%	0.677	S	S	*	*			trans	-54	113.1	169.7	47.4	0	0	0	0	105.7	D11 I15	D11-T13 PolarHBondContact O-N 2.99Å; T13-I15 PolarHBondContact O-N 3.47Å
14	R	42.8	Very low	53.9	Low	207 Å²	207	125.4 Å²	125.4	78%	0.781	64%	0.638	S	S	*	*			trans	-47.4	141.3	167.4	-70.6	-177.6	176.4	-175.9	-0.6	107.2	I12 E16	I12-R14 PolarHBondContact O-N 3.41Å; R14-E16 PolarHBondContact O-N 2.88Å
15	I	48.5	Very low	56.6	Low	173 Å²	173	127.5 Å²	127.5	89%	0.887	63%	0.63	S	S	*	*	S	Bend	trans	-57.2	-21.9	-177.1	-68.2	167.3	0	0	0	111.3	T13 R17	T13-I15 PolarHBondContact O-N 3.47Å; I15-R17 PolarHBondContact O-N 3.04Å
16	E	54.1	Low	59.6	Low	166 Å²	166	118.1 Å²	118.1	78%	0.776	59%	0.589	S	S	*	*			trans	-67.2	97.6	172.6	-65.9	176.4	177.2	0	0	111.2	R14	R14-E16 PolarHBondContact O-N 2.88Å
17	R	69.5	Low	62.5	Low	232 Å²	232	112.2 Å²	112.2	88%	0.875	55%	0.554	S	S	*	*			trans	-70.9	144.8	165.7	-64.4	179.8	-179.6	173	1.1	109.4	I15 G19	I15-R17 PolarHBondContact O-N 3.04Å; R17-G19 PolarHBondContact O-N 3.04Å
18	I	75.1	Confident	65.5	Low	99 Å²	99	107 Å²	107	51%	0.508	52%	0.52	S	S	.	.			trans	-61.2	112.8	175.1	-60.7	165.5	0	0	0	108.7	E373 E374	I18-E373 WeakPolarHBondContact CD1-O 3.48Å; I18-E373 HydrophobicContact CG2-CG 3.95Å; I18-E374 HydrophobicContact CG2-CG 4.04Å
19	G	79.7	Confident	68.5	Low	32 Å²	32	99.8 Å²	99.8	33%	0.33	49%	0.487	S	S	.	.			trans	-99.1	175	179.8	0	0	0	0	0	112.2	R17 H21 S22 R370	R17-G19 PolarHBondContact O-N 3.04Å; G19-H21 PolarHBondContact O-N 3.21Å; G19-H21 VanDerWaalsContact O-N 3.1Å; G19-S22 PolarHBondContact N-OG 3.41Å; G19-S22 PolarHBondContact O-OG 3.07Å; G19-R370 PolarHBondContact O-NH1 3.01Å; G19-R370 PolarHBondContact O-NH2 3.36Å
20	A	78.8	Confident	71.4	Confident	66 Å²	66	96.3 Å²	96.3	55%	0.545	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.1	176.3	0	0	0	0	0	113.2	H23 R370	A20-H23 PolarHBondContact O-CE1 2.9Å; A20-H23 PolarHBondContact O-ND1 3.45Å; A20-R370 PolarHBondContact O-NH1 3.13Å
21	H	85.4	Confident	74.1	Confident	53 Å²	53	94 Å²	94	25%	0.245	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130	9.6	-173.4	-61.6	-58.5	0	0	0	113.6	G19 H23 I24 M84	G19-H21 PolarHBondContact O-N 3.21Å; G19-H21 VanDerWaalsContact O-N 3.1Å; H21-H23 PolarHBondContact O-N 3.45Å; H21-I24 HydrophobicContact CB-CD1 4Å; H21-I24 WeakPolarHBondContact O-CB 3.49Å; H21-I24 PolarHBondContact O-N 2.71Å; H21-I24 VanDerWaalsContact O-N 3.1Å; H21-M84 HydrophobicContact CB-CE 3.26Å; H21-M84 HydrophobicContact CB-SD 3.16Å; H21-M84 WeakPolarHBondContact CB-SD 3.08Å; H21-M84 PolarHBondContact CD2-SD 3.32Å
22	S	84.9	Confident	76.8	Confident	47 Å²	47	90.5 Å²	90.5	33%	0.329	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-32.5	-179.8	58	0	0	0	0	113.4	G19 I24 E373	G19-S22 PolarHBondContact N-OG 3.41Å; G19-S22 PolarHBondContact O-OG 3.07Å; S22-I24 PolarHBondContact O-N 3.36Å; S22-I24 VanDerWaalsContact O-N 3.17Å; S22-E373 WeakPolarHBondContact CB-OE1 3.47Å; S22-E373 PolarHBondContact OG-OE1 2.64Å
23	H	89	Confident	79.5	Confident	22 Å²	22	85.1 Å²	85.1	10%	0.102	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.8	175.1	64.4	-66.6	0	0	0	114.9	A20 H21 G41 I369 R370 E373	A20-H23 PolarHBondContact O-CE1 2.9Å; A20-H23 PolarHBondContact O-ND1 3.45Å; H21-H23 PolarHBondContact O-N 3.45Å; H23-G41 WeakPolarHBondContact O-CA 3.35Å; H23-I369 HydrophobicContact CB-CG2 4.22Å; H23-R370 PolarHBondContact ND1-NH1 2.88Å; H23-R370 VanDerWaalsContact ND1-NH1 3.11Å; H23-E373 HydrophobicContact CB-CB 4.19Å; H23-E373 HydrophobicContact CB-CG 3.95Å; H23-E373 PolarHBondContact N-OE1 3.3Å
24	I	92.4	Very high	82.3	Confident	4 Å²	4	84 Å²	84	2%	0.021	42%	0.418	C	S	.	.			trans	-85.8	119.4	-176.2	-56.8	174	0	0	0	109.1	H21 S22 L42 A81	H21-I24 HydrophobicContact CB-CD1 4Å; H21-I24 WeakPolarHBondContact O-CB 3.49Å; H21-I24 PolarHBondContact O-N 2.71Å; H21-I24 VanDerWaalsContact O-N 3.1Å; S22-I24 PolarHBondContact O-N 3.36Å; S22-I24 VanDerWaalsContact O-N 3.17Å; I24-L42 HydrophobicContact CD1-CD2 4.1Å; I24-L42 HydrophobicContact CG1-CD2 4.28Å; I24-L42 HydrophobicContact CG2-CD2 4.31Å; I24-L42 HydrophobicContact CG2-CG 4.27Å; I24-A81 HydrophobicContact CD1-CB 3.38Å
25	R	91.3	Very high	84.8	Confident	181 Å²	181	75.3 Å²	75.3	68%	0.683	39%	0.389	S	S	*	.			trans	-114.6	1.3	-177.9	-57.6	-174.1	-174.7	176.8	3.6	113.6	Q40	R25-Q40 HydrophobicContact CB-CB 4.43Å; R25-Q40 PolarHBondContact N-O 3.03Å
26	G	93.4	Very high	87	Confident	1 Å²	1	74.2 Å²	74.2	1%	0.01	37%	0.374	C	S	.	.	S	Bend	trans	159.4	-176	-179.7	0	0	0	0	0	112.4	L42 S89	G26-L42 WeakPolarHBondContact O-CD1 3.15Å; G26-S89 VanDerWaalsContact CA-OG 3.31Å; G26-S89 WeakPolarHBondContact CA-OG 3.39Å
27	L	94.3	Very high	88.9	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	36%	0.358	C	S	.	.			trans	-78.6	-15.5	179.8	-74.6	178.8	0	0	0	114.2	L29 L42 R49 A52 L56 I82 I86 S89	L27-L29 HydrophobicContact CB-CD1 3.89Å; L27-L29 HydrophobicContact CB-CG 3.84Å; L27-L29 HydrophobicContact CD1-CD1 3.91Å; L27-L42 HydrophobicContact CD2-CD1 4.09Å; L27-R49 VanDerWaalsContact O-CZ 3.27Å; L27-R49 PolarHBondContact O-NE 3.45Å; L27-R49 PolarHBondContact O-NH2 3.38Å; L27-A52 HydrophobicContact CD1-CB 3.97Å; L27-A52 HydrophobicContact CD2-CB 4.02Å; L27-L56 HydrophobicContact CD1-CB 4.22Å; L27-L56 HydrophobicContact CD1-CD2 4.04Å; L27-I82 HydrophobicContact CD2-CG2 4.33Å; L27-I86 HydrophobicContact CD1-CG1 3.98Å; L27-I86 HydrophobicContact CD2-CG1 4.12Å; L27-I86 HydrophobicContact CG-CG1 4.37Å; L27-S89 PolarHBondContact N-OG 2.86Å
28	G	93.8	Very high	90.1	Very high	0 Å²	0	63 Å²	63	0%	0	34%	0.336	C	S	.	.			trans	66.8	35.6	179.3	0	0	0	0	0	113.9	R36 Q40 R49	G28-R36 PolarHBondContact O-N 2.97Å; G28-Q40 VanDerWaalsContact CA-OE1 3.28Å; G28-R49 PolarHBondContact O-NH2 2.91Å
29	L	94.7	Very high	91	Very high	35 Å²	35	59.6 Å²	59.6	18%	0.183	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-89.9	156.3	177.1	-56.6	171.4	0	0	0	110.3	L27 L33 P35	L27-L29 HydrophobicContact CB-CD1 3.89Å; L27-L29 HydrophobicContact CB-CG 3.84Å; L27-L29 HydrophobicContact CD1-CD1 3.91Å; L29-L33 HydrophobicContact CD1-CD2 4.3Å; L29-P35 HydrophobicContact CD2-CB 3.75Å; L29-P35 HydrophobicContact CD2-CG 4.47Å
30	D	92.9	Very high	91.5	Very high	50 Å²	50	62.6 Å²	62.6	27%	0.267	33%	0.326	S	S	.	.			trans	-91.8	-179.3	163.4	65.5	20.9	0	0	0	112	A32 L33 E34	D30-A32 PolarHBondContact O-N 3.13Å; D30-A32 WeakPolarHBondContact OD1-CA 3.4Å; D30-A32 WeakPolarHBondContact OD1-CB 3.49Å; D30-A32 PolarHBondContact OD1-N 3.4Å; D30-L33 PolarHBondContact O-N 3.46Å; D30-L33 PolarHBondContact OD1-N 3.27Å; D30-E34 PolarHBondContact N-O 3.4Å; D30-E34 WeakPolarHBondContact OD1-CA 3.45Å; D30-E34 PolarHBondContact OD1-N 3.15Å
31	D	89.4	Confident	92.2	Very high	177 Å²	177	60.2 Å²	60.2	95%	0.947	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.8	-178.4	-54.2	-32.7	0	0	0	112.9	L33	D31-L33 VanDerWaalsContact C-N 3.33Å
32	A	91.6	Very high	92.6	Very high	69 Å²	69	58.1 Å²	58.1	57%	0.57	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	9.3	175.6	0	0	0	0	0	112.8	D30 E34	D30-A32 PolarHBondContact O-N 3.13Å; D30-A32 WeakPolarHBondContact OD1-CA 3.4Å; D30-A32 WeakPolarHBondContact OD1-CB 3.49Å; D30-A32 PolarHBondContact OD1-N 3.4Å; A32-E34 HydrophobicContact CB-CG 4.29Å; A32-E34 PolarHBondContact O-N 2.93Å
33	L	91.9	Very high	93.1	Very high	49 Å²	49	56.3 Å²	56.3	26%	0.257	29%	0.285	S	S	.	.	S	Bend	trans	61.1	23.2	-173.3	-57.4	173.1	0	0	0	113.4	L29 D30 D31	L29-L33 HydrophobicContact CD1-CD2 4.3Å; D30-L33 PolarHBondContact O-N 3.46Å; D30-L33 PolarHBondContact OD1-N 3.27Å; D31-L33 VanDerWaalsContact C-N 3.33Å
34	E	94.9	Very high	93.4	Very high	99 Å²	99	55.2 Å²	55.2	46%	0.463	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-89.4	125.3	174.5	-58.4	-159.8	150.5	0	0	110.7	D30 A32 R36	D30-E34 PolarHBondContact N-O 3.4Å; D30-E34 WeakPolarHBondContact OD1-CA 3.45Å; D30-E34 PolarHBondContact OD1-N 3.15Å; A32-E34 HydrophobicContact CB-CG 4.29Å; A32-E34 PolarHBondContact O-N 2.93Å; E34-R36 PolarHBondContact O-N 3.5Å
35	P	95.7	Very high	93.6	Very high	25 Å²	25	55.8 Å²	55.8	16%	0.162	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-76.3	127.3	179.9	27.8	-31.5	0	0	0	111.1	L29 L46 R49 R50	L29-P35 HydrophobicContact CD2-CB 3.75Å; L29-P35 HydrophobicContact CD2-CG 4.47Å; P35-L46 HydrophobicContact CB-CD2 4.08Å; P35-L46 HydrophobicContact CG-CB 3.96Å; P35-L46 HydrophobicContact CG-CD2 4Å; P35-L46 WeakPolarHBondContact CG-O 3.47Å; P35-R49 HydrophobicContact CB-CB 3.98Å; P35-R50 HydrophobicContact CG-CB 4.19Å
36	R	94.6	Very high	93.8	Very high	150 Å²	150	50.7 Å²	50.7	57%	0.566	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-72.6	145	168.6	-62.1	-176.5	-176.3	-178.5	2.5	110.3	G28 E34 V38 R49	G28-R36 PolarHBondContact O-N 2.97Å; E34-R36 PolarHBondContact O-N 3.5Å; R36-V38 PolarHBondContact O-N 3.4Å; R36-V38 VanDerWaalsContact O-N 3.17Å; R36-R49 PolarHBondContact O-NH1 2.81Å; R36-R49 PolarHBondContact O-NH2 3.47Å
37	Q	93.3	Very high	93.9	Very high	97 Å²	97	54.4 Å²	54.4	45%	0.453	30%	0.3	S	S	.	.	S	Bend	trans	-53.9	-39.9	-177.9	-171.8	64	22	0	0	113.2	V43 G44	Q37-V43 WeakPolarHBondContact O-CA 3.31Å; Q37-G44 PolarHBondContact O-N 3.15Å
38	V	94.8	Very high	94	Very high	66 Å²	66	54.5 Å²	54.5	40%	0.4	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	116.3	174.9	-178.5	0	0	0	0	107.5	R36 V43 Q365 I369	R36-V38 PolarHBondContact O-N 3.4Å; R36-V38 VanDerWaalsContact O-N 3.17Å; V38-V43 HydrophobicContact CG1-CG2 4.24Å; V38-V43 HydrophobicContact CG2-CG1 4.24Å; V38-V43 HydrophobicContact CG2-CG2 4.3Å; V38-Q365 HydrophobicContact CG2-CG 3.84Å; V38-I369 HydrophobicContact CG1-CD1 4.13Å
39	S	94.2	Very high	94.1	Very high	28 Å²	28	54.5 Å²	54.5	20%	0.196	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	144.6	176.1	-175.4	0	0	0	0	110.9	G41 L42	S39-G41 PolarHBondContact O-N 3.41Å; S39-G41 VanDerWaalsContact O-N 3.07Å; S39-L42 PolarHBondContact N-O 3.17Å; S39-L42 VanDerWaalsContact N-O 3.12Å; S39-L42 PolarHBondContact O-N 3.45Å
40	Q	91.3	Very high	94.2	Very high	94 Å²	94	59 Å²	59	44%	0.439	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	32.7	176.9	-62.9	-177.6	-39.7	0	0	114.8	R25 G28 L42	R25-Q40 HydrophobicContact CB-CB 4.43Å; R25-Q40 PolarHBondContact N-O 3.03Å; G28-Q40 VanDerWaalsContact CA-OE1 3.28Å; Q40-L42 VanDerWaalsContact C-N 3.32Å; Q40-L42 PolarHBondContact O-N 3.2Å
41	G	92.2	Very high	94.3	Very high	17 Å²	17	58.3 Å²	58.3	18%	0.175	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	-12.5	178.5	0	0	0	0	0	115.3	H23 S39	H23-G41 WeakPolarHBondContact O-CA 3.35Å; S39-G41 PolarHBondContact O-N 3.41Å; S39-G41 VanDerWaalsContact O-N 3.07Å
42	L	94.8	Very high	94.6	Very high	9 Å²	9	49.9 Å²	49.9	5%	0.047	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	144	173.2	-67.3	179.1	0	0	0	111.7	I24 G26 L27 S39 Q40 R49 A81	I24-L42 HydrophobicContact CD1-CD2 4.1Å; I24-L42 HydrophobicContact CG1-CD2 4.28Å; I24-L42 HydrophobicContact CG2-CD2 4.31Å; I24-L42 HydrophobicContact CG2-CG 4.27Å; G26-L42 WeakPolarHBondContact O-CD1 3.15Å; L27-L42 HydrophobicContact CD2-CD1 4.09Å; S39-L42 PolarHBondContact N-O 3.17Å; S39-L42 VanDerWaalsContact N-O 3.12Å; S39-L42 PolarHBondContact O-N 3.45Å; Q40-L42 VanDerWaalsContact C-N 3.32Å; Q40-L42 PolarHBondContact O-N 3.2Å; L42-R49 HydrophobicContact CD1-CG 4.2Å; L42-A81 HydrophobicContact CD2-CB 4.14Å
43	V	95	Very high	94.7	Very high	8 Å²	8	46.6 Å²	46.6	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.3	-179.5	179.2	0	0	0	0	109.1	Q37 V38 E362 Q365 I366 I369	Q37-V43 WeakPolarHBondContact O-CA 3.31Å; V38-V43 HydrophobicContact CG1-CG2 4.24Å; V38-V43 HydrophobicContact CG2-CG1 4.24Å; V38-V43 HydrophobicContact CG2-CG2 4.3Å; V43-E362 HydrophobicContact CG1-CB 4.23Å; V43-E362 HydrophobicContact CG1-CG 4.3Å; V43-Q365 HydrophobicContact CG1-CB 4.04Å; V43-Q365 HydrophobicContact CG1-CG 3.98Å; V43-Q365 HydrophobicContact CG2-CG 3.94Å; V43-I366 HydrophobicContact CB-CG1 3.81Å; V43-I366 HydrophobicContact CG1-CG1 4.22Å; V43-I366 HydrophobicContact CG2-CG1 4.1Å; V43-I369 HydrophobicContact CG2-CD1 3.35Å
44	G	94.8	Very high	94.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	64.2	-143.8	177.1	0	0	0	0	0	112.3	Q37 L46 R49 E362	Q37-G44 PolarHBondContact O-N 3.15Å; G44-L46 PolarHBondContact O-N 3.24Å; G44-L46 VanDerWaalsContact O-N 3.17Å; G44-R49 WeakPolarHBondContact O-CD 3.39Å; G44-R49 PolarHBondContact O-NH1 3.17Å; G44-E362 VanDerWaalsContact CA-OE1 3.25Å; G44-E362 WeakPolarHBondContact CA-OE1 3.43Å
45	Q	95.9	Very high	94.5	Very high	15 Å²	15	44 Å²	44	7%	0.07	24%	0.237	C	C	.	.			trans	46.6	41.7	-177.1	-64.3	-59.9	-27.8	0	0	113.5	A47 A48 R49 T77 I82 S356 Y358	Q45-A47 PolarHBondContact O-N 2.86Å; Q45-A48 HydrophobicContact CB-CB 4.38Å; Q45-A48 PolarHBondContact O-N 3.38Å; Q45-R49 HydrophobicContact CB-CG 4.33Å; Q45-R49 WeakPolarHBondContact O-CB 3.47Å; Q45-R49 WeakPolarHBondContact O-CG 3.46Å; Q45-R49 PolarHBondContact O-N 2.88Å; Q45-T77 PolarHBondContact NE2-O 2.85Å; Q45-I82 HydrophobicContact CB-CD1 4.49Å; Q45-S356 PolarHBondContact NE2-O 3.41Å; Q45-Y358 HydrophobicContact CG-CE1 3.64Å; Q45-Y358 WeakPolarHBondContact CG-OH 3.46Å
46	L	95.6	Very high	94.3	Very high	74 Å²	74	43.2 Å²	43.2	39%	0.387	23%	0.231	S	C	.	.	H	α-helix	trans	-57.4	-48.3	-170.6	-56.6	180	0	0	0	111.9	P35 G44 A48 R49 R50	P35-L46 HydrophobicContact CB-CD2 4.08Å; P35-L46 HydrophobicContact CG-CB 3.96Å; P35-L46 HydrophobicContact CG-CD2 4Å; P35-L46 WeakPolarHBondContact CG-O 3.47Å; G44-L46 PolarHBondContact O-N 3.24Å; G44-L46 VanDerWaalsContact O-N 3.17Å; L46-A48 PolarHBondContact O-N 3.02Å; L46-R49 PolarHBondContact O-N 2.95Å; L46-R50 WeakPolarHBondContact O-CB 3.44Å; L46-R50 PolarHBondContact O-N 2.83Å
47	A	95.6	Very high	94.1	Very high	80 Å²	80	39.7 Å²	39.7	66%	0.661	22%	0.221	S	C	*	.	H	α-helix	trans	-60.5	-46.1	179.2	0	0	0	0	0	112.4	Q45 R50 A51	Q45-A47 PolarHBondContact O-N 2.86Å; A47-R50 PolarHBondContact O-N 3.46Å; A47-A51 WeakPolarHBondContact O-CB 3.29Å; A47-A51 PolarHBondContact O-N 2.97Å
48	A	96.4	Very high	93.7	Very high	2 Å²	2	36.5 Å²	36.5	2%	0.017	21%	0.206	C	C	.	.	H	α-helix	trans	-69.7	-37.6	-178.5	0	0	0	0	0	112.5	Q45 L46 A51 A52 I82 I353 T355	Q45-A48 HydrophobicContact CB-CB 4.38Å; Q45-A48 PolarHBondContact O-N 3.38Å; L46-A48 PolarHBondContact O-N 3.02Å; A48-A51 PolarHBondContact O-N 2.93Å; A48-A52 VanDerWaalsContact O-CB 3.31Å; A48-A52 WeakPolarHBondContact O-CB 3.25Å; A48-A52 PolarHBondContact O-N 3.27Å; A48-I82 HydrophobicContact CB-CD1 3.75Å; A48-I353 HydrophobicContact CB-CG2 3.69Å; A48-T355 HydrophobicContact CB-CG2 4.02Å
49	R	96.7	Very high	93.3	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-69.6	-39.3	176.1	-74.5	168.1	64.1	-153.4	-4.9	112.3	L27 G28 P35 R36 L42 G44 Q45 L46 A52 G53	L27-R49 VanDerWaalsContact O-CZ 3.27Å; L27-R49 PolarHBondContact O-NE 3.45Å; L27-R49 PolarHBondContact O-NH2 3.38Å; G28-R49 PolarHBondContact O-NH2 2.91Å; P35-R49 HydrophobicContact CB-CB 3.98Å; R36-R49 PolarHBondContact O-NH1 2.81Å; R36-R49 PolarHBondContact O-NH2 3.47Å; L42-R49 HydrophobicContact CD1-CG 4.2Å; G44-R49 WeakPolarHBondContact O-CD 3.39Å; G44-R49 PolarHBondContact O-NH1 3.17Å; Q45-R49 HydrophobicContact CB-CG 4.33Å; Q45-R49 WeakPolarHBondContact O-CB 3.47Å; Q45-R49 WeakPolarHBondContact O-CG 3.46Å; Q45-R49 PolarHBondContact O-N 2.88Å; L46-R49 PolarHBondContact O-N 2.95Å; R49-A52 PolarHBondContact O-N 3.06Å; R49-G53 PolarHBondContact O-N 3.16Å
50	R	96.1	Very high	92.9	Very high	130 Å²	130	37.8 Å²	37.8	49%	0.491	20%	0.203	S	C	.	.	H	α-helix	trans	-61.1	-47	172.7	-174.4	173.3	-173.6	158.1	8.8	110.9	P35 L46 A47 A52 G53 V54	P35-R50 HydrophobicContact CG-CB 4.19Å; L46-R50 WeakPolarHBondContact O-CB 3.44Å; L46-R50 PolarHBondContact O-N 2.83Å; A47-R50 PolarHBondContact O-N 3.46Å; R50-A52 PolarHBondContact O-N 3.49Å; R50-G53 WeakPolarHBondContact O-CA 3.47Å; R50-G53 PolarHBondContact O-N 3.34Å; R50-G53 VanDerWaalsContact O-N 3.12Å; R50-V54 PolarHBondContact O-N 3.04Å; R50-V54 VanDerWaalsContact O-N 3.14Å
51	A	95.8	Very high	92.6	Very high	35 Å²	35	38.1 Å²	38.1	29%	0.289	21%	0.208	S	C	.	.	H	α-helix	trans	-60.8	-44.1	175.5	0	0	0	0	0	111.9	A47 A48 G53 V54 I55 I353	A47-A51 WeakPolarHBondContact O-CB 3.29Å; A47-A51 PolarHBondContact O-N 2.97Å; A48-A51 PolarHBondContact O-N 2.93Å; A51-G53 VanDerWaalsContact C-N 3.25Å; A51-G53 PolarHBondContact O-N 3.39Å; A51-V54 PolarHBondContact O-N 2.89Å; A51-I55 WeakPolarHBondContact O-CG1 3.32Å; A51-I55 PolarHBondContact O-N 3.39Å; A51-I55 VanDerWaalsContact O-N 3.13Å; A51-I353 HydrophobicContact CB-CD1 3.86Å; A51-I353 HydrophobicContact CB-CG1 3.98Å; A51-I353 HydrophobicContact CB-CG2 4.18Å
52	A	95	Very high	91.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-32.9	174	0	0	0	0	0	112.8	L27 A48 R49 R50 I55 L56 I82 I86	L27-A52 HydrophobicContact CD1-CB 3.97Å; L27-A52 HydrophobicContact CD2-CB 4.02Å; A48-A52 VanDerWaalsContact O-CB 3.31Å; A48-A52 WeakPolarHBondContact O-CB 3.25Å; A48-A52 PolarHBondContact O-N 3.27Å; R49-A52 PolarHBondContact O-N 3.06Å; R50-A52 PolarHBondContact O-N 3.49Å; A52-I55 PolarHBondContact O-N 3.15Å; A52-L56 WeakPolarHBondContact O-CB 3.34Å; A52-L56 PolarHBondContact O-N 3.42Å; A52-I82 HydrophobicContact CB-CG2 3.66Å; A52-I86 HydrophobicContact CB-CD1 3.96Å; A52-I86 HydrophobicContact CB-CG1 4.08Å
53	G	94.3	Very high	90.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-41	173	0	0	0	0	0	113.5	R49 R50 A51 I55 L56 E57	R49-G53 PolarHBondContact O-N 3.16Å; R50-G53 WeakPolarHBondContact O-CA 3.47Å; R50-G53 PolarHBondContact O-N 3.34Å; R50-G53 VanDerWaalsContact O-N 3.12Å; A51-G53 VanDerWaalsContact C-N 3.25Å; A51-G53 PolarHBondContact O-N 3.39Å; G53-I55 VanDerWaalsContact C-N 3.33Å; G53-L56 WeakPolarHBondContact O-CB 3.44Å; G53-L56 PolarHBondContact O-N 3.3Å; G53-E57 PolarHBondContact O-N 2.96Å
54	V	92.4	Very high	89.5	Confident	85 Å²	85	50.4 Å²	50.4	52%	0.515	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-41.9	173.9	179.1	0	0	0	0	110.7	R50 A51 L56 E57 M58	R50-V54 PolarHBondContact O-N 3.04Å; R50-V54 VanDerWaalsContact O-N 3.14Å; A51-V54 PolarHBondContact O-N 2.89Å; V54-L56 VanDerWaalsContact C-N 3.35Å; V54-E57 PolarHBondContact O-N 2.89Å; V54-M58 WeakPolarHBondContact O-CB 3.48Å; V54-M58 PolarHBondContact O-N 3.28Å
55	I	90.9	Very high	88.3	Confident	9 Å²	9	52.6 Å²	52.6	5%	0.046	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-39.8	175.2	-60.9	-56.2	0	0	0	111.4	A51 A52 G53 M58 I59 V69 V319 L351 I353	A51-I55 WeakPolarHBondContact O-CG1 3.32Å; A51-I55 PolarHBondContact O-N 3.39Å; A51-I55 VanDerWaalsContact O-N 3.13Å; A52-I55 PolarHBondContact O-N 3.15Å; G53-I55 VanDerWaalsContact C-N 3.33Å; I55-M58 HydrophobicContact CD1-CE 3.91Å; I55-M58 HydrophobicContact CG2-CE 4.29Å; I55-M58 WeakPolarHBondContact O-CB 3.4Å; I55-M58 PolarHBondContact O-N 2.83Å; I55-I59 HydrophobicContact CG2-CD1 3.9Å; I55-I59 HydrophobicContact CG2-CG1 4.47Å; I55-I59 WeakPolarHBondContact O-CD1 3.23Å; I55-I59 VanDerWaalsContact O-CG1 3.24Å; I55-I59 WeakPolarHBondContact O-CG1 3.29Å; I55-I59 PolarHBondContact O-N 3.32Å; I55-V69 HydrophobicContact CD1-CG2 3.66Å; I55-V69 HydrophobicContact CG1-CG1 4.49Å; I55-V69 HydrophobicContact CG1-CG2 4Å; I55-V69 HydrophobicContact CG2-CG2 4.15Å; I55-V319 HydrophobicContact CG2-CG1 4.48Å; I55-L351 HydrophobicContact CD1-CD1 4.25Å; I55-I353 HydrophobicContact CG1-CD1 4.38Å
56	L	90.8	Very high	87	Confident	8 Å²	8	52.7 Å²	52.7	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-59.2	-47.5	176.4	176.2	69.1	0	0	0	111.2	L27 A52 G53 V54 M58 I59 K60 I86 S89 L90	L27-L56 HydrophobicContact CD1-CB 4.22Å; L27-L56 HydrophobicContact CD1-CD2 4.04Å; A52-L56 WeakPolarHBondContact O-CB 3.34Å; A52-L56 PolarHBondContact O-N 3.42Å; G53-L56 WeakPolarHBondContact O-CB 3.44Å; G53-L56 PolarHBondContact O-N 3.3Å; V54-L56 VanDerWaalsContact C-N 3.35Å; L56-M58 VanDerWaalsContact C-N 3.35Å; L56-I59 PolarHBondContact O-N 2.97Å; L56-K60 WeakPolarHBondContact O-CG 3.49Å; L56-K60 PolarHBondContact O-N 3.13Å; L56-I86 HydrophobicContact CD1-CG2 4.28Å; L56-S89 VanDerWaalsContact CD2-CB 3.49Å; L56-L90 HydrophobicContact CD1-CD2 3.48Å; L56-L90 VanDerWaalsContact CD1-CD2 3.48Å; L56-L90 HydrophobicContact CD1-CG 3.53Å
57	E	89.9	Confident	86.4	Confident	75 Å²	75	55.3 Å²	55.3	35%	0.35	30%	0.301	S	S	.	.	H	α-helix	trans	-68.5	-37.4	-179.7	-147.8	63.1	-172.3	0	0	111.4	G53 V54 I59 K60 D61	G53-E57 PolarHBondContact O-N 2.96Å; V54-E57 PolarHBondContact O-N 2.89Å; E57-I59 VanDerWaalsContact C-N 3.29Å; E57-I59 PolarHBondContact O-N 3.4Å; E57-K60 PolarHBondContact O-N 2.99Å; E57-K60 IonicContact OE2-NZ 3.56Å; E57-K60 PolarHBondContact OE2-NZ 3.35Å; E57-D61 WeakPolarHBondContact O-CB 3.36Å; E57-D61 PolarHBondContact O-N 3.48Å
58	M	86.4	Confident	86.2	Confident	30 Å²	30	51.7 Å²	51.7	15%	0.148	27%	0.271	C	S	.	.	H	α-helix	trans	-58.5	-39.2	171.6	-175.9	-175.3	70.9	0	0	112.6	V54 I55 L56 G62 I64 R67	V54-M58 WeakPolarHBondContact O-CB 3.48Å; V54-M58 PolarHBondContact O-N 3.28Å; I55-M58 HydrophobicContact CD1-CE 3.91Å; I55-M58 HydrophobicContact CG2-CE 4.29Å; I55-M58 WeakPolarHBondContact O-CB 3.4Å; I55-M58 PolarHBondContact O-N 2.83Å; L56-M58 VanDerWaalsContact C-N 3.35Å; M58-G62 PolarHBondContact O-N 3.18Å; M58-I64 HydrophobicContact CG-CB 4.33Å; M58-I64 HydrophobicContact CG-CD1 3.95Å; M58-I64 HydrophobicContact CG-CG1 4.45Å; M58-I64 HydrophobicContact SD-CD1 4.18Å; M58-R67 HydrophobicContact CE-CB 4.07Å; M58-R67 HydrophobicContact CE-CG 4.35Å; M58-R67 HydrophobicContact SD-CG 4.37Å
59	I	85.9	Confident	86.1	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.051	27%	0.271	C	S	.	.	H	α-helix	trans	-67.6	-43.9	176.4	-66.4	157.3	0	0	0	110.3	I55 L56 E57 D61 G62 I86 L90 V291 V319	I55-I59 HydrophobicContact CG2-CD1 3.9Å; I55-I59 HydrophobicContact CG2-CG1 4.47Å; I55-I59 WeakPolarHBondContact O-CD1 3.23Å; I55-I59 VanDerWaalsContact O-CG1 3.24Å; I55-I59 WeakPolarHBondContact O-CG1 3.29Å; I55-I59 PolarHBondContact O-N 3.32Å; L56-I59 PolarHBondContact O-N 2.97Å; E57-I59 VanDerWaalsContact C-N 3.29Å; E57-I59 PolarHBondContact O-N 3.4Å; I59-D61 VanDerWaalsContact C-N 3.35Å; I59-D61 PolarHBondContact O-N 3.38Å; I59-G62 PolarHBondContact O-N 2.64Å; I59-I86 HydrophobicContact CD1-CG2 4.18Å; I59-L90 HydrophobicContact CB-CD2 4Å; I59-L90 HydrophobicContact CD1-CD1 4.35Å; I59-L90 HydrophobicContact CG2-CD1 4.21Å; I59-L90 HydrophobicContact CG2-CD2 3.49Å; I59-L90 VanDerWaalsContact CG2-CD2 3.49Å; I59-V291 HydrophobicContact CD1-CG2 3.7Å; I59-V291 HydrophobicContact CG1-CG2 4.49Å; I59-V291 HydrophobicContact CG2-CG2 4.44Å; I59-V319 HydrophobicContact CD1-CB 4.26Å; I59-V319 HydrophobicContact CD1-CG1 4.12Å; I59-V319 HydrophobicContact CD1-CG2 4.5Å; I59-V319 HydrophobicContact CG1-CB 3.96Å; I59-V319 HydrophobicContact CG1-CG1 4.1Å; I59-V319 HydrophobicContact CG1-CG2 3.66Å
60	K	85.5	Confident	86.1	Confident	111 Å²	111	51.7 Å²	51.7	48%	0.483	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-37.4	179.2	-71.9	176.7	-175.2	169.1	0	112.8	L56 E57 G62 L90	L56-K60 WeakPolarHBondContact O-CG 3.49Å; L56-K60 PolarHBondContact O-N 3.13Å; E57-K60 PolarHBondContact O-N 2.99Å; E57-K60 IonicContact OE2-NZ 3.56Å; E57-K60 PolarHBondContact OE2-NZ 3.35Å; K60-G62 PolarHBondContact O-N 2.92Å; K60-L90 HydrophobicContact CG-CD2 4.25Å
61	D	84.4	Confident	86.2	Confident	102 Å²	102	45.5 Å²	45.5	55%	0.545	25%	0.247	S	C	.	.	H	α-helix	trans	-63.4	-29.4	176.1	-79.9	-8.9	0	0	0	111.5	E57 I59 H63	E57-D61 WeakPolarHBondContact O-CB 3.36Å; E57-D61 PolarHBondContact O-N 3.48Å; I59-D61 VanDerWaalsContact C-N 3.35Å; I59-D61 PolarHBondContact O-N 3.38Å; D61-H63 PolarHBondContact O-CE1 3.03Å; D61-H63 PolarHBondContact O-N 2.97Å; D61-H63 PolarHBondContact O-ND1 3.21Å
62	G	75.3	Confident	86.2	Confident	44 Å²	44	44.2 Å²	44.2	45%	0.454	24%	0.237	S	C	.	.			trans	66.6	2.4	170.5	0	0	0	0	0	116	M58 I59 K60 I64	M58-G62 PolarHBondContact O-N 3.18Å; I59-G62 PolarHBondContact O-N 2.64Å; K60-G62 PolarHBondContact O-N 2.92Å; G62-I64 VanDerWaalsContact C-N 3.34Å
63	H	71.9	Confident	86.2	Confident	173 Å²	173	45.3 Å²	45.3	80%	0.801	25%	0.248	S	C	*	.			trans	-81.4	-13.8	-178.8	-71.3	81	0	0	0	113.4	D61	D61-H63 PolarHBondContact O-CE1 3.03Å; D61-H63 PolarHBondContact O-N 2.97Å; D61-H63 PolarHBondContact O-ND1 3.21Å
64	I	69.6	Low	86	Confident	75 Å²	75	51.1 Å²	51.1	39%	0.385	28%	0.275	S	S	.	.			trans	-119.3	110.5	-171.7	-49	-173.6	0	0	0	109.4	M58 G62 R67	M58-I64 HydrophobicContact CG-CB 4.33Å; M58-I64 HydrophobicContact CG-CD1 3.95Å; M58-I64 HydrophobicContact CG-CG1 4.45Å; M58-I64 HydrophobicContact SD-CD1 4.18Å; G62-I64 VanDerWaalsContact C-N 3.34Å; I64-R67 HydrophobicContact CG2-CG 3.44Å; I64-R67 VanDerWaalsContact CG2-CG 3.44Å
65	A	70.5	Confident	85.9	Confident	45 Å²	45	51.5 Å²	51.5	37%	0.372	28%	0.28	S	S	.	.			trans	-94.9	161.7	171.7	0	0	0	0	0	111.5	R67 D315	A65-R67 VanDerWaalsContact C-N 3.32Å; A65-R67 PolarHBondContact O-N 2.93Å; A65-D315 WeakPolarHBondContact CB-O 3.48Å
66	G	69.2	Low	85.7	Confident	17 Å²	17	53 Å²	53	18%	0.175	30%	0.297	C	S	.	.	S	Bend	trans	73.4	16.5	165.2	0	0	0	0	0	116.3	L312 S317	G66-L312 WeakPolarHBondContact CA-O 3.47Å; G66-S317 PolarHBondContact N-O 3.38Å
67	R	82.1	Confident	85.8	Confident	130 Å²	130	52.7 Å²	52.7	49%	0.491	30%	0.295	S	S	.	.			trans	-87.2	141.4	175.5	-66.1	-67.9	-175	176.5	0.1	110.9	M58 I64 A65 L320	M58-R67 HydrophobicContact CE-CB 4.07Å; M58-R67 HydrophobicContact CE-CG 4.35Å; M58-R67 HydrophobicContact SD-CG 4.37Å; I64-R67 HydrophobicContact CG2-CG 3.44Å; I64-R67 VanDerWaalsContact CG2-CG 3.44Å; A65-R67 VanDerWaalsContact C-N 3.32Å; A65-R67 PolarHBondContact O-N 2.93Å; R67-L320 PolarHBondContact O-N 3.13Å; R67-L320 VanDerWaalsContact O-N 3.09Å
68	A	90.8	Very high	86	Confident	4 Å²	4	50 Å²	50	3%	0.033	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	137.5	175.6	0	0	0	0	0	111.1	L312 L320 M322 L350 L351	A68-L312 HydrophobicContact CB-CD1 3.7Å; A68-L312 HydrophobicContact CB-CD2 4.02Å; A68-L320 CarbonylContact C-O 3.52Å; A68-L320 VanDerWaalsContact CA-O 3.23Å; A68-L320 WeakPolarHBondContact CA-O 3.44Å; A68-L320 HydrophobicContact CB-CB 3.93Å; A68-L320 HydrophobicContact CB-CD2 4.01Å; A68-L320 HydrophobicContact CB-CG 4.22Å; A68-M322 HydrophobicContact CB-CE 4.3Å; A68-L350 HydrophobicContact CB-CD2 3.19Å; A68-L350 WeakPolarHBondContact O-CA 3.41Å; A68-L351 PolarHBondContact O-N 3.45Å
69	V	94.9	Very high	86.4	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.012	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.8	-176.4	-178.6	0	0	0	0	108.3	I55 L320 I321 M322 L351 I353	I55-V69 HydrophobicContact CD1-CG2 3.66Å; I55-V69 HydrophobicContact CG1-CG1 4.49Å; I55-V69 HydrophobicContact CG1-CG2 4Å; I55-V69 HydrophobicContact CG2-CG2 4.15Å; V69-L320 PolarHBondContact N-O 2.85Å; V69-I321 CarbonylContact O-C 3.59Å; V69-I321 WeakPolarHBondContact O-CA 3.41Å; V69-M322 PolarHBondContact O-N 3.1Å; V69-L351 CarbonylContact C-O 3.6Å; V69-L351 WeakPolarHBondContact CA-O 3.35Å; V69-I353 HydrophobicContact CG1-CD1 3.67Å; V69-I353 HydrophobicContact CG1-CG1 3.96Å
70	L	96.9	Very high	86.7	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	120.4	175.4	-178	65.6	0	0	0	109.9	V297 M322 T324 H340 I342 L347 L350 L351 I352 I353	L70-V297 HydrophobicContact CD1-CG1 4.19Å; L70-M322 CarbonylContact C-O 3.6Å; L70-M322 WeakPolarHBondContact CA-O 3.17Å; L70-M322 HydrophobicContact CD1-CB 3.88Å; L70-T324 HydrophobicContact CD1-CG2 3.93Å; L70-T324 HydrophobicContact CD2-CG2 4.38Å; L70-T324 HydrophobicContact CG-CG2 4.34Å; L70-H340 HydrophobicContact CD2-CB 4.27Å; L70-I342 HydrophobicContact CD1-CD1 3.82Å; L70-I342 HydrophobicContact CD2-CD1 3.87Å; L70-I342 HydrophobicContact CG-CD1 4.48Å; L70-L347 HydrophobicContact CD2-CD1 4.01Å; L70-L350 HydrophobicContact CB-CB 4.42Å; L70-L350 HydrophobicContact CB-CD1 4.11Å; L70-L350 HydrophobicContact CD2-CD1 4.41Å; L70-L351 PolarHBondContact N-O 2.8Å; L70-I352 HydrophobicContact CB-CG1 4.33Å; L70-I352 HydrophobicContact CD2-CD1 4.41Å; L70-I352 HydrophobicContact CD2-CG1 4.23Å; L70-I352 HydrophobicContact CD2-CG2 4.49Å; L70-I352 CarbonylContact O-C 3.57Å; L70-I352 WeakPolarHBondContact O-CA 3.37Å; L70-I353 PolarHBondContact O-N 2.91Å
71	I	97.4	Very high	87.1	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	112.1	169.6	-48.8	178.8	0	0	0	108.3	K79 I82 I321 M322 A323 T324 I353 T355	I71-K79 HydrophobicContact CB-CB 4.47Å; I71-K79 HydrophobicContact CG2-CB 3.91Å; I71-K79 HydrophobicContact CG2-CD 4.36Å; I71-K79 HydrophobicContact CG2-CG 3.79Å; I71-K79 WeakPolarHBondContact O-CD 3.4Å; I71-I82 HydrophobicContact CD1-CB 4.44Å; I71-I82 HydrophobicContact CD1-CG2 4.16Å; I71-I321 HydrophobicContact CD1-CG2 3.79Å; I71-I321 HydrophobicContact CG1-CG2 4.09Å; I71-M322 PolarHBondContact N-O 3.5Å; I71-A323 WeakPolarHBondContact O-CA 3.47Å; I71-T324 PolarHBondContact O-N 3.12Å; I71-T324 VanDerWaalsContact O-N 3.09Å; I71-I353 CarbonylContact C-O 3.47Å; I71-I353 WeakPolarHBondContact CA-O 3.3Å; I71-T355 HydrophobicContact CG2-CG2 3.86Å
72	A	96.4	Very high	87.6	Confident	8 Å²	8	40.9 Å²	40.9	7%	0.066	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	145.6	-177.2	0	0	0	0	0	111.6	T324 I352 I353 A354 T355	A72-T324 HydrophobicContact CB-CG2 4.01Å; A72-I352 HydrophobicContact CB-CG2 4.08Å; A72-I353 PolarHBondContact N-O 2.98Å; A72-A354 CarbonylContact O-C 3.49Å; A72-A354 WeakPolarHBondContact O-CA 3.49Å; A72-T355 PolarHBondContact O-N 2.82Å; A72-T355 PolarHBondContact O-OG1 3.2Å
73	G	94.1	Very high	88.4	Confident	23 Å²	23	38.8 Å²	38.8	24%	0.237	23%	0.225	C	C	.	.			trans	157	176.7	171.8	0	0	0	0	0	113	K79 T324 N325 T355	G73-K79 PolarHBondContact O-NZ 3.02Å; G73-T324 PolarHBondContact N-O 2.67Å; G73-N325 WeakPolarHBondContact O-CA 3.31Å; G73-T355 WeakPolarHBondContact CA-OG1 3.48Å
74	Q	90.9	Very high	89.3	Confident	121 Å²	121	33 Å²	33	57%	0.565	20%	0.199	S	C	*	.			trans	-60.5	156.7	-174	-64.8	-178.8	4	0	0	112.6	G76 T77 K79	Q74-G76 PolarHBondContact O-N 3.18Å; Q74-T77 HydrophobicContact CB-CG2 3.93Å; Q74-T77 WeakPolarHBondContact O-CG2 3.23Å; Q74-T77 PolarHBondContact O-N 2.97Å; Q74-T77 PolarHBondContact O-OG1 3.17Å; Q74-K79 PolarHBondContact O-NZ 2.76Å
75	P	89.4	Confident	90.5	Very high	94 Å²	94	29.5 Å²	29.5	61%	0.61	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	138.7	169.7	-24	34	0	0	0	111.3	N325	P75-N325 HydrophobicContact CG-CB 4.19Å
76	G	88.3	Confident	91.5	Very high	39 Å²	39	27.5 Å²	27.5	40%	0.402	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	0.7	177.6	0	0	0	0	0	116.5	Q74 G78 Y358	Q74-G76 PolarHBondContact O-N 3.18Å; G76-G78 VanDerWaalsContact C-N 3.27Å; G76-G78 PolarHBondContact O-N 3.01Å; G76-Y358 WeakPolarHBondContact O-CE2 3.45Å
77	T	92.9	Very high	92.4	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.018	16%	0.161	C	C	.	.	S	Bend	trans	-80.6	4.4	178.5	60.1	0	0	0	0	115.1	Q45 Q74 T355 S356 Y358	Q45-T77 PolarHBondContact NE2-O 2.85Å; Q74-T77 HydrophobicContact CB-CG2 3.93Å; Q74-T77 WeakPolarHBondContact O-CG2 3.23Å; Q74-T77 PolarHBondContact O-N 2.97Å; Q74-T77 PolarHBondContact O-OG1 3.17Å; T77-T355 WeakPolarHBondContact CB-OG1 3.44Å; T77-T355 WeakPolarHBondContact OG1-CB 3.48Å; T77-T355 PolarHBondContact OG1-OG1 2.97Å; T77-S356 WeakPolarHBondContact CG2-O 3.33Å; T77-Y358 PolarHBondContact O-OH 3.08Å
78	G	92.6	Very high	92.8	Very high	17 Å²	17	26.3 Å²	26.3	18%	0.175	16%	0.162	C	C	.	.			trans	84.1	26.3	175.4	0	0	0	0	0	116.1	G76 A81 I82	G76-G78 VanDerWaalsContact C-N 3.27Å; G76-G78 PolarHBondContact O-N 3.01Å; G78-A81 WeakPolarHBondContact O-CB 3.41Å; G78-A81 PolarHBondContact O-N 3.47Å; G78-I82 WeakPolarHBondContact O-CG1 3.48Å; G78-I82 PolarHBondContact O-N 2.86Å
79	K	94.6	Very high	92.8	Very high	14 Å²	14	27.6 Å²	27.6	6%	0.061	17%	0.171	C	C	.	.	H	α-helix	trans	-55.9	-55.3	177.1	-59.5	-176.9	-75.2	-73.3	0	113	I71 G73 Q74 A81 I82 A83 A323 T324 T355	I71-K79 HydrophobicContact CB-CB 4.47Å; I71-K79 HydrophobicContact CG2-CB 3.91Å; I71-K79 HydrophobicContact CG2-CD 4.36Å; I71-K79 HydrophobicContact CG2-CG 3.79Å; I71-K79 WeakPolarHBondContact O-CD 3.4Å; G73-K79 PolarHBondContact O-NZ 3.02Å; Q74-K79 PolarHBondContact O-NZ 2.76Å; K79-A81 PolarHBondContact O-N 2.8Å; K79-I82 PolarHBondContact O-N 3.03Å; K79-A83 PolarHBondContact O-N 2.85Å; K79-A83 VanDerWaalsContact O-N 3.13Å; K79-A323 HydrophobicContact CB-CB 4.23Å; K79-A323 HydrophobicContact CD-CB 4.5Å; K79-T324 VanDerWaalsContact CD-O 3.26Å; K79-T324 WeakPolarHBondContact CD-O 3.48Å; K79-T324 VanDerWaalsContact CE-O 3.23Å; K79-T324 WeakPolarHBondContact CE-O 3.48Å; K79-T355 HydrophobicContact CG-CG2 4.3Å
80	T	92.6	Very high	92.4	Very high	36 Å²	36	28.6 Å²	28.6	22%	0.221	18%	0.176	C	C	.	.	H	α-helix	trans	-62	-34.3	176	-40.1	0	0	0	0	111.5	A83 M84 F293 D295	T80-A83 PolarHBondContact O-N 3.21Å; T80-M84 WeakPolarHBondContact O-CG 3.35Å; T80-M84 PolarHBondContact O-N 3.34Å; T80-F293 HydrophobicContact CG2-CE1 3.92Å; T80-F293 HydrophobicContact CG2-CZ 4.2Å; T80-D295 PolarHBondContact OG1-OD2 2.84Å
81	A	93.7	Very high	91.8	Very high	10 Å²	10	30.4 Å²	30.4	8%	0.083	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-41.2	175.7	0	0	0	0	0	112.5	I24 L42 G78 K79 M84 G85	I24-A81 HydrophobicContact CD1-CB 3.38Å; L42-A81 HydrophobicContact CD2-CB 4.14Å; G78-A81 WeakPolarHBondContact O-CB 3.41Å; G78-A81 PolarHBondContact O-N 3.47Å; K79-A81 PolarHBondContact O-N 2.8Å; A81-M84 PolarHBondContact O-N 3.24Å; A81-G85 PolarHBondContact O-N 3.43Å
82	I	95.4	Very high	90.8	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.015	23%	0.234	C	C	.	.	H	α-helix	trans	-65.8	-44.2	175.3	-67.5	165	0	0	0	110.5	L27 Q45 A48 A52 I71 G78 K79 M84 G85 I86 T355	L27-I82 HydrophobicContact CD2-CG2 4.33Å; Q45-I82 HydrophobicContact CB-CD1 4.49Å; A48-I82 HydrophobicContact CB-CD1 3.75Å; A52-I82 HydrophobicContact CB-CG2 3.66Å; I71-I82 HydrophobicContact CD1-CB 4.44Å; I71-I82 HydrophobicContact CD1-CG2 4.16Å; G78-I82 WeakPolarHBondContact O-CG1 3.48Å; G78-I82 PolarHBondContact O-N 2.86Å; K79-I82 PolarHBondContact O-N 3.03Å; I82-M84 VanDerWaalsContact C-N 3.33Å; I82-M84 PolarHBondContact O-N 3.17Å; I82-G85 CarbonylContact O-C 3.56Å; I82-G85 WeakPolarHBondContact O-CA 3.42Å; I82-G85 PolarHBondContact O-N 3.02Å; I82-I86 HydrophobicContact CG2-CD1 4.49Å; I82-I86 WeakPolarHBondContact O-CG1 3.16Å; I82-I86 PolarHBondContact O-N 3.5Å; I82-T355 HydrophobicContact CD1-CG2 3.77Å
83	A	93	Very high	89.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-42.3	176.8	0	0	0	0	0	112.1	K79 T80 G85 I86 A87 F293	K79-A83 PolarHBondContact O-N 2.85Å; K79-A83 VanDerWaalsContact O-N 3.13Å; T80-A83 PolarHBondContact O-N 3.21Å; A83-G85 VanDerWaalsContact C-N 3.34Å; A83-I86 WeakPolarHBondContact O-CB 3.4Å; A83-I86 PolarHBondContact O-N 3.42Å; A83-A87 PolarHBondContact O-N 2.92Å; A83-F293 HydrophobicContact CB-CD1 4.44Å; A83-F293 HydrophobicContact CB-CD2 3.48Å; A83-F293 VanDerWaalsContact CB-CD2 3.48Å; A83-F293 HydrophobicContact CB-CE1 4.44Å; A83-F293 HydrophobicContact CB-CE2 3.47Å; A83-F293 VanDerWaalsContact CB-CE2 3.47Å; A83-F293 HydrophobicContact CB-CG 3.99Å; A83-F293 HydrophobicContact CB-CZ 3.99Å
84	M	90.8	Very high	89.4	Confident	52 Å²	52	39.7 Å²	39.7	26%	0.256	25%	0.248	S	C	.	.	H	α-helix	trans	-66.3	-35.2	172.5	-73.2	-176	62.5	0	0	112.6	H21 T80 A81 I82 I86 A87 Q88	H21-M84 HydrophobicContact CB-CE 3.26Å; H21-M84 HydrophobicContact CB-SD 3.16Å; H21-M84 WeakPolarHBondContact CB-SD 3.08Å; H21-M84 PolarHBondContact CD2-SD 3.32Å; T80-M84 WeakPolarHBondContact O-CG 3.35Å; T80-M84 PolarHBondContact O-N 3.34Å; A81-M84 PolarHBondContact O-N 3.24Å; I82-M84 VanDerWaalsContact C-N 3.33Å; I82-M84 PolarHBondContact O-N 3.17Å; M84-I86 VanDerWaalsContact C-N 3.32Å; M84-I86 PolarHBondContact O-N 3.39Å; M84-A87 WeakPolarHBondContact O-CB 3.39Å; M84-A87 PolarHBondContact O-N 2.71Å; M84-Q88 VanDerWaalsContact O-CG 3.31Å; M84-Q88 WeakPolarHBondContact O-CG 3.34Å; M84-Q88 PolarHBondContact O-N 2.94Å
85	G	92.9	Very high	89.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.9	-41.4	171.9	0	0	0	0	0	112.3	A81 I82 A83 S89	A81-G85 PolarHBondContact O-N 3.43Å; I82-G85 CarbonylContact O-C 3.56Å; I82-G85 WeakPolarHBondContact O-CA 3.42Å; I82-G85 PolarHBondContact O-N 3.02Å; A83-G85 VanDerWaalsContact C-N 3.34Å; G85-S89 WeakPolarHBondContact O-CB 3.46Å; G85-S89 PolarHBondContact O-N 3.41Å; G85-S89 VanDerWaalsContact O-N 3.07Å; G85-S89 PolarHBondContact O-OG 3.46Å
86	I	92.5	Very high	89.3	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-50.5	172.6	-64.3	166.9	0	0	0	109.6	L27 A52 L56 I59 I82 A83 M84 Q88 S89 L90 I321	L27-I86 HydrophobicContact CD1-CG1 3.98Å; L27-I86 HydrophobicContact CD2-CG1 4.12Å; L27-I86 HydrophobicContact CG-CG1 4.37Å; A52-I86 HydrophobicContact CB-CD1 3.96Å; A52-I86 HydrophobicContact CB-CG1 4.08Å; L56-I86 HydrophobicContact CD1-CG2 4.28Å; I59-I86 HydrophobicContact CD1-CG2 4.18Å; I82-I86 HydrophobicContact CG2-CD1 4.49Å; I82-I86 WeakPolarHBondContact O-CG1 3.16Å; I82-I86 PolarHBondContact O-N 3.5Å; A83-I86 WeakPolarHBondContact O-CB 3.4Å; A83-I86 PolarHBondContact O-N 3.42Å; M84-I86 VanDerWaalsContact C-N 3.32Å; M84-I86 PolarHBondContact O-N 3.39Å; I86-Q88 PolarHBondContact O-N 3.1Å; I86-S89 PolarHBondContact O-N 3.48Å; I86-S89 VanDerWaalsContact O-N 3.07Å; I86-L90 HydrophobicContact CG2-CD1 3.95Å; I86-L90 HydrophobicContact CG2-CG 4.41Å; I86-L90 WeakPolarHBondContact O-CG 3.34Å; I86-L90 PolarHBondContact O-N 3.47Å; I86-I321 HydrophobicContact CD1-CD1 3.59Å; I86-I321 HydrophobicContact CG2-CD1 4.31Å
87	A	88.9	Confident	89.5	Confident	14 Å²	14	32.9 Å²	32.9	12%	0.116	20%	0.201	C	C	.	.	H	α-helix	trans	-54.3	-50.3	179.7	0	0	0	0	0	112.5	A83 M84 S89 L90 F96	A83-A87 PolarHBondContact O-N 2.92Å; M84-A87 WeakPolarHBondContact O-CB 3.39Å; M84-A87 PolarHBondContact O-N 2.71Å; A87-S89 VanDerWaalsContact C-N 3.26Å; A87-S89 PolarHBondContact O-N 2.96Å; A87-L90 PolarHBondContact O-N 2.96Å; A87-F96 HydrophobicContact CB-CB 4.09Å; A87-F96 HydrophobicContact CB-CD1 3.83Å; A87-F96 HydrophobicContact CB-CD2 3.34Å; A87-F96 HydrophobicContact CB-CE1 4.03Å; A87-F96 HydrophobicContact CB-CE2 3.61Å; A87-F96 HydrophobicContact CB-CG 3.47Å; A87-F96 VanDerWaalsContact CB-CG 3.47Å; A87-F96 HydrophobicContact CB-CZ 3.94Å
88	Q	89.6	Confident	89.5	Confident	108 Å²	108	35.7 Å²	35.7	51%	0.505	22%	0.224	S	C	.	.	H	α-helix	trans	-66.1	-29.4	179.7	-66.6	-63.4	-26	0	0	112.5	M84 I86	M84-Q88 VanDerWaalsContact O-CG 3.31Å; M84-Q88 WeakPolarHBondContact O-CG 3.34Å; M84-Q88 PolarHBondContact O-N 2.94Å; I86-Q88 PolarHBondContact O-N 3.1Å
89	S	90.8	Very high	89.5	Confident	32 Å²	32	36.2 Å²	36.2	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-81.8	-18.7	179.2	-51.9	0	0	0	0	113.7	G26 L27 L56 G85 I86 A87 G91	G26-S89 VanDerWaalsContact CA-OG 3.31Å; G26-S89 WeakPolarHBondContact CA-OG 3.39Å; L27-S89 PolarHBondContact N-OG 2.86Å; L56-S89 VanDerWaalsContact CD2-CB 3.49Å; G85-S89 WeakPolarHBondContact O-CB 3.46Å; G85-S89 PolarHBondContact O-N 3.41Å; G85-S89 VanDerWaalsContact O-N 3.07Å; G85-S89 PolarHBondContact O-OG 3.46Å; I86-S89 PolarHBondContact O-N 3.48Å; I86-S89 VanDerWaalsContact O-N 3.07Å; A87-S89 VanDerWaalsContact C-N 3.26Å; A87-S89 PolarHBondContact O-N 2.96Å; S89-G91 VanDerWaalsContact C-N 3.33Å
90	L	87.3	Confident	89.5	Confident	23 Å²	23	36.7 Å²	36.7	12%	0.12	23%	0.229	C	C	.	.	H	α-helix	trans	-75.9	-24.1	173.2	-73.7	166.4	0	0	0	112.2	L56 I59 K60 I86 A87 T94 V291	L56-L90 HydrophobicContact CD1-CD2 3.48Å; L56-L90 VanDerWaalsContact CD1-CD2 3.48Å; L56-L90 HydrophobicContact CD1-CG 3.53Å; I59-L90 HydrophobicContact CB-CD2 4Å; I59-L90 HydrophobicContact CD1-CD1 4.35Å; I59-L90 HydrophobicContact CG2-CD1 4.21Å; I59-L90 HydrophobicContact CG2-CD2 3.49Å; I59-L90 VanDerWaalsContact CG2-CD2 3.49Å; K60-L90 HydrophobicContact CG-CD2 4.25Å; I86-L90 HydrophobicContact CG2-CD1 3.95Å; I86-L90 HydrophobicContact CG2-CG 4.41Å; I86-L90 WeakPolarHBondContact O-CG 3.34Å; I86-L90 PolarHBondContact O-N 3.47Å; A87-L90 PolarHBondContact O-N 2.96Å; L90-T94 HydrophobicContact CB-CG2 4.12Å; L90-T94 HydrophobicContact CD1-CG2 4.06Å; L90-T94 HydrophobicContact CD2-CG2 4.42Å; L90-T94 HydrophobicContact CG-CG2 4.44Å; L90-T94 PolarHBondContact O-OG1 3.29Å; L90-V291 HydrophobicContact CD1-CB 4.49Å; L90-V291 HydrophobicContact CD1-CG2 3.46Å; L90-V291 VanDerWaalsContact CD1-CG2 3.46Å
91	G	83.6	Confident	89.4	Confident	38 Å²	38	35 Å²	35	39%	0.392	22%	0.219	S	C	.	.			trans	92.6	174.3	179.9	0	0	0	0	0	113.3	S89 D93	S89-G91 VanDerWaalsContact C-N 3.33Å; G91-D93 PolarHBondContact O-N 3Å
92	S	76.8	Confident	89.3	Confident	120 Å²	120	37.4 Å²	37.4	84%	0.839	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.8	-176.4	50.4	0	0	0	0	114.3
93	D	77.1	Confident	89.1	Confident	78 Å²	78	42.9 Å²	42.9	42%	0.417	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-19.9	-171.9	-73.1	16.2	0	0	0	112.9	G91 R126	G91-D93 PolarHBondContact O-N 3Å; D93-R126 IonicContact OD2-CZ 2.79Å; D93-R126 IonicContact OD2-NH2 3.67Å; D93-R126 PolarHBondContact OD2-NH2 2.9Å
94	T	82.9	Confident	89	Confident	29 Å²	29	43 Å²	43	18%	0.178	26%	0.261	C	S	.	.	S	Bend	trans	-92.2	123.3	-179.7	-55.3	0	0	0	0	109.6	L90 F96 I288	L90-T94 HydrophobicContact CB-CG2 4.12Å; L90-T94 HydrophobicContact CD1-CG2 4.06Å; L90-T94 HydrophobicContact CD2-CG2 4.42Å; L90-T94 HydrophobicContact CG-CG2 4.44Å; L90-T94 PolarHBondContact O-OG1 3.29Å; T94-F96 PolarHBondContact O-N 3Å; T94-I288 HydrophobicContact CG2-CG2 4.31Å
95	P	88.4	Confident	89	Confident	25 Å²	25	44.2 Å²	44.2	16%	0.162	27%	0.265	C	S	.	.			trans	-67.4	129.5	-178.8	19	-21.3	0	0	0	110.7	G290 V291	P95-G290 CarbonylContact O-C 3.51Å; P95-G290 WeakPolarHBondContact O-CA 3.35Å; P95-V291 PolarHBondContact O-N 3.32Å
96	F	90.6	Very high	88.7	Confident	63 Å²	63	46.8 Å²	46.8	28%	0.276	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	116.7	173.3	-179.3	-93.5	0	0	0	108.8	A87 T94 A98 V291 F293	A87-F96 HydrophobicContact CB-CB 4.09Å; A87-F96 HydrophobicContact CB-CD1 3.83Å; A87-F96 HydrophobicContact CB-CD2 3.34Å; A87-F96 HydrophobicContact CB-CE1 4.03Å; A87-F96 HydrophobicContact CB-CE2 3.61Å; A87-F96 HydrophobicContact CB-CG 3.47Å; A87-F96 VanDerWaalsContact CB-CG 3.47Å; A87-F96 HydrophobicContact CB-CZ 3.94Å; T94-F96 PolarHBondContact O-N 3Å; F96-A98 HydrophobicContact CE1-CB 3.89Å; F96-V291 WeakPolarHBondContact CA-O 3.29Å; F96-V291 HydrophobicContact CD2-CB 3.83Å; F96-V291 HydrophobicContact CD2-CG1 3.86Å; F96-V291 HydrophobicContact CE2-CB 4.32Å; F96-V291 HydrophobicContact CE2-CG1 3.82Å; F96-F293 HydrophobicContact CE1-CB 4.4Å; F96-F293 HydrophobicContact CE2-CB 3.91Å; F96-F293 HydrophobicContact CZ-CB 3.56Å; F96-F293 HydrophobicContact CZ-CD1 4.43Å; F96-F293 HydrophobicContact CZ-CG 4.15Å
97	T	92.4	Very high	88.4	Confident	23 Å²	23	55.4 Å²	55.4	14%	0.141	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	118.6	176.6	-59.3	0	0	0	0	108.8	K121 A122 V291 L292 F293	T97-K121 HydrophobicContact CG2-CB 4.18Å; T97-A122 PolarHBondContact OG1-N 3.29Å; T97-V291 PolarHBondContact N-O 2.95Å; T97-L292 HydrophobicContact CG2-CD1 3.95Å; T97-F293 PolarHBondContact O-N 3.2Å
98	A	92.2	Very high	88.2	Confident	61 Å²	61	62.2 Å²	62.2	50%	0.504	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	136.2	170.9	0	0	0	0	0	110	F96 F293	F96-A98 HydrophobicContact CE1-CB 3.89Å; A98-F293 CarbonylContact C-O 3.56Å; A98-F293 WeakPolarHBondContact CA-O 3.46Å; A98-F293 HydrophobicContact CB-CD1 4.12Å
99	L	93.9	Very high	88.2	Confident	28 Å²	28	58.6 Å²	58.6	15%	0.147	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	137.1	179.9	-170.6	77.5	0	0	0	108.7	E103 I104 A118 F293 I294 D295	L99-E103 WeakPolarHBondContact CA-OE2 3.41Å; L99-E103 HydrophobicContact CD1-CB 3.98Å; L99-E103 WeakPolarHBondContact CD1-OE2 3.47Å; L99-E103 HydrophobicContact CG-CB 4.49Å; L99-I104 HydrophobicContact CD2-CD1 3.75Å; L99-I104 HydrophobicContact CD2-CG1 3.56Å; L99-I104 HydrophobicContact CG-CG1 4.34Å; L99-A118 HydrophobicContact CD2-CB 4.09Å; L99-F293 PolarHBondContact N-O 2.72Å; L99-I294 CarbonylContact O-C 3.55Å; L99-I294 VanDerWaalsContact O-CA 3.28Å; L99-I294 WeakPolarHBondContact O-CA 3.42Å; L99-D295 PolarHBondContact O-N 3.5Å
100	A	94.2	Very high	88.3	Confident	25 Å²	25	59.3 Å²	59.3	21%	0.207	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	141.7	165.5	0	0	0	0	0	109.8	S102 E103	A100-S102 PolarHBondContact O-N 2.95Å; A100-E103 HydrophobicContact CB-CG 3.99Å; A100-E103 PolarHBondContact N-OE2 2.89Å; A100-E103 WeakPolarHBondContact O-CB 3.42Å; A100-E103 PolarHBondContact O-N 3.43Å
101	G	90.8	Very high	88.6	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-23.3	179.9	0	0	0	0	0	114	F105 D295 L300	G101-F105 WeakPolarHBondContact O-CE2 3.42Å; G101-D295 PolarHBondContact N-O 2.9Å; G101-L300 WeakPolarHBondContact O-CD2 3.41Å
102	S	91.4	Very high	89	Confident	60 Å²	60	61.8 Å²	61.8	42%	0.42	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-23.8	174.6	51.3	0	0	0	0	114.5	A100 I104 F105	A100-S102 PolarHBondContact O-N 2.95Å; S102-I104 PolarHBondContact O-N 3.22Å; S102-F105 PolarHBondContact O-N 2.88Å
103	E	90.2	Very high	89.7	Confident	119 Å²	119	56.7 Å²	56.7	56%	0.556	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-18.4	-176.2	-71.9	169.5	173.6	0	0	113.1	L99 A100 F105	L99-E103 WeakPolarHBondContact CA-OE2 3.41Å; L99-E103 HydrophobicContact CD1-CB 3.98Å; L99-E103 WeakPolarHBondContact CD1-OE2 3.47Å; L99-E103 HydrophobicContact CG-CB 4.49Å; A100-E103 HydrophobicContact CB-CG 3.99Å; A100-E103 PolarHBondContact N-OE2 2.89Å; A100-E103 WeakPolarHBondContact O-CB 3.42Å; A100-E103 PolarHBondContact O-N 3.43Å; E103-F105 PolarHBondContact O-N 3.47Å
104	I	91.4	Very high	90.5	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-24.6	179.5	-62.4	169.9	0	0	0	111.7	L99 S102 S106 K111 A114 L115 L300	L99-I104 HydrophobicContact CD2-CD1 3.75Å; L99-I104 HydrophobicContact CD2-CG1 3.56Å; L99-I104 HydrophobicContact CG-CG1 4.34Å; S102-I104 PolarHBondContact O-N 3.22Å; I104-S106 PolarHBondContact O-N 3.41Å; I104-S106 VanDerWaalsContact O-N 3.12Å; I104-K111 HydrophobicContact CG2-CB 3.83Å; I104-K111 HydrophobicContact CG2-CG 4.26Å; I104-K111 WeakPolarHBondContact CG2-O 3.33Å; I104-A114 HydrophobicContact CG2-CB 4.16Å; I104-L115 HydrophobicContact CD1-CD1 4.43Å; I104-L115 HydrophobicContact CD1-CD2 3.48Å; I104-L115 VanDerWaalsContact CD1-CD2 3.48Å; I104-L115 HydrophobicContact CD1-CG 3.84Å; I104-L115 HydrophobicContact CG1-CD2 4.31Å; I104-L115 HydrophobicContact CG1-CG 4.41Å; I104-L115 HydrophobicContact CG2-CG 4.14Å; I104-L300 HydrophobicContact CD1-CD2 3.37Å
105	F	90.4	Very high	91	Very high	79 Å²	79	52.4 Å²	52.4	35%	0.346	29%	0.291	S	S	.	.			trans	-83.6	92	-178.4	-58.6	-80	0	0	0	109.8	G101 S102 E103 K111 M299	G101-F105 WeakPolarHBondContact O-CE2 3.42Å; S102-F105 PolarHBondContact O-N 2.88Å; E103-F105 PolarHBondContact O-N 3.47Å; F105-K111 HydrophobicContact CD1-CD 3.81Å; F105-K111 HydrophobicContact CD1-CG 4.19Å; F105-K111 HydrophobicContact CE1-CD 3.68Å; F105-K111 HydrophobicContact CE1-CG 4.44Å; F105-M299 WeakPolarHBondContact CE2-O 3.5Å; F105-M299 WeakPolarHBondContact CZ-O 3.05Å
106	S	87.1	Confident	91.2	Very high	53 Å²	53	52.1 Å²	52.1	37%	0.371	29%	0.29	S	S	.	.			trans	-115.8	155.4	175.5	-176.4	0	0	0	0	111.8	I104 E108	I104-S106 PolarHBondContact O-N 3.41Å; I104-S106 VanDerWaalsContact O-N 3.12Å; S106-E108 PolarHBondContact OG-N 3.41Å; S106-E108 VanDerWaalsContact OG-N 3.09Å
107	L	86.4	Confident	91.3	Very high	185 Å²	185	49.5 Å²	49.5	97%	0.969	28%	0.279	S	S	*	.	S	Bend	trans	-86.6	-20.9	168.5	-67.6	175	0	0	0	112.2
108	E	84.9	Confident	91.4	Very high	157 Å²	157	48.6 Å²	48.6	73%	0.734	27%	0.273	S	S	*	.	S	Bend	trans	-83.9	-27	-174.8	-63.8	-176.2	166.6	0	0	112.8	S106	S106-E108 PolarHBondContact OG-N 3.41Å; S106-E108 VanDerWaalsContact OG-N 3.09Å
109	M	89.3	Confident	91.5	Very high	32 Å²	32	46.3 Å²	46.3	16%	0.158	25%	0.252	C	S	.	.	S	Bend	trans	-143.5	153.4	-178.9	65.2	-179	72.6	0	0	111.4	E113 A114 E263	M109-E113 HydrophobicContact CB-CG 4.35Å; M109-A114 HydrophobicContact CG-CB 4.25Å; M109-A114 HydrophobicContact SD-CB 3.87Å; M109-E263 HydrophobicContact CB-CG 4.31Å
110	S	92.8	Very high	91.4	Very high	46 Å²	46	45.9 Å²	45.9	32%	0.322	25%	0.249	S	C	.	.			trans	-65.5	151.3	174.7	58.7	0	0	0	0	112.7	T112 E113 A114 E263	S110-T112 VanDerWaalsContact C-N 3.26Å; S110-T112 PolarHBondContact O-N 3.06Å; S110-T112 PolarHBondContact OG-OG1 3.43Å; S110-E113 WeakPolarHBondContact O-CA 3.25Å; S110-E113 WeakPolarHBondContact O-CB 3.47Å; S110-E113 PolarHBondContact O-N 2.94Å; S110-E113 WeakPolarHBondContact OG-CB 3.36Å; S110-E113 PolarHBondContact OG-N 3.38Å; S110-A114 PolarHBondContact O-N 3.01Å; S110-E263 VanDerWaalsContact CB-OE1 3.29Å; S110-E263 WeakPolarHBondContact CB-OE1 3.49Å; S110-E263 PolarHBondContact N-OE1 3.11Å; S110-E263 PolarHBondContact OG-OE1 3.18Å
111	K	93.3	Very high	91.3	Very high	51 Å²	51	48.9 Å²	48.9	22%	0.222	26%	0.257	C	S	.	.	H	α-helix	trans	-55.8	-41	177.9	-62.5	173.6	-64.2	-176.5	0	112.4	I104 F105 E113 A114 L115 D301 E303	I104-K111 HydrophobicContact CG2-CB 3.83Å; I104-K111 HydrophobicContact CG2-CG 4.26Å; I104-K111 WeakPolarHBondContact CG2-O 3.33Å; F105-K111 HydrophobicContact CD1-CD 3.81Å; F105-K111 HydrophobicContact CD1-CG 4.19Å; F105-K111 HydrophobicContact CE1-CD 3.68Å; F105-K111 HydrophobicContact CE1-CG 4.44Å; K111-E113 VanDerWaalsContact C-N 3.31Å; K111-A114 PolarHBondContact O-N 3.47Å; K111-L115 PolarHBondContact O-N 2.82Å; K111-D301 WeakPolarHBondContact CD-OD2 3.34Å; K111-D301 IonicContact NZ-OD1 3.69Å; K111-D301 IonicContact NZ-OD2 3.47Å; K111-D301 PolarHBondContact NZ-OD2 2.8Å; K111-E303 VanDerWaalsContact CE-OE2 3.28Å; K111-E303 WeakPolarHBondContact CE-OE2 3.12Å; K111-E303 IonicContact NZ-OE2 3.8Å; K111-E303 PolarHBondContact NZ-OE2 2.98Å
112	T	91.7	Very high	91.4	Very high	62 Å²	62	48.9 Å²	48.9	38%	0.38	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-35.7	176.7	45.7	0	0	0	0	112.1	S110 S116 F307	S110-T112 VanDerWaalsContact C-N 3.26Å; S110-T112 PolarHBondContact O-N 3.06Å; S110-T112 PolarHBondContact OG-OG1 3.43Å; T112-S116 VanDerWaalsContact O-CB 3.32Å; T112-S116 WeakPolarHBondContact O-CB 3.32Å; T112-S116 PolarHBondContact O-N 2.81Å; T112-F307 HydrophobicContact CG2-CB 4.43Å; T112-F307 HydrophobicContact CG2-CD2 4.09Å; T112-F307 HydrophobicContact CG2-CG 4.46Å
113	E	92.3	Very high	91.4	Very high	14 Å²	14	46.5 Å²	46.5	7%	0.065	24%	0.239	C	C	.	.	H	α-helix	trans	-71.8	-43.8	177.2	176.5	57.9	-168.4	0	0	111	M109 S110 K111 L115 S116 Q117 E263 I264 R269	M109-E113 HydrophobicContact CB-CG 4.35Å; S110-E113 WeakPolarHBondContact O-CA 3.25Å; S110-E113 WeakPolarHBondContact O-CB 3.47Å; S110-E113 PolarHBondContact O-N 2.94Å; S110-E113 WeakPolarHBondContact OG-CB 3.36Å; S110-E113 PolarHBondContact OG-N 3.38Å; K111-E113 VanDerWaalsContact C-N 3.31Å; E113-L115 VanDerWaalsContact C-N 3.32Å; E113-L115 PolarHBondContact O-N 3.38Å; E113-S116 PolarHBondContact O-N 3.25Å; E113-S116 VanDerWaalsContact O-N 3.13Å; E113-Q117 WeakPolarHBondContact O-CG 3.41Å; E113-Q117 PolarHBondContact O-N 3.38Å; E113-Q117 PolarHBondContact OE1-NE2 2.64Å; E113-E263 HydrophobicContact CG-CB 4.19Å; E113-E263 HydrophobicContact CG-CG 4.06Å; E113-I264 PolarHBondContact OE1-N 3.22Å; E113-R269 IonicContact OE1-CZ 3.42Å; E113-R269 IonicContact OE1-NH1 2.82Å; E113-R269 IonicContact OE1-NH2 3.87Å; E113-R269 PolarHBondContact OE1-NH2 2.86Å; E113-R269 IonicContact OE2-CZ 2.97Å; E113-R269 VanDerWaalsContact OE2-CZ 3.29Å; E113-R269 IonicContact OE2-NH1 2.64Å; E113-R269 PolarHBondContact OE2-NH1 3.04Å; E113-R269 IonicContact OE2-NH2 3.04Å; E113-R269 PolarHBondContact OE2-NH2 3.33Å
114	A	93.4	Very high	91.5	Very high	16 Å²	16	40.9 Å²	40.9	13%	0.132	21%	0.213	C	C	.	.	H	α-helix	trans	-57.4	-44.9	174.2	0	0	0	0	0	111.9	I104 M109 S110 K111 Q117 A118	I104-A114 HydrophobicContact CG2-CB 4.16Å; M109-A114 HydrophobicContact CG-CB 4.25Å; M109-A114 HydrophobicContact SD-CB 3.87Å; S110-A114 PolarHBondContact O-N 3.01Å; K111-A114 PolarHBondContact O-N 3.47Å; A114-Q117 PolarHBondContact O-N 3.34Å; A114-A118 PolarHBondContact O-N 2.97Å
115	L	93.9	Very high	91.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-45.1	173.2	-81	171	0	0	0	112	I104 K111 E113 Q117 A118 F119 I294 C304 F307 L308	I104-L115 HydrophobicContact CD1-CD1 4.43Å; I104-L115 HydrophobicContact CD1-CD2 3.48Å; I104-L115 VanDerWaalsContact CD1-CD2 3.48Å; I104-L115 HydrophobicContact CD1-CG 3.84Å; I104-L115 HydrophobicContact CG1-CD2 4.31Å; I104-L115 HydrophobicContact CG1-CG 4.41Å; I104-L115 HydrophobicContact CG2-CG 4.14Å; K111-L115 PolarHBondContact O-N 2.82Å; E113-L115 VanDerWaalsContact C-N 3.32Å; E113-L115 PolarHBondContact O-N 3.38Å; L115-Q117 VanDerWaalsContact C-N 3.28Å; L115-Q117 PolarHBondContact O-N 3.26Å; L115-A118 WeakPolarHBondContact O-CB 3.43Å; L115-A118 PolarHBondContact O-N 2.92Å; L115-A118 VanDerWaalsContact O-N 3.14Å; L115-F119 WeakPolarHBondContact O-CD2 3.45Å; L115-F119 PolarHBondContact O-N 3.2Å; L115-I294 HydrophobicContact CD2-CD1 4.35Å; L115-C304 HydrophobicContact CD1-CB 3.76Å; L115-F307 HydrophobicContact CB-CD1 3.75Å; L115-F307 HydrophobicContact CB-CE1 3.59Å; L115-F307 HydrophobicContact CB-CZ 4.38Å; L115-F307 HydrophobicContact CD1-CD1 3.87Å; L115-F307 HydrophobicContact CD1-CG 4.45Å; L115-F307 HydrophobicContact CG-CD1 4.41Å; L115-L308 HydrophobicContact CD2-CD2 4.12Å
116	S	93.4	Very high	91.5	Very high	20 Å²	20	39.3 Å²	39.3	14%	0.14	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-38.7	178.2	-169.3	0	0	0	0	112.1	T112 E113 R120 R269	T112-S116 VanDerWaalsContact O-CB 3.32Å; T112-S116 WeakPolarHBondContact O-CB 3.32Å; T112-S116 PolarHBondContact O-N 2.81Å; E113-S116 PolarHBondContact O-N 3.25Å; E113-S116 VanDerWaalsContact O-N 3.13Å; S116-R120 WeakPolarHBondContact O-CG 3.34Å; S116-R120 PolarHBondContact O-N 3.26Å; S116-R269 PolarHBondContact OG-NH1 3Å
117	Q	92.5	Very high	91.6	Very high	7 Å²	7	39.1 Å²	39.1	3%	0.033	20%	0.2	C	C	.	.	H	α-helix	trans	-66.1	-42	174.7	-68.7	-177.8	18.7	0	0	111.2	E113 A114 L115 F119 R120 K121 H241 G262	E113-Q117 WeakPolarHBondContact O-CG 3.41Å; E113-Q117 PolarHBondContact O-N 3.38Å; E113-Q117 PolarHBondContact OE1-NE2 2.64Å; A114-Q117 PolarHBondContact O-N 3.34Å; L115-Q117 VanDerWaalsContact C-N 3.28Å; L115-Q117 PolarHBondContact O-N 3.26Å; Q117-F119 PolarHBondContact O-N 2.95Å; Q117-R120 PolarHBondContact O-N 3.28Å; Q117-K121 WeakPolarHBondContact O-CB 3.45Å; Q117-K121 VanDerWaalsContact O-CG 3.31Å; Q117-K121 WeakPolarHBondContact O-CG 3.28Å; Q117-K121 PolarHBondContact O-N 3.47Å; Q117-H241 PolarHBondContact OE1-CE1 3.24Å; Q117-G262 PolarHBondContact NE2-O 3.44Å
118	A	93.9	Very high	91.5	Very high	4 Å²	4	35.7 Å²	35.7	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-60.6	-43.4	176.4	0	0	0	0	0	112.3	L99 A114 L115 R120 K121 A122 L292	L99-A118 HydrophobicContact CD2-CB 4.09Å; A114-A118 PolarHBondContact O-N 2.97Å; L115-A118 WeakPolarHBondContact O-CB 3.43Å; L115-A118 PolarHBondContact O-N 2.92Å; L115-A118 VanDerWaalsContact O-N 3.14Å; A118-R120 PolarHBondContact O-N 3.25Å; A118-K121 PolarHBondContact O-N 3.03Å; A118-A122 PolarHBondContact O-N 2.6Å; A118-L292 HydrophobicContact CB-CD1 3.93Å; A118-L292 HydrophobicContact CB-CD2 4.38Å
119	F	93.6	Very high	91.4	Very high	13 Å²	13	33 Å²	33	6%	0.057	16%	0.164	C	C	.	.	H	α-helix	trans	-60.3	-44.4	173.6	-90.2	-104.4	0	0	0	111.9	L115 Q117 A122 I123 L292 F307 L308 A311 P318	L115-F119 WeakPolarHBondContact O-CD2 3.45Å; L115-F119 PolarHBondContact O-N 3.2Å; Q117-F119 PolarHBondContact O-N 2.95Å; F119-A122 PolarHBondContact O-N 2.97Å; F119-I123 WeakPolarHBondContact O-CG1 3.44Å; F119-L292 HydrophobicContact CD2-CD2 3.41Å; F119-L292 VanDerWaalsContact CD2-CD2 3.41Å; F119-L292 HydrophobicContact CE2-CD2 3.38Å; F119-L292 HydrophobicContact CG-CD2 4.04Å; F119-L292 HydrophobicContact CZ-CD2 3.99Å; F119-F307 HydrophobicContact CD2-CE1 4.44Å; F119-L308 HydrophobicContact CE2-CD2 3.36Å; F119-L308 HydrophobicContact CZ-CD2 3.63Å; F119-A311 HydrophobicContact CD1-CB 4.14Å; F119-A311 HydrophobicContact CE1-CB 3.79Å; F119-A311 HydrophobicContact CE2-CB 4.43Å; F119-A311 HydrophobicContact CZ-CB 3.94Å; F119-P318 HydrophobicContact CD1-CG 3.93Å; F119-P318 HydrophobicContact CE1-CG 4.36Å
120	R	92.9	Very high	91.1	Very high	19 Å²	19	38.5 Å²	38.5	7%	0.072	19%	0.19	C	C	.	.	H	α-helix	trans	-74.1	-25.5	-178.8	-67.8	-171.8	74.1	88.7	-11.3	113.9	S116 Q117 A118 A122 L240 H241 D244 N273	S116-R120 WeakPolarHBondContact O-CG 3.34Å; S116-R120 PolarHBondContact O-N 3.26Å; Q117-R120 PolarHBondContact O-N 3.28Å; A118-R120 PolarHBondContact O-N 3.25Å; R120-A122 VanDerWaalsContact C-N 3.32Å; R120-L240 HydrophobicContact CB-CB 4.12Å; R120-L240 HydrophobicContact CG-CB 4.5Å; R120-L240 PolarHBondContact O-N 3.02Å; R120-H241 HydrophobicContact CB-CB 3.89Å; R120-H241 PolarHBondContact O-N 2.99Å; R120-D244 WeakPolarHBondContact CD-OD2 3.48Å; R120-D244 IonicContact CZ-OD1 3.92Å; R120-D244 IonicContact CZ-OD2 3.69Å; R120-D244 IonicContact NE-OD1 2.68Å; R120-D244 PolarHBondContact NE-OD1 3.5Å; R120-D244 IonicContact NE-OD2 2.69Å; R120-D244 PolarHBondContact NE-OD2 3.19Å; R120-D244 IonicContact NH2-OD1 2.75Å; R120-D244 PolarHBondContact NH2-OD1 3.34Å; R120-D244 IonicContact NH2-OD2 3.29Å; R120-N273 PolarHBondContact NH1-OD1 3.02Å; R120-N273 PolarHBondContact NH2-OD1 3.33Å; R120-N273 VanDerWaalsContact NH2-OD1 3.11Å
121	K	92.8	Very high	90.7	Very high	89 Å²	89	37 Å²	37	39%	0.387	18%	0.179	S	C	.	.	H	α-helix	trans	-69	-32.7	169.8	-75.2	175.7	-177.8	176.9	0	111.9	T97 Q117 A118 I123 H241	T97-K121 HydrophobicContact CG2-CB 4.18Å; Q117-K121 WeakPolarHBondContact O-CB 3.45Å; Q117-K121 VanDerWaalsContact O-CG 3.31Å; Q117-K121 WeakPolarHBondContact O-CG 3.28Å; Q117-K121 PolarHBondContact O-N 3.47Å; A118-K121 PolarHBondContact O-N 3.03Å; K121-I123 VanDerWaalsContact C-N 3.26Å; K121-I123 PolarHBondContact O-N 2.9Å; K121-H241 HydrophobicContact CB-CB 4.49Å; K121-H241 WeakPolarHBondContact CE-CD2 3.42Å; K121-H241 VanDerWaalsContact CE-NE2 3.32Å; K121-H241 WeakPolarHBondContact CE-NE2 3.49Å; K121-H241 HydrophobicContact CG-CB 3.64Å
122	A	92.1	Very high	90.6	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	3.8	178.4	0	0	0	0	0	114.2	T97 A118 F119 R120 G290 L292 P318	T97-A122 PolarHBondContact OG1-N 3.29Å; A118-A122 PolarHBondContact O-N 2.6Å; F119-A122 PolarHBondContact O-N 2.97Å; R120-A122 VanDerWaalsContact C-N 3.32Å; A122-G290 CarbonylContact O-C 3.56Å; A122-G290 WeakPolarHBondContact O-CA 3.31Å; A122-G290 PolarHBondContact O-N 3.34Å; A122-L292 HydrophobicContact CB-CB 3.91Å; A122-P318 HydrophobicContact CB-CB 3.9Å; A122-P318 HydrophobicContact CB-CG 3.88Å
123	I	91.4	Very high	90.7	Very high	9 Å²	9	35.4 Å²	35.4	5%	0.046	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	121	175.1	-56.9	158.8	0	0	0	108.5	F119 K121 S239 L240 I287 L316 P318	F119-I123 WeakPolarHBondContact O-CG1 3.44Å; K121-I123 VanDerWaalsContact C-N 3.26Å; K121-I123 PolarHBondContact O-N 2.9Å; I123-S239 VanDerWaalsContact O-CA 3.31Å; I123-S239 WeakPolarHBondContact O-CA 3.46Å; I123-L240 HydrophobicContact CB-CD1 3.79Å; I123-L240 HydrophobicContact CB-CG 4.1Å; I123-L240 HydrophobicContact CD1-CD1 3.84Å; I123-L240 HydrophobicContact CG1-CD1 4.46Å; I123-L240 HydrophobicContact CG2-CD1 3.53Å; I123-L240 HydrophobicContact CG2-CG 3.9Å; I123-L240 PolarHBondContact O-N 2.9Å; I123-I287 HydrophobicContact CG2-CG2 3.84Å; I123-L316 WeakPolarHBondContact CD1-O 3.37Å; I123-L316 WeakPolarHBondContact CG1-O 3.41Å; I123-P318 HydrophobicContact CG1-CB 4.3Å; I123-P318 HydrophobicContact CG1-CG 4.28Å
124	G	91.3	Very high	90.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	146.7	179.5	0	0	0	0	0	111.5	V238 I288	G124-V238 CarbonylContact C-O 3.55Å; G124-I288 PolarHBondContact N-O 3.35Å; G124-I288 PolarHBondContact O-N 3.07Å
125	V	91.8	Very high	90.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	113.1	169.1	-176.1	0	0	0	0	106.7	I127 V238 L240 I243 V276 A285	V125-I127 HydrophobicContact CG1-CG1 4.01Å; V125-V238 HydrophobicContact CB-CG2 4.35Å; V125-V238 PolarHBondContact N-O 3.02Å; V125-V238 PolarHBondContact O-N 2.7Å; V125-L240 HydrophobicContact CG2-CD2 3.51Å; V125-L240 HydrophobicContact CG2-CG 4.13Å; V125-I243 HydrophobicContact CB-CD1 4.33Å; V125-I243 HydrophobicContact CG2-CD1 4.19Å; V125-V276 HydrophobicContact CG1-CG1 4.45Å; V125-V276 HydrophobicContact CG2-CG1 3.95Å; V125-V276 HydrophobicContact CG2-CG2 4.39Å; V125-A285 HydrophobicContact CG1-CB 3.8Å
126	R	90.9	Very high	90.8	Very high	48 Å²	48	36.8 Å²	36.8	18%	0.181	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	113.1	175.2	-178.9	-173.9	-78.6	149.4	-7.8	108.6	D93 V235 H236 A285 E286 I288	D93-R126 IonicContact OD2-CZ 2.79Å; D93-R126 IonicContact OD2-NH2 3.67Å; D93-R126 PolarHBondContact OD2-NH2 2.9Å; R126-V235 HydrophobicContact CG-CG1 3.28Å; R126-H236 CarbonylContact C-O 3.56Å; R126-H236 WeakPolarHBondContact CA-O 3.37Å; R126-A285 CarbonylContact O-C 3.37Å; R126-A285 VanDerWaalsContact O-CA 3.28Å; R126-A285 WeakPolarHBondContact O-CA 3.24Å; R126-E286 HydrophobicContact CB-CB 4.35Å; R126-E286 PolarHBondContact N-O 3.47Å; R126-E286 IonicContact NH1-OE2 3.24Å; R126-E286 PolarHBondContact NH1-OE2 3.07Å; R126-E286 PolarHBondContact O-N 3.44Å; R126-I288 HydrophobicContact CB-CD1 3.74Å; R126-I288 HydrophobicContact CB-CG1 4.28Å
127	I	89.3	Confident	90.8	Very high	49 Å²	49	36.6 Å²	36.6	25%	0.251	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128	179.4	-54.9	173.1	0	0	0	107.6	V125 H236 V238 W279 A285	V125-I127 HydrophobicContact CG1-CG1 4.01Å; I127-H236 PolarHBondContact N-O 2.92Å; I127-H236 PolarHBondContact O-N 2.88Å; I127-V238 HydrophobicContact CD1-CG2 4.07Å; I127-W279 HydrophobicContact CD1-CZ3 4.33Å; I127-A285 HydrophobicContact CG1-CB 4.32Å
128	K	84.7	Confident	90.9	Very high	112 Å²	112	36.2 Å²	36.2	49%	0.487	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	116.7	176.1	-68.5	176.1	166.1	-164.8	0	108.2	E233 V235 K284	K128-E233 VanDerWaalsContact CD-OE1 3.23Å; K128-E233 WeakPolarHBondContact CD-OE1 3.23Å; K128-E233 WeakPolarHBondContact CG-OE1 3.35Å; K128-E233 IonicContact NZ-OE1 3.23Å; K128-V235 HydrophobicContact CG-CG2 4.3Å; K128-K284 PolarHBondContact N-O 3.45Å
129	E	81.6	Confident	90.8	Very high	100 Å²	100	37.5 Å²	37.5	47%	0.467	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.2	177.6	-168.5	174.3	178.8	0	0	109.8	T131 V234	E129-T131 HydrophobicContact CG-CG2 4.08Å; E129-V234 PolarHBondContact N-O 2.8Å; E129-V234 PolarHBondContact O-N 2.76Å
130	E	84.2	Confident	90.8	Very high	149 Å²	149	41.3 Å²	41.3	70%	0.696	19%	0.192	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.2	171.3	-67.4	-171.9	174	0	0	109.2
131	T	84.4	Confident	90.7	Very high	15 Å²	15	42.4 Å²	42.4	9%	0.092	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.2	176.6	58.1	0	0	0	0	110.5	E129 K232	E129-T131 HydrophobicContact CG-CG2 4.08Å; T131-K232 PolarHBondContact N-O 2.81Å; T131-K232 PolarHBondContact O-N 3.43Å; T131-K232 PolarHBondContact OG1-O 3.36Å
132	E	90.6	Very high	90.7	Very high	51 Å²	51	42.2 Å²	42.2	24%	0.238	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	113.6	170.5	-62.1	-163.9	151.6	0	0	108.8	K193 Q229 R231	E132-K193 HydrophobicContact CB-CB 4.28Å; E132-K193 HydrophobicContact CB-CD 4.22Å; E132-K193 VanDerWaalsContact O-CB 3.31Å; E132-K193 WeakPolarHBondContact O-CB 3.42Å; E132-K193 PolarHBondContact O-N 3.48Å; E132-K193 WeakPolarHBondContact OE2-CD 3.35Å; E132-K193 IonicContact OE2-NZ 3.94Å; E132-K193 PolarHBondContact OE2-NZ 3.38Å; E132-Q229 PolarHBondContact OE2-NE2 3.36Å; E132-R231 HydrophobicContact CG-CG 4.26Å; E132-R231 IonicContact OE1-CZ 2.72Å; E132-R231 IonicContact OE1-NE 3.33Å; E132-R231 PolarHBondContact OE1-NE 2.95Å; E132-R231 IonicContact OE1-NH2 3.23Å; E132-R231 PolarHBondContact OE1-NH2 3.39Å
133	I	92.8	Very high	90.5	Very high	27 Å²	27	45.1 Å²	45.1	14%	0.138	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.5	177.9	60.4	168.5	0	0	0	110.3	I191 K230 K232	I133-I191 CarbonylContact C-O 3.56Å; I133-I191 WeakPolarHBondContact CA-O 3.49Å; I133-K230 HydrophobicContact CG1-CB 4.2Å; I133-K230 WeakPolarHBondContact CG1-O 3.37Å; I133-K230 PolarHBondContact N-O 3.09Å; I133-K230 PolarHBondContact O-N 3.34Å; I133-K230 VanDerWaalsContact O-O 3.14Å; I133-K232 HydrophobicContact CD1-CB 3.87Å; I133-K232 HydrophobicContact CD1-CD 3.77Å; I133-K232 HydrophobicContact CD1-CG 4.45Å; I133-K232 HydrophobicContact CG1-CB 4.11Å
134	I	93.8	Very high	90.3	Very high	16 Å²	16	49.9 Å²	49.9	8%	0.082	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	119.7	170.7	-57.7	172.1	0	0	0	107.5	L159 Y168 T190 I191 L228 Q229	I134-L159 HydrophobicContact CG2-CD1 3.68Å; I134-Y168 HydrophobicContact CD1-CE1 4.02Å; I134-Y168 HydrophobicContact CG2-CE2 4.2Å; I134-T190 CarbonylContact O-C 3.55Å; I134-T190 VanDerWaalsContact O-CA 3.31Å; I134-T190 WeakPolarHBondContact O-CA 3.24Å; I134-I191 HydrophobicContact CB-CB 4.34Å; I134-I191 PolarHBondContact N-O 2.83Å; I134-I191 PolarHBondContact O-N 3.06Å; I134-L228 CarbonylContact C-O 3.51Å; I134-L228 VanDerWaalsContact CA-O 3.23Å; I134-L228 WeakPolarHBondContact CA-O 3.44Å; I134-Q229 HydrophobicContact CG1-CB 4.48Å; I134-Q229 HydrophobicContact CG1-CG 4.45Å
135	E	94.1	Very high	89.8	Confident	44 Å²	44	57.7 Å²	57.7	21%	0.206	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.1	-177	-178.6	-175.4	-153.3	0	0	109.8	T161 T190 P224 L228 K230	E135-T161 WeakPolarHBondContact O-CG2 3.4Å; E135-T190 HydrophobicContact CB-CG2 4.15Å; E135-T190 HydrophobicContact CG-CG2 3.9Å; E135-P224 HydrophobicContact CG-CB 3.86Å; E135-P224 HydrophobicContact CG-CG 3.7Å; E135-L228 PolarHBondContact N-O 3.36Å; E135-L228 WeakPolarHBondContact O-CD2 3.43Å; E135-K230 IonicContact OE2-NZ 3.68Å; E135-K230 PolarHBondContact OE2-NZ 3.05Å
136	G	94.5	Very high	89.2	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	165.2	-179.1	0	0	0	0	0	114.2	I189	G136-I189 PolarHBondContact N-O 3.46Å; G136-I189 VanDerWaalsContact N-O 3.17Å; G136-I189 PolarHBondContact O-N 3.15Å
137	E	94.1	Very high	88.3	Confident	15 Å²	15	63.2 Å²	63.2	7%	0.07	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	133	167.4	-178	-178.4	153.5	0	0	110.1	V139 L159 K160 V188 S204 C223	E137-V139 PolarHBondContact O-N 3.26Å; E137-L159 CarbonylContact O-C 3.52Å; E137-L159 WeakPolarHBondContact O-CA 3.42Å; E137-K160 PolarHBondContact N-O 3.49Å; E137-K160 PolarHBondContact O-N 2.85Å; E137-V188 HydrophobicContact CB-CG2 4.47Å; E137-S204 WeakPolarHBondContact OE2-CB 3.4Å; E137-S204 PolarHBondContact OE2-OG 3.07Å; E137-C223 PolarHBondContact OE2-SG 3.34Å
138	V	94.2	Very high	87.5	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	112.4	174.5	-178.5	0	0	0	0	110.1	I141 L157 L159 V183 G186 D187 I189	V138-I141 HydrophobicContact CG1-CD1 3.91Å; V138-I141 HydrophobicContact CG1-CG1 3.48Å; V138-I141 VanDerWaalsContact CG1-CG1 3.48Å; V138-L157 HydrophobicContact CG1-CD1 3.83Å; V138-L157 HydrophobicContact CG2-CD1 4.33Å; V138-L159 HydrophobicContact CB-CD2 4.38Å; V138-L159 HydrophobicContact CG2-CD2 3.72Å; V138-V183 HydrophobicContact CG2-CG1 3.89Å; V138-G186 PolarHBondContact O-N 2.86Å; V138-D187 WeakPolarHBondContact CG2-O 3.45Å; V138-D187 PolarHBondContact N-O 3.35Å; V138-I189 HydrophobicContact CG2-CD1 3.65Å; V138-I189 HydrophobicContact CG2-CG1 3.85Å; V138-I189 HydrophobicContact CG2-CG2 4.22Å
139	V	92.8	Very high	86.6	Confident	30 Å²	30	64.2 Å²	64.2	18%	0.182	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	-49	174.9	-179.6	0	0	0	0	110.1	E137 T158 K160 A185 R207	E137-V139 PolarHBondContact O-N 3.26Å; V139-T158 HydrophobicContact CB-CG2 3.92Å; V139-T158 HydrophobicContact CG1-CG2 4.44Å; V139-T158 HydrophobicContact CG2-CG2 4.27Å; V139-T158 PolarHBondContact N-O 3.15Å; V139-K160 HydrophobicContact CG2-CB 3.47Å; V139-K160 VanDerWaalsContact CG2-CB 3.47Å; V139-K160 HydrophobicContact CG2-CD 4.16Å; V139-K160 HydrophobicContact CG2-CG 4.44Å; V139-A185 WeakPolarHBondContact O-CB 3.48Å; V139-R207 PolarHBondContact O-NH1 3.37Å
140	E	92.6	Very high	85.5	Confident	93 Å²	93	64.9 Å²	64.9	44%	0.435	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	147.9	-175.1	-167.1	179.2	171.6	0	0	111.3	Q142 T158	E140-Q142 HydrophobicContact CG-CG 4.27Å; E140-Q142 WeakPolarHBondContact OE1-CG 3.42Å; E140-Q142 PolarHBondContact OE1-NE2 3.06Å; E140-T158 PolarHBondContact O-N 2.67Å
141	I	91.9	Very high	84.7	Confident	43 Å²	43	60.3 Å²	60.3	22%	0.221	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	118.3	172.4	-45.5	178.6	0	0	0	108	V138 I143 L157 V183	V138-I141 HydrophobicContact CG1-CD1 3.91Å; V138-I141 HydrophobicContact CG1-CG1 3.48Å; V138-I141 VanDerWaalsContact CG1-CG1 3.48Å; I141-I143 HydrophobicContact CG2-CD1 4.11Å; I141-I143 HydrophobicContact CG2-CG1 4.05Å; I141-L157 HydrophobicContact CD1-CD1 4.43Å; I141-L157 HydrophobicContact CG1-CD1 3.8Å; I141-V183 HydrophobicContact CD1-CB 4.38Å; I141-V183 HydrophobicContact CD1-CG1 4.06Å; I141-V183 WeakPolarHBondContact CD1-O 3.5Å
142	Q	91.1	Very high	84.3	Confident	84 Å²	84	62.6 Å²	62.6	39%	0.393	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.5	173.8	-64	178.1	-2.7	0	0	108.6	E140 G155 K156	E140-Q142 HydrophobicContact CG-CG 4.27Å; E140-Q142 WeakPolarHBondContact OE1-CG 3.42Å; E140-Q142 PolarHBondContact OE1-NE2 3.06Å; Q142-G155 CarbonylContact O-C 3.49Å; Q142-G155 WeakPolarHBondContact O-CA 3.5Å; Q142-K156 HydrophobicContact CB-CB 4.36Å; Q142-K156 PolarHBondContact N-O 2.97Å; Q142-K156 PolarHBondContact O-N 3.02Å
143	I	89.3	Confident	83.9	Confident	61 Å²	61	62.9 Å²	62.9	31%	0.313	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	110.6	178.3	-60.8	164.8	0	0	0	108	I141 R145 I175	I141-I143 HydrophobicContact CG2-CD1 4.11Å; I141-I143 HydrophobicContact CG2-CG1 4.05Å; I143-R145 HydrophobicContact CG2-CG 4.16Å; I143-I175 HydrophobicContact CD1-CG2 3.93Å; I143-I175 HydrophobicContact CG1-CG2 4.18Å; I143-I175 HydrophobicContact CG2-CD1 4.43Å; I143-I175 HydrophobicContact CG2-CG2 3.81Å
144	D	85.8	Confident	83.6	Confident	110 Å²	110	65.6 Å²	65.6	59%	0.588	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.1	174.7	-65.1	-37	0	0	0	109.4	V154	D144-V154 PolarHBondContact N-O 3.01Å; D144-V154 PolarHBondContact O-N 2.9Å
145	R	81.1	Confident	83.4	Confident	165 Å²	165	64.9 Å²	64.9	62%	0.623	39%	0.392	S	S	*	.			trans	-108.2	128.9	174.9	-64.5	-174.7	-178.3	-177.6	1	109.3	I143 A147 K153	I143-R145 HydrophobicContact CG2-CG 4.16Å; R145-A147 PolarHBondContact O-N 3.18Å; R145-K153 HydrophobicContact CG-CG 4.47Å
146	P	79.6	Confident	83.4	Confident	49 Å²	49	67.4 Å²	67.4	32%	0.318	40%	0.403	S	S	.	.			trans	-62.1	136.7	175	21.6	-28.1	0	0	0	110.4	T148 G149	P146-T148 PolarHBondContact O-N 3.33Å; P146-G149 PolarHBondContact O-N 3.42Å
147	A	72.3	Confident	83.4	Confident	115 Å²	115	67.5 Å²	67.5	95%	0.95	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-21.7	-173.3	0	0	0	0	0	114.1	R145 G149	R145-A147 PolarHBondContact O-N 3.18Å; A147-G149 VanDerWaalsContact C-N 3.34Å
148	T	71.8	Confident	83.4	Confident	111 Å²	111	67.5 Å²	67.5	68%	0.681	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-7.3	178.3	52.6	0	0	0	0	113.7	P146 T150	P146-T148 PolarHBondContact O-N 3.33Å; T148-T150 PolarHBondContact O-N 3.18Å; T148-T150 PolarHBondContact O-OG1 2.94Å; T148-T150 PolarHBondContact OG1-O 2.72Å
149	G	65.4	Low	83.5	Confident	71 Å²	71	67.5 Å²	67.5	73%	0.732	40%	0.404	S	S	*	.	S	Bend	trans	71.5	-9.9	-176.3	0	0	0	0	0	114.7	P146 A147	P146-G149 PolarHBondContact O-N 3.42Å; A147-G149 VanDerWaalsContact C-N 3.34Å
150	T	59.1	Low	83.5	Confident	114 Å²	114	70.4 Å²	70.4	70%	0.699	41%	0.414	S	S	*	.			trans	-114	103.3	178.2	42.3	0	0	0	0	109.8	T148	T148-T150 PolarHBondContact O-N 3.18Å; T148-T150 PolarHBondContact O-OG1 2.94Å; T148-T150 PolarHBondContact OG1-O 2.72Å
151	G	68.1	Low	83.5	Confident	52 Å²	52	66 Å²	66	54%	0.536	39%	0.394	S	S	.	.	S	Bend	trans	163.3	168.8	176.5	0	0	0	0	0	112.2	K153	G151-K153 PolarHBondContact O-N 3.14Å
152	A	75	Confident	83.4	Confident	63 Å²	63	67.7 Å²	67.7	52%	0.521	41%	0.406	S	S	.	.			trans	-67.7	125.3	175.7	0	0	0	0	0	110.2	N172	A152-N172 WeakPolarHBondContact CA-ND2 3.31Å; A152-N172 WeakPolarHBondContact CA-OD1 3.44Å; A152-N172 WeakPolarHBondContact CB-ND2 3.35Å
153	K	82.7	Confident	83.4	Confident	58 Å²	58	70.3 Å²	70.3	25%	0.252	42%	0.419	S	S	.	.			trans	-69.7	132.3	165.6	-52.3	173.9	-167.7	163.3	0	108.1	R145 G151 N172 I175 D176	R145-K153 HydrophobicContact CG-CG 4.47Å; G151-K153 PolarHBondContact O-N 3.14Å; K153-N172 WeakPolarHBondContact CA-OD1 3.44Å; K153-N172 WeakPolarHBondContact CB-OD1 3.42Å; K153-N172 PolarHBondContact N-OD1 3Å; K153-N172 PolarHBondContact O-OD1 3.28Å; K153-I175 HydrophobicContact CB-CD1 3.73Å; K153-I175 HydrophobicContact CB-CG2 4.38Å; K153-I175 HydrophobicContact CD-CG2 3.95Å; K153-I175 WeakPolarHBondContact O-CD1 3.35Å; K153-D176 IonicContact NZ-OD1 2.75Å; K153-D176 PolarHBondContact NZ-OD1 3.17Å
154	V	86.9	Confident	83.4	Confident	83 Å²	83	70.5 Å²	70.5	50%	0.503	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.7	170	-176.5	0	0	0	0	106.7	D144	D144-V154 PolarHBondContact N-O 3.01Å; D144-V154 PolarHBondContact O-N 2.9Å
155	G	89.8	Confident	83.8	Confident	2 Å²	2	70.4 Å²	70.4	2%	0.021	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	166.7	-179.5	0	0	0	0	0	112.1	Q142 L170	Q142-G155 CarbonylContact O-C 3.49Å; Q142-G155 WeakPolarHBondContact O-CA 3.5Å; G155-L170 PolarHBondContact N-O 3.35Å; G155-L170 PolarHBondContact O-N 3.12Å
156	K	93.9	Very high	84.4	Confident	97 Å²	97	64.7 Å²	64.7	42%	0.422	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138.5	172.1	-65.9	-175.3	174.8	-179.1	0	109.2	Q142 I167 Y168 D169	Q142-K156 HydrophobicContact CB-CB 4.36Å; Q142-K156 PolarHBondContact N-O 2.97Å; Q142-K156 PolarHBondContact O-N 3.02Å; K156-I167 HydrophobicContact CB-CG2 4.31Å; K156-Y168 CarbonylContact C-O 3.54Å; K156-Y168 WeakPolarHBondContact CA-O 3.46Å; K156-D169 WeakPolarHBondContact CE-OD1 3.31Å; K156-D169 WeakPolarHBondContact CG-OD1 3.33Å
157	L	94.4	Very high	85.1	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.9	178.5	178.3	66.2	0	0	0	109.2	V138 I141 L159 I167 Y168 L170 I189 I191	V138-L157 HydrophobicContact CG1-CD1 3.83Å; V138-L157 HydrophobicContact CG2-CD1 4.33Å; I141-L157 HydrophobicContact CD1-CD1 4.43Å; I141-L157 HydrophobicContact CG1-CD1 3.8Å; L157-L159 HydrophobicContact CD1-CD2 4.3Å; L157-L159 HydrophobicContact CD2-CD1 4.08Å; L157-L159 HydrophobicContact CD2-CD2 4.11Å; L157-L159 HydrophobicContact CD2-CG 3.99Å; L157-L159 HydrophobicContact CG-CD2 4.12Å; L157-L159 HydrophobicContact CG-CG 3.99Å; L157-I167 WeakPolarHBondContact O-CA 3.26Å; L157-Y168 PolarHBondContact N-O 3.12Å; L157-Y168 PolarHBondContact O-N 3.3Å; L157-L170 HydrophobicContact CB-CD1 3.82Å; L157-L170 HydrophobicContact CB-CD2 3.86Å; L157-L170 HydrophobicContact CB-CG 3.86Å; L157-L170 HydrophobicContact CD2-CD2 4.15Å; L157-I189 HydrophobicContact CD2-CD1 4.39Å; L157-I191 HydrophobicContact CD2-CD1 3.9Å
158	T	94.8	Very high	86.1	Confident	15 Å²	15	65.5 Å²	65.5	9%	0.092	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.1	174.1	-52.8	0	0	0	0	108.8	V139 E140 E165 I167	V139-T158 HydrophobicContact CB-CG2 3.92Å; V139-T158 HydrophobicContact CG1-CG2 4.44Å; V139-T158 HydrophobicContact CG2-CG2 4.27Å; V139-T158 PolarHBondContact N-O 3.15Å; E140-T158 PolarHBondContact O-N 2.67Å; T158-E165 HydrophobicContact CG2-CG 3.88Å; T158-E165 WeakPolarHBondContact CG2-OE1 3.45Å; T158-I167 HydrophobicContact CG2-CG1 4.14Å
159	L	95	Very high	87.1	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.7	176.2	-67.3	178.6	0	0	0	110.6	I134 E137 V138 L157 E165 T166 Y168 I189 I191 L228	I134-L159 HydrophobicContact CG2-CD1 3.68Å; E137-L159 CarbonylContact O-C 3.52Å; E137-L159 WeakPolarHBondContact O-CA 3.42Å; V138-L159 HydrophobicContact CB-CD2 4.38Å; V138-L159 HydrophobicContact CG2-CD2 3.72Å; L157-L159 HydrophobicContact CD1-CD2 4.3Å; L157-L159 HydrophobicContact CD2-CD1 4.08Å; L157-L159 HydrophobicContact CD2-CD2 4.11Å; L157-L159 HydrophobicContact CD2-CG 3.99Å; L157-L159 HydrophobicContact CG-CD2 4.12Å; L157-L159 HydrophobicContact CG-CG 3.99Å; L159-E165 WeakPolarHBondContact O-CA 3.42Å; L159-T166 PolarHBondContact N-O 2.96Å; L159-T166 PolarHBondContact O-N 2.84Å; L159-Y168 HydrophobicContact CB-CE2 4.31Å; L159-Y168 HydrophobicContact CD1-CD2 4.09Å; L159-Y168 HydrophobicContact CD1-CE2 3.98Å; L159-Y168 HydrophobicContact CG-CD2 4.36Å; L159-Y168 HydrophobicContact CG-CE2 4.46Å; L159-I189 HydrophobicContact CD2-CD1 4.1Å; L159-I189 HydrophobicContact CD2-CG1 4.13Å; L159-I191 HydrophobicContact CD1-CD1 4.23Å; L159-L228 HydrophobicContact CB-CD2 3.68Å
160	K	93.6	Very high	88.4	Confident	91 Å²	91	63.2 Å²	63.2	40%	0.396	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.3	-178.3	176.6	173.2	179.1	174	0	112.1	E137 V139 M164 E165	E137-K160 PolarHBondContact N-O 3.49Å; E137-K160 PolarHBondContact O-N 2.85Å; V139-K160 HydrophobicContact CG2-CB 3.47Å; V139-K160 VanDerWaalsContact CG2-CB 3.47Å; V139-K160 HydrophobicContact CG2-CD 4.16Å; V139-K160 HydrophobicContact CG2-CG 4.44Å; K160-M164 CarbonylContact C-O 3.5Å; K160-M164 WeakPolarHBondContact CA-O 3.35Å; K160-E165 HydrophobicContact CB-CB 4.32Å; K160-E165 HydrophobicContact CB-CG 4.17Å; K160-E165 HydrophobicContact CG-CB 4.32Å
161	T	93.3	Very high	89.9	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.006	33%	0.334	C	S	.	.			trans	-109.3	-178.3	161.9	58.8	0	0	0	0	109.5	E135 E163 M164 P224 G226 L228	E135-T161 WeakPolarHBondContact O-CG2 3.4Å; T161-E163 PolarHBondContact O-N 3.34Å; T161-M164 PolarHBondContact N-O 3.13Å; T161-M164 VanDerWaalsContact OG1-CG 3.29Å; T161-M164 WeakPolarHBondContact OG1-CG 3.44Å; T161-M164 PolarHBondContact OG1-N 2.86Å; T161-M164 PolarHBondContact OG1-O 3.47Å; T161-P224 WeakPolarHBondContact CA-O 3.5Å; T161-P224 WeakPolarHBondContact CB-O 3.15Å; T161-P224 HydrophobicContact CG2-CB 4.34Å; T161-G226 VanDerWaalsContact CB-O 3.31Å; T161-G226 WeakPolarHBondContact CB-O 3.46Å; T161-G226 PolarHBondContact OG1-O 2.82Å; T161-L228 HydrophobicContact CG2-CB 4.49Å; T161-L228 HydrophobicContact CG2-CD2 3.69Å; T161-L228 HydrophobicContact CG2-CG 3.67Å
162	T	89.7	Confident	90.8	Very high	79 Å²	79	60.6 Å²	60.6	49%	0.485	33%	0.325	S	S	.	.	S	Bend	trans	-62.9	-25.9	173.1	55.8	0	0	0	0	113	C223 P224 E225	T162-C223 HydrophobicContact CG2-CB 4.17Å; T162-P224 PolarHBondContact N-O 3.23Å; T162-E225 HydrophobicContact CG2-CG 3.92Å; T162-E225 WeakPolarHBondContact OG1-CA 3.4Å
163	E	89.7	Confident	91.5	Very high	139 Å²	139	66.1 Å²	66.1	65%	0.65	34%	0.337	S	S	*	.	S	Bend	trans	-102.5	-31.8	-173.5	-65.6	-179	-171.5	0	0	114	T161 G226	T161-E163 PolarHBondContact O-N 3.34Å; E163-G226 WeakPolarHBondContact OE2-CA 3.31Å
164	M	90.7	Very high	91.9	Very high	65 Å²	65	65.3 Å²	65.3	32%	0.32	34%	0.335	S	S	.	.			trans	-144.4	157.8	-173.2	59.7	175.3	67.2	0	0	113.5	K160 T161 E227 L228	K160-M164 CarbonylContact C-O 3.5Å; K160-M164 WeakPolarHBondContact CA-O 3.35Å; T161-M164 PolarHBondContact N-O 3.13Å; T161-M164 VanDerWaalsContact OG1-CG 3.29Å; T161-M164 WeakPolarHBondContact OG1-CG 3.44Å; T161-M164 PolarHBondContact OG1-N 2.86Å; T161-M164 PolarHBondContact OG1-O 3.47Å; M164-E227 HydrophobicContact CE-CB 3.95Å; M164-E227 HydrophobicContact CE-CG 3.79Å; M164-E227 HydrophobicContact SD-CB 4.36Å; M164-L228 HydrophobicContact CG-CB 4.44Å; M164-L228 HydrophobicContact CG-CD1 3.76Å; M164-L228 HydrophobicContact CG-CG 3.97Å; M164-L228 HydrophobicContact SD-CB 3.99Å; M164-L228 HydrophobicContact SD-CD1 4.09Å; M164-L228 HydrophobicContact SD-CG 4.17Å; M164-L228 PolarHBondContact SD-N 3.04Å; M164-L228 VanDerWaalsContact SD-N 3.37Å
165	E	93.4	Very high	92	Very high	107 Å²	107	61.4 Å²	61.4	50%	0.5	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.3	175.7	-177	171.1	170.2	0	0	108.7	T158 L159 K160	T158-E165 HydrophobicContact CG2-CG 3.88Å; T158-E165 WeakPolarHBondContact CG2-OE1 3.45Å; L159-E165 WeakPolarHBondContact O-CA 3.42Å; K160-E165 HydrophobicContact CB-CB 4.32Å; K160-E165 HydrophobicContact CB-CG 4.17Å; K160-E165 HydrophobicContact CG-CB 4.32Å
166	T	93.8	Very high	92	Very high	45 Å²	45	65 Å²	65	28%	0.276	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	147.9	-177.5	65.3	0	0	0	0	111.7	L159 Y168 L228	L159-T166 PolarHBondContact N-O 2.96Å; L159-T166 PolarHBondContact O-N 2.84Å; T166-Y168 WeakPolarHBondContact OG1-CE2 3.33Å; T166-Y168 PolarHBondContact OG1-OH 3.08Å; T166-L228 HydrophobicContact CG2-CD1 3.77Å; T166-L228 WeakPolarHBondContact OG1-CD1 3.42Å
167	I	94.7	Very high	91.8	Very high	115 Å²	115	62.3 Å²	62.3	59%	0.59	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	127.5	178.6	-55.3	171.1	0	0	0	108.6	K156 L157 T158	K156-I167 HydrophobicContact CB-CG2 4.31Å; L157-I167 WeakPolarHBondContact O-CA 3.26Å; T158-I167 HydrophobicContact CG2-CG1 4.14Å
168	Y	93	Very high	91.7	Very high	66 Å²	66	62.5 Å²	62.5	26%	0.259	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.5	176.8	-66.1	-81.9	0	0	0	110.7	I134 K156 L157 L159 T166	I134-Y168 HydrophobicContact CD1-CE1 4.02Å; I134-Y168 HydrophobicContact CG2-CE2 4.2Å; K156-Y168 CarbonylContact C-O 3.54Å; K156-Y168 WeakPolarHBondContact CA-O 3.46Å; L157-Y168 PolarHBondContact N-O 3.12Å; L157-Y168 PolarHBondContact O-N 3.3Å; L159-Y168 HydrophobicContact CB-CE2 4.31Å; L159-Y168 HydrophobicContact CD1-CD2 4.09Å; L159-Y168 HydrophobicContact CD1-CE2 3.98Å; L159-Y168 HydrophobicContact CG-CD2 4.36Å; L159-Y168 HydrophobicContact CG-CE2 4.46Å; T166-Y168 WeakPolarHBondContact OG1-CE2 3.33Å; T166-Y168 PolarHBondContact OG1-OH 3.08Å
169	D	93.2	Very high	91.4	Very high	124 Å²	124	65.2 Å²	65.2	66%	0.663	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	130.4	169.1	-65	-47.2	0	0	0	110	K156	K156-D169 WeakPolarHBondContact CE-OD1 3.31Å; K156-D169 WeakPolarHBondContact CG-OD1 3.33Å
170	L	91.5	Very high	91.2	Very high	11 Å²	11	73.3 Å²	73.3	6%	0.058	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131	-176.3	-59.2	177.3	0	0	0	111.4	G155 L157 M174 I175 L178	G155-L170 PolarHBondContact N-O 3.35Å; G155-L170 PolarHBondContact O-N 3.12Å; L157-L170 HydrophobicContact CB-CD1 3.82Å; L157-L170 HydrophobicContact CB-CD2 3.86Å; L157-L170 HydrophobicContact CB-CG 3.86Å; L157-L170 HydrophobicContact CD2-CD2 4.15Å; L170-M174 HydrophobicContact CB-CB 4.46Å; L170-M174 HydrophobicContact CD2-CB 4.12Å; L170-I175 HydrophobicContact CB-CD1 4.34Å; L170-I175 HydrophobicContact CB-CG1 3.86Å; L170-I175 HydrophobicContact CD1-CG1 4.22Å; L170-L178 HydrophobicContact CD1-CD1 3.38Å; L170-L178 HydrophobicContact CD2-CD1 4.38Å
171	G	90	Very high	90.9	Very high	44 Å²	44	73.1 Å²	73.1	45%	0.454	38%	0.38	S	S	.	.			trans	-84.4	168.9	166.7	0	0	0	0	0	113.2	K173 M174 I175	G171-K173 VanDerWaalsContact C-N 3.34Å; G171-K173 PolarHBondContact O-N 2.57Å; G171-M174 PolarHBondContact O-N 2.81Å; G171-M174 VanDerWaalsContact O-N 3.09Å; G171-I175 WeakPolarHBondContact O-CG1 3.42Å; G171-I175 PolarHBondContact O-N 3.44Å; G171-I175 VanDerWaalsContact O-N 3.12Å
172	N	88.9	Confident	90.7	Very high	66 Å²	66	80.9 Å²	80.9	35%	0.353	41%	0.413	S	S	.	.	H	α-helix	trans	-44.1	-51.1	179.2	-81.4	-38.2	0	0	0	114.6	A152 K153 M174 I175 D176	A152-N172 WeakPolarHBondContact CA-ND2 3.31Å; A152-N172 WeakPolarHBondContact CA-OD1 3.44Å; A152-N172 WeakPolarHBondContact CB-ND2 3.35Å; K153-N172 WeakPolarHBondContact CA-OD1 3.44Å; K153-N172 WeakPolarHBondContact CB-OD1 3.42Å; K153-N172 PolarHBondContact N-OD1 3Å; K153-N172 PolarHBondContact O-OD1 3.28Å; N172-M174 VanDerWaalsContact C-N 3.33Å; N172-M174 PolarHBondContact O-N 3.28Å; N172-I175 PolarHBondContact O-N 2.68Å; N172-D176 PolarHBondContact O-N 3.3Å
173	K	88.9	Confident	90.8	Very high	180 Å²	180	77.8 Å²	77.8	78%	0.783	39%	0.394	S	S	*	.	H	α-helix	trans	-61.1	-41.2	-176.6	-69.4	-175.9	178.4	-178.9	0	112.2	G171 D176 S177	G171-K173 VanDerWaalsContact C-N 3.34Å; G171-K173 PolarHBondContact O-N 2.57Å; K173-D176 PolarHBondContact O-N 3.41Å; K173-S177 PolarHBondContact O-N 3.27Å; K173-S177 PolarHBondContact O-OG 2.85Å
174	M	89.9	Confident	90.7	Very high	40 Å²	40	75 Å²	75	20%	0.197	38%	0.381	C	S	.	.	H	α-helix	trans	-69.3	-38.7	179.1	-73.4	-61.3	-69.4	0	0	111.7	L170 G171 N172 D176 S177 L178 I191 I198	L170-M174 HydrophobicContact CB-CB 4.46Å; L170-M174 HydrophobicContact CD2-CB 4.12Å; G171-M174 PolarHBondContact O-N 2.81Å; G171-M174 VanDerWaalsContact O-N 3.09Å; N172-M174 VanDerWaalsContact C-N 3.33Å; N172-M174 PolarHBondContact O-N 3.28Å; M174-D176 VanDerWaalsContact C-N 3.34Å; M174-D176 PolarHBondContact O-N 3.28Å; M174-S177 PolarHBondContact O-N 2.79Å; M174-L178 WeakPolarHBondContact O-CB 3.25Å; M174-L178 WeakPolarHBondContact O-CG 3.35Å; M174-L178 PolarHBondContact O-N 3.11Å; M174-I191 HydrophobicContact CE-CD1 4.07Å; M174-I191 HydrophobicContact CE-CG1 4.48Å; M174-I191 HydrophobicContact CE-CG2 3.6Å; M174-I198 HydrophobicContact CE-CD1 3.61Å; M174-I198 HydrophobicContact CE-CG1 3.94Å; M174-I198 HydrophobicContact SD-CD1 4.39Å
175	I	90.3	Very high	90.7	Very high	1 Å²	1	73.8 Å²	73.8	1%	0.005	38%	0.382	C	S	.	.	H	α-helix	trans	-62.2	-43.6	175.9	-65.4	166	0	0	0	110.6	I143 K153 L170 G171 N172 L178 S179	I143-I175 HydrophobicContact CD1-CG2 3.93Å; I143-I175 HydrophobicContact CG1-CG2 4.18Å; I143-I175 HydrophobicContact CG2-CD1 4.43Å; I143-I175 HydrophobicContact CG2-CG2 3.81Å; K153-I175 HydrophobicContact CB-CD1 3.73Å; K153-I175 HydrophobicContact CB-CG2 4.38Å; K153-I175 HydrophobicContact CD-CG2 3.95Å; K153-I175 WeakPolarHBondContact O-CD1 3.35Å; L170-I175 HydrophobicContact CB-CD1 4.34Å; L170-I175 HydrophobicContact CB-CG1 3.86Å; L170-I175 HydrophobicContact CD1-CG1 4.22Å; G171-I175 WeakPolarHBondContact O-CG1 3.42Å; G171-I175 PolarHBondContact O-N 3.44Å; G171-I175 VanDerWaalsContact O-N 3.12Å; N172-I175 PolarHBondContact O-N 2.68Å; I175-L178 PolarHBondContact O-N 3.22Å; I175-S179 WeakPolarHBondContact O-CB 3.45Å; I175-S179 PolarHBondContact O-N 3.31Å
176	D	89.3	Confident	90.4	Very high	79 Å²	79	68.7 Å²	68.7	42%	0.422	36%	0.358	S	S	.	.	H	α-helix	trans	-67	-39	177.5	-68.1	-24.4	0	0	0	111.5	K153 N172 K173 M174 S179 K180	K153-D176 IonicContact NZ-OD1 2.75Å; K153-D176 PolarHBondContact NZ-OD1 3.17Å; N172-D176 PolarHBondContact O-N 3.3Å; K173-D176 PolarHBondContact O-N 3.41Å; M174-D176 VanDerWaalsContact C-N 3.34Å; M174-D176 PolarHBondContact O-N 3.28Å; D176-S179 PolarHBondContact O-N 3.01Å; D176-K180 WeakPolarHBondContact O-CB 3.47Å; D176-K180 PolarHBondContact O-N 3.2Å
177	S	90.6	Very high	90.3	Very high	40 Å²	40	66.5 Å²	66.5	28%	0.28	35%	0.345	S	S	.	.	H	α-helix	trans	-62.3	-45.7	172.9	-68.7	0	0	0	0	112.8	K173 M174 S179 K180 E181	K173-S177 PolarHBondContact O-N 3.27Å; K173-S177 PolarHBondContact O-OG 2.85Å; M174-S177 PolarHBondContact O-N 2.79Å; S177-S179 VanDerWaalsContact C-N 3.31Å; S177-S179 PolarHBondContact O-N 3.14Å; S177-K180 PolarHBondContact O-N 3.19Å; S177-E181 PolarHBondContact O-N 3.1Å
178	L	91	Very high	90.2	Very high	5 Å²	5	61 Å²	61	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-41.2	175.6	-74.8	169.4	0	0	0	111.5	L170 M174 I175 K182 V183 I189 I198	L170-L178 HydrophobicContact CD1-CD1 3.38Å; L170-L178 HydrophobicContact CD2-CD1 4.38Å; M174-L178 WeakPolarHBondContact O-CB 3.25Å; M174-L178 WeakPolarHBondContact O-CG 3.35Å; M174-L178 PolarHBondContact O-N 3.11Å; I175-L178 PolarHBondContact O-N 3.22Å; L178-K182 PolarHBondContact O-N 3.1Å; L178-V183 HydrophobicContact CD2-CB 3.8Å; L178-V183 HydrophobicContact CD2-CG1 4Å; L178-V183 HydrophobicContact CD2-CG2 3.77Å; L178-V183 PolarHBondContact O-N 3.16Å; L178-V183 VanDerWaalsContact O-N 3.07Å; L178-I189 HydrophobicContact CD2-CD1 4.23Å; L178-I198 HydrophobicContact CB-CD1 4.37Å; L178-I198 HydrophobicContact CD2-CD1 3.48Å; L178-I198 VanDerWaalsContact CD2-CD1 3.48Å; L178-I198 HydrophobicContact CD2-CG2 4.21Å; L178-I198 HydrophobicContact CG-CD1 3.47Å; L178-I198 VanDerWaalsContact CG-CD1 3.47Å
179	S	88.8	Confident	90.3	Very high	72 Å²	72	57.9 Å²	57.9	50%	0.503	30%	0.304	S	S	.	.	H	α-helix	trans	-67.8	-35.7	177.1	-172.1	0	0	0	0	112.3	I175 D176 S177 K182	I175-S179 WeakPolarHBondContact O-CB 3.45Å; I175-S179 PolarHBondContact O-N 3.31Å; D176-S179 PolarHBondContact O-N 3.01Å; S177-S179 VanDerWaalsContact C-N 3.31Å; S177-S179 PolarHBondContact O-N 3.14Å; S179-K182 PolarHBondContact O-N 3.1Å
180	K	90.3	Very high	90.3	Very high	169 Å²	169	53.3 Å²	53.3	74%	0.735	28%	0.28	S	S	*	.	H	α-helix	trans	-67.2	-43.9	177.5	-176.9	-179.4	176.3	-174.6	0	111.5	D176 S177 K182	D176-K180 WeakPolarHBondContact O-CB 3.47Å; D176-K180 PolarHBondContact O-N 3.2Å; S177-K180 PolarHBondContact O-N 3.19Å; K180-K182 PolarHBondContact O-N 3.47Å
181	E	88.5	Confident	90.4	Very high	88 Å²	88	53.3 Å²	53.3	41%	0.411	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-1.8	177.2	-65.6	-58.5	139.7	0	0	113.4	S177 V183	S177-E181 PolarHBondContact O-N 3.1Å; E181-V183 VanDerWaalsContact C-N 3.28Å; E181-V183 HydrophobicContact CB-CG2 3.92Å; E181-V183 PolarHBondContact O-N 3.4Å
182	K	89.4	Confident	90.5	Very high	163 Å²	163	52.7 Å²	52.7	71%	0.709	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	46.2	-179.3	-59.9	179.4	179.4	177.2	0	112.4	L178 S179 K180	L178-K182 PolarHBondContact O-N 3.1Å; S179-K182 PolarHBondContact O-N 3.1Å; K180-K182 PolarHBondContact O-N 3.47Å
183	V	90.2	Very high	90.4	Very high	14 Å²	14	55.1 Å²	55.1	9%	0.085	27%	0.274	C	S	.	.			trans	-70.3	134.9	178.4	-176.2	0	0	0	0	110	V138 I141 L178 E181 D187 I189 I198	V138-V183 HydrophobicContact CG2-CG1 3.89Å; I141-V183 HydrophobicContact CD1-CB 4.38Å; I141-V183 HydrophobicContact CD1-CG1 4.06Å; I141-V183 WeakPolarHBondContact CD1-O 3.5Å; L178-V183 HydrophobicContact CD2-CB 3.8Å; L178-V183 HydrophobicContact CD2-CG1 4Å; L178-V183 HydrophobicContact CD2-CG2 3.77Å; L178-V183 PolarHBondContact O-N 3.16Å; L178-V183 VanDerWaalsContact O-N 3.07Å; E181-V183 VanDerWaalsContact C-N 3.28Å; E181-V183 HydrophobicContact CB-CG2 3.92Å; E181-V183 PolarHBondContact O-N 3.4Å; V183-D187 HydrophobicContact CG1-CB 4.29Å; V183-I189 HydrophobicContact CG1-CD1 4.29Å; V183-I189 HydrophobicContact CG1-CG2 3.73Å; V183-I189 HydrophobicContact CG2-CG2 4.2Å; V183-I198 HydrophobicContact CG2-CG2 4.28Å
184	Q	89	Confident	90.3	Very high	80 Å²	80	50.6 Å²	50.6	37%	0.374	27%	0.271	S	S	.	.			trans	-129	164.5	-179.5	-65.5	-177.1	-14.2	0	0	111	G186 D187	Q184-G186 PolarHBondContact O-N 3.41Å; Q184-D187 PolarHBondContact N-OD2 3.07Å; Q184-D187 WeakPolarHBondContact O-CB 3.48Å; Q184-D187 PolarHBondContact O-N 2.66Å; Q184-D187 VanDerWaalsContact O-N 3.11Å
185	A	89.9	Confident	90	Very high	40 Å²	40	53.1 Å²	53.1	33%	0.331	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	130.7	171.3	0	0	0	0	0	110.9	V139	V139-A185 WeakPolarHBondContact O-CB 3.48Å
186	G	87.8	Confident	89.9	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-0.5	-173.3	0	0	0	0	0	114.9	V138 Q184 R203 S204	V138-G186 PolarHBondContact O-N 2.86Å; Q184-G186 PolarHBondContact O-N 3.41Å; G186-R203 VanDerWaalsContact O-CG 3.31Å; G186-R203 WeakPolarHBondContact O-CG 3.39Å; G186-S204 WeakPolarHBondContact O-CB 3.34Å; G186-S204 PolarHBondContact O-N 3.36Å
187	D	90.9	Very high	89.9	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	144.1	170.8	-68.7	-29.5	0	0	0	111.2	V138 V183 Q184 I189 K200 G202	V138-D187 WeakPolarHBondContact CG2-O 3.45Å; V138-D187 PolarHBondContact N-O 3.35Å; V183-D187 HydrophobicContact CG1-CB 4.29Å; Q184-D187 PolarHBondContact N-OD2 3.07Å; Q184-D187 WeakPolarHBondContact O-CB 3.48Å; Q184-D187 PolarHBondContact O-N 2.66Å; Q184-D187 VanDerWaalsContact O-N 3.11Å; D187-I189 HydrophobicContact CB-CG2 4.24Å; D187-K200 WeakPolarHBondContact OD1-CE 3.5Å; D187-K200 IonicContact OD1-NZ 3.36Å; D187-K200 PolarHBondContact OD1-NZ 3.07Å; D187-K200 VanDerWaalsContact OD2-CE 3.26Å; D187-K200 WeakPolarHBondContact OD2-CE 3.39Å; D187-K200 IonicContact OD2-NZ 2.62Å; D187-K200 PolarHBondContact OD2-NZ 3.07Å; D187-G202 WeakPolarHBondContact CA-O 3.23Å
188	V	92.9	Very high	90	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.4	168.9	-176.2	0	0	0	0	108	E137 L201 G202 P224	E137-V188 HydrophobicContact CB-CG2 4.47Å; V188-L201 HydrophobicContact CG1-CB 4.44Å; V188-L201 HydrophobicContact CG1-CD1 4.21Å; V188-L201 PolarHBondContact O-N 3.27Å; V188-G202 PolarHBondContact N-O 2.97Å; V188-G202 PolarHBondContact O-N 2.87Å; V188-P224 HydrophobicContact CG1-CG 3.6Å
189	I	94.6	Very high	90.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	152.9	-175.5	67	173.7	0	0	0	111.7	G136 V138 L157 L159 L178 V183 D187 I191 I198 T199	G136-I189 PolarHBondContact N-O 3.46Å; G136-I189 VanDerWaalsContact N-O 3.17Å; G136-I189 PolarHBondContact O-N 3.15Å; V138-I189 HydrophobicContact CG2-CD1 3.65Å; V138-I189 HydrophobicContact CG2-CG1 3.85Å; V138-I189 HydrophobicContact CG2-CG2 4.22Å; L157-I189 HydrophobicContact CD2-CD1 4.39Å; L159-I189 HydrophobicContact CD2-CD1 4.1Å; L159-I189 HydrophobicContact CD2-CG1 4.13Å; L178-I189 HydrophobicContact CD2-CD1 4.23Å; V183-I189 HydrophobicContact CG1-CD1 4.29Å; V183-I189 HydrophobicContact CG1-CG2 3.73Å; V183-I189 HydrophobicContact CG2-CG2 4.2Å; D187-I189 HydrophobicContact CB-CG2 4.24Å; I189-I191 HydrophobicContact CD1-CD1 4.02Å; I189-I191 HydrophobicContact CD1-CG1 4.11Å; I189-I198 HydrophobicContact CB-CG2 4.33Å; I189-I198 HydrophobicContact CD1-CG2 4.2Å; I189-T199 WeakPolarHBondContact CA-O 3.41Å
190	T	93.8	Very high	90.2	Very high	27 Å²	27	58.5 Å²	58.5	17%	0.166	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130	166.4	56.9	0	0	0	0	109.5	I134 E135 I198 T199 L201	I134-T190 CarbonylContact O-C 3.55Å; I134-T190 VanDerWaalsContact O-CA 3.31Å; I134-T190 WeakPolarHBondContact O-CA 3.24Å; E135-T190 HydrophobicContact CB-CG2 4.15Å; E135-T190 HydrophobicContact CG-CG2 3.9Å; T190-I198 WeakPolarHBondContact O-CA 3.46Å; T190-T199 PolarHBondContact N-O 3.36Å; T190-T199 PolarHBondContact O-N 2.94Å; T190-T199 WeakPolarHBondContact OG1-CB 3.42Å; T190-T199 PolarHBondContact OG1-O 3.19Å; T190-L201 HydrophobicContact CG2-CD1 3.62Å; T190-L201 HydrophobicContact CG2-CD2 4.27Å; T190-L201 HydrophobicContact CG2-CG 3.99Å
191	I	93.6	Very high	90.2	Very high	12 Å²	12	53.6 Å²	53.6	6%	0.062	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.5	175.5	-55.9	174.8	0	0	0	108	I133 I134 L157 L159 M174 I189 I198	I133-I191 CarbonylContact C-O 3.56Å; I133-I191 WeakPolarHBondContact CA-O 3.49Å; I134-I191 HydrophobicContact CB-CB 4.34Å; I134-I191 PolarHBondContact N-O 2.83Å; I134-I191 PolarHBondContact O-N 3.06Å; L157-I191 HydrophobicContact CD2-CD1 3.9Å; L159-I191 HydrophobicContact CD1-CD1 4.23Å; M174-I191 HydrophobicContact CE-CD1 4.07Å; M174-I191 HydrophobicContact CE-CG1 4.48Å; M174-I191 HydrophobicContact CE-CG2 3.6Å; I189-I191 HydrophobicContact CD1-CD1 4.02Å; I189-I191 HydrophobicContact CD1-CG1 4.11Å; I191-I198 HydrophobicContact CG1-CG1 4.3Å; I191-I198 HydrophobicContact CG1-CG2 4.39Å
192	D	91.1	Very high	90.2	Very high	31 Å²	31	49.7 Å²	49.7	17%	0.166	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	119.9	167	174.2	-10.4	0	0	0	108.9	A194 T195 G196 K197	D192-A194 VanDerWaalsContact C-N 3.34Å; D192-A194 PolarHBondContact O-N 3.49Å; D192-A194 PolarHBondContact OD1-N 2.94Å; D192-T195 VanDerWaalsContact CB-OG1 3.31Å; D192-T195 WeakPolarHBondContact CB-OG1 3.41Å; D192-T195 PolarHBondContact OD1-N 3.02Å; D192-T195 WeakPolarHBondContact OD2-CB 3.38Å; D192-T195 VanDerWaalsContact OD2-CG2 3.24Å; D192-T195 WeakPolarHBondContact OD2-CG2 3.4Å; D192-T195 PolarHBondContact OD2-OG1 3.09Å; D192-G196 WeakPolarHBondContact O-CA 3.42Å; D192-G196 PolarHBondContact O-N 3.39Å; D192-K197 PolarHBondContact N-O 3.39Å
193	K	88.5	Confident	90.1	Very high	116 Å²	116	42.8 Å²	42.8	50%	0.504	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-29.7	-174.3	-171.9	177.4	172.2	-171.1	0	112.8	E132	E132-K193 HydrophobicContact CB-CB 4.28Å; E132-K193 HydrophobicContact CB-CD 4.22Å; E132-K193 VanDerWaalsContact O-CB 3.31Å; E132-K193 WeakPolarHBondContact O-CB 3.42Å; E132-K193 PolarHBondContact O-N 3.48Å; E132-K193 WeakPolarHBondContact OE2-CD 3.35Å; E132-K193 IonicContact OE2-NZ 3.94Å; E132-K193 PolarHBondContact OE2-NZ 3.38Å
194	A	85.9	Confident	89.8	Confident	86 Å²	86	42.2 Å²	42.2	71%	0.711	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-46.3	-179.5	0	0	0	0	0	111.1	D192	D192-A194 VanDerWaalsContact C-N 3.34Å; D192-A194 PolarHBondContact O-N 3.49Å; D192-A194 PolarHBondContact OD1-N 2.94Å
195	T	84.4	Confident	89.2	Confident	93 Å²	93	44 Å²	44	57%	0.571	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-20.5	-176.7	65.3	0	0	0	0	113.6	D192 K197	D192-T195 VanDerWaalsContact CB-OG1 3.31Å; D192-T195 WeakPolarHBondContact CB-OG1 3.41Å; D192-T195 PolarHBondContact OD1-N 3.02Å; D192-T195 WeakPolarHBondContact OD2-CB 3.38Å; D192-T195 VanDerWaalsContact OD2-CG2 3.24Å; D192-T195 WeakPolarHBondContact OD2-CG2 3.4Å; D192-T195 PolarHBondContact OD2-OG1 3.09Å; T195-K197 PolarHBondContact O-N 2.89Å; T195-K197 WeakPolarHBondContact OG1-CB 3.23Å; T195-K197 PolarHBondContact OG1-N 3.34Å
196	G	86.8	Confident	88.2	Confident	20 Å²	20	46.9 Å²	46.9	21%	0.206	26%	0.256	C	S	.	.			trans	67.8	13.8	-171.7	0	0	0	0	0	113.2	D192	D192-G196 WeakPolarHBondContact O-CA 3.42Å; D192-G196 PolarHBondContact O-N 3.39Å
197	K	89.8	Confident	87.2	Confident	143 Å²	143	50.6 Å²	50.6	62%	0.622	27%	0.27	S	S	*	.			trans	-75.8	129	178.5	-173.4	179.6	176.9	-175.8	0	109.5	D192 T195	D192-K197 PolarHBondContact N-O 3.39Å; T195-K197 PolarHBondContact O-N 2.89Å; T195-K197 WeakPolarHBondContact OG1-CB 3.23Å; T195-K197 PolarHBondContact OG1-N 3.34Å
198	I	93.5	Very high	85.7	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.9	178.3	-50.8	-178.2	0	0	0	107.7	M174 L178 V183 I189 T190 I191	M174-I198 HydrophobicContact CE-CD1 3.61Å; M174-I198 HydrophobicContact CE-CG1 3.94Å; M174-I198 HydrophobicContact SD-CD1 4.39Å; L178-I198 HydrophobicContact CB-CD1 4.37Å; L178-I198 HydrophobicContact CD2-CD1 3.48Å; L178-I198 VanDerWaalsContact CD2-CD1 3.48Å; L178-I198 HydrophobicContact CD2-CG2 4.21Å; L178-I198 HydrophobicContact CG-CD1 3.47Å; L178-I198 VanDerWaalsContact CG-CD1 3.47Å; V183-I198 HydrophobicContact CG2-CG2 4.28Å; I189-I198 HydrophobicContact CB-CG2 4.33Å; I189-I198 HydrophobicContact CD1-CG2 4.2Å; T190-I198 WeakPolarHBondContact O-CA 3.46Å; I191-I198 HydrophobicContact CG1-CG1 4.3Å; I191-I198 HydrophobicContact CG1-CG2 4.39Å
199	T	91.8	Very high	84.2	Confident	60 Å²	60	63.3 Å²	63.3	37%	0.368	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.8	176.4	-50	0	0	0	0	109.1	I189 T190	I189-T199 WeakPolarHBondContact CA-O 3.41Å; T190-T199 PolarHBondContact N-O 3.36Å; T190-T199 PolarHBondContact O-N 2.94Å; T190-T199 WeakPolarHBondContact OG1-CB 3.42Å; T190-T199 PolarHBondContact OG1-O 3.19Å
200	K	91.4	Very high	82.6	Confident	80 Å²	80	69.2 Å²	69.2	35%	0.348	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.1	176	-179.8	171.5	173.8	159.2	0	109.7	D187	D187-K200 WeakPolarHBondContact OD1-CE 3.5Å; D187-K200 IonicContact OD1-NZ 3.36Å; D187-K200 PolarHBondContact OD1-NZ 3.07Å; D187-K200 VanDerWaalsContact OD2-CE 3.26Å; D187-K200 WeakPolarHBondContact OD2-CE 3.39Å; D187-K200 IonicContact OD2-NZ 2.62Å; D187-K200 PolarHBondContact OD2-NZ 3.07Å
201	L	89.8	Confident	80.8	Confident	66 Å²	66	73.5 Å²	73.5	35%	0.346	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-37.4	179.3	-63.7	-176.9	0	0	0	111.5	V188 T190	V188-L201 HydrophobicContact CG1-CB 4.44Å; V188-L201 HydrophobicContact CG1-CD1 4.21Å; V188-L201 PolarHBondContact O-N 3.27Å; T190-L201 HydrophobicContact CG2-CD1 3.62Å; T190-L201 HydrophobicContact CG2-CD2 4.27Å; T190-L201 HydrophobicContact CG2-CG 3.99Å
202	G	89	Confident	78.9	Confident	6 Å²	6	81.3 Å²	81.3	6%	0.062	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-160.7	-179.5	0	0	0	0	0	111.7	D187 V188 K219	D187-G202 WeakPolarHBondContact CA-O 3.23Å; V188-G202 PolarHBondContact N-O 2.97Å; V188-G202 PolarHBondContact O-N 2.87Å; G202-K219 CarbonylContact C-O 3.55Å; G202-K219 WeakPolarHBondContact CA-O 3.42Å
203	R	86.5	Confident	77.3	Confident	19 Å²	19	84.1 Å²	84.1	7%	0.072	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.7	177.9	-159.2	170	-174.7	154	6.6	110.5	G186 K219 F220 V221	G186-R203 VanDerWaalsContact O-CG 3.31Å; G186-R203 WeakPolarHBondContact O-CG 3.39Å; R203-K219 PolarHBondContact N-O 2.87Å; R203-F220 HydrophobicContact CB-CD1 4.27Å; R203-F220 HydrophobicContact CB-CE1 4.35Å; R203-F220 CarbonylContact O-C 3.57Å; R203-F220 VanDerWaalsContact O-CA 3.24Å; R203-F220 WeakPolarHBondContact O-CA 3.26Å; R203-V221 PolarHBondContact O-N 3.18Å
204	S	84.4	Confident	75.9	Confident	1 Å²	1	81.5 Å²	81.5	1%	0.007	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	140.7	178.4	-173.9	0	0	0	0	111.4	E137 G186 T206 R207 V221 C223	E137-S204 WeakPolarHBondContact OE2-CB 3.4Å; E137-S204 PolarHBondContact OE2-OG 3.07Å; G186-S204 WeakPolarHBondContact O-CB 3.34Å; G186-S204 PolarHBondContact O-N 3.36Å; S204-T206 PolarHBondContact O-N 3.08Å; S204-T206 PolarHBondContact OG-OG1 3.35Å; S204-T206 VanDerWaalsContact OG-OG1 3.07Å; S204-R207 PolarHBondContact O-N 3.3Å; S204-V221 WeakPolarHBondContact CA-O 3.27Å; S204-C223 PolarHBondContact OG-SG 3.43Å
205	F	76.6	Confident	74.7	Confident	118 Å²	118	79.6 Å²	79.6	52%	0.518	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-62.6	-30.2	177.8	-77.1	-85	0	0	0	113	R207 A208 F220 V221 Q222	F205-R207 VanDerWaalsContact C-N 3.33Å; F205-R207 PolarHBondContact O-N 3.41Å; F205-A208 WeakPolarHBondContact O-CB 3.16Å; F205-A208 PolarHBondContact O-N 3.26Å; F205-F220 HydrophobicContact CD1-CB 3.93Å; F205-F220 HydrophobicContact CD1-CG 4.45Å; F205-F220 HydrophobicContact CD2-CB 4.27Å; F205-F220 HydrophobicContact CE1-CB 3.51Å; F205-F220 HydrophobicContact CE1-CG 4.29Å; F205-F220 HydrophobicContact CE2-CB 3.88Å; F205-F220 HydrophobicContact CG-CB 4.3Å; F205-F220 HydrophobicContact CZ-CB 3.49Å; F205-F220 VanDerWaalsContact CZ-CB 3.49Å; F205-V221 WeakPolarHBondContact CD2-O 3.45Å; F205-Q222 HydrophobicContact CD2-CG 3.99Å; F205-Q222 HydrophobicContact CE2-CG 3.95Å
206	T	69.6	Low	73.5	Confident	101 Å²	101	80.6 Å²	80.6	62%	0.62	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-69	-30.5	-175.5	54.7	0	0	0	0	112.7	S204	S204-T206 PolarHBondContact O-N 3.08Å; S204-T206 PolarHBondContact OG-OG1 3.35Å; S204-T206 VanDerWaalsContact OG-OG1 3.07Å
207	R	65.5	Low	72.3	Confident	77 Å²	77	88.2 Å²	88.2	29%	0.291	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-106.7	17.4	-179	-68.9	-174	172.8	-172.5	0.5	113.8	V139 S204 F205 R209	V139-R207 PolarHBondContact O-NH1 3.37Å; S204-R207 PolarHBondContact O-N 3.3Å; F205-R207 VanDerWaalsContact C-N 3.33Å; F205-R207 PolarHBondContact O-N 3.41Å; R207-R209 PolarHBondContact O-N 2.92Å
208	A	60.6	Low	71.3	Confident	28 Å²	28	84.1 Å²	84.1	23%	0.231	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.8	178.4	0	0	0	0	0	113.8	F205 M214 F220	F205-A208 WeakPolarHBondContact O-CB 3.16Å; F205-A208 PolarHBondContact O-N 3.26Å; A208-M214 WeakPolarHBondContact O-CE 3.31Å; A208-F220 HydrophobicContact CB-CD1 3.95Å; A208-F220 HydrophobicContact CB-CE1 3.33Å; A208-F220 HydrophobicContact CB-CZ 4Å
209	R	60.9	Low	70.8	Confident	240 Å²	240	91.7 Å²	91.7	91%	0.906	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-15.2	-175.1	-70.4	-175.8	177.6	-178.5	-0	114.8	R207 Y211	R207-R209 PolarHBondContact O-N 2.92Å; R209-Y211 VanDerWaalsContact C-N 3.32Å; R209-Y211 PolarHBondContact O-N 3.37Å
210	D	60.5	Low	70.4	Confident	124 Å²	124	92.5 Å²	92.5	66%	0.663	48%	0.484	S	S	*	.	S	Bend	trans	-85.7	-0.7	-170.2	-61.5	-29.4	0	0	0	114
211	Y	56.9	Low	70.3	Confident	116 Å²	116	91 Å²	91	46%	0.455	48%	0.481	S	S	.	.			trans	-129.8	111.4	-175.3	-99.3	-99.4	0	0	0	112	R209 A213 M214	R209-Y211 VanDerWaalsContact C-N 3.32Å; R209-Y211 PolarHBondContact O-N 3.37Å; Y211-A213 VanDerWaalsContact C-N 3.34Å; Y211-A213 PolarHBondContact O-N 3.13Å; Y211-M214 WeakPolarHBondContact O-CG 3.41Å
212	D	53.8	Low	70.3	Confident	177 Å²	177	94.8 Å²	94.8	95%	0.947	50%	0.497	S	S	*	.	S	Bend	trans	-79	-14.5	-175.8	-149.9	10.6	0	0	0	113.2
213	A	56.6	Low	70.2	Confident	90 Å²	90	96.1 Å²	96.1	74%	0.744	51%	0.506	S	S	*	.			trans	-110.2	62.5	179.5	0	0	0	0	0	112	Y211 G215	Y211-A213 VanDerWaalsContact C-N 3.34Å; Y211-A213 PolarHBondContact O-N 3.13Å; A213-G215 PolarHBondContact O-N 3.43Å
214	M	60.3	Low	70.4	Confident	61 Å²	61	95.8 Å²	95.8	30%	0.3	51%	0.506	S	S	.	.			trans	-77.2	118.8	174.4	-69.9	-86.6	-175.4	0	0	110.1	A208 Y211 T218 F220	A208-M214 WeakPolarHBondContact O-CE 3.31Å; Y211-M214 WeakPolarHBondContact O-CG 3.41Å; M214-T218 HydrophobicContact SD-CG2 4.3Å; M214-F220 HydrophobicContact CE-CE1 4.31Å; M214-F220 HydrophobicContact CE-CZ 4.12Å; M214-F220 HydrophobicContact SD-CZ 4.04Å
215	G	60.4	Low	70.6	Confident	46 Å²	46	102.3 Å²	102.3	47%	0.474	54%	0.536	S	S	.	.			trans	-64.2	143.4	166.2	0	0	0	0	0	110.2	A213 Q217 T218	A213-G215 PolarHBondContact O-N 3.43Å; G215-Q217 PolarHBondContact O-N 3.2Å; G215-T218 PolarHBondContact O-N 2.9Å; G215-T218 PolarHBondContact O-OG1 3.45Å
216	A	58.6	Low	71.3	Confident	113 Å²	113	97.5 Å²	97.5	93%	0.934	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	6.4	-176.8	0	0	0	0	0	115.9
217	Q	61.1	Low	72.3	Confident	180 Å²	180	98.8 Å²	98.8	84%	0.841	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	5.6	-171.9	-70	-101.6	-13.9	0	0	113	G215 K219	G215-Q217 PolarHBondContact O-N 3.2Å; Q217-K219 PolarHBondContact O-N 2.79Å
218	T	70.3	Confident	73.4	Confident	58 Å²	58	95.1 Å²	95.1	36%	0.356	51%	0.505	S	S	.	.			trans	-73	111.4	-178.9	45.5	0	0	0	0	110.8	M214 G215	M214-T218 HydrophobicContact SD-CG2 4.3Å; G215-T218 PolarHBondContact O-N 2.9Å; G215-T218 PolarHBondContact O-OG1 3.45Å
219	K	81.2	Confident	74.9	Confident	164 Å²	164	97.3 Å²	97.3	71%	0.713	51%	0.51	S	S	*	.			trans	-81.3	128	174	-68.6	-176.5	-179.8	-179.8	0	109.5	G202 R203 Q217	G202-K219 CarbonylContact C-O 3.55Å; G202-K219 WeakPolarHBondContact CA-O 3.42Å; R203-K219 PolarHBondContact N-O 2.87Å; Q217-K219 PolarHBondContact O-N 2.79Å
220	F	84.4	Confident	76.3	Confident	77 Å²	77	88.8 Å²	88.8	34%	0.338	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.9	174.3	-65.4	-81.3	0	0	0	110.5	R203 F205 A208 M214	R203-F220 HydrophobicContact CB-CD1 4.27Å; R203-F220 HydrophobicContact CB-CE1 4.35Å; R203-F220 CarbonylContact O-C 3.57Å; R203-F220 VanDerWaalsContact O-CA 3.24Å; R203-F220 WeakPolarHBondContact O-CA 3.26Å; F205-F220 HydrophobicContact CD1-CB 3.93Å; F205-F220 HydrophobicContact CD1-CG 4.45Å; F205-F220 HydrophobicContact CD2-CB 4.27Å; F205-F220 HydrophobicContact CE1-CB 3.51Å; F205-F220 HydrophobicContact CE1-CG 4.29Å; F205-F220 HydrophobicContact CE2-CB 3.88Å; F205-F220 HydrophobicContact CG-CB 4.3Å; F205-F220 HydrophobicContact CZ-CB 3.49Å; F205-F220 VanDerWaalsContact CZ-CB 3.49Å; A208-F220 HydrophobicContact CB-CD1 3.95Å; A208-F220 HydrophobicContact CB-CE1 3.33Å; A208-F220 HydrophobicContact CB-CZ 4Å; M214-F220 HydrophobicContact CE-CE1 4.31Å; M214-F220 HydrophobicContact CE-CZ 4.12Å; M214-F220 HydrophobicContact SD-CZ 4.04Å
221	V	89.6	Confident	77.7	Confident	48 Å²	48	92 Å²	92	29%	0.291	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.9	-177.6	-176.1	0	0	0	0	108	R203 S204 F205	R203-V221 PolarHBondContact O-N 3.18Å; S204-V221 WeakPolarHBondContact CA-O 3.27Å; F205-V221 WeakPolarHBondContact CD2-O 3.45Å
222	Q	88.6	Confident	79.1	Confident	146 Å²	146	91.9 Å²	91.9	68%	0.682	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-71.6	154.7	176.2	-68.5	-178	-9.7	0	0	110.9	F205	F205-Q222 HydrophobicContact CD2-CG 3.99Å; F205-Q222 HydrophobicContact CE2-CG 3.95Å
223	C	87.8	Confident	80.5	Confident	35 Å²	35	88.2 Å²	88.2	24%	0.236	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-57.5	128.7	171.6	-53.7	0	0	0	0	108.8	E137 T162 S204	E137-C223 PolarHBondContact OE2-SG 3.34Å; T162-C223 HydrophobicContact CG2-CB 4.17Å; S204-C223 PolarHBondContact OG-SG 3.43Å
224	P	90.9	Very high	81.7	Confident	12 Å²	12	85.8 Å²	85.8	8%	0.078	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-60.1	143.1	177.3	-21.8	32.2	0	0	0	111.6	E135 T161 T162 V188	E135-P224 HydrophobicContact CG-CB 3.86Å; E135-P224 HydrophobicContact CG-CG 3.7Å; T161-P224 WeakPolarHBondContact CA-O 3.5Å; T161-P224 WeakPolarHBondContact CB-O 3.15Å; T161-P224 HydrophobicContact CG2-CB 4.34Å; T162-P224 PolarHBondContact N-O 3.23Å; V188-P224 HydrophobicContact CG1-CG 3.6Å
225	E	89.4	Confident	82.8	Confident	138 Å²	138	86 Å²	86	65%	0.645	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-97.1	157.4	176.3	-60.4	-175	165.9	0	0	111.7	T162 K230	T162-E225 HydrophobicContact CG2-CG 3.92Å; T162-E225 WeakPolarHBondContact OG1-CA 3.4Å; E225-K230 WeakPolarHBondContact O-CE 3.48Å; E225-K230 PolarHBondContact O-NZ 3.04Å
226	G	89.7	Confident	84.1	Confident	17 Å²	17	88.2 Å²	88.2	18%	0.175	44%	0.44	C	S	.	.	S	Bend	trans	84.1	-158.5	178.6	0	0	0	0	0	114.8	T161 E163	T161-G226 VanDerWaalsContact CB-O 3.31Å; T161-G226 WeakPolarHBondContact CB-O 3.46Å; T161-G226 PolarHBondContact OG1-O 2.82Å; E163-G226 WeakPolarHBondContact OE2-CA 3.31Å
227	E	90.5	Very high	85.4	Confident	127 Å²	127	85.9 Å²	85.9	59%	0.593	41%	0.414	S	S	*	.			trans	-66.9	143.4	177.4	-56.8	-168.9	155.8	0	0	112.4	M164 Q229 K230	M164-E227 HydrophobicContact CE-CB 3.95Å; M164-E227 HydrophobicContact CE-CG 3.79Å; M164-E227 HydrophobicContact SD-CB 4.36Å; E227-Q229 VanDerWaalsContact C-N 3.34Å; E227-Q229 PolarHBondContact O-N 2.96Å; E227-K230 WeakPolarHBondContact O-CE 3.46Å
228	L	89.7	Confident	86.8	Confident	1 Å²	1	79.3 Å²	79.3	1%	0.005	39%	0.387	C	S	.	.	S	Bend	trans	-63.1	-39.2	176.9	-87.9	156.9	0	0	0	112.2	I134 E135 L159 T161 M164 T166	I134-L228 CarbonylContact C-O 3.51Å; I134-L228 VanDerWaalsContact CA-O 3.23Å; I134-L228 WeakPolarHBondContact CA-O 3.44Å; E135-L228 PolarHBondContact N-O 3.36Å; E135-L228 WeakPolarHBondContact O-CD2 3.43Å; L159-L228 HydrophobicContact CB-CD2 3.68Å; T161-L228 HydrophobicContact CG2-CB 4.49Å; T161-L228 HydrophobicContact CG2-CD2 3.69Å; T161-L228 HydrophobicContact CG2-CG 3.67Å; M164-L228 HydrophobicContact CG-CB 4.44Å; M164-L228 HydrophobicContact CG-CD1 3.76Å; M164-L228 HydrophobicContact CG-CG 3.97Å; M164-L228 HydrophobicContact SD-CB 3.99Å; M164-L228 HydrophobicContact SD-CD1 4.09Å; M164-L228 HydrophobicContact SD-CG 4.17Å; M164-L228 PolarHBondContact SD-N 3.04Å; M164-L228 VanDerWaalsContact SD-N 3.37Å; T166-L228 HydrophobicContact CG2-CD1 3.77Å; T166-L228 WeakPolarHBondContact OG1-CD1 3.42Å
229	Q	91.8	Very high	87.9	Confident	73 Å²	73	77.3 Å²	77.3	34%	0.341	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.2	179.6	-174.5	178.9	-20	0	0	109.4	E132 I134 E227	E132-Q229 PolarHBondContact OE2-NE2 3.36Å; I134-Q229 HydrophobicContact CG1-CB 4.48Å; I134-Q229 HydrophobicContact CG1-CG 4.45Å; E227-Q229 VanDerWaalsContact C-N 3.34Å; E227-Q229 PolarHBondContact O-N 2.96Å
230	K	90	Very high	88.4	Confident	62 Å²	62	69.6 Å²	69.6	27%	0.27	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	141.4	-179.9	-59.2	176.9	-172.9	172	0	109.5	I133 E135 E225 E227	I133-K230 HydrophobicContact CG1-CB 4.2Å; I133-K230 WeakPolarHBondContact CG1-O 3.37Å; I133-K230 PolarHBondContact N-O 3.09Å; I133-K230 PolarHBondContact O-N 3.34Å; I133-K230 VanDerWaalsContact O-O 3.14Å; E135-K230 IonicContact OE2-NZ 3.68Å; E135-K230 PolarHBondContact OE2-NZ 3.05Å; E225-K230 WeakPolarHBondContact O-CE 3.48Å; E225-K230 PolarHBondContact O-NZ 3.04Å; E227-K230 WeakPolarHBondContact O-CE 3.46Å
231	R	89.7	Confident	88.8	Confident	190 Å²	190	66.3 Å²	66.3	72%	0.717	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	122.3	166.8	-70	-173.4	174.8	177.5	0.1	108.3	E132	E132-R231 HydrophobicContact CG-CG 4.26Å; E132-R231 IonicContact OE1-CZ 2.72Å; E132-R231 IonicContact OE1-NE 3.33Å; E132-R231 PolarHBondContact OE1-NE 2.95Å; E132-R231 IonicContact OE1-NH2 3.23Å; E132-R231 PolarHBondContact OE1-NH2 3.39Å
232	K	86	Confident	88.9	Confident	114 Å²	114	67.5 Å²	67.5	50%	0.496	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	117.9	177.6	-172.4	175.5	179.9	178.8	0	109	T131 I133 V234	T131-K232 PolarHBondContact N-O 2.81Å; T131-K232 PolarHBondContact O-N 3.43Å; T131-K232 PolarHBondContact OG1-O 3.36Å; I133-K232 HydrophobicContact CD1-CB 3.87Å; I133-K232 HydrophobicContact CD1-CD 3.77Å; I133-K232 HydrophobicContact CD1-CG 4.45Å; I133-K232 HydrophobicContact CG1-CB 4.11Å; K232-V234 HydrophobicContact CD-CG2 4.33Å; K232-V234 HydrophobicContact CG-CG2 4.15Å; K232-V234 PolarHBondContact O-N 2.99Å
233	E	83.4	Confident	89	Confident	100 Å²	100	61.4 Å²	61.4	47%	0.467	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	117.8	165.9	-168.1	-177.9	170.6	0	0	107.7	K128	K128-E233 VanDerWaalsContact CD-OE1 3.23Å; K128-E233 WeakPolarHBondContact CD-OE1 3.23Å; K128-E233 WeakPolarHBondContact CG-OE1 3.35Å; K128-E233 IonicContact NZ-OE1 3.23Å
234	V	82.1	Confident	89.3	Confident	40 Å²	40	59.8 Å²	59.8	24%	0.242	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.4	173.5	-171.2	0	0	0	0	107.3	E129 K232 H236	E129-V234 PolarHBondContact N-O 2.8Å; E129-V234 PolarHBondContact O-N 2.76Å; K232-V234 HydrophobicContact CD-CG2 4.33Å; K232-V234 HydrophobicContact CG-CG2 4.15Å; K232-V234 PolarHBondContact O-N 2.99Å; V234-H236 WeakPolarHBondContact CG1-CE1 3.34Å; V234-H236 VanDerWaalsContact CG1-NE2 3.27Å; V234-H236 WeakPolarHBondContact CG1-NE2 3.49Å
235	V	84.6	Confident	89.2	Confident	66 Å²	66	59.3 Å²	59.3	40%	0.4	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	121.1	177.2	-174.9	0	0	0	0	108	R126 K128	R126-V235 HydrophobicContact CG-CG1 3.28Å; K128-V235 HydrophobicContact CG-CG2 4.3Å
236	H	86.1	Confident	89.3	Confident	92 Å²	92	56.5 Å²	56.5	43%	0.426	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	123.5	175.3	-66.5	-64.1	0	0	0	109.3	R126 I127 V234	R126-H236 CarbonylContact C-O 3.56Å; R126-H236 WeakPolarHBondContact CA-O 3.37Å; I127-H236 PolarHBondContact N-O 2.92Å; I127-H236 PolarHBondContact O-N 2.88Å; V234-H236 WeakPolarHBondContact CG1-CE1 3.34Å; V234-H236 VanDerWaalsContact CG1-NE2 3.27Å; V234-H236 WeakPolarHBondContact CG1-NE2 3.49Å
237	T	86.7	Confident	89.2	Confident	63 Å²	63	60.2 Å²	60.2	39%	0.387	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	119.7	170.7	-53	0	0	0	0	108.1	I288	T237-I288 HydrophobicContact CG2-CD1 4.38Å
238	V	90.9	Very high	89.1	Confident	43 Å²	43	56.1 Å²	56.1	26%	0.261	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.9	177.3	-68.4	0	0	0	0	109.7	G124 V125 I127 I243	G124-V238 CarbonylContact C-O 3.55Å; V125-V238 HydrophobicContact CB-CG2 4.35Å; V125-V238 PolarHBondContact N-O 3.02Å; V125-V238 PolarHBondContact O-N 2.7Å; I127-V238 HydrophobicContact CD1-CG2 4.07Å; V238-I243 HydrophobicContact CG2-CD1 3.89Å; V238-I243 HydrophobicContact CG2-CG1 4.07Å
239	S	92.4	Very high	88.6	Confident	16 Å²	16	60.9 Å²	60.9	11%	0.112	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	153.9	175.8	67.5	0	0	0	0	111.8	I123 H241 E242 I243	I123-S239 VanDerWaalsContact O-CA 3.31Å; I123-S239 WeakPolarHBondContact O-CA 3.46Å; S239-H241 PolarHBondContact O-N 3.05Å; S239-E242 PolarHBondContact N-OE2 3.18Å; S239-E242 PolarHBondContact O-N 3.47Å; S239-E242 VanDerWaalsContact O-N 3.12Å; S239-E242 VanDerWaalsContact OG-CG 3.24Å; S239-E242 WeakPolarHBondContact OG-CG 3.37Å; S239-E242 PolarHBondContact OG-N 3.28Å; S239-E242 PolarHBondContact OG-OE2 3.47Å; S239-I243 PolarHBondContact O-N 3.28Å
240	L	92.6	Very high	87.8	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-59	-34.2	173.8	-74.1	-177.5	0	0	0	112.2	R120 I123 V125 I243 D244 V276	R120-L240 HydrophobicContact CB-CB 4.12Å; R120-L240 HydrophobicContact CG-CB 4.5Å; R120-L240 PolarHBondContact O-N 3.02Å; I123-L240 HydrophobicContact CB-CD1 3.79Å; I123-L240 HydrophobicContact CB-CG 4.1Å; I123-L240 HydrophobicContact CD1-CD1 3.84Å; I123-L240 HydrophobicContact CG1-CD1 4.46Å; I123-L240 HydrophobicContact CG2-CD1 3.53Å; I123-L240 HydrophobicContact CG2-CG 3.9Å; I123-L240 PolarHBondContact O-N 2.9Å; V125-L240 HydrophobicContact CG2-CD2 3.51Å; V125-L240 HydrophobicContact CG2-CG 4.13Å; L240-I243 HydrophobicContact CD2-CD1 4.43Å; L240-I243 PolarHBondContact O-N 2.9Å; L240-D244 VanDerWaalsContact O-CG 3.27Å; L240-D244 PolarHBondContact O-N 2.94Å; L240-V276 HydrophobicContact CD2-CG1 4.31Å; L240-V276 HydrophobicContact CD2-CG2 3.89Å
241	H	92.6	Very high	87.1	Confident	7 Å²	7	68.8 Å²	68.8	3%	0.032	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-39.3	176.4	176.5	68.6	0	0	0	112.5	Q117 R120 K121 S239 I243 D244 V245	Q117-H241 PolarHBondContact OE1-CE1 3.24Å; R120-H241 HydrophobicContact CB-CB 3.89Å; R120-H241 PolarHBondContact O-N 2.99Å; K121-H241 HydrophobicContact CB-CB 4.49Å; K121-H241 WeakPolarHBondContact CE-CD2 3.42Å; K121-H241 VanDerWaalsContact CE-NE2 3.32Å; K121-H241 WeakPolarHBondContact CE-NE2 3.49Å; K121-H241 HydrophobicContact CG-CB 3.64Å; S239-H241 PolarHBondContact O-N 3.05Å; H241-I243 VanDerWaalsContact C-N 3.34Å; H241-I243 PolarHBondContact O-N 3.01Å; H241-D244 WeakPolarHBondContact O-CB 3.48Å; H241-D244 PolarHBondContact O-N 2.89Å; H241-V245 WeakPolarHBondContact O-CG2 3.42Å; H241-V245 PolarHBondContact O-N 3.38Å
242	E	91.3	Very high	86.3	Confident	74 Å²	74	59.8 Å²	59.8	35%	0.346	31%	0.31	S	S	.	.	H	α-helix	trans	-63.2	-42.8	176.1	-73.9	163.9	157.7	0	0	111.4	S239 D244 V245 I246 L256	S239-E242 PolarHBondContact N-OE2 3.18Å; S239-E242 PolarHBondContact O-N 3.47Å; S239-E242 VanDerWaalsContact O-N 3.12Å; S239-E242 VanDerWaalsContact OG-CG 3.24Å; S239-E242 WeakPolarHBondContact OG-CG 3.37Å; S239-E242 PolarHBondContact OG-N 3.28Å; S239-E242 PolarHBondContact OG-OE2 3.47Å; E242-D244 VanDerWaalsContact C-N 3.31Å; E242-D244 PolarHBondContact O-N 3.47Å; E242-V245 PolarHBondContact O-N 3.48Å; E242-I246 WeakPolarHBondContact O-CB 3.36Å; E242-I246 WeakPolarHBondContact O-CD1 3.43Å; E242-I246 WeakPolarHBondContact O-CG1 3.4Å; E242-I246 PolarHBondContact O-N 3Å; E242-L256 HydrophobicContact CB-CD1 4.28Å; E242-L256 HydrophobicContact CB-CD2 4.47Å; E242-L256 HydrophobicContact CG-CD1 4.15Å; E242-L256 HydrophobicContact CG-CD2 4.06Å
243	I	91.7	Very high	85.9	Confident	18 Å²	18	60.7 Å²	60.7	9%	0.092	31%	0.314	C	S	.	.	H	α-helix	trans	-61.2	-42.3	175.7	-57.6	170.9	0	0	0	110.3	V125 V238 S239 L240 H241 N247 I272	V125-I243 HydrophobicContact CB-CD1 4.33Å; V125-I243 HydrophobicContact CG2-CD1 4.19Å; V238-I243 HydrophobicContact CG2-CD1 3.89Å; V238-I243 HydrophobicContact CG2-CG1 4.07Å; S239-I243 PolarHBondContact O-N 3.28Å; L240-I243 HydrophobicContact CD2-CD1 4.43Å; L240-I243 PolarHBondContact O-N 2.9Å; H241-I243 VanDerWaalsContact C-N 3.34Å; H241-I243 PolarHBondContact O-N 3.01Å; I243-N247 WeakPolarHBondContact CG2-ND2 3.08Å; I243-N247 WeakPolarHBondContact O-CB 3.28Å; I243-N247 PolarHBondContact O-N 3.21Å; I243-N247 VanDerWaalsContact O-N 3.08Å; I243-N247 PolarHBondContact O-ND2 3.44Å; I243-I272 HydrophobicContact CB-CG2 4.33Å; I243-I272 HydrophobicContact CG2-CD1 4.15Å; I243-I272 HydrophobicContact CG2-CG1 4.22Å; I243-I272 HydrophobicContact CG2-CG2 3.69Å
244	D	92.6	Very high	85.6	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-51.7	176.5	-70.6	-3.1	0	0	0	112.7	R120 L240 H241 E242 I246 N247 S248 I264 R269 I272	R120-D244 WeakPolarHBondContact CD-OD2 3.48Å; R120-D244 IonicContact CZ-OD1 3.92Å; R120-D244 IonicContact CZ-OD2 3.69Å; R120-D244 IonicContact NE-OD1 2.68Å; R120-D244 PolarHBondContact NE-OD1 3.5Å; R120-D244 IonicContact NE-OD2 2.69Å; R120-D244 PolarHBondContact NE-OD2 3.19Å; R120-D244 IonicContact NH2-OD1 2.75Å; R120-D244 PolarHBondContact NH2-OD1 3.34Å; R120-D244 IonicContact NH2-OD2 3.29Å; L240-D244 VanDerWaalsContact O-CG 3.27Å; L240-D244 PolarHBondContact O-N 2.94Å; H241-D244 WeakPolarHBondContact O-CB 3.48Å; H241-D244 PolarHBondContact O-N 2.89Å; E242-D244 VanDerWaalsContact C-N 3.31Å; E242-D244 PolarHBondContact O-N 3.47Å; D244-I246 VanDerWaalsContact C-N 3.34Å; D244-I246 PolarHBondContact O-N 3.04Å; D244-N247 PolarHBondContact O-N 2.95Å; D244-S248 WeakPolarHBondContact O-CB 3.12Å; D244-S248 PolarHBondContact O-N 2.85Å; D244-I264 HydrophobicContact CB-CD1 3.69Å; D244-I264 HydrophobicContact CB-CG2 4.29Å; D244-R269 IonicContact OD2-NE 2.95Å; D244-R269 PolarHBondContact OD2-NE 2.8Å; D244-I272 VanDerWaalsContact CA-CD1 3.45Å; D244-I272 HydrophobicContact CB-CD1 4.25Å; D244-I272 VanDerWaalsContact OD1-CD1 3.25Å; D244-I272 WeakPolarHBondContact OD1-CD1 3.03Å
245	V	90.3	Very high	85.4	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.018	31%	0.31	C	S	.	.	H	α-helix	trans	-64.4	-42.4	-175.7	175.4	0	0	0	0	110.4	H241 E242 N247 S248 G252 A255 L256 T261 I264	H241-V245 WeakPolarHBondContact O-CG2 3.42Å; H241-V245 PolarHBondContact O-N 3.38Å; E242-V245 PolarHBondContact O-N 3.48Å; V245-N247 VanDerWaalsContact C-N 3.34Å; V245-N247 PolarHBondContact O-N 2.88Å; V245-S248 PolarHBondContact O-N 2.76Å; V245-G252 WeakPolarHBondContact CG1-O 3.5Å; V245-G252 WeakPolarHBondContact O-CA 3.44Å; V245-A255 HydrophobicContact CG1-CB 3.96Å; V245-L256 HydrophobicContact CB-CD2 3.72Å; V245-L256 HydrophobicContact CB-CG 4.29Å; V245-L256 HydrophobicContact CG1-CD2 3.8Å; V245-L256 HydrophobicContact CG1-CG 3.98Å; V245-L256 HydrophobicContact CG2-CD2 3.96Å; V245-T261 HydrophobicContact CG1-CG2 4.07Å; V245-T261 HydrophobicContact CG2-CG2 3.8Å; V245-I264 HydrophobicContact CG2-CD1 3.71Å
246	I	89.8	Confident	85	Confident	78 Å²	78	58.7 Å²	58.7	40%	0.4	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-42.7	178.6	-69.3	166.9	0	0	0	111.1	E242 D244 L256	E242-I246 WeakPolarHBondContact O-CB 3.36Å; E242-I246 WeakPolarHBondContact O-CD1 3.43Å; E242-I246 WeakPolarHBondContact O-CG1 3.4Å; E242-I246 PolarHBondContact O-N 3Å; D244-I246 VanDerWaalsContact C-N 3.34Å; D244-I246 PolarHBondContact O-N 3.04Å; I246-L256 HydrophobicContact CD1-CD1 4.09Å; I246-L256 HydrophobicContact CG1-CD1 4Å
247	N	88.4	Confident	84.6	Confident	96 Å²	96	61.5 Å²	61.5	51%	0.513	32%	0.315	S	S	.	.	H	α-helix	trans	-84.5	-15.8	-177.5	-72.8	-76.9	0	0	0	113.5	I243 D244 V245 V268 I272	I243-N247 WeakPolarHBondContact CG2-ND2 3.08Å; I243-N247 WeakPolarHBondContact O-CB 3.28Å; I243-N247 PolarHBondContact O-N 3.21Å; I243-N247 VanDerWaalsContact O-N 3.08Å; I243-N247 PolarHBondContact O-ND2 3.44Å; D244-N247 PolarHBondContact O-N 2.95Å; V245-N247 VanDerWaalsContact C-N 3.34Å; V245-N247 PolarHBondContact O-N 2.88Å; N247-V268 HydrophobicContact CB-CG1 4.45Å; N247-I272 HydrophobicContact CB-CD1 4.08Å
248	S	87.9	Confident	84.3	Confident	41 Å²	41	62.2 Å²	62.2	29%	0.287	32%	0.322	S	S	.	.	H	α-helix	trans	-79	-23.6	179.3	-176.1	0	0	0	0	113.6	D244 V245	D244-S248 WeakPolarHBondContact O-CB 3.12Å; D244-S248 PolarHBondContact O-N 2.85Å; V245-S248 PolarHBondContact O-N 2.76Å
249	R	79.4	Confident	83.5	Confident	101 Å²	101	62.4 Å²	62.4	38%	0.381	33%	0.333	S	S	.	.	S	Bend	trans	-140.9	147.2	-173.2	-61.1	-172.3	-174.7	-161	6.4	112.1	Q251 G252 D260 T261	R249-Q251 PolarHBondContact O-N 2.72Å; R249-Q251 VanDerWaalsContact O-N 3.13Å; R249-G252 PolarHBondContact O-N 2.95Å; R249-D260 PolarHBondContact NH1-O 3.25Å; R249-D260 IonicContact NH1-OD1 3.94Å; R249-D260 IonicContact NH1-OD2 3.83Å; R249-D260 IonicContact NH2-OD1 4Å; R249-T261 VanDerWaalsContact NH2-C 3.3Å; R249-T261 PolarHBondContact NH2-O 3.14Å
250	T	74.9	Confident	82.8	Confident	152 Å²	152	66.2 Å²	66.2	93%	0.933	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25	178.2	-31.6	0	0	0	0	113.9
251	Q	74.9	Confident	82	Confident	148 Å²	148	66.7 Å²	66.7	69%	0.692	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	37.5	171.6	-68	-169.1	-21.5	0	0	111.8	R249 F253 L254	R249-Q251 PolarHBondContact O-N 2.72Å; R249-Q251 VanDerWaalsContact O-N 3.13Å; Q251-F253 PolarHBondContact O-N 3.42Å; Q251-L254 PolarHBondContact O-N 2.81Å; Q251-L254 VanDerWaalsContact O-N 3.1Å
252	G	74.2	Confident	81.6	Confident	2 Å²	2	67.2 Å²	67.2	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-57.1	-32.2	-176.7	0	0	0	0	0	114.2	V245 R249 L254 A255 L256	V245-G252 WeakPolarHBondContact CG1-O 3.5Å; V245-G252 WeakPolarHBondContact O-CA 3.44Å; R249-G252 PolarHBondContact O-N 2.95Å; G252-L254 VanDerWaalsContact C-N 3.3Å; G252-L254 PolarHBondContact O-N 3.29Å; G252-A255 WeakPolarHBondContact O-CB 3.38Å; G252-A255 PolarHBondContact O-N 3.21Å; G252-A255 VanDerWaalsContact O-N 3.14Å; G252-L256 PolarHBondContact O-N 3.41Å
253	F	77.4	Confident	81.5	Confident	133 Å²	133	68.9 Å²	68.9	58%	0.583	37%	0.37	S	S	*	.	H	α-helix	trans	-59.1	-38.4	176.3	-177.9	-101.3	0	0	0	113.2	Q251 A255 L256 F257	Q251-F253 PolarHBondContact O-N 3.42Å; F253-A255 VanDerWaalsContact C-N 3.34Å; F253-L256 WeakPolarHBondContact O-CB 3.22Å; F253-L256 PolarHBondContact O-N 3.11Å; F253-F257 AromaticContact CD1-CE2 4Å; F253-F257 HydrophobicContact CD1-CE2 4Å; F253-F257 HydrophobicContact CD2-CE2 4.28Å; F253-F257 HydrophobicContact CE1-CD2 4.32Å; F253-F257 AromaticContact CE1-CE2 3.49Å; F253-F257 HydrophobicContact CE1-CE2 3.49Å; F253-F257 VanDerWaalsContact CE1-CE2 3.49Å; F253-F257 HydrophobicContact CE1-CZ 4.25Å; F253-F257 AromaticContact CE2-CE2 3.81Å; F253-F257 HydrophobicContact CE2-CE2 3.81Å; F253-F257 HydrophobicContact CE2-CZ 4.22Å; F253-F257 HydrophobicContact CG-CE2 4.38Å; F253-F257 AromaticContact CZ-CE2 3.4Å; F253-F257 HydrophobicContact CZ-CE2 3.4Å; F253-F257 VanDerWaalsContact CZ-CE2 3.4Å; F253-F257 AromaticContact CZ-CZ 3.78Å; F253-F257 HydrophobicContact CZ-CZ 3.78Å; F253-F257 WeakPolarHBondContact O-CD2 3.47Å; F253-F257 WeakPolarHBondContact O-CE2 3.28Å
254	L	77.4	Confident	81.4	Confident	107 Å²	107	68.5 Å²	68.5	56%	0.56	37%	0.368	S	S	*	.	H	α-helix	trans	-71.4	-33.2	179	-173.3	64.3	0	0	0	111.6	Q251 G252 L256 F257 S258	Q251-L254 PolarHBondContact O-N 2.81Å; Q251-L254 VanDerWaalsContact O-N 3.1Å; G252-L254 VanDerWaalsContact C-N 3.3Å; G252-L254 PolarHBondContact O-N 3.29Å; L254-L256 PolarHBondContact O-N 2.95Å; L254-F257 PolarHBondContact O-N 3.27Å; L254-S258 PolarHBondContact O-N 3.39Å; L254-S258 VanDerWaalsContact O-N 3.09Å
255	A	77.7	Confident	81.4	Confident	8 Å²	8	75.5 Å²	75.5	7%	0.066	40%	0.398	C	S	.	.	H	α-helix	trans	-62.4	-30.5	178.4	0	0	0	0	0	112.8	V245 G252 F253 F257 S258 G259	V245-A255 HydrophobicContact CG1-CB 3.96Å; G252-A255 WeakPolarHBondContact O-CB 3.38Å; G252-A255 PolarHBondContact O-N 3.21Å; G252-A255 VanDerWaalsContact O-N 3.14Å; F253-A255 VanDerWaalsContact C-N 3.34Å; A255-F257 PolarHBondContact O-N 3.34Å; A255-S258 WeakPolarHBondContact CA-OG 3.36Å; A255-S258 PolarHBondContact O-N 3.18Å; A255-S258 PolarHBondContact O-OG 2.92Å; A255-G259 PolarHBondContact O-N 2.97Å
256	L	75.8	Confident	81.4	Confident	48 Å²	48	78.9 Å²	78.9	25%	0.251	42%	0.422	S	S	.	.	H	α-helix	trans	-59.9	-33.1	173.6	-67.9	174.1	0	0	0	112.7	E242 V245 I246 G252 F253 L254	E242-L256 HydrophobicContact CB-CD1 4.28Å; E242-L256 HydrophobicContact CB-CD2 4.47Å; E242-L256 HydrophobicContact CG-CD1 4.15Å; E242-L256 HydrophobicContact CG-CD2 4.06Å; V245-L256 HydrophobicContact CB-CD2 3.72Å; V245-L256 HydrophobicContact CB-CG 4.29Å; V245-L256 HydrophobicContact CG1-CD2 3.8Å; V245-L256 HydrophobicContact CG1-CG 3.98Å; V245-L256 HydrophobicContact CG2-CD2 3.96Å; I246-L256 HydrophobicContact CD1-CD1 4.09Å; I246-L256 HydrophobicContact CG1-CD1 4Å; G252-L256 PolarHBondContact O-N 3.41Å; F253-L256 WeakPolarHBondContact O-CB 3.22Å; F253-L256 PolarHBondContact O-N 3.11Å; L254-L256 PolarHBondContact O-N 2.95Å
257	F	78.1	Confident	81.5	Confident	152 Å²	152	81 Å²	81	67%	0.667	43%	0.43	S	S	*	.	H	α-helix	trans	-91.6	-27.5	-179.9	-61	-80.8	0	0	0	113	F253 L254 A255	F253-F257 AromaticContact CD1-CE2 4Å; F253-F257 HydrophobicContact CD1-CE2 4Å; F253-F257 HydrophobicContact CD2-CE2 4.28Å; F253-F257 HydrophobicContact CE1-CD2 4.32Å; F253-F257 AromaticContact CE1-CE2 3.49Å; F253-F257 HydrophobicContact CE1-CE2 3.49Å; F253-F257 VanDerWaalsContact CE1-CE2 3.49Å; F253-F257 HydrophobicContact CE1-CZ 4.25Å; F253-F257 AromaticContact CE2-CE2 3.81Å; F253-F257 HydrophobicContact CE2-CE2 3.81Å; F253-F257 HydrophobicContact CE2-CZ 4.22Å; F253-F257 HydrophobicContact CG-CE2 4.38Å; F253-F257 AromaticContact CZ-CE2 3.4Å; F253-F257 HydrophobicContact CZ-CE2 3.4Å; F253-F257 VanDerWaalsContact CZ-CE2 3.4Å; F253-F257 AromaticContact CZ-CZ 3.78Å; F253-F257 HydrophobicContact CZ-CZ 3.78Å; F253-F257 WeakPolarHBondContact O-CD2 3.47Å; F253-F257 WeakPolarHBondContact O-CE2 3.28Å; L254-F257 PolarHBondContact O-N 3.27Å; A255-F257 PolarHBondContact O-N 3.34Å
258	S	80.4	Confident	81.7	Confident	78 Å²	78	77.7 Å²	77.7	55%	0.545	41%	0.413	S	S	.	.	H	α-helix	trans	-84.5	-19.4	178.9	67.1	0	0	0	0	113.5	L254 A255 D260	L254-S258 PolarHBondContact O-N 3.39Å; L254-S258 VanDerWaalsContact O-N 3.09Å; A255-S258 WeakPolarHBondContact CA-OG 3.36Å; A255-S258 PolarHBondContact O-N 3.18Å; A255-S258 PolarHBondContact O-OG 2.92Å; S258-D260 PolarHBondContact O-N 3.12Å; S258-D260 PolarHBondContact OG-N 3.32Å
259	G	74.1	Confident	81.9	Confident	46 Å²	46	77 Å²	77	47%	0.474	40%	0.404	S	S	.	.	S	Bend	trans	78.6	-5.1	-174.2	0	0	0	0	0	114	A255 T261	A255-G259 PolarHBondContact O-N 2.97Å; G259-T261 PolarHBondContact O-N 3.3Å
260	D	76.7	Confident	82.5	Confident	97 Å²	97	78.3 Å²	78.3	52%	0.519	42%	0.415	S	S	.	.			trans	-82	60.6	175.6	-179.4	19.9	0	0	0	110.9	R249 S258	R249-D260 PolarHBondContact NH1-O 3.25Å; R249-D260 IonicContact NH1-OD1 3.94Å; R249-D260 IonicContact NH1-OD2 3.83Å; R249-D260 IonicContact NH2-OD1 4Å; S258-D260 PolarHBondContact O-N 3.12Å; S258-D260 PolarHBondContact OG-N 3.32Å
261	T	77.3	Confident	83.4	Confident	12 Å²	12	76.9 Å²	76.9	7%	0.074	40%	0.398	C	S	.	.			trans	-77.9	-30	176.6	59.6	0	0	0	0	111	V245 R249 G259	V245-T261 HydrophobicContact CG1-CG2 4.07Å; V245-T261 HydrophobicContact CG2-CG2 3.8Å; R249-T261 VanDerWaalsContact NH2-C 3.3Å; R249-T261 PolarHBondContact NH2-O 3.14Å; G259-T261 PolarHBondContact O-N 3.3Å
262	G	82.4	Confident	84.3	Confident	17 Å²	17	70.2 Å²	70.2	18%	0.175	37%	0.367	C	S	.	.			trans	57.9	-162.6	-172	0	0	0	0	0	112.5	Q117	Q117-G262 PolarHBondContact NE2-O 3.44Å
263	E	89	Confident	85.1	Confident	110 Å²	110	72.4 Å²	72.4	51%	0.514	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-85.6	132.3	175.2	-54.4	-160	141.3	0	0	111.3	M109 S110 E113	M109-E263 HydrophobicContact CB-CG 4.31Å; S110-E263 VanDerWaalsContact CB-OE1 3.29Å; S110-E263 WeakPolarHBondContact CB-OE1 3.49Å; S110-E263 PolarHBondContact N-OE1 3.11Å; S110-E263 PolarHBondContact OG-OE1 3.18Å; E113-E263 HydrophobicContact CG-CB 4.19Å; E113-E263 HydrophobicContact CG-CG 4.06Å
264	I	90.8	Very high	85.9	Confident	10 Å²	10	69.1 Å²	69.1	5%	0.051	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-97.9	130	-179.5	-55.9	175.7	0	0	0	109.4	E113 D244 V245 V268 R269	E113-I264 PolarHBondContact OE1-N 3.22Å; D244-I264 HydrophobicContact CB-CD1 3.69Å; D244-I264 HydrophobicContact CB-CG2 4.29Å; V245-I264 HydrophobicContact CG2-CD1 3.71Å; I264-V268 HydrophobicContact CG2-CB 4.41Å; I264-R269 HydrophobicContact CG2-CG 4.33Å
265	K	91.4	Very high	86.6	Confident	147 Å²	147	68.9 Å²	68.9	64%	0.639	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-62.3	140.4	178.8	-64.8	-177.1	178.6	-176.8	0	111.6	E267 V268 R269	K265-E267 VanDerWaalsContact C-N 3.28Å; K265-E267 PolarHBondContact O-N 3.1Å; K265-V268 HydrophobicContact CB-CG2 4.37Å; K265-V268 PolarHBondContact O-N 2.93Å; K265-R269 PolarHBondContact O-N 2.95Å
266	S	90.7	Very high	87.3	Confident	73 Å²	73	68.6 Å²	68.6	51%	0.51	37%	0.367	S	S	.	.	H	α-helix	trans	-59.1	-37.5	177	53	0	0	0	0	113	V268 R269 E270	S266-V268 VanDerWaalsContact C-N 3.26Å; S266-V268 PolarHBondContact O-N 2.98Å; S266-R269 WeakPolarHBondContact O-CA 3.5Å; S266-R269 WeakPolarHBondContact O-CB 3.28Å; S266-R269 PolarHBondContact O-N 3.43Å; S266-E270 WeakPolarHBondContact O-CG 3.46Å; S266-E270 PolarHBondContact O-N 3.05Å
267	E	92.4	Very high	88.1	Confident	123 Å²	123	68.6 Å²	68.6	58%	0.575	37%	0.37	S	S	*	.	H	α-helix	trans	-55.3	-40.5	177.7	-64.1	171.9	-176.6	0	0	112.3	K265 E270 Q271	K265-E267 VanDerWaalsContact C-N 3.28Å; K265-E267 PolarHBondContact O-N 3.1Å; E267-E270 PolarHBondContact O-N 3.16Å; E267-Q271 VanDerWaalsContact O-CG 3.27Å; E267-Q271 WeakPolarHBondContact O-CG 3.31Å; E267-Q271 PolarHBondContact O-N 3.09Å
268	V	93.3	Very high	88.8	Confident	26 Å²	26	66.1 Å²	66.1	16%	0.158	36%	0.361	C	S	.	.	H	α-helix	trans	-67.3	-42.1	178.3	177.3	0	0	0	0	110.1	N247 I264 K265 S266 Q271 I272	N247-V268 HydrophobicContact CB-CG1 4.45Å; I264-V268 HydrophobicContact CG2-CB 4.41Å; K265-V268 HydrophobicContact CB-CG2 4.37Å; K265-V268 PolarHBondContact O-N 2.93Å; S266-V268 VanDerWaalsContact C-N 3.26Å; S266-V268 PolarHBondContact O-N 2.98Å; V268-Q271 PolarHBondContact O-N 2.76Å; V268-I272 HydrophobicContact CG1-CD1 3.71Å; V268-I272 WeakPolarHBondContact O-CB 3.04Å; V268-I272 WeakPolarHBondContact O-CD1 3.18Å; V268-I272 VanDerWaalsContact O-CG1 3.25Å; V268-I272 WeakPolarHBondContact O-CG1 3.14Å; V268-I272 PolarHBondContact O-N 2.91Å
269	R	92	Very high	89.3	Confident	28 Å²	28	66.5 Å²	66.5	11%	0.106	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-42.4	177.5	-67.6	-176.7	167.2	147.3	8.5	112.2	E113 S116 D244 I264 K265 S266 I272 N273	E113-R269 IonicContact OE1-CZ 3.42Å; E113-R269 IonicContact OE1-NH1 2.82Å; E113-R269 IonicContact OE1-NH2 3.87Å; E113-R269 PolarHBondContact OE1-NH2 2.86Å; E113-R269 IonicContact OE2-CZ 2.97Å; E113-R269 VanDerWaalsContact OE2-CZ 3.29Å; E113-R269 IonicContact OE2-NH1 2.64Å; E113-R269 PolarHBondContact OE2-NH1 3.04Å; E113-R269 IonicContact OE2-NH2 3.04Å; E113-R269 PolarHBondContact OE2-NH2 3.33Å; S116-R269 PolarHBondContact OG-NH1 3Å; D244-R269 IonicContact OD2-NE 2.95Å; D244-R269 PolarHBondContact OD2-NE 2.8Å; I264-R269 HydrophobicContact CG2-CG 4.33Å; K265-R269 PolarHBondContact O-N 2.95Å; S266-R269 WeakPolarHBondContact O-CA 3.5Å; S266-R269 WeakPolarHBondContact O-CB 3.28Å; S266-R269 PolarHBondContact O-N 3.43Å; R269-I272 PolarHBondContact O-N 2.82Å; R269-N273 WeakPolarHBondContact O-CB 3.39Å; R269-N273 PolarHBondContact O-N 2.9Å; R269-N273 PolarHBondContact O-ND2 2.98Å; R269-N273 PolarHBondContact O-OD1 3.21Å
270	E	91.9	Very high	90.1	Very high	128 Å²	128	71.7 Å²	71.7	60%	0.598	36%	0.356	S	S	*	.	H	α-helix	trans	-63.8	-44.4	177.3	-73.1	172	-164.2	0	0	111.4	S266 E267 I272 N273 A274	S266-E270 WeakPolarHBondContact O-CG 3.46Å; S266-E270 PolarHBondContact O-N 3.05Å; E267-E270 PolarHBondContact O-N 3.16Å; E270-I272 VanDerWaalsContact C-N 3.34Å; E270-I272 PolarHBondContact O-N 2.77Å; E270-N273 PolarHBondContact O-N 3.1Å; E270-A274 PolarHBondContact O-N 2.96Å
271	Q	93.8	Very high	90.8	Very high	122 Å²	122	75.1 Å²	75.1	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-61.5	-41.6	174.6	-72.5	175.1	16.8	0	0	112.4	E267 V268 A274 K275	E267-Q271 VanDerWaalsContact O-CG 3.27Å; E267-Q271 WeakPolarHBondContact O-CG 3.31Å; E267-Q271 PolarHBondContact O-N 3.09Å; V268-Q271 PolarHBondContact O-N 2.76Å; Q271-A274 PolarHBondContact O-N 2.98Å; Q271-K275 WeakPolarHBondContact O-CG 3.48Å; Q271-K275 PolarHBondContact O-N 2.9Å; Q271-K275 VanDerWaalsContact O-N 3.07Å
272	I	93.2	Very high	91.5	Very high	8 Å²	8	79 Å²	79	4%	0.041	39%	0.386	C	S	.	.	H	α-helix	trans	-67.6	-43.8	177.6	-70.5	163.8	0	0	0	110.7	I243 D244 N247 V268 R269 E270 A274 K275 V276	I243-I272 HydrophobicContact CB-CG2 4.33Å; I243-I272 HydrophobicContact CG2-CD1 4.15Å; I243-I272 HydrophobicContact CG2-CG1 4.22Å; I243-I272 HydrophobicContact CG2-CG2 3.69Å; D244-I272 VanDerWaalsContact CA-CD1 3.45Å; D244-I272 HydrophobicContact CB-CD1 4.25Å; D244-I272 VanDerWaalsContact OD1-CD1 3.25Å; D244-I272 WeakPolarHBondContact OD1-CD1 3.03Å; N247-I272 HydrophobicContact CB-CD1 4.08Å; V268-I272 HydrophobicContact CG1-CD1 3.71Å; V268-I272 WeakPolarHBondContact O-CB 3.04Å; V268-I272 WeakPolarHBondContact O-CD1 3.18Å; V268-I272 VanDerWaalsContact O-CG1 3.25Å; V268-I272 WeakPolarHBondContact O-CG1 3.14Å; V268-I272 PolarHBondContact O-N 2.91Å; R269-I272 PolarHBondContact O-N 2.82Å; E270-I272 VanDerWaalsContact C-N 3.34Å; E270-I272 PolarHBondContact O-N 2.77Å; I272-A274 VanDerWaalsContact C-N 3.28Å; I272-A274 PolarHBondContact O-N 2.88Å; I272-K275 PolarHBondContact O-N 3.43Å; I272-V276 HydrophobicContact CG2-CG2 4.09Å; I272-V276 WeakPolarHBondContact O-CB 3.24Å; I272-V276 VanDerWaalsContact O-CG2 3.31Å; I272-V276 WeakPolarHBondContact O-CG2 3.48Å; I272-V276 PolarHBondContact O-N 2.8Å
273	N	92.3	Very high	91.7	Very high	48 Å²	48	81.1 Å²	81.1	26%	0.257	41%	0.407	S	S	.	.	H	α-helix	trans	-58.4	-43.6	176.7	-68.4	-12.9	0	0	0	110.8	R120 R269 E270 V276 C277	R120-N273 PolarHBondContact NH1-OD1 3.02Å; R120-N273 PolarHBondContact NH2-OD1 3.33Å; R120-N273 VanDerWaalsContact NH2-OD1 3.11Å; R269-N273 WeakPolarHBondContact O-CB 3.39Å; R269-N273 PolarHBondContact O-N 2.9Å; R269-N273 PolarHBondContact O-ND2 2.98Å; R269-N273 PolarHBondContact O-OD1 3.21Å; E270-N273 PolarHBondContact O-N 3.1Å; N273-V276 PolarHBondContact O-N 3.45Å; N273-C277 WeakPolarHBondContact O-CB 3.38Å; N273-C277 PolarHBondContact O-N 2.88Å; N273-C277 PolarHBondContact O-SG 2.84Å
274	A	92.9	Very high	91.6	Very high	63 Å²	63	81.3 Å²	81.3	52%	0.521	41%	0.407	S	S	.	.	H	α-helix	trans	-60.6	-46	176.2	0	0	0	0	0	112.3	E270 Q271 I272 C277 E278	E270-A274 PolarHBondContact O-N 2.96Å; Q271-A274 PolarHBondContact O-N 2.98Å; I272-A274 VanDerWaalsContact C-N 3.28Å; I272-A274 PolarHBondContact O-N 2.88Å; A274-C277 PolarHBondContact O-N 2.97Å; A274-E278 PolarHBondContact O-N 3.23Å
275	K	92.8	Very high	91.7	Very high	103 Å²	103	81.3 Å²	81.3	45%	0.448	41%	0.408	S	S	.	.	H	α-helix	trans	-65	-39	177.1	-74.5	-180	178.3	179	0	113.3	Q271 I272 C277 E278 W279	Q271-K275 WeakPolarHBondContact O-CG 3.48Å; Q271-K275 PolarHBondContact O-N 2.9Å; Q271-K275 VanDerWaalsContact O-N 3.07Å; I272-K275 PolarHBondContact O-N 3.43Å; K275-C277 VanDerWaalsContact C-N 3.33Å; K275-E278 WeakPolarHBondContact O-CB 3.46Å; K275-E278 PolarHBondContact O-N 2.83Å; K275-W279 VanDerWaalsContact O-CG 3.29Å; K275-W279 PolarHBondContact O-N 3.09Å
276	V	92.2	Very high	91.6	Very high	2 Å²	2	78.8 Å²	78.8	1%	0.012	40%	0.399	C	S	.	.	H	α-helix	trans	-67.9	-37.1	177.7	171.6	0	0	0	0	110.5	V125 L240 I272 N273 W279 R280 I287	V125-V276 HydrophobicContact CG1-CG1 4.45Å; V125-V276 HydrophobicContact CG2-CG1 3.95Å; V125-V276 HydrophobicContact CG2-CG2 4.39Å; L240-V276 HydrophobicContact CD2-CG1 4.31Å; L240-V276 HydrophobicContact CD2-CG2 3.89Å; I272-V276 HydrophobicContact CG2-CG2 4.09Å; I272-V276 WeakPolarHBondContact O-CB 3.24Å; I272-V276 VanDerWaalsContact O-CG2 3.31Å; I272-V276 WeakPolarHBondContact O-CG2 3.48Å; I272-V276 PolarHBondContact O-N 2.8Å; N273-V276 PolarHBondContact O-N 3.45Å; V276-W279 HydrophobicContact CG2-CE3 4.32Å; V276-W279 HydrophobicContact CG2-CZ3 4.42Å; V276-W279 PolarHBondContact O-N 3.28Å; V276-R280 WeakPolarHBondContact O-CB 3.35Å; V276-R280 PolarHBondContact O-N 3Å; V276-I287 HydrophobicContact CG1-CD1 3.77Å; V276-I287 HydrophobicContact CG1-CG1 3.91Å
277	C	91.4	Very high	91.5	Very high	47 Å²	47	76.7 Å²	76.7	32%	0.318	38%	0.381	S	S	.	.	H	α-helix	trans	-62.9	-44	170.9	-70.8	0	0	0	0	111.8	N273 A274 K275 W279 R280 E281	N273-C277 WeakPolarHBondContact O-CB 3.38Å; N273-C277 PolarHBondContact O-N 2.88Å; N273-C277 PolarHBondContact O-SG 2.84Å; A274-C277 PolarHBondContact O-N 2.97Å; K275-C277 VanDerWaalsContact C-N 3.33Å; C277-W279 PolarHBondContact O-N 3.07Å; C277-R280 WeakPolarHBondContact O-CB 3.23Å; C277-R280 PolarHBondContact O-N 3.32Å; C277-E281 WeakPolarHBondContact O-CG 3.08Å; C277-E281 PolarHBondContact O-N 3.27Å
278	E	93.3	Very high	91.3	Very high	101 Å²	101	71.6 Å²	71.6	47%	0.472	36%	0.358	S	S	.	.	H	α-helix	trans	-58.5	-48.1	174.6	-176.4	-177.2	-176.8	0	0	111.4	A274 K275 R280 E281 E282	A274-E278 PolarHBondContact O-N 3.23Å; K275-E278 WeakPolarHBondContact O-CB 3.46Å; K275-E278 PolarHBondContact O-N 2.83Å; E278-R280 PolarHBondContact O-N 2.7Å; E278-E281 PolarHBondContact O-N 3.25Å; E278-E281 VanDerWaalsContact O-N 3.13Å; E278-E282 WeakPolarHBondContact O-CB 3.42Å; E278-E282 WeakPolarHBondContact O-CG 3.18Å; E278-E282 PolarHBondContact O-N 2.66Å
279	W	91.8	Very high	90.8	Very high	85 Å²	85	72.7 Å²	72.7	32%	0.322	37%	0.366	S	S	.	.	H	α-helix	trans	-62.6	-31.6	177.2	-65.7	-17.3	0	0	0	113.5	I127 K275 V276 C277 G283 K284 A285	I127-W279 HydrophobicContact CD1-CZ3 4.33Å; K275-W279 VanDerWaalsContact O-CG 3.29Å; K275-W279 PolarHBondContact O-N 3.09Å; V276-W279 HydrophobicContact CG2-CE3 4.32Å; V276-W279 HydrophobicContact CG2-CZ3 4.42Å; V276-W279 PolarHBondContact O-N 3.28Å; C277-W279 PolarHBondContact O-N 3.07Å; W279-G283 PolarHBondContact O-N 3.14Å; W279-K284 HydrophobicContact CB-CB 4.47Å; W279-K284 PolarHBondContact O-N 2.95Å; W279-A285 HydrophobicContact CB-CB 3.73Å; W279-A285 PolarHBondContact O-N 3.37Å; W279-A285 VanDerWaalsContact O-N 3.08Å
280	R	90.4	Very high	90.6	Very high	156 Å²	156	71.4 Å²	71.4	59%	0.589	36%	0.361	S	S	*	.	H	α-helix	trans	-68.9	-44.3	173.4	-178.6	-172.4	173.4	-163.6	0.2	111.3	V276 C277 E278 E282 G283 A285	V276-R280 WeakPolarHBondContact O-CB 3.35Å; V276-R280 PolarHBondContact O-N 3Å; C277-R280 WeakPolarHBondContact O-CB 3.23Å; C277-R280 PolarHBondContact O-N 3.32Å; E278-R280 PolarHBondContact O-N 2.7Å; R280-E282 VanDerWaalsContact C-N 3.34Å; R280-G283 PolarHBondContact O-N 3.02Å; R280-G283 VanDerWaalsContact O-N 3.17Å; R280-A285 WeakPolarHBondContact CA-O 3.15Å
281	E	91.8	Very high	90.6	Very high	169 Å²	169	65.3 Å²	65.3	79%	0.79	33%	0.332	S	S	*	.	H	α-helix	trans	-65.7	-36.7	177.7	-72.2	177.9	-176.1	0	0	112.2	C277 E278 G283	C277-E281 WeakPolarHBondContact O-CG 3.08Å; C277-E281 PolarHBondContact O-N 3.27Å; E278-E281 PolarHBondContact O-N 3.25Å; E278-E281 VanDerWaalsContact O-N 3.13Å; E281-G283 PolarHBondContact O-N 3.45Å
282	E	90.9	Very high	90.6	Very high	94 Å²	94	59.5 Å²	59.5	44%	0.439	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-10.3	174.3	-67.4	-176.4	131.1	0	0	113.6	E278 R280 K284	E278-E282 WeakPolarHBondContact O-CB 3.42Å; E278-E282 WeakPolarHBondContact O-CG 3.18Å; E278-E282 PolarHBondContact O-N 2.66Å; R280-E282 VanDerWaalsContact C-N 3.34Å; E282-K284 VanDerWaalsContact C-N 3.26Å; E282-K284 HydrophobicContact CB-CD 4.36Å; E282-K284 HydrophobicContact CB-CG 4.12Å; E282-K284 PolarHBondContact O-N 3.01Å; E282-K284 IonicContact OE1-NZ 2.86Å; E282-K284 PolarHBondContact OE1-NZ 3.19Å; E282-K284 VanDerWaalsContact OE1-NZ 3.11Å; E282-K284 VanDerWaalsContact OE2-CD 3.29Å; E282-K284 WeakPolarHBondContact OE2-CD 3.47Å; E282-K284 VanDerWaalsContact OE2-CE 3.23Å; E282-K284 WeakPolarHBondContact OE2-CE 3.43Å; E282-K284 IonicContact OE2-NZ 2.98Å; E282-K284 PolarHBondContact OE2-NZ 3.26Å
283	G	87.7	Confident	90.7	Very high	61 Å²	61	59.4 Å²	59.4	63%	0.629	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	14.4	-175.8	0	0	0	0	0	114.8	W279 R280 E281	W279-G283 PolarHBondContact O-N 3.14Å; R280-G283 PolarHBondContact O-N 3.02Å; R280-G283 VanDerWaalsContact O-N 3.17Å; E281-G283 PolarHBondContact O-N 3.45Å
284	K	87.6	Confident	90.9	Very high	114 Å²	114	57.1 Å²	57.1	50%	0.496	29%	0.292	S	S	.	.	S	Bend	trans	-79.6	-25.3	176.3	-66.5	-179.1	-170.9	151.3	0	112.7	K128 W279 E282	K128-K284 PolarHBondContact N-O 3.45Å; W279-K284 HydrophobicContact CB-CB 4.47Å; W279-K284 PolarHBondContact O-N 2.95Å; E282-K284 VanDerWaalsContact C-N 3.26Å; E282-K284 HydrophobicContact CB-CD 4.36Å; E282-K284 HydrophobicContact CB-CG 4.12Å; E282-K284 PolarHBondContact O-N 3.01Å; E282-K284 IonicContact OE1-NZ 2.86Å; E282-K284 PolarHBondContact OE1-NZ 3.19Å; E282-K284 VanDerWaalsContact OE1-NZ 3.11Å; E282-K284 VanDerWaalsContact OE2-CD 3.29Å; E282-K284 WeakPolarHBondContact OE2-CD 3.47Å; E282-K284 VanDerWaalsContact OE2-CE 3.23Å; E282-K284 WeakPolarHBondContact OE2-CE 3.43Å; E282-K284 IonicContact OE2-NZ 2.98Å; E282-K284 PolarHBondContact OE2-NZ 3.26Å
285	A	91	Very high	91	Very high	10 Å²	10	56 Å²	56	8%	0.083	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.7	179.1	0	0	0	0	0	112.3	V125 R126 I127 W279 R280	V125-A285 HydrophobicContact CG1-CB 3.8Å; R126-A285 CarbonylContact O-C 3.37Å; R126-A285 VanDerWaalsContact O-CA 3.28Å; R126-A285 WeakPolarHBondContact O-CA 3.24Å; I127-A285 HydrophobicContact CG1-CB 4.32Å; W279-A285 HydrophobicContact CB-CB 3.73Å; W279-A285 PolarHBondContact O-N 3.37Å; W279-A285 VanDerWaalsContact O-N 3.08Å; R280-A285 WeakPolarHBondContact CA-O 3.15Å
286	E	90.2	Very high	91.1	Very high	94 Å²	94	55 Å²	55	44%	0.439	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.8	173.3	-179.9	-176.5	-160.3	0	0	108.8	R126	R126-E286 HydrophobicContact CB-CB 4.35Å; R126-E286 PolarHBondContact N-O 3.47Å; R126-E286 IonicContact NH1-OE2 3.24Å; R126-E286 PolarHBondContact NH1-OE2 3.07Å; R126-E286 PolarHBondContact O-N 3.44Å
287	I	89.1	Confident	91.3	Very high	28 Å²	28	54.9 Å²	54.9	14%	0.144	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	124.6	175.4	-55.6	176.7	0	0	0	108	I123 V276 P289 L316	I123-I287 HydrophobicContact CG2-CG2 3.84Å; V276-I287 HydrophobicContact CG1-CD1 3.77Å; V276-I287 HydrophobicContact CG1-CG1 3.91Å; I287-P289 WeakPolarHBondContact O-CD 3.21Å; I287-L316 HydrophobicContact CD1-CD2 3.66Å; I287-L316 HydrophobicContact CG2-CD2 4.36Å
288	I	87.3	Confident	91.4	Very high	17 Å²	17	53.2 Å²	53.2	9%	0.087	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	108.5	177	-55.9	174.5	0	0	0	107.7	T94 G124 R126 T237 G290	T94-I288 HydrophobicContact CG2-CG2 4.31Å; G124-I288 PolarHBondContact N-O 3.35Å; G124-I288 PolarHBondContact O-N 3.07Å; R126-I288 HydrophobicContact CB-CD1 3.74Å; R126-I288 HydrophobicContact CB-CG1 4.28Å; T237-I288 HydrophobicContact CG2-CD1 4.38Å; I288-G290 PolarHBondContact O-N 3.47Å
289	P	83.3	Confident	91.5	Very high	49 Å²	49	51.3 Å²	51.3	32%	0.318	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	118.6	170.9	28.3	-31.5	0	0	0	108.3	I287	I287-P289 WeakPolarHBondContact O-CD 3.21Å
290	G	88.5	Confident	91.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.			trans	-93	-160.7	174.7	0	0	0	0	0	112.6	P95 A122 I288 P318 V319	P95-G290 CarbonylContact O-C 3.51Å; P95-G290 WeakPolarHBondContact O-CA 3.35Å; A122-G290 CarbonylContact O-C 3.56Å; A122-G290 WeakPolarHBondContact O-CA 3.31Å; A122-G290 PolarHBondContact O-N 3.34Å; I288-G290 PolarHBondContact O-N 3.47Å; G290-P318 WeakPolarHBondContact O-CB 3.4Å; G290-V319 PolarHBondContact O-N 3.48Å; G290-V319 VanDerWaalsContact O-N 3.1Å
291	V	90.5	Very high	91.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.7	179.7	176.8	0	0	0	0	109.7	I59 L90 P95 F96 T97 V319 I321	I59-V291 HydrophobicContact CD1-CG2 3.7Å; I59-V291 HydrophobicContact CG1-CG2 4.49Å; I59-V291 HydrophobicContact CG2-CG2 4.44Å; L90-V291 HydrophobicContact CD1-CB 4.49Å; L90-V291 HydrophobicContact CD1-CG2 3.46Å; L90-V291 VanDerWaalsContact CD1-CG2 3.46Å; P95-V291 PolarHBondContact O-N 3.32Å; F96-V291 WeakPolarHBondContact CA-O 3.29Å; F96-V291 HydrophobicContact CD2-CB 3.83Å; F96-V291 HydrophobicContact CD2-CG1 3.86Å; F96-V291 HydrophobicContact CE2-CB 4.32Å; F96-V291 HydrophobicContact CE2-CG1 3.82Å; T97-V291 PolarHBondContact N-O 2.95Å; V291-V319 WeakPolarHBondContact CA-O 3.4Å; V291-I321 HydrophobicContact CG1-CB 4.5Å; V291-I321 HydrophobicContact CG1-CD1 3.65Å; V291-I321 HydrophobicContact CG1-CG1 3.9Å
292	L	94.3	Very high	91.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	114.8	168.4	176.8	59.1	0	0	0	108.6	T97 A118 F119 A122 I294 P318 V319 L320 I321	T97-L292 HydrophobicContact CG2-CD1 3.95Å; A118-L292 HydrophobicContact CB-CD1 3.93Å; A118-L292 HydrophobicContact CB-CD2 4.38Å; F119-L292 HydrophobicContact CD2-CD2 3.41Å; F119-L292 VanDerWaalsContact CD2-CD2 3.41Å; F119-L292 HydrophobicContact CE2-CD2 3.38Å; F119-L292 HydrophobicContact CG-CD2 4.04Å; F119-L292 HydrophobicContact CZ-CD2 3.99Å; A122-L292 HydrophobicContact CB-CB 3.91Å; L292-I294 HydrophobicContact CD2-CD1 4.43Å; L292-I294 HydrophobicContact CG-CG1 4.24Å; L292-P318 HydrophobicContact CB-CG 4.35Å; L292-V319 PolarHBondContact N-O 3.39Å; L292-L320 HydrophobicContact CB-CD1 4.26Å; L292-L320 HydrophobicContact CD2-CD1 4Å; L292-L320 HydrophobicContact CG-CD1 3.97Å; L292-L320 CarbonylContact O-C 3.56Å; L292-L320 WeakPolarHBondContact O-CA 3.49Å; L292-I321 PolarHBondContact O-N 3.26Å
293	F	95.9	Very high	92.1	Very high	7 Å²	7	37.6 Å²	37.6	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	122.5	174.6	176.5	-111.5	0	0	0	110.8	T80 A83 F96 T97 A98 L99 D295 I321 A323	T80-F293 HydrophobicContact CG2-CE1 3.92Å; T80-F293 HydrophobicContact CG2-CZ 4.2Å; A83-F293 HydrophobicContact CB-CD1 4.44Å; A83-F293 HydrophobicContact CB-CD2 3.48Å; A83-F293 VanDerWaalsContact CB-CD2 3.48Å; A83-F293 HydrophobicContact CB-CE1 4.44Å; A83-F293 HydrophobicContact CB-CE2 3.47Å; A83-F293 VanDerWaalsContact CB-CE2 3.47Å; A83-F293 HydrophobicContact CB-CG 3.99Å; A83-F293 HydrophobicContact CB-CZ 3.99Å; F96-F293 HydrophobicContact CE1-CB 4.4Å; F96-F293 HydrophobicContact CE2-CB 3.91Å; F96-F293 HydrophobicContact CZ-CB 3.56Å; F96-F293 HydrophobicContact CZ-CD1 4.43Å; F96-F293 HydrophobicContact CZ-CG 4.15Å; T97-F293 PolarHBondContact O-N 3.2Å; A98-F293 CarbonylContact C-O 3.56Å; A98-F293 WeakPolarHBondContact CA-O 3.46Å; A98-F293 HydrophobicContact CB-CD1 4.12Å; L99-F293 PolarHBondContact N-O 2.72Å; F293-D295 HydrophobicContact CE1-CB 3.72Å; F293-D295 HydrophobicContact CZ-CB 3.9Å; F293-I321 CarbonylContact C-O 3.56Å; F293-I321 VanDerWaalsContact CA-O 3.22Å; F293-I321 WeakPolarHBondContact CA-O 3.37Å; F293-I321 HydrophobicContact CD2-CB 4.11Å; F293-I321 HydrophobicContact CD2-CG2 3.86Å; F293-I321 WeakPolarHBondContact CD2-O 3.07Å; F293-I321 HydrophobicContact CE2-CG2 4.29Å; F293-A323 HydrophobicContact CE2-CB 3.8Å; F293-A323 HydrophobicContact CZ-CB 3.86Å
294	I	96.3	Very high	92.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	109.5	173.9	-55	-178.7	0	0	0	109.5	L99 L115 L292 V297 L308 L320 I321 M322 A323	L99-I294 CarbonylContact O-C 3.55Å; L99-I294 VanDerWaalsContact O-CA 3.28Å; L99-I294 WeakPolarHBondContact O-CA 3.42Å; L115-I294 HydrophobicContact CD2-CD1 4.35Å; L292-I294 HydrophobicContact CD2-CD1 4.43Å; L292-I294 HydrophobicContact CG-CG1 4.24Å; I294-V297 HydrophobicContact CG2-CB 4.42Å; I294-V297 HydrophobicContact CG2-CG2 4.44Å; I294-L308 HydrophobicContact CD1-CD2 4.42Å; I294-L320 HydrophobicContact CD1-CD1 3.78Å; I294-L320 HydrophobicContact CG1-CD1 3.97Å; I294-I321 PolarHBondContact N-O 3.18Å; I294-M322 HydrophobicContact CB-CG 4.35Å; I294-M322 CarbonylContact O-C 3.55Å; I294-M322 WeakPolarHBondContact O-CA 3.45Å; I294-A323 PolarHBondContact O-N 3Å
295	D	95.2	Very high	92.8	Very high	39 Å²	39	29.4 Å²	29.4	21%	0.209	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	153.9	171.6	-148.6	-13.9	0	0	0	111.1	T80 L99 G101 F293 V297	T80-D295 PolarHBondContact OG1-OD2 2.84Å; L99-D295 PolarHBondContact O-N 3.5Å; G101-D295 PolarHBondContact N-O 2.9Å; F293-D295 HydrophobicContact CE1-CB 3.72Å; F293-D295 HydrophobicContact CZ-CB 3.9Å; D295-V297 VanDerWaalsContact C-N 3.3Å; D295-V297 PolarHBondContact O-N 3.32Å
296	E	94.1	Very high	92.9	Very high	81 Å²	81	32.5 Å²	32.5	38%	0.379	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	45.1	-179.7	-56.3	-167	147.3	0	0	113.9	H298 M299 A323	E296-H298 PolarHBondContact O-N 3.2Å; E296-M299 HydrophobicContact CB-CG 4.15Å; E296-M299 VanDerWaalsContact O-CB 3.28Å; E296-M299 WeakPolarHBondContact O-CB 3.23Å; E296-M299 WeakPolarHBondContact O-CG 3.48Å; E296-M299 PolarHBondContact O-N 3.2Å; E296-A323 PolarHBondContact N-O 2.76Å
297	V	95.8	Very high	93.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-56.5	-24.5	-175.1	72.6	0	0	0	0	114.2	L70 I294 D295 M299 L300 F305 M322 A323 I342	L70-V297 HydrophobicContact CD1-CG1 4.19Å; I294-V297 HydrophobicContact CG2-CB 4.42Å; I294-V297 HydrophobicContact CG2-CG2 4.44Å; D295-V297 VanDerWaalsContact C-N 3.3Å; D295-V297 PolarHBondContact O-N 3.32Å; V297-M299 PolarHBondContact O-N 2.96Å; V297-M299 VanDerWaalsContact O-N 3.07Å; V297-L300 HydrophobicContact CG2-CD1 3.74Å; V297-L300 HydrophobicContact CG2-CG 4.2Å; V297-L300 VanDerWaalsContact O-CB 3.31Å; V297-L300 WeakPolarHBondContact O-CB 3.41Å; V297-L300 VanDerWaalsContact O-CG 3.28Å; V297-L300 WeakPolarHBondContact O-CG 3.49Å; V297-L300 PolarHBondContact O-N 3.06Å; V297-F305 HydrophobicContact CG2-CE1 3.89Å; V297-F305 HydrophobicContact CG2-CZ 4.31Å; V297-M322 HydrophobicContact CB-CB 4.13Å; V297-M322 HydrophobicContact CB-CG 4.49Å; V297-M322 HydrophobicContact CG1-CB 4.2Å; V297-M322 HydrophobicContact CG2-CB 4.2Å; V297-M322 HydrophobicContact CG2-CG 4.07Å; V297-M322 HydrophobicContact CG2-SD 3.61Å; V297-A323 PolarHBondContact N-O 2.63Å; V297-I342 HydrophobicContact CG1-CD1 3.88Å; V297-I342 HydrophobicContact CG1-CG1 4.29Å
298	H	94.6	Very high	93.4	Very high	13 Å²	13	28 Å²	28	6%	0.06	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-63.5	-11.4	174.6	61.8	-87	0	0	0	113.7	E296 L300 T324 N325 R326 T329 H340	E296-H298 PolarHBondContact O-N 3.2Å; H298-L300 VanDerWaalsContact C-N 3.31Å; H298-T324 PolarHBondContact ND1-OG1 2.77Å; H298-N325 PolarHBondContact CE1-OD1 2.82Å; H298-R326 HydrophobicContact CB-CB 4.4Å; H298-R326 HydrophobicContact CB-CG 4.25Å; H298-R326 VanDerWaalsContact CD2-CG 3.46Å; H298-R326 WeakPolarHBondContact CD2-CG 3.39Å; H298-T329 HydrophobicContact CB-CG2 4.17Å; H298-H340 WeakPolarHBondContact CB-O 3.28Å
299	M	94.4	Very high	93.6	Very high	61 Å²	61	27.9 Å²	27.9	30%	0.3	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-81.2	-10	173.1	-66.8	-60.6	-70.1	0	0	113.3	F105 E296 V297 R332	F105-M299 WeakPolarHBondContact CE2-O 3.5Å; F105-M299 WeakPolarHBondContact CZ-O 3.05Å; E296-M299 HydrophobicContact CB-CG 4.15Å; E296-M299 VanDerWaalsContact O-CB 3.28Å; E296-M299 WeakPolarHBondContact O-CB 3.23Å; E296-M299 WeakPolarHBondContact O-CG 3.48Å; E296-M299 PolarHBondContact O-N 3.2Å; V297-M299 PolarHBondContact O-N 2.96Å; V297-M299 VanDerWaalsContact O-N 3.07Å; M299-R332 WeakPolarHBondContact O-CD 3.39Å; M299-R332 PolarHBondContact O-NH1 2.82Å
300	L	95.4	Very high	93.9	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.163	C	C	.	.			trans	-73.6	155.5	174.5	-57.4	-169.8	0	0	0	111.8	G101 I104 V297 H298 C304 F305 L308	G101-L300 WeakPolarHBondContact O-CD2 3.41Å; I104-L300 HydrophobicContact CD1-CD2 3.37Å; V297-L300 HydrophobicContact CG2-CD1 3.74Å; V297-L300 HydrophobicContact CG2-CG 4.2Å; V297-L300 VanDerWaalsContact O-CB 3.31Å; V297-L300 WeakPolarHBondContact O-CB 3.41Å; V297-L300 VanDerWaalsContact O-CG 3.28Å; V297-L300 WeakPolarHBondContact O-CG 3.49Å; V297-L300 PolarHBondContact O-N 3.06Å; H298-L300 VanDerWaalsContact C-N 3.31Å; L300-C304 HydrophobicContact CB-CB 4Å; L300-C304 HydrophobicContact CD1-CB 4.3Å; L300-C304 HydrophobicContact CD2-CB 4.5Å; L300-F305 HydrophobicContact CB-CD2 4.49Å; L300-F305 HydrophobicContact CB-CE1 4.23Å; L300-F305 HydrophobicContact CB-CE2 3.92Å; L300-F305 HydrophobicContact CB-CZ 3.79Å; L300-F305 HydrophobicContact CD1-CE1 4.26Å; L300-L308 HydrophobicContact CD1-CD1 3.86Å
301	D	94.6	Very high	94	Very high	19 Å²	19	34.7 Å²	34.7	10%	0.102	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-101	172.8	173.9	64.5	22.7	0	0	0	112.7	K111 E303 C304 F305 R332	K111-D301 WeakPolarHBondContact CD-OD2 3.34Å; K111-D301 IonicContact NZ-OD1 3.69Å; K111-D301 IonicContact NZ-OD2 3.47Å; K111-D301 PolarHBondContact NZ-OD2 2.8Å; D301-E303 PolarHBondContact O-N 2.97Å; D301-E303 PolarHBondContact OD1-N 2.79Å; D301-C304 WeakPolarHBondContact O-CB 3.06Å; D301-C304 PolarHBondContact O-N 3.49Å; D301-C304 PolarHBondContact OD1-N 2.86Å; D301-C304 PolarHBondContact OD1-SG 3.39Å; D301-F305 WeakPolarHBondContact O-CD2 3.28Å; D301-F305 PolarHBondContact O-N 3.37Å; D301-F305 VanDerWaalsContact O-N 3.13Å; D301-R332 WeakPolarHBondContact CA-O 3.44Å; D301-R332 HydrophobicContact CB-CB 4.09Å; D301-R332 WeakPolarHBondContact CB-O 3.44Å
302	M	93.9	Very high	94	Very high	73 Å²	73	35.3 Å²	35.3	36%	0.36	17%	0.172	S	C	.	.	H	α-helix	trans	-58	-34.2	-178.4	-169.4	66.4	-163.8	0	0	113.3	F305 S306 I331 R332 T334 P343	M302-F305 PolarHBondContact O-N 3.26Å; M302-S306 WeakPolarHBondContact O-CB 3.07Å; M302-S306 PolarHBondContact O-N 2.94Å; M302-I331 HydrophobicContact SD-CG2 4.38Å; M302-R332 PolarHBondContact N-O 2.98Å; M302-R332 VanDerWaalsContact N-O 3.15Å; M302-T334 HydrophobicContact CB-CG2 3.89Å; M302-T334 HydrophobicContact CG-CG2 4.12Å; M302-T334 HydrophobicContact SD-CG2 4.37Å; M302-P343 HydrophobicContact CE-CB 4.2Å; M302-P343 HydrophobicContact CE-CG 4.17Å; M302-P343 HydrophobicContact SD-CB 4.06Å; M302-P343 HydrophobicContact SD-CG 3.73Å
303	E	93.9	Very high	93.6	Very high	124 Å²	124	41.1 Å²	41.1	58%	0.579	20%	0.2	S	C	*	.	H	α-helix	trans	-67.5	-42.1	178.6	-67.6	175.5	-174.3	0	0	111.1	K111 D301 S306 F307	K111-E303 VanDerWaalsContact CE-OE2 3.28Å; K111-E303 WeakPolarHBondContact CE-OE2 3.12Å; K111-E303 IonicContact NZ-OE2 3.8Å; K111-E303 PolarHBondContact NZ-OE2 2.98Å; D301-E303 PolarHBondContact O-N 2.97Å; D301-E303 PolarHBondContact OD1-N 2.79Å; E303-S306 PolarHBondContact O-N 2.89Å; E303-F307 PolarHBondContact O-N 3.48Å
304	C	95.6	Very high	93.1	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-45.7	173.6	-65.5	0	0	0	0	111.3	L115 L300 D301 S306 F307 L308	L115-C304 HydrophobicContact CD1-CB 3.76Å; L300-C304 HydrophobicContact CB-CB 4Å; L300-C304 HydrophobicContact CD1-CB 4.3Å; L300-C304 HydrophobicContact CD2-CB 4.5Å; D301-C304 WeakPolarHBondContact O-CB 3.06Å; D301-C304 PolarHBondContact O-N 3.49Å; D301-C304 PolarHBondContact OD1-N 2.86Å; D301-C304 PolarHBondContact OD1-SG 3.39Å; C304-S306 PolarHBondContact O-N 2.99Å; C304-F307 WeakPolarHBondContact O-CB 3.35Å; C304-F307 PolarHBondContact O-N 2.84Å; C304-L308 VanDerWaalsContact O-CG 3.31Å; C304-L308 WeakPolarHBondContact O-CG 3.17Å; C304-L308 PolarHBondContact O-N 3.46Å
305	F	95.3	Very high	92.3	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-39.7	178.6	-69.9	-59.1	0	0	0	113	V297 L300 D301 M302 F307 L308 N309 I331 G341 I342 P343 L346	V297-F305 HydrophobicContact CG2-CE1 3.89Å; V297-F305 HydrophobicContact CG2-CZ 4.31Å; L300-F305 HydrophobicContact CB-CD2 4.49Å; L300-F305 HydrophobicContact CB-CE1 4.23Å; L300-F305 HydrophobicContact CB-CE2 3.92Å; L300-F305 HydrophobicContact CB-CZ 3.79Å; L300-F305 HydrophobicContact CD1-CE1 4.26Å; D301-F305 WeakPolarHBondContact O-CD2 3.28Å; D301-F305 PolarHBondContact O-N 3.37Å; D301-F305 VanDerWaalsContact O-N 3.13Å; M302-F305 PolarHBondContact O-N 3.26Å; F305-F307 VanDerWaalsContact C-N 3.33Å; F305-F307 PolarHBondContact O-N 3.19Å; F305-L308 HydrophobicContact CD1-CD1 4.22Å; F305-L308 PolarHBondContact O-N 3Å; F305-N309 PolarHBondContact O-N 2.81Å; F305-I331 HydrophobicContact CD2-CG2 4.22Å; F305-I331 HydrophobicContact CE2-CG2 4.2Å; F305-G341 WeakPolarHBondContact CE2-O 3.31Å; F305-G341 WeakPolarHBondContact CZ-O 3.31Å; F305-I342 HydrophobicContact CE1-CB 4.47Å; F305-I342 HydrophobicContact CE1-CG1 4.07Å; F305-I342 HydrophobicContact CE1-CG2 4.23Å; F305-I342 HydrophobicContact CZ-CG1 4.08Å; F305-P343 HydrophobicContact CB-CG 3.7Å; F305-P343 VanDerWaalsContact CD2-CD 3.5Å; F305-P343 HydrophobicContact CD2-CG 3.85Å; F305-P343 HydrophobicContact CG-CG 3.82Å; F305-L346 HydrophobicContact CD1-CD2 3.56Å; F305-L346 HydrophobicContact CE1-CD2 4.19Å; F305-L346 HydrophobicContact CG-CD2 4.49Å
306	S	93.6	Very high	91.6	Very high	76 Å²	76	50.6 Å²	50.6	53%	0.531	26%	0.255	S	S	.	.	H	α-helix	trans	-62.1	-41.2	174.3	-177	0	0	0	0	111.7	M302 E303 C304 R310	M302-S306 WeakPolarHBondContact O-CB 3.07Å; M302-S306 PolarHBondContact O-N 2.94Å; E303-S306 PolarHBondContact O-N 2.89Å; C304-S306 PolarHBondContact O-N 2.99Å; S306-R310 PolarHBondContact O-N 3.44Å
307	F	94.1	Very high	91.3	Very high	27 Å²	27	47 Å²	47	12%	0.118	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-47.2	173.3	176.9	-88.4	0	0	0	112.1	T112 L115 F119 E303 C304 F305 N309 R310 A311	T112-F307 HydrophobicContact CG2-CB 4.43Å; T112-F307 HydrophobicContact CG2-CD2 4.09Å; T112-F307 HydrophobicContact CG2-CG 4.46Å; L115-F307 HydrophobicContact CB-CD1 3.75Å; L115-F307 HydrophobicContact CB-CE1 3.59Å; L115-F307 HydrophobicContact CB-CZ 4.38Å; L115-F307 HydrophobicContact CD1-CD1 3.87Å; L115-F307 HydrophobicContact CD1-CG 4.45Å; L115-F307 HydrophobicContact CG-CD1 4.41Å; F119-F307 HydrophobicContact CD2-CE1 4.44Å; E303-F307 PolarHBondContact O-N 3.48Å; C304-F307 WeakPolarHBondContact O-CB 3.35Å; C304-F307 PolarHBondContact O-N 2.84Å; F305-F307 VanDerWaalsContact C-N 3.33Å; F305-F307 PolarHBondContact O-N 3.19Å; F307-N309 VanDerWaalsContact C-N 3.32Å; F307-N309 PolarHBondContact O-N 3.49Å; F307-R310 PolarHBondContact O-N 3.21Å; F307-A311 HydrophobicContact CD1-CB 4.4Å; F307-A311 HydrophobicContact CE1-CB 4.03Å; F307-A311 HydrophobicContact CZ-CB 4.47Å; F307-A311 WeakPolarHBondContact O-CB 3.28Å; F307-A311 PolarHBondContact O-N 2.96Å
308	L	93.8	Very high	91.1	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-58.2	-43.9	179.1	-71.7	175.6	0	0	0	111.6	L115 F119 I294 L300 C304 F305 R310 A311 L312 L320	L115-L308 HydrophobicContact CD2-CD2 4.12Å; F119-L308 HydrophobicContact CE2-CD2 3.36Å; F119-L308 HydrophobicContact CZ-CD2 3.63Å; I294-L308 HydrophobicContact CD1-CD2 4.42Å; L300-L308 HydrophobicContact CD1-CD1 3.86Å; C304-L308 VanDerWaalsContact O-CG 3.31Å; C304-L308 WeakPolarHBondContact O-CG 3.17Å; C304-L308 PolarHBondContact O-N 3.46Å; F305-L308 HydrophobicContact CD1-CD1 4.22Å; F305-L308 PolarHBondContact O-N 3Å; L308-R310 VanDerWaalsContact C-N 3.31Å; L308-R310 PolarHBondContact O-N 3.44Å; L308-A311 PolarHBondContact O-N 3.21Å; L308-L312 WeakPolarHBondContact O-CB 3.5Å; L308-L312 VanDerWaalsContact O-CG 3.28Å; L308-L312 WeakPolarHBondContact O-CG 3.13Å; L308-L312 PolarHBondContact O-N 3.36Å; L308-L320 HydrophobicContact CD2-CD2 4.22Å
309	N	91.5	Very high	90.9	Very high	14 Å²	14	46.6 Å²	46.6	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-45	177.1	-91.9	-27.9	0	0	0	112.4	F305 F307 D345 L346 R349	F305-N309 PolarHBondContact O-N 2.81Å; F307-N309 VanDerWaalsContact C-N 3.32Å; F307-N309 PolarHBondContact O-N 3.49Å; N309-D345 PolarHBondContact ND2-OD2 2.93Å; N309-L346 WeakPolarHBondContact OD1-CD1 3.31Å; N309-R349 PolarHBondContact O-NH1 3.45Å
310	R	91.1	Very high	90.8	Very high	176 Å²	176	43.7 Å²	43.7	66%	0.664	22%	0.223	S	C	*	.	H	α-helix	trans	-70.4	-39.8	176.9	-170.7	-176.8	69.6	169.5	2	112.2	S306 F307 L308 L312 E313	S306-R310 PolarHBondContact O-N 3.44Å; F307-R310 PolarHBondContact O-N 3.21Å; L308-R310 VanDerWaalsContact C-N 3.31Å; L308-R310 PolarHBondContact O-N 3.44Å; R310-L312 VanDerWaalsContact C-N 3.3Å; R310-L312 PolarHBondContact O-N 3.21Å; R310-E313 PolarHBondContact O-N 3.35Å
311	A	90.4	Very high	90.8	Very high	16 Å²	16	43.7 Å²	43.7	13%	0.132	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-30.2	-178.3	0	0	0	0	0	112.7	F119 F307 L308 E313 S314 S317	F119-A311 HydrophobicContact CD1-CB 4.14Å; F119-A311 HydrophobicContact CE1-CB 3.79Å; F119-A311 HydrophobicContact CE2-CB 4.43Å; F119-A311 HydrophobicContact CZ-CB 3.94Å; F307-A311 HydrophobicContact CD1-CB 4.4Å; F307-A311 HydrophobicContact CE1-CB 4.03Å; F307-A311 HydrophobicContact CZ-CB 4.47Å; F307-A311 WeakPolarHBondContact O-CB 3.28Å; F307-A311 PolarHBondContact O-N 2.96Å; L308-A311 PolarHBondContact O-N 3.21Å; A311-E313 VanDerWaalsContact C-N 3.26Å; A311-E313 PolarHBondContact O-N 3.44Å; A311-S314 PolarHBondContact O-N 3.19Å; A311-S317 VanDerWaalsContact O-CB 3.28Å; A311-S317 WeakPolarHBondContact O-CB 3.31Å; A311-S317 PolarHBondContact O-OG 2.96Å
312	L	89.9	Confident	90.9	Very high	13 Å²	13	42.8 Å²	42.8	7%	0.068	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-16.6	174.9	-71.2	170	0	0	0	113.4	G66 A68 L308 R310 S314 L320 L346	G66-L312 WeakPolarHBondContact CA-O 3.47Å; A68-L312 HydrophobicContact CB-CD1 3.7Å; A68-L312 HydrophobicContact CB-CD2 4.02Å; L308-L312 WeakPolarHBondContact O-CB 3.5Å; L308-L312 VanDerWaalsContact O-CG 3.28Å; L308-L312 WeakPolarHBondContact O-CG 3.13Å; L308-L312 PolarHBondContact O-N 3.36Å; R310-L312 VanDerWaalsContact C-N 3.3Å; R310-L312 PolarHBondContact O-N 3.21Å; L312-S314 VanDerWaalsContact C-N 3.28Å; L312-S314 PolarHBondContact O-N 2.9Å; L312-L320 HydrophobicContact CD1-CD2 4.09Å; L312-L320 HydrophobicContact CD2-CB 3.89Å; L312-L320 HydrophobicContact CD2-CD2 4.09Å; L312-L320 HydrophobicContact CG-CD2 4.41Å; L312-L346 HydrophobicContact CD1-CD1 3.9Å
313	E	87	Confident	91.1	Very high	122 Å²	122	39.3 Å²	39.3	57%	0.57	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-6.8	177.3	-68.9	172.1	-175.9	0	0	113	R310 A311 R349	R310-E313 PolarHBondContact O-N 3.35Å; A311-E313 VanDerWaalsContact C-N 3.26Å; A311-E313 PolarHBondContact O-N 3.44Å; E313-R349 IonicContact OE1-CZ 3.37Å; E313-R349 IonicContact OE1-NH1 2.69Å; E313-R349 PolarHBondContact OE1-NH1 3.41Å; E313-R349 IonicContact OE1-NH2 3.11Å; E313-R349 PolarHBondContact OE1-NH2 2.97Å
314	S	85	Confident	91.1	Very high	62 Å²	62	33.5 Å²	33.5	43%	0.434	17%	0.174	S	C	.	.	S	Bend	trans	-80.3	139	179.2	-175.6	0	0	0	0	112.4	A311 L312 L316 S317	A311-S314 PolarHBondContact O-N 3.19Å; L312-S314 VanDerWaalsContact C-N 3.28Å; L312-S314 PolarHBondContact O-N 2.9Å; S314-L316 PolarHBondContact O-N 3.29Å; S314-S317 WeakPolarHBondContact O-CB 3.47Å; S314-S317 PolarHBondContact O-N 3.49Å
315	D	78.8	Confident	91	Very high	145 Å²	145	35.8 Å²	35.8	78%	0.775	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.8	177.1	-59.8	-28.1	0	0	0	113.9	A65 S317	A65-D315 WeakPolarHBondContact CB-O 3.48Å; D315-S317 VanDerWaalsContact C-N 3.32Å
316	L	80.1	Confident	90.8	Very high	39 Å²	39	42.4 Å²	42.4	20%	0.204	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	6.9	178	-60.2	179.3	0	0	0	112.4	I123 I287 S314	I123-L316 WeakPolarHBondContact CD1-O 3.37Å; I123-L316 WeakPolarHBondContact CG1-O 3.41Å; I287-L316 HydrophobicContact CD1-CD2 3.66Å; I287-L316 HydrophobicContact CG2-CD2 4.36Å; S314-L316 PolarHBondContact O-N 3.29Å
317	S	87.9	Confident	90.6	Very high	5 Å²	5	41.1 Å²	41.1	4%	0.035	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-68.5	126.3	-174.8	-160.7	0	0	0	0	111	G66 A311 S314 D315	G66-S317 PolarHBondContact N-O 3.38Å; A311-S317 VanDerWaalsContact O-CB 3.28Å; A311-S317 WeakPolarHBondContact O-CB 3.31Å; A311-S317 PolarHBondContact O-OG 2.96Å; S314-S317 WeakPolarHBondContact O-CB 3.47Å; S314-S317 PolarHBondContact O-N 3.49Å; D315-S317 VanDerWaalsContact C-N 3.32Å
318	P	91.2	Very high	90.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-66.7	164.1	176.9	32.3	-35.6	0	0	0	110.2	F119 A122 I123 G290 L292 L320	F119-P318 HydrophobicContact CD1-CG 3.93Å; F119-P318 HydrophobicContact CE1-CG 4.36Å; A122-P318 HydrophobicContact CB-CB 3.9Å; A122-P318 HydrophobicContact CB-CG 3.88Å; I123-P318 HydrophobicContact CG1-CB 4.3Å; I123-P318 HydrophobicContact CG1-CG 4.28Å; G290-P318 WeakPolarHBondContact O-CB 3.4Å; L292-P318 HydrophobicContact CB-CG 4.35Å; P318-L320 PolarHBondContact O-N 3.15Å
319	V	90.8	Very high	90.6	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	120.9	173.4	176.4	0	0	0	0	109.1	I55 I59 G290 V291 L292 I321	I55-V319 HydrophobicContact CG2-CG1 4.48Å; I59-V319 HydrophobicContact CD1-CB 4.26Å; I59-V319 HydrophobicContact CD1-CG1 4.12Å; I59-V319 HydrophobicContact CD1-CG2 4.5Å; I59-V319 HydrophobicContact CG1-CB 3.96Å; I59-V319 HydrophobicContact CG1-CG1 4.1Å; I59-V319 HydrophobicContact CG1-CG2 3.66Å; G290-V319 PolarHBondContact O-N 3.48Å; G290-V319 VanDerWaalsContact O-N 3.1Å; V291-V319 WeakPolarHBondContact CA-O 3.4Å; L292-V319 PolarHBondContact N-O 3.39Å; V319-I321 HydrophobicContact CG1-CG1 4.42Å
320	L	93.8	Very high	90.8	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	119.9	-179.7	175.9	64.3	0	0	0	109.8	R67 A68 V69 L292 I294 L308 L312 P318 M322	R67-L320 PolarHBondContact O-N 3.13Å; R67-L320 VanDerWaalsContact O-N 3.09Å; A68-L320 CarbonylContact C-O 3.52Å; A68-L320 VanDerWaalsContact CA-O 3.23Å; A68-L320 WeakPolarHBondContact CA-O 3.44Å; A68-L320 HydrophobicContact CB-CB 3.93Å; A68-L320 HydrophobicContact CB-CD2 4.01Å; A68-L320 HydrophobicContact CB-CG 4.22Å; V69-L320 PolarHBondContact N-O 2.85Å; L292-L320 HydrophobicContact CB-CD1 4.26Å; L292-L320 HydrophobicContact CD2-CD1 4Å; L292-L320 HydrophobicContact CG-CD1 3.97Å; L292-L320 CarbonylContact O-C 3.56Å; L292-L320 WeakPolarHBondContact O-CA 3.49Å; I294-L320 HydrophobicContact CD1-CD1 3.78Å; I294-L320 HydrophobicContact CG1-CD1 3.97Å; L308-L320 HydrophobicContact CD2-CD2 4.22Å; L312-L320 HydrophobicContact CD1-CD2 4.09Å; L312-L320 HydrophobicContact CD2-CB 3.89Å; L312-L320 HydrophobicContact CD2-CD2 4.09Å; L312-L320 HydrophobicContact CG-CD2 4.41Å; P318-L320 PolarHBondContact O-N 3.15Å; L320-M322 HydrophobicContact CD1-CG 4.03Å; L320-M322 HydrophobicContact CD2-CE 4.05Å; L320-M322 HydrophobicContact CD2-CG 4.15Å; L320-M322 HydrophobicContact CD2-SD 3.78Å; L320-M322 HydrophobicContact CG-CE 4.45Å; L320-M322 HydrophobicContact CG-CG 3.88Å; L320-M322 HydrophobicContact CG-SD 4.2Å
321	I	95.4	Very high	90.9	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122	172.1	-56.3	-177.8	0	0	0	108.1	V69 I71 I86 V291 L292 F293 I294 V319	V69-I321 CarbonylContact O-C 3.59Å; V69-I321 WeakPolarHBondContact O-CA 3.41Å; I71-I321 HydrophobicContact CD1-CG2 3.79Å; I71-I321 HydrophobicContact CG1-CG2 4.09Å; I86-I321 HydrophobicContact CD1-CD1 3.59Å; I86-I321 HydrophobicContact CG2-CD1 4.31Å; V291-I321 HydrophobicContact CG1-CB 4.5Å; V291-I321 HydrophobicContact CG1-CD1 3.65Å; V291-I321 HydrophobicContact CG1-CG1 3.9Å; L292-I321 PolarHBondContact O-N 3.26Å; F293-I321 CarbonylContact C-O 3.56Å; F293-I321 VanDerWaalsContact CA-O 3.22Å; F293-I321 WeakPolarHBondContact CA-O 3.37Å; F293-I321 HydrophobicContact CD2-CB 4.11Å; F293-I321 HydrophobicContact CD2-CG2 3.86Å; F293-I321 WeakPolarHBondContact CD2-O 3.07Å; F293-I321 HydrophobicContact CE2-CG2 4.29Å; I294-I321 PolarHBondContact N-O 3.18Å; V319-I321 HydrophobicContact CG1-CG1 4.42Å
322	M	96.4	Very high	91	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	146	178.9	-63.7	178.2	-69.6	0	0	109.8	A68 V69 L70 I71 I294 V297 L320 L350	A68-M322 HydrophobicContact CB-CE 4.3Å; V69-M322 PolarHBondContact O-N 3.1Å; L70-M322 CarbonylContact C-O 3.6Å; L70-M322 WeakPolarHBondContact CA-O 3.17Å; L70-M322 HydrophobicContact CD1-CB 3.88Å; I71-M322 PolarHBondContact N-O 3.5Å; I294-M322 HydrophobicContact CB-CG 4.35Å; I294-M322 CarbonylContact O-C 3.55Å; I294-M322 WeakPolarHBondContact O-CA 3.45Å; V297-M322 HydrophobicContact CB-CB 4.13Å; V297-M322 HydrophobicContact CB-CG 4.49Å; V297-M322 HydrophobicContact CG1-CB 4.2Å; V297-M322 HydrophobicContact CG2-CB 4.2Å; V297-M322 HydrophobicContact CG2-CG 4.07Å; V297-M322 HydrophobicContact CG2-SD 3.61Å; L320-M322 HydrophobicContact CD1-CG 4.03Å; L320-M322 HydrophobicContact CD2-CE 4.05Å; L320-M322 HydrophobicContact CD2-CG 4.15Å; L320-M322 HydrophobicContact CD2-SD 3.78Å; L320-M322 HydrophobicContact CG-CE 4.45Å; L320-M322 HydrophobicContact CG-CG 3.88Å; L320-M322 HydrophobicContact CG-SD 4.2Å; M322-L350 HydrophobicContact CE-CD1 3.43Å; M322-L350 VanDerWaalsContact CE-CD1 3.43Å; M322-L350 HydrophobicContact CE-CD2 3.35Å; M322-L350 HydrophobicContact CE-CG 4.04Å
323	A	96.6	Very high	91.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.3	173	0	0	0	0	0	111.7	I71 K79 F293 I294 E296 V297	I71-A323 WeakPolarHBondContact O-CA 3.47Å; K79-A323 HydrophobicContact CB-CB 4.23Å; K79-A323 HydrophobicContact CD-CB 4.5Å; F293-A323 HydrophobicContact CE2-CB 3.8Å; F293-A323 HydrophobicContact CZ-CB 3.86Å; I294-A323 PolarHBondContact O-N 3Å; E296-A323 PolarHBondContact N-O 2.76Å; V297-A323 PolarHBondContact N-O 2.63Å
324	T	95.3	Very high	91.4	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	142	174.3	-169.4	0	0	0	0	111.2	L70 I71 A72 G73 K79 H298 R326 H340	L70-T324 HydrophobicContact CD1-CG2 3.93Å; L70-T324 HydrophobicContact CD2-CG2 4.38Å; L70-T324 HydrophobicContact CG-CG2 4.34Å; I71-T324 PolarHBondContact O-N 3.12Å; I71-T324 VanDerWaalsContact O-N 3.09Å; A72-T324 HydrophobicContact CB-CG2 4.01Å; G73-T324 PolarHBondContact N-O 2.67Å; K79-T324 VanDerWaalsContact CD-O 3.26Å; K79-T324 WeakPolarHBondContact CD-O 3.48Å; K79-T324 VanDerWaalsContact CE-O 3.23Å; K79-T324 WeakPolarHBondContact CE-O 3.48Å; H298-T324 PolarHBondContact ND1-OG1 2.77Å; T324-R326 PolarHBondContact OG1-N 3.04Å; T324-H340 HydrophobicContact CG2-CB 3.81Å
325	N	92.3	Very high	91.8	Very high	50 Å²	50	51.3 Å²	51.3	27%	0.267	28%	0.278	S	S	.	.			trans	-109.6	2.6	171.7	62.1	-8	0	0	0	112.4	G73 P75 H298	G73-N325 WeakPolarHBondContact O-CA 3.31Å; P75-N325 HydrophobicContact CG-CB 4.19Å; H298-N325 PolarHBondContact CE1-OD1 2.82Å
326	R	91.2	Very high	92.3	Very high	139 Å²	139	53.1 Å²	53.1	53%	0.525	28%	0.275	S	S	.	.			trans	-98.1	139	179.8	-63.1	-67	-175.8	165.7	-1.1	111	H298 T324 T329 H340	H298-R326 HydrophobicContact CB-CB 4.4Å; H298-R326 HydrophobicContact CB-CG 4.25Å; H298-R326 VanDerWaalsContact CD2-CG 3.46Å; H298-R326 WeakPolarHBondContact CD2-CG 3.39Å; T324-R326 PolarHBondContact OG1-N 3.04Å; R326-T329 HydrophobicContact CB-CG2 3.93Å; R326-T329 HydrophobicContact CG-CG2 4.38Å; R326-H340 PolarHBondContact O-ND1 2.83Å
327	G	91	Very high	93	Very high	50 Å²	50	58.1 Å²	58.1	52%	0.515	30%	0.298	S	S	.	.	S	Bend	trans	-81.4	-85.5	176.3	0	0	0	0	0	111.7	H340	G327-H340 WeakPolarHBondContact O-CA 3.36Å; G327-H340 PolarHBondContact O-N 2.89Å
328	I	93.1	Very high	93.3	Very high	127 Å²	127	58.2 Å²	58.2	65%	0.651	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.4	170.7	-63.2	172.2	0	0	0	107.2	Q337	I328-Q337 HydrophobicContact CG2-CB 4.06Å
329	T	94.1	Very high	93.5	Very high	37 Å²	37	61 Å²	61	23%	0.227	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	161.5	177	-172.6	0	0	0	0	110.6	H298 R326 Q337 S338	H298-T329 HydrophobicContact CB-CG2 4.17Å; R326-T329 HydrophobicContact CB-CG2 3.93Å; R326-T329 HydrophobicContact CG-CG2 4.38Å; T329-Q337 WeakPolarHBondContact O-CA 3.23Å; T329-S338 PolarHBondContact N-O 2.83Å; T329-S338 VanDerWaalsContact N-O 3.12Å; T329-S338 PolarHBondContact O-N 3.2Å; T329-S338 VanDerWaalsContact O-O 3.12Å
330	R	94.6	Very high	93.7	Very high	127 Å²	127	62.6 Å²	62.6	48%	0.479	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	134.7	176.3	-178.2	177.3	167.1	166.8	5.2	110.4	R332 T334 N335 Y336 Q337	R330-R332 PolarHBondContact O-N 3.41Å; R330-T334 PolarHBondContact NE-O 3.37Å; R330-T334 PolarHBondContact NH2-O 2.82Å; R330-N335 PolarHBondContact NH2-OD1 3.5Å; R330-Y336 WeakPolarHBondContact CA-O 3.43Å; R330-Q337 HydrophobicContact CB-CG 4.49Å
331	I	94.7	Very high	93.6	Very high	10 Å²	10	62.6 Å²	62.6	5%	0.051	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-73.6	122.3	170.2	-55.2	166	0	0	0	107.6	M302 F305 G333 T334 Y336 S338 P343	M302-I331 HydrophobicContact SD-CG2 4.38Å; F305-I331 HydrophobicContact CD2-CG2 4.22Å; F305-I331 HydrophobicContact CE2-CG2 4.2Å; I331-G333 PolarHBondContact O-N 3.24Å; I331-T334 HydrophobicContact CB-CG2 4.45Å; I331-T334 HydrophobicContact CG2-CG2 4.29Å; I331-T334 PolarHBondContact O-N 3.11Å; I331-T334 VanDerWaalsContact O-N 3.1Å; I331-T334 PolarHBondContact O-OG1 2.76Å; I331-Y336 PolarHBondContact N-O 3.21Å; I331-S338 WeakPolarHBondContact CD1-OG 3.39Å; I331-S338 VanDerWaalsContact CG1-OG 3.24Å; I331-S338 WeakPolarHBondContact CG1-OG 3.27Å; I331-P343 HydrophobicContact CD1-CB 3.81Å; I331-P343 HydrophobicContact CD1-CG 4.27Å
332	R	92.6	Very high	93.6	Very high	105 Å²	105	62.5 Å²	62.5	40%	0.396	32%	0.323	S	S	.	.	B	Isolated β-bridge	trans	-61.9	139.9	-178	-60.6	-177.6	76.3	-169.5	2.4	110.4	M299 D301 M302 R330 T334	M299-R332 WeakPolarHBondContact O-CD 3.39Å; M299-R332 PolarHBondContact O-NH1 2.82Å; D301-R332 WeakPolarHBondContact CA-O 3.44Å; D301-R332 HydrophobicContact CB-CB 4.09Å; D301-R332 WeakPolarHBondContact CB-O 3.44Å; M302-R332 PolarHBondContact N-O 2.98Å; M302-R332 VanDerWaalsContact N-O 3.15Å; R330-R332 PolarHBondContact O-N 3.41Å; R332-T334 VanDerWaalsContact C-N 3.3Å
333	G	91.9	Very high	93.5	Very high	78 Å²	78	62.9 Å²	62.9	80%	0.804	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	-7.9	-173.3	0	0	0	0	0	114.9	I331	I331-G333 PolarHBondContact O-N 3.24Å
334	T	93.2	Very high	93.3	Very high	26 Å²	26	68.9 Å²	68.9	16%	0.16	36%	0.356	C	S	.	.	S	Bend	trans	-125.1	170.8	177.2	81.9	0	0	0	0	110.8	M302 R330 I331 R332 Y336	M302-T334 HydrophobicContact CB-CG2 3.89Å; M302-T334 HydrophobicContact CG-CG2 4.12Å; M302-T334 HydrophobicContact SD-CG2 4.37Å; R330-T334 PolarHBondContact NE-O 3.37Å; R330-T334 PolarHBondContact NH2-O 2.82Å; I331-T334 HydrophobicContact CB-CG2 4.45Å; I331-T334 HydrophobicContact CG2-CG2 4.29Å; I331-T334 PolarHBondContact O-N 3.11Å; I331-T334 VanDerWaalsContact O-N 3.1Å; I331-T334 PolarHBondContact O-OG1 2.76Å; R332-T334 VanDerWaalsContact C-N 3.3Å; T334-Y336 PolarHBondContact OG1-N 2.8Å
335	N	92.1	Very high	93.1	Very high	133 Å²	133	72.6 Å²	72.6	71%	0.711	38%	0.376	S	S	*	.	S	Bend	trans	-95.2	1.9	170.8	-69.9	-32	0	0	0	113.2	R330	R330-N335 PolarHBondContact NH2-OD1 3.5Å
336	Y	90.3	Very high	93	Very high	183 Å²	183	70.2 Å²	70.2	72%	0.718	36%	0.363	S	S	*	.			trans	-89.2	139.9	-173.2	-61.5	-78.8	0	0	0	111.3	R330 I331 T334	R330-Y336 WeakPolarHBondContact CA-O 3.43Å; I331-Y336 PolarHBondContact N-O 3.21Å; T334-Y336 PolarHBondContact OG1-N 2.8Å
337	Q	93.5	Very high	93	Very high	145 Å²	145	64.9 Å²	64.9	68%	0.678	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	141.7	168.1	-65.5	-173.8	0.3	0	0	109.6	I328 T329 R330	I328-Q337 HydrophobicContact CG2-CB 4.06Å; T329-Q337 WeakPolarHBondContact O-CA 3.23Å; R330-Q337 HydrophobicContact CB-CG 4.49Å
338	S	94.8	Very high	92.9	Very high	7 Å²	7	69.6 Å²	69.6	5%	0.049	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	160.5	175.8	70.8	0	0	0	0	111.1	T329 I331 H340 G341 I342	T329-S338 PolarHBondContact N-O 2.83Å; T329-S338 VanDerWaalsContact N-O 3.12Å; T329-S338 PolarHBondContact O-N 3.2Å; T329-S338 VanDerWaalsContact O-O 3.12Å; I331-S338 WeakPolarHBondContact CD1-OG 3.39Å; I331-S338 VanDerWaalsContact CG1-OG 3.24Å; I331-S338 WeakPolarHBondContact CG1-OG 3.27Å; S338-H340 PolarHBondContact O-N 3.03Å; S338-G341 PolarHBondContact O-N 2.9Å; S338-G341 WeakPolarHBondContact OG-CA 3.4Å; S338-I342 WeakPolarHBondContact CB-O 3.32Å; S338-I342 PolarHBondContact OG-N 3.37Å; S338-I342 VanDerWaalsContact OG-N 3.14Å; S338-I342 PolarHBondContact OG-O 3.17Å
339	P	94.9	Very high	92.7	Very high	59 Å²	59	69.4 Å²	69.4	38%	0.383	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	132.6	167.4	-21.5	33.3	0	0	0	110	G341 I342 L347	P339-G341 PolarHBondContact O-N 3.48Å; P339-I342 PolarHBondContact O-N 2.82Å; P339-L347 HydrophobicContact CB-CD2 3.91Å; P339-L347 HydrophobicContact CG-CD2 4.25Å
340	H	94.9	Very high	92.6	Very high	36 Å²	36	68.3 Å²	68.3	17%	0.167	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	4.5	179.9	-54.9	-50.2	0	0	0	116.1	L70 H298 T324 R326 G327 S338 I342	L70-H340 HydrophobicContact CD2-CB 4.27Å; H298-H340 WeakPolarHBondContact CB-O 3.28Å; T324-H340 HydrophobicContact CG2-CB 3.81Å; R326-H340 PolarHBondContact O-ND1 2.83Å; G327-H340 WeakPolarHBondContact O-CA 3.36Å; G327-H340 PolarHBondContact O-N 2.89Å; S338-H340 PolarHBondContact O-N 3.03Å; H340-I342 HydrophobicContact CB-CD1 4.14Å; H340-I342 HydrophobicContact CB-CG1 4.18Å
341	G	93.1	Very high	92.5	Very high	0 Å²	0	67 Å²	67	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.5	20.5	-172.7	0	0	0	0	0	113.2	F305 S338 P339	F305-G341 WeakPolarHBondContact CE2-O 3.31Å; F305-G341 WeakPolarHBondContact CZ-O 3.31Å; S338-G341 PolarHBondContact O-N 2.9Å; S338-G341 WeakPolarHBondContact OG-CA 3.4Å; P339-G341 PolarHBondContact O-N 3.48Å
342	I	95.2	Very high	92.5	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	36%	0.363	C	S	.	.			trans	-108.2	137.7	179.5	-59.7	178	0	0	0	108	L70 V297 F305 S338 P339 H340 L346 L347 L350	L70-I342 HydrophobicContact CD1-CD1 3.82Å; L70-I342 HydrophobicContact CD2-CD1 3.87Å; L70-I342 HydrophobicContact CG-CD1 4.48Å; V297-I342 HydrophobicContact CG1-CD1 3.88Å; V297-I342 HydrophobicContact CG1-CG1 4.29Å; F305-I342 HydrophobicContact CE1-CB 4.47Å; F305-I342 HydrophobicContact CE1-CG1 4.07Å; F305-I342 HydrophobicContact CE1-CG2 4.23Å; F305-I342 HydrophobicContact CZ-CG1 4.08Å; S338-I342 WeakPolarHBondContact CB-O 3.32Å; S338-I342 PolarHBondContact OG-N 3.37Å; S338-I342 VanDerWaalsContact OG-N 3.14Å; S338-I342 PolarHBondContact OG-O 3.17Å; P339-I342 PolarHBondContact O-N 2.82Å; H340-I342 HydrophobicContact CB-CD1 4.14Å; H340-I342 HydrophobicContact CB-CG1 4.18Å; I342-L346 HydrophobicContact CG2-CB 3.99Å; I342-L346 HydrophobicContact CG2-CD2 3.91Å; I342-L346 HydrophobicContact CG2-CG 4.03Å; I342-L347 HydrophobicContact CG2-CB 4.35Å; I342-L350 HydrophobicContact CD1-CD1 4.11Å; I342-L350 HydrophobicContact CG2-CD1 4.4Å
343	P	94.9	Very high	92.7	Very high	8 Å²	8	66.3 Å²	66.3	5%	0.052	35%	0.348	C	S	.	.			trans	-69.1	148.5	176.5	13	-4.2	0	0	0	111.2	M302 F305 I331 D345 L346 L347	M302-P343 HydrophobicContact CE-CB 4.2Å; M302-P343 HydrophobicContact CE-CG 4.17Å; M302-P343 HydrophobicContact SD-CB 4.06Å; M302-P343 HydrophobicContact SD-CG 3.73Å; F305-P343 HydrophobicContact CB-CG 3.7Å; F305-P343 VanDerWaalsContact CD2-CD 3.5Å; F305-P343 HydrophobicContact CD2-CG 3.85Å; F305-P343 HydrophobicContact CG-CG 3.82Å; I331-P343 HydrophobicContact CD1-CB 3.81Å; I331-P343 HydrophobicContact CD1-CG 4.27Å; P343-D345 VanDerWaalsContact C-OD1 3.29Å; P343-D345 VanDerWaalsContact CB-OD1 3.23Å; P343-D345 WeakPolarHBondContact CB-OD1 3.19Å; P343-D345 PolarHBondContact O-N 3.5Å; P343-L346 PolarHBondContact O-N 2.82Å; P343-L347 PolarHBondContact O-N 2.89Å
344	I	91.7	Very high	92.9	Very high	125 Å²	125	66 Å²	66	64%	0.641	34%	0.337	S	S	*	.	H	α-helix	trans	-64.1	-32.2	-165.3	-59.4	171.8	0	0	0	111.6	L347 D348	I344-L347 PolarHBondContact O-N 2.89Å; I344-D348 WeakPolarHBondContact O-CB 3.48Å; I344-D348 PolarHBondContact O-N 2.89Å
345	D	90	Very high	93	Very high	79 Å²	79	65.3 Å²	65.3	42%	0.422	33%	0.333	S	S	.	.	H	α-helix	trans	-60.6	-43.6	176.4	62.5	-30.4	0	0	0	112.8	N309 P343	N309-D345 PolarHBondContact ND2-OD2 2.93Å; P343-D345 VanDerWaalsContact C-OD1 3.29Å; P343-D345 VanDerWaalsContact CB-OD1 3.23Å; P343-D345 WeakPolarHBondContact CB-OD1 3.19Å; P343-D345 PolarHBondContact O-N 3.5Å
346	L	91.8	Very high	93.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-72.5	-44.5	173.3	178.8	59.4	0	0	0	109.7	F305 N309 L312 I342 P343 D348 R349 L350	F305-L346 HydrophobicContact CD1-CD2 3.56Å; F305-L346 HydrophobicContact CE1-CD2 4.19Å; F305-L346 HydrophobicContact CG-CD2 4.49Å; N309-L346 WeakPolarHBondContact OD1-CD1 3.31Å; L312-L346 HydrophobicContact CD1-CD1 3.9Å; I342-L346 HydrophobicContact CG2-CB 3.99Å; I342-L346 HydrophobicContact CG2-CD2 3.91Å; I342-L346 HydrophobicContact CG2-CG 4.03Å; P343-L346 PolarHBondContact O-N 2.82Å; L346-D348 VanDerWaalsContact C-N 3.28Å; L346-D348 PolarHBondContact O-N 3.19Å; L346-R349 WeakPolarHBondContact O-CA 3.44Å; L346-R349 WeakPolarHBondContact O-CB 3.43Å; L346-R349 PolarHBondContact O-N 2.94Å; L346-L350 HydrophobicContact CD1-CD2 4.06Å; L346-L350 HydrophobicContact CD1-CG 4.49Å; L346-L350 HydrophobicContact CG-CD1 4.24Å; L346-L350 HydrophobicContact CG-CD2 4.37Å; L346-L350 HydrophobicContact CG-CG 4.37Å; L346-L350 WeakPolarHBondContact O-CG 3.04Å; L346-L350 PolarHBondContact O-N 3.01Å
347	L	91.2	Very high	93.3	Very high	28 Å²	28	57.4 Å²	57.4	15%	0.147	31%	0.313	C	S	.	.	H	α-helix	trans	-57.6	-38	-176.2	-169.3	65.2	0	0	0	113.1	L70 P339 I342 P343 I344 R349 L350 I352	L70-L347 HydrophobicContact CD2-CD1 4.01Å; P339-L347 HydrophobicContact CB-CD2 3.91Å; P339-L347 HydrophobicContact CG-CD2 4.25Å; I342-L347 HydrophobicContact CG2-CB 4.35Å; P343-L347 PolarHBondContact O-N 2.89Å; I344-L347 PolarHBondContact O-N 2.89Å; L347-R349 PolarHBondContact O-N 3.42Å; L347-L350 HydrophobicContact CD1-CD1 4.23Å; L347-L350 PolarHBondContact O-N 2.84Å; L347-L350 VanDerWaalsContact O-N 3.11Å; L347-I352 HydrophobicContact CD1-CD1 3.83Å; L347-I352 HydrophobicContact CG-CD1 4.49Å
348	D	88.3	Confident	93.4	Very high	149 Å²	149	52.1 Å²	52.1	80%	0.797	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-23.5	176.6	-165.1	47	0	0	0	113	I344 L346	I344-D348 WeakPolarHBondContact O-CB 3.48Å; I344-D348 PolarHBondContact O-N 2.89Å; L346-D348 VanDerWaalsContact C-N 3.28Å; L346-D348 PolarHBondContact O-N 3.19Å
349	R	88.4	Confident	93.4	Very high	122 Å²	122	55.4 Å²	55.4	46%	0.46	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-12.6	175.4	-59.8	175.2	176	-156.8	-3.8	113	N309 E313 L346 L347	N309-R349 PolarHBondContact O-NH1 3.45Å; E313-R349 IonicContact OE1-CZ 3.37Å; E313-R349 IonicContact OE1-NH1 2.69Å; E313-R349 PolarHBondContact OE1-NH1 3.41Å; E313-R349 IonicContact OE1-NH2 3.11Å; E313-R349 PolarHBondContact OE1-NH2 2.97Å; L346-R349 WeakPolarHBondContact O-CA 3.44Å; L346-R349 WeakPolarHBondContact O-CB 3.43Å; L346-R349 PolarHBondContact O-N 2.94Å; L347-R349 PolarHBondContact O-N 3.42Å
350	L	91.7	Very high	93.4	Very high	14 Å²	14	58.3 Å²	58.3	7%	0.073	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	141.5	-173.1	-56.7	178	0	0	0	112.7	A68 L70 M322 I342 L346 L347	A68-L350 HydrophobicContact CB-CD2 3.19Å; A68-L350 WeakPolarHBondContact O-CA 3.41Å; L70-L350 HydrophobicContact CB-CB 4.42Å; L70-L350 HydrophobicContact CB-CD1 4.11Å; L70-L350 HydrophobicContact CD2-CD1 4.41Å; M322-L350 HydrophobicContact CE-CD1 3.43Å; M322-L350 VanDerWaalsContact CE-CD1 3.43Å; M322-L350 HydrophobicContact CE-CD2 3.35Å; M322-L350 HydrophobicContact CE-CG 4.04Å; I342-L350 HydrophobicContact CD1-CD1 4.11Å; I342-L350 HydrophobicContact CG2-CD1 4.4Å; L346-L350 HydrophobicContact CD1-CD2 4.06Å; L346-L350 HydrophobicContact CD1-CG 4.49Å; L346-L350 HydrophobicContact CG-CD1 4.24Å; L346-L350 HydrophobicContact CG-CD2 4.37Å; L346-L350 HydrophobicContact CG-CG 4.37Å; L346-L350 WeakPolarHBondContact O-CG 3.04Å; L346-L350 PolarHBondContact O-N 3.01Å; L347-L350 HydrophobicContact CD1-CD1 4.23Å; L347-L350 PolarHBondContact O-N 2.84Å; L347-L350 VanDerWaalsContact O-N 3.11Å
351	L	92.8	Very high	93.5	Very high	100 Å²	100	65.1 Å²	65.1	52%	0.524	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.7	161.8	-63.6	177.6	0	0	0	109.5	I55 A68 V69 L70	I55-L351 HydrophobicContact CD1-CD1 4.25Å; A68-L351 PolarHBondContact O-N 3.45Å; V69-L351 CarbonylContact C-O 3.6Å; V69-L351 WeakPolarHBondContact CA-O 3.35Å; L70-L351 PolarHBondContact N-O 2.8Å
352	I	95.2	Very high	93.6	Very high	85 Å²	85	66.5 Å²	66.5	44%	0.436	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118	-177.7	-52	178.6	0	0	0	110.4	L70 A72 L347	L70-I352 HydrophobicContact CB-CG1 4.33Å; L70-I352 HydrophobicContact CD2-CD1 4.41Å; L70-I352 HydrophobicContact CD2-CG1 4.23Å; L70-I352 HydrophobicContact CD2-CG2 4.49Å; L70-I352 CarbonylContact O-C 3.57Å; L70-I352 WeakPolarHBondContact O-CA 3.37Å; A72-I352 HydrophobicContact CB-CG2 4.08Å; L347-I352 HydrophobicContact CD1-CD1 3.83Å; L347-I352 HydrophobicContact CG-CD1 4.49Å
353	I	96.6	Very high	93.6	Very high	15 Å²	15	66.8 Å²	66.8	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.9	169.9	-58.1	178.9	0	0	0	108.2	A48 A51 I55 V69 L70 I71 A72	A48-I353 HydrophobicContact CB-CG2 3.69Å; A51-I353 HydrophobicContact CB-CD1 3.86Å; A51-I353 HydrophobicContact CB-CG1 3.98Å; A51-I353 HydrophobicContact CB-CG2 4.18Å; I55-I353 HydrophobicContact CG1-CD1 4.38Å; V69-I353 HydrophobicContact CG1-CD1 3.67Å; V69-I353 HydrophobicContact CG1-CG1 3.96Å; L70-I353 PolarHBondContact O-N 2.91Å; I71-I353 CarbonylContact C-O 3.47Å; I71-I353 WeakPolarHBondContact CA-O 3.3Å; A72-I353 PolarHBondContact N-O 2.98Å
354	A	96.1	Very high	93.7	Very high	71 Å²	71	71.6 Å²	71.6	59%	0.587	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	136.3	174.7	0	0	0	0	0	111.1	A72	A72-A354 CarbonylContact O-C 3.49Å; A72-A354 WeakPolarHBondContact O-CA 3.49Å
355	T	95.8	Very high	93.9	Very high	12 Å²	12	68.7 Å²	68.7	7%	0.074	35%	0.354	C	S	.	.			trans	-106.1	144.4	171.7	53.5	0	0	0	0	110.3	A48 I71 A72 G73 T77 K79 I82	A48-T355 HydrophobicContact CB-CG2 4.02Å; I71-T355 HydrophobicContact CG2-CG2 3.86Å; A72-T355 PolarHBondContact O-N 2.82Å; A72-T355 PolarHBondContact O-OG1 3.2Å; G73-T355 WeakPolarHBondContact CA-OG1 3.48Å; T77-T355 WeakPolarHBondContact CB-OG1 3.44Å; T77-T355 WeakPolarHBondContact OG1-CB 3.48Å; T77-T355 PolarHBondContact OG1-OG1 2.97Å; K79-T355 HydrophobicContact CG-CG2 4.3Å; I82-T355 HydrophobicContact CD1-CG2 3.77Å
356	S	94.6	Very high	94.1	Very high	73 Å²	73	65.7 Å²	65.7	51%	0.51	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-102.8	155.8	-178.3	-56.6	0	0	0	0	111.5	Q45 T77	Q45-S356 PolarHBondContact NE2-O 3.41Å; T77-S356 WeakPolarHBondContact CG2-O 3.33Å
357	P	93.9	Very high	94.3	Very high	77 Å²	77	65.7 Å²	65.7	50%	0.5	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-59.3	144.5	168.3	-22.7	34.7	0	0	0	111.3
358	Y	95	Very high	94.4	Very high	35 Å²	35	68.6 Å²	68.6	14%	0.137	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-73.4	144.7	177.3	-70.2	-67.9	0	0	0	111.6	Q45 G76 T77 E362 I366 L395	Q45-Y358 HydrophobicContact CG-CE1 3.64Å; Q45-Y358 WeakPolarHBondContact CG-OH 3.46Å; G76-Y358 WeakPolarHBondContact O-CE2 3.45Å; T77-Y358 PolarHBondContact O-OH 3.08Å; Y358-E362 HydrophobicContact CD1-CB 3.93Å; Y358-I366 HydrophobicContact CD1-CD1 3.8Å; Y358-I366 HydrophobicContact CD2-CD1 3.95Å; Y358-I366 HydrophobicContact CE1-CD1 3.74Å; Y358-I366 HydrophobicContact CE2-CD1 3.91Å; Y358-I366 HydrophobicContact CG-CD1 3.9Å; Y358-L395 HydrophobicContact CD2-CD2 4.33Å; Y358-L395 HydrophobicContact CE2-CD2 4.29Å
359	T	95.8	Very high	94.7	Very high	76 Å²	76	62.5 Å²	62.5	47%	0.466	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-77.5	160.4	169.4	62.3	0	0	0	0	111	K361 E362 T363	T359-K361 PolarHBondContact O-N 3Å; T359-E362 PolarHBondContact N-OE2 3.25Å; T359-E362 PolarHBondContact O-N 3.3Å; T359-E362 VanDerWaalsContact OG1-CD 3.29Å; T359-E362 VanDerWaalsContact OG1-CG 3.29Å; T359-E362 WeakPolarHBondContact OG1-CG 3.4Å; T359-E362 PolarHBondContact OG1-N 3.22Å; T359-E362 PolarHBondContact OG1-OE2 3.12Å; T359-T363 PolarHBondContact O-N 2.89Å; T359-T363 PolarHBondContact O-OG1 3.38Å
360	E	95.5	Very high	95	Very high	119 Å²	119	57 Å²	57	56%	0.556	30%	0.296	S	S	*	.	H	α-helix	trans	-54.2	-39.9	177.9	-173.6	-176.1	177.9	0	0	112.8	T363 R364 T387 M391	E360-T363 PolarHBondContact O-N 2.73Å; E360-R364 WeakPolarHBondContact O-CB 3.42Å; E360-R364 PolarHBondContact O-N 3.26Å; E360-T387 HydrophobicContact CG-CG2 3.8Å; E360-M391 HydrophobicContact CB-CE 4.48Å; E360-M391 HydrophobicContact CB-CG 4.47Å; E360-M391 HydrophobicContact CB-SD 4.36Å; E360-M391 HydrophobicContact CG-CG 4.4Å
361	K	95.3	Very high	95.1	Very high	180 Å²	180	56.7 Å²	56.7	78%	0.783	29%	0.294	S	S	*	.	H	α-helix	trans	-63.6	-42.3	177.2	-67	-176.6	179.6	179.2	0	112	T359 Q365	T359-K361 PolarHBondContact O-N 3Å; K361-Q365 PolarHBondContact O-N 2.86Å; K361-Q365 VanDerWaalsContact O-N 3.15Å
362	E	95.6	Very high	95.1	Very high	28 Å²	28	57.9 Å²	57.9	13%	0.131	30%	0.297	C	S	.	.	H	α-helix	trans	-68.9	-44	177.1	-68.9	165.8	145.2	0	0	110.9	V43 G44 Y358 T359 R364 Q365 I366	V43-E362 HydrophobicContact CG1-CB 4.23Å; V43-E362 HydrophobicContact CG1-CG 4.3Å; G44-E362 VanDerWaalsContact CA-OE1 3.25Å; G44-E362 WeakPolarHBondContact CA-OE1 3.43Å; Y358-E362 HydrophobicContact CD1-CB 3.93Å; T359-E362 PolarHBondContact N-OE2 3.25Å; T359-E362 PolarHBondContact O-N 3.3Å; T359-E362 VanDerWaalsContact OG1-CD 3.29Å; T359-E362 VanDerWaalsContact OG1-CG 3.29Å; T359-E362 WeakPolarHBondContact OG1-CG 3.4Å; T359-E362 PolarHBondContact OG1-N 3.22Å; T359-E362 PolarHBondContact OG1-OE2 3.12Å; E362-R364 VanDerWaalsContact C-N 3.33Å; E362-R364 PolarHBondContact O-N 3.22Å; E362-Q365 PolarHBondContact O-N 3.4Å; E362-Q365 VanDerWaalsContact O-N 3.13Å; E362-I366 VanDerWaalsContact O-CG1 3.23Å; E362-I366 WeakPolarHBondContact O-CG1 3.47Å; E362-I366 PolarHBondContact O-N 3.47Å
363	T	95.7	Very high	94.8	Very high	6 Å²	6	56.4 Å²	56.4	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-56.2	-47.4	175.5	-60.7	0	0	0	0	111.2	T359 E360 Q365 I366 L367 T387 M391 L395	T359-T363 PolarHBondContact O-N 2.89Å; T359-T363 PolarHBondContact O-OG1 3.38Å; E360-T363 PolarHBondContact O-N 2.73Å; T363-Q365 VanDerWaalsContact C-N 3.32Å; T363-Q365 PolarHBondContact O-N 3.21Å; T363-I366 PolarHBondContact O-N 3.32Å; T363-L367 HydrophobicContact CG2-CD1 4.15Å; T363-L367 VanDerWaalsContact O-CG 3.3Å; T363-L367 WeakPolarHBondContact O-CG 3.47Å; T363-L367 PolarHBondContact O-N 3.4Å; T363-T387 HydrophobicContact CG2-CG2 4.22Å; T363-M391 HydrophobicContact CG2-SD 4.27Å; T363-M391 PolarHBondContact OG1-SD 3.12Å; T363-M391 VanDerWaalsContact OG1-SD 3.38Å; T363-L395 HydrophobicContact CG2-CD1 4.27Å
364	R	96.1	Very high	94.5	Very high	109 Å²	109	57 Å²	57	41%	0.411	29%	0.291	S	S	.	.	H	α-helix	trans	-58.4	-45.1	176.4	-174.3	174.5	180	-177.5	0.8	111.7	E360 E362 L367 K368 E380 T387	E360-R364 WeakPolarHBondContact O-CB 3.42Å; E360-R364 PolarHBondContact O-N 3.26Å; E362-R364 VanDerWaalsContact C-N 3.33Å; E362-R364 PolarHBondContact O-N 3.22Å; R364-L367 PolarHBondContact O-N 3.38Å; R364-K368 PolarHBondContact O-N 3.2Å; R364-E380 IonicContact CZ-OE2 2.66Å; R364-E380 IonicContact NH2-OE2 2.83Å; R364-E380 PolarHBondContact NH2-OE2 2.66Å; R364-T387 HydrophobicContact CB-CG2 3.88Å
365	Q	95.8	Very high	94.3	Very high	64 Å²	64	59.9 Å²	59.9	30%	0.299	30%	0.296	S	S	.	.	H	α-helix	trans	-68	-38.8	-179.2	-173.8	64.5	25.1	0	0	112.2	V38 V43 K361 E362 T363 K368 I369	V38-Q365 HydrophobicContact CG2-CG 3.84Å; V43-Q365 HydrophobicContact CG1-CB 4.04Å; V43-Q365 HydrophobicContact CG1-CG 3.98Å; V43-Q365 HydrophobicContact CG2-CG 3.94Å; K361-Q365 PolarHBondContact O-N 2.86Å; K361-Q365 VanDerWaalsContact O-N 3.15Å; E362-Q365 PolarHBondContact O-N 3.4Å; E362-Q365 VanDerWaalsContact O-N 3.13Å; T363-Q365 VanDerWaalsContact C-N 3.32Å; T363-Q365 PolarHBondContact O-N 3.21Å; Q365-K368 WeakPolarHBondContact O-CB 3.49Å; Q365-K368 PolarHBondContact O-N 2.89Å; Q365-I369 WeakPolarHBondContact O-CG1 3.36Å; Q365-I369 PolarHBondContact O-N 3.46Å
366	I	95.1	Very high	94.2	Very high	17 Å²	17	60.1 Å²	60.1	9%	0.087	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-47.8	174.9	-67	161.9	0	0	0	109.9	V43 Y358 E362 T363 K368 I369 R370 L395	V43-I366 HydrophobicContact CB-CG1 3.81Å; V43-I366 HydrophobicContact CG1-CG1 4.22Å; V43-I366 HydrophobicContact CG2-CG1 4.1Å; Y358-I366 HydrophobicContact CD1-CD1 3.8Å; Y358-I366 HydrophobicContact CD2-CD1 3.95Å; Y358-I366 HydrophobicContact CE1-CD1 3.74Å; Y358-I366 HydrophobicContact CE2-CD1 3.91Å; Y358-I366 HydrophobicContact CG-CD1 3.9Å; E362-I366 VanDerWaalsContact O-CG1 3.23Å; E362-I366 WeakPolarHBondContact O-CG1 3.47Å; E362-I366 PolarHBondContact O-N 3.47Å; T363-I366 PolarHBondContact O-N 3.32Å; I366-K368 VanDerWaalsContact C-N 3.28Å; I366-K368 PolarHBondContact O-N 3.28Å; I366-I369 PolarHBondContact O-N 3.07Å; I366-R370 WeakPolarHBondContact O-CG 3.42Å; I366-R370 PolarHBondContact O-N 3.14Å; I366-L395 HydrophobicContact CD1-CD2 4.28Å; I366-L395 HydrophobicContact CG2-CD1 4.1Å; I366-L395 HydrophobicContact CG2-CD2 4.1Å
367	L	95.1	Very high	94.2	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-40.8	177.3	-67.2	171.3	0	0	0	111.1	T363 R364 I369 R370 C371 L386 L395 A398 I399 I402	T363-L367 HydrophobicContact CG2-CD1 4.15Å; T363-L367 VanDerWaalsContact O-CG 3.3Å; T363-L367 WeakPolarHBondContact O-CG 3.47Å; T363-L367 PolarHBondContact O-N 3.4Å; R364-L367 PolarHBondContact O-N 3.38Å; L367-I369 PolarHBondContact O-N 2.95Å; L367-R370 WeakPolarHBondContact O-CB 3.46Å; L367-R370 PolarHBondContact O-N 3.42Å; L367-R370 VanDerWaalsContact O-N 3.15Å; L367-C371 PolarHBondContact O-N 3.17Å; L367-C371 PolarHBondContact O-SG 3.02Å; L367-L386 HydrophobicContact CD1-CD2 4.2Å; L367-L386 HydrophobicContact CD1-CG 4Å; L367-L386 HydrophobicContact CD2-CD2 4.33Å; L367-L395 HydrophobicContact CD2-CD1 4.09Å; L367-L395 HydrophobicContact CG-CD1 4.37Å; L367-A398 HydrophobicContact CD2-CB 3.88Å; L367-I399 HydrophobicContact CD2-CG1 4.1Å; L367-I402 HydrophobicContact CD2-CD1 3.99Å
368	K	95.2	Very high	94.2	Very high	88 Å²	88	59.8 Å²	59.8	38%	0.383	28%	0.282	S	S	.	.	H	α-helix	trans	-58.6	-48.1	176	-173	173.7	-179.7	171	0	112.7	R364 Q365 I366 R370 C371 E372	R364-K368 PolarHBondContact O-N 3.2Å; Q365-K368 WeakPolarHBondContact O-CB 3.49Å; Q365-K368 PolarHBondContact O-N 2.89Å; I366-K368 VanDerWaalsContact C-N 3.28Å; I366-K368 PolarHBondContact O-N 3.28Å; K368-R370 PolarHBondContact O-N 3.19Å; K368-C371 WeakPolarHBondContact O-CB 3.26Å; K368-C371 PolarHBondContact O-N 3Å; K368-C371 VanDerWaalsContact O-N 3.16Å; K368-E372 WeakPolarHBondContact CE-OE1 3.48Å; K368-E372 WeakPolarHBondContact O-CG 3.33Å; K368-E372 PolarHBondContact O-N 3.41Å
369	I	94.8	Very high	94.3	Very high	21 Å²	21	58.6 Å²	58.6	11%	0.108	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-37.7	176.3	-67	169.4	0	0	0	110.9	H23 V38 V43 Q365 I366 L367 E372 E373	H23-I369 HydrophobicContact CB-CG2 4.22Å; V38-I369 HydrophobicContact CG1-CD1 4.13Å; V43-I369 HydrophobicContact CG2-CD1 3.35Å; Q365-I369 WeakPolarHBondContact O-CG1 3.36Å; Q365-I369 PolarHBondContact O-N 3.46Å; I366-I369 PolarHBondContact O-N 3.07Å; L367-I369 PolarHBondContact O-N 2.95Å; I369-E372 PolarHBondContact O-N 3.47Å; I369-E373 WeakPolarHBondContact O-CB 3.05Å; I369-E373 PolarHBondContact O-N 3.29Å
370	R	93.8	Very high	94.2	Very high	8 Å²	8	60.4 Å²	60.4	3%	0.03	28%	0.282	C	S	.	.	H	α-helix	trans	-67.8	-37	176.7	-69.2	-63.7	-58.2	175.1	0.6	112.7	G19 A20 H23 I366 L367 K368 E373 E374 I399 I402	G19-R370 PolarHBondContact O-NH1 3.01Å; G19-R370 PolarHBondContact O-NH2 3.36Å; A20-R370 PolarHBondContact O-NH1 3.13Å; H23-R370 PolarHBondContact ND1-NH1 2.88Å; H23-R370 VanDerWaalsContact ND1-NH1 3.11Å; I366-R370 WeakPolarHBondContact O-CG 3.42Å; I366-R370 PolarHBondContact O-N 3.14Å; L367-R370 WeakPolarHBondContact O-CB 3.46Å; L367-R370 PolarHBondContact O-N 3.42Å; L367-R370 VanDerWaalsContact O-N 3.15Å; K368-R370 PolarHBondContact O-N 3.19Å; R370-E373 PolarHBondContact O-N 3.1Å; R370-E374 IonicContact CZ-OE1 3.35Å; R370-E374 IonicContact NE-OE1 2.67Å; R370-E374 IonicContact NH2-OE1 3.15Å; R370-E374 PolarHBondContact NH2-OE1 3.39Å; R370-E374 WeakPolarHBondContact O-CB 3.31Å; R370-E374 WeakPolarHBondContact O-CG 3.24Å; R370-E374 PolarHBondContact O-N 2.96Å; R370-I399 HydrophobicContact CG-CD1 4.13Å; R370-I399 HydrophobicContact CG-CG1 4.13Å; R370-I402 HydrophobicContact CB-CD1 3.86Å
371	C	93.4	Very high	94.2	Very high	6 Å²	6	61.5 Å²	61.5	4%	0.041	29%	0.287	C	S	.	.	H	α-helix	trans	-64.3	-41.3	173.4	-60.8	0	0	0	0	111.7	L367 K368 E374 D375 V376 L378	L367-C371 PolarHBondContact O-N 3.17Å; L367-C371 PolarHBondContact O-SG 3.02Å; K368-C371 WeakPolarHBondContact O-CB 3.26Å; K368-C371 PolarHBondContact O-N 3Å; K368-C371 VanDerWaalsContact O-N 3.16Å; C371-E374 PolarHBondContact O-N 2.89Å; C371-D375 PolarHBondContact O-N 3.25Å; C371-V376 WeakPolarHBondContact CB-O 3.13Å; C371-V376 PolarHBondContact O-N 3Å; C371-L378 HydrophobicContact CB-CD1 3.72Å; C371-L378 WeakPolarHBondContact SG-CD1 3.5Å
372	E	92.1	Very high	94.2	Very high	126 Å²	126	53 Å²	53	59%	0.589	25%	0.25	S	C	*	.	H	α-helix	trans	-64.1	-42.3	174.7	-69.4	171.1	-168.6	0	0	112	K368 I369 D375	K368-E372 WeakPolarHBondContact CE-OE1 3.48Å; K368-E372 WeakPolarHBondContact O-CG 3.33Å; K368-E372 PolarHBondContact O-N 3.41Å; I369-E372 PolarHBondContact O-N 3.47Å; E372-D375 PolarHBondContact O-N 2.93Å
373	E	90.5	Very high	94.2	Very high	54 Å²	54	52.3 Å²	52.3	25%	0.252	25%	0.247	S	C	.	.	H	α-helix	trans	-67.5	-36.1	177.9	-178.3	74.4	-177.3	0	0	112.7	I18 S22 H23 I369 R370 D375	I18-E373 WeakPolarHBondContact CD1-O 3.48Å; I18-E373 HydrophobicContact CG2-CG 3.95Å; S22-E373 WeakPolarHBondContact CB-OE1 3.47Å; S22-E373 PolarHBondContact OG-OE1 2.64Å; H23-E373 HydrophobicContact CB-CB 4.19Å; H23-E373 HydrophobicContact CB-CG 3.95Å; H23-E373 PolarHBondContact N-OE1 3.3Å; I369-E373 WeakPolarHBondContact O-CB 3.05Å; I369-E373 PolarHBondContact O-N 3.29Å; R370-E373 PolarHBondContact O-N 3.1Å; E373-D375 VanDerWaalsContact C-N 3.34Å
374	E	90.1	Very high	94.2	Very high	28 Å²	28	55.5 Å²	55.5	13%	0.131	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-0.6	179.5	-68.7	-179.6	-154.1	0	0	113.7	I18 R370 C371 V376 S403	I18-E374 HydrophobicContact CG2-CG 4.04Å; R370-E374 IonicContact CZ-OE1 3.35Å; R370-E374 IonicContact NE-OE1 2.67Å; R370-E374 IonicContact NH2-OE1 3.15Å; R370-E374 PolarHBondContact NH2-OE1 3.39Å; R370-E374 WeakPolarHBondContact O-CB 3.31Å; R370-E374 WeakPolarHBondContact O-CG 3.24Å; R370-E374 PolarHBondContact O-N 2.96Å; C371-E374 PolarHBondContact O-N 2.89Å; E374-V376 HydrophobicContact CB-CG2 4.06Å; E374-V376 PolarHBondContact O-N 3.47Å; E374-S403 WeakPolarHBondContact OE2-CB 3.25Å; E374-S403 PolarHBondContact OE2-OG 2.99Å
375	D	91.1	Very high	94.2	Very high	130 Å²	130	52.6 Å²	52.6	70%	0.695	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	51.5	-176.4	-163.3	33.3	0	0	0	112.1	C371 E372 E373	C371-D375 PolarHBondContact O-N 3.25Å; E372-D375 PolarHBondContact O-N 2.93Å; E373-D375 VanDerWaalsContact C-N 3.34Å
376	V	93.8	Very high	94.2	Very high	18 Å²	18	49.6 Å²	49.6	11%	0.109	25%	0.247	C	C	.	.			trans	-120.9	115.9	178.3	-174.1	0	0	0	0	109.5	C371 E374 L378 I402 V417	C371-V376 WeakPolarHBondContact CB-O 3.13Å; C371-V376 PolarHBondContact O-N 3Å; E374-V376 HydrophobicContact CB-CG2 4.06Å; E374-V376 PolarHBondContact O-N 3.47Å; V376-L378 HydrophobicContact CB-CD1 4.3Å; V376-L378 HydrophobicContact CG1-CD1 3.84Å; V376-L378 VanDerWaalsContact O-CD1 3.29Å; V376-L378 WeakPolarHBondContact O-CD1 3.31Å; V376-I402 HydrophobicContact CB-CG2 4.05Å; V376-I402 HydrophobicContact CG1-CG2 4.27Å; V376-I402 HydrophobicContact CG2-CG2 4.16Å; V376-V417 HydrophobicContact CG1-CG2 3.63Å
377	E	94.6	Very high	94.2	Very high	126 Å²	126	48.9 Å²	48.9	59%	0.589	24%	0.243	S	C	*	.			trans	-82.9	127.8	174.3	-63.4	-179.8	171.8	0	0	110.5	V417	E377-V417 PolarHBondContact O-N 2.88Å
378	L	94.3	Very high	94.3	Very high	16 Å²	16	56.5 Å²	56.5	8%	0.084	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-120.1	141.8	175	-67.2	73.7	0	0	0	110	C371 V376 A382 L386 V417	C371-L378 HydrophobicContact CB-CD1 3.72Å; C371-L378 WeakPolarHBondContact SG-CD1 3.5Å; V376-L378 HydrophobicContact CB-CD1 4.3Å; V376-L378 HydrophobicContact CG1-CD1 3.84Å; V376-L378 VanDerWaalsContact O-CD1 3.29Å; V376-L378 WeakPolarHBondContact O-CD1 3.31Å; L378-A382 HydrophobicContact CB-CB 4.38Å; L378-L386 HydrophobicContact CD2-CD2 3.84Å; L378-V417 HydrophobicContact CG-CB 4.03Å; L378-V417 HydrophobicContact CG-CG1 4.37Å
379	S	96.1	Very high	94.3	Very high	11 Å²	11	53.1 Å²	53.1	8%	0.077	26%	0.258	C	S	.	.			trans	-63.8	152	167.3	56.8	0	0	0	0	112	E381 A382 H383 E416 V417	S379-E381 PolarHBondContact O-N 2.83Å; S379-A382 WeakPolarHBondContact O-CA 3.5Å; S379-A382 WeakPolarHBondContact O-CB 3.24Å; S379-A382 PolarHBondContact O-N 3.5Å; S379-A382 WeakPolarHBondContact OG-CB 3.46Å; S379-A382 PolarHBondContact OG-N 3.34Å; S379-H383 PolarHBondContact O-N 2.91Å; S379-E416 WeakPolarHBondContact CA-OE1 3.35Å; S379-E416 WeakPolarHBondContact CB-OE1 3.49Å; S379-E416 PolarHBondContact N-OE1 3.39Å; S379-V417 PolarHBondContact N-O 2.87Å; S379-V417 VanDerWaalsContact N-O 3.09Å; S379-V417 PolarHBondContact OG-O 2.75Å
380	E	94.8	Very high	94.2	Very high	113 Å²	113	52.6 Å²	52.6	53%	0.528	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-34.1	179.5	-74	-63.3	157.3	0	0	112.8	R364 T384	R364-E380 IonicContact CZ-OE2 2.66Å; R364-E380 IonicContact NH2-OE2 2.83Å; R364-E380 PolarHBondContact NH2-OE2 2.66Å; E380-T384 PolarHBondContact O-N 3.39Å; E380-T384 VanDerWaalsContact O-N 3.09Å; E380-T384 PolarHBondContact O-OG1 2.8Å
381	E	95.4	Very high	94.1	Very high	143 Å²	143	56.5 Å²	56.5	67%	0.668	28%	0.277	S	S	*	.	H	α-helix	trans	-67.1	-44.1	173.5	-62.5	-173.8	-179.9	0	0	111.5	S379 H383 T384 V385 V419	S379-E381 PolarHBondContact O-N 2.83Å; E381-H383 VanDerWaalsContact C-N 3.33Å; E381-H383 PolarHBondContact O-N 3.07Å; E381-T384 PolarHBondContact O-N 2.94Å; E381-V385 WeakPolarHBondContact O-CG2 3.22Å; E381-V385 PolarHBondContact O-N 2.89Å; E381-V419 HydrophobicContact CB-CG2 3.72Å
382	A	95.1	Very high	94.1	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.9	-41.2	176.1	0	0	0	0	0	111.5	L378 S379 T384 V385 L386 V419 I422	L378-A382 HydrophobicContact CB-CB 4.38Å; S379-A382 WeakPolarHBondContact O-CA 3.5Å; S379-A382 WeakPolarHBondContact O-CB 3.24Å; S379-A382 PolarHBondContact O-N 3.5Å; S379-A382 WeakPolarHBondContact OG-CB 3.46Å; S379-A382 PolarHBondContact OG-N 3.34Å; A382-T384 VanDerWaalsContact C-N 3.34Å; A382-T384 PolarHBondContact O-N 3.24Å; A382-V385 PolarHBondContact O-N 2.92Å; A382-L386 VanDerWaalsContact O-CB 3.31Å; A382-L386 WeakPolarHBondContact O-CB 3.41Å; A382-L386 PolarHBondContact O-N 2.79Å; A382-V419 HydrophobicContact CB-CG2 4.36Å; A382-I422 HydrophobicContact CB-CD1 3.65Å; A382-I422 WeakPolarHBondContact O-CD1 3.37Å
383	H	94.8	Very high	94.1	Very high	15 Å²	15	58.2 Å²	58.2	7%	0.069	29%	0.287	C	S	.	.	H	α-helix	trans	-59.5	-42.3	173.6	-93.8	-59.5	0	0	0	112.9	S379 E381 L386 T387	S379-H383 PolarHBondContact O-N 2.91Å; E381-H383 VanDerWaalsContact C-N 3.33Å; E381-H383 PolarHBondContact O-N 3.07Å; H383-L386 PolarHBondContact O-N 2.79Å; H383-T387 WeakPolarHBondContact O-CB 3.2Å; H383-T387 PolarHBondContact O-N 2.98Å; H383-T387 PolarHBondContact O-OG1 2.82Å
384	T	95.9	Very high	94.1	Very high	72 Å²	72	58.2 Å²	58.2	44%	0.442	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-45.5	178.8	-56.7	0	0	0	0	110.9	E380 E381 A382 T387 R388	E380-T384 PolarHBondContact O-N 3.39Å; E380-T384 VanDerWaalsContact O-N 3.09Å; E380-T384 PolarHBondContact O-OG1 2.8Å; E381-T384 PolarHBondContact O-N 2.94Å; A382-T384 VanDerWaalsContact C-N 3.34Å; A382-T384 PolarHBondContact O-N 3.24Å; T384-T387 PolarHBondContact O-N 3.23Å; T384-R388 PolarHBondContact O-N 3.01Å; T384-R388 VanDerWaalsContact O-N 3.07Å
385	V	95.9	Very high	94.2	Very high	48 Å²	48	58.2 Å²	58.2	29%	0.291	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-45	176.5	174.1	0	0	0	0	111.3	E381 A382 T387 R388 I389 V419 I422	E381-V385 WeakPolarHBondContact O-CG2 3.22Å; E381-V385 PolarHBondContact O-N 2.89Å; A382-V385 PolarHBondContact O-N 2.92Å; V385-T387 VanDerWaalsContact C-N 3.34Å; V385-T387 PolarHBondContact O-N 3.26Å; V385-R388 PolarHBondContact O-N 2.69Å; V385-I389 HydrophobicContact CG1-CD1 4.07Å; V385-I389 WeakPolarHBondContact O-CG1 3.44Å; V385-I389 PolarHBondContact O-N 3.06Å; V385-V419 HydrophobicContact CG2-CG1 4.09Å; V385-V419 HydrophobicContact CG2-CG2 4.28Å; V385-I422 HydrophobicContact CG1-CG2 4.35Å
386	L	95.8	Very high	94.2	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-40	179	-170	65.8	0	0	0	112.2	L367 L378 A382 H383 R388 I389 G390 A398 L401 I402 I422	L367-L386 HydrophobicContact CD1-CD2 4.2Å; L367-L386 HydrophobicContact CD1-CG 4Å; L367-L386 HydrophobicContact CD2-CD2 4.33Å; L378-L386 HydrophobicContact CD2-CD2 3.84Å; A382-L386 VanDerWaalsContact O-CB 3.31Å; A382-L386 WeakPolarHBondContact O-CB 3.41Å; A382-L386 PolarHBondContact O-N 2.79Å; H383-L386 PolarHBondContact O-N 2.79Å; L386-R388 VanDerWaalsContact C-N 3.33Å; L386-R388 PolarHBondContact O-N 3.44Å; L386-I389 PolarHBondContact O-N 3.31Å; L386-G390 PolarHBondContact O-N 3.18Å; L386-A398 HydrophobicContact CD1-CB 4.33Å; L386-L401 HydrophobicContact CD1-CB 3.88Å; L386-L401 HydrophobicContact CD1-CD1 4.11Å; L386-I402 HydrophobicContact CD2-CD1 4.22Å; L386-I402 HydrophobicContact CD2-CG1 3.6Å; L386-I422 HydrophobicContact CB-CD1 4.1Å
387	T	96.3	Very high	94.2	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-45.5	176	-57.9	0	0	0	0	110.4	E360 T363 R364 H383 T384 V385 I389 G390 M391	E360-T387 HydrophobicContact CG-CG2 3.8Å; T363-T387 HydrophobicContact CG2-CG2 4.22Å; R364-T387 HydrophobicContact CB-CG2 3.88Å; H383-T387 WeakPolarHBondContact O-CB 3.2Å; H383-T387 PolarHBondContact O-N 2.98Å; H383-T387 PolarHBondContact O-OG1 2.82Å; T384-T387 PolarHBondContact O-N 3.23Å; V385-T387 VanDerWaalsContact C-N 3.34Å; V385-T387 PolarHBondContact O-N 3.26Å; T387-I389 PolarHBondContact O-N 3.04Å; T387-G390 PolarHBondContact O-N 2.88Å; T387-G390 VanDerWaalsContact O-N 3.13Å; T387-M391 WeakPolarHBondContact O-CG 3.23Å; T387-M391 PolarHBondContact O-N 3.38Å
388	R	95.8	Very high	94.2	Very high	161 Å²	161	54.9 Å²	54.9	61%	0.608	27%	0.265	S	S	*	.	H	α-helix	trans	-60.7	-44.1	176	-174.4	173.9	177	169.7	1.6	112.1	T384 V385 L386 G390 M391 E392	T384-R388 PolarHBondContact O-N 3.01Å; T384-R388 VanDerWaalsContact O-N 3.07Å; V385-R388 PolarHBondContact O-N 2.69Å; L386-R388 VanDerWaalsContact C-N 3.33Å; L386-R388 PolarHBondContact O-N 3.44Å; R388-G390 VanDerWaalsContact C-N 3.29Å; R388-G390 PolarHBondContact O-N 3.09Å; R388-M391 PolarHBondContact O-N 3.11Å; R388-E392 HydrophobicContact CG-CG 4.46Å; R388-E392 WeakPolarHBondContact CG-OE1 3.4Å; R388-E392 IonicContact CZ-OE1 2.66Å; R388-E392 IonicContact NE-OE1 3.86Å; R388-E392 PolarHBondContact NE-OE1 3.26Å; R388-E392 IonicContact NH2-OE1 3.23Å; R388-E392 PolarHBondContact NH2-OE1 2.97Å; R388-E392 WeakPolarHBondContact O-CG 3.29Å; R388-E392 PolarHBondContact O-N 2.69Å
389	I	95	Very high	94.2	Very high	17 Å²	17	55.6 Å²	55.6	9%	0.087	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-43.7	173.7	-67.5	167.5	0	0	0	110.5	V385 L386 T387 M391 E392 T393 Y397 L401 I422 Y426	V385-I389 HydrophobicContact CG1-CD1 4.07Å; V385-I389 WeakPolarHBondContact O-CG1 3.44Å; V385-I389 PolarHBondContact O-N 3.06Å; L386-I389 PolarHBondContact O-N 3.31Å; T387-I389 PolarHBondContact O-N 3.04Å; I389-M391 VanDerWaalsContact C-N 3.29Å; I389-M391 PolarHBondContact O-N 3.5Å; I389-E392 PolarHBondContact O-N 3.37Å; I389-T393 WeakPolarHBondContact O-CB 3.41Å; I389-T393 PolarHBondContact O-N 3.03Å; I389-T393 PolarHBondContact O-OG1 3.49Å; I389-Y397 HydrophobicContact CG2-CD1 3.99Å; I389-Y397 HydrophobicContact CG2-CE1 3.87Å; I389-L401 HydrophobicContact CD1-CD1 4.29Å; I389-L401 HydrophobicContact CG2-CD1 3.83Å; I389-I422 HydrophobicContact CD1-CG2 3.78Å; I389-Y426 HydrophobicContact CD1-CD2 3.97Å; I389-Y426 HydrophobicContact CD1-CE2 4.4Å; I389-Y426 HydrophobicContact CD1-CG 4.46Å; I389-Y426 HydrophobicContact CG1-CD2 4.42Å; I389-Y426 HydrophobicContact CG1-CE2 4.36Å; I389-Y426 HydrophobicContact CG2-CD2 4.27Å; I389-Y426 HydrophobicContact CG2-CE2 4.07Å
390	G	93	Very high	94	Very high	9 Å²	9	60.5 Å²	60.5	9%	0.093	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-31.7	178.2	0	0	0	0	0	114.2	L386 T387 R388	L386-G390 PolarHBondContact O-N 3.18Å; T387-G390 PolarHBondContact O-N 2.88Å; T387-G390 VanDerWaalsContact O-N 3.13Å; R388-G390 VanDerWaalsContact C-N 3.29Å; R388-G390 PolarHBondContact O-N 3.09Å
391	M	93.1	Very high	94	Very high	90 Å²	90	55.3 Å²	55.3	44%	0.443	27%	0.266	S	S	.	.	H	α-helix	trans	-77.8	-37.9	175.5	-67.7	-61	-63.3	0	0	112.9	E360 T363 T387 R388 I389	E360-M391 HydrophobicContact CB-CE 4.48Å; E360-M391 HydrophobicContact CB-CG 4.47Å; E360-M391 HydrophobicContact CB-SD 4.36Å; E360-M391 HydrophobicContact CG-CG 4.4Å; T363-M391 HydrophobicContact CG2-SD 4.27Å; T363-M391 PolarHBondContact OG1-SD 3.12Å; T363-M391 VanDerWaalsContact OG1-SD 3.38Å; T387-M391 WeakPolarHBondContact O-CG 3.23Å; T387-M391 PolarHBondContact O-N 3.38Å; R388-M391 PolarHBondContact O-N 3.11Å; I389-M391 VanDerWaalsContact C-N 3.29Å; I389-M391 PolarHBondContact O-N 3.5Å
392	E	91.9	Very high	94	Very high	123 Å²	123	48.6 Å²	48.6	58%	0.575	23%	0.234	S	C	*	.	H	α-helix	trans	-80.9	-24.5	-178.9	-69.9	175.6	-175.7	0	0	112.8	R388 I389	R388-E392 HydrophobicContact CG-CG 4.46Å; R388-E392 WeakPolarHBondContact CG-OE1 3.4Å; R388-E392 IonicContact CZ-OE1 2.66Å; R388-E392 IonicContact NE-OE1 3.86Å; R388-E392 PolarHBondContact NE-OE1 3.26Å; R388-E392 IonicContact NH2-OE1 3.23Å; R388-E392 PolarHBondContact NH2-OE1 2.97Å; R388-E392 WeakPolarHBondContact O-CG 3.29Å; R388-E392 PolarHBondContact O-N 2.69Å; I389-E392 PolarHBondContact O-N 3.37Å
393	T	91.9	Very high	93.9	Very high	45 Å²	45	51 Å²	51	28%	0.276	25%	0.252	S	S	.	.	S	Bend	trans	-117.1	-106.2	-177.8	63.7	0	0	0	0	112.1	I389 Y397 D431	I389-T393 WeakPolarHBondContact O-CB 3.41Å; I389-T393 PolarHBondContact O-N 3.03Å; I389-T393 PolarHBondContact O-OG1 3.49Å; T393-Y397 WeakPolarHBondContact OG1-CD1 3.35Å; T393-D431 HydrophobicContact CG2-CB 4.07Å
394	S	91.7	Very high	93.9	Very high	54 Å²	54	52.1 Å²	52.1	38%	0.378	26%	0.259	S	S	.	.			trans	-143.2	148.7	173.8	72.4	0	0	0	0	111.3	R396 Y397 A398	S394-R396 PolarHBondContact O-N 3.5Å; S394-Y397 PolarHBondContact O-N 2.9Å; S394-Y397 VanDerWaalsContact O-N 3.15Å; S394-Y397 WeakPolarHBondContact OG-CB 3.36Å; S394-Y397 PolarHBondContact OG-N 3.13Å; S394-Y397 VanDerWaalsContact OG-N 3.16Å; S394-A398 PolarHBondContact O-N 3.3Å
395	L	91.3	Very high	93.9	Very high	28 Å²	28	48.8 Å²	48.8	15%	0.147	24%	0.239	C	C	.	.	H	α-helix	trans	-57.5	-36.6	174.6	-177	63.5	0	0	0	111.9	Y358 T363 I366 L367 A398 I399	Y358-L395 HydrophobicContact CD2-CD2 4.33Å; Y358-L395 HydrophobicContact CE2-CD2 4.29Å; T363-L395 HydrophobicContact CG2-CD1 4.27Å; I366-L395 HydrophobicContact CD1-CD2 4.28Å; I366-L395 HydrophobicContact CG2-CD1 4.1Å; I366-L395 HydrophobicContact CG2-CD2 4.1Å; L367-L395 HydrophobicContact CD2-CD1 4.09Å; L367-L395 HydrophobicContact CG-CD1 4.37Å; L395-A398 PolarHBondContact O-N 3.38Å; L395-I399 HydrophobicContact CD1-CD1 4.39Å; L395-I399 HydrophobicContact CG-CD1 4.01Å; L395-I399 VanDerWaalsContact O-CG1 3.28Å; L395-I399 WeakPolarHBondContact O-CG1 3.49Å; L395-I399 PolarHBondContact O-N 2.62Å
396	R	91.8	Very high	93.8	Very high	187 Å²	187	46.8 Å²	46.8	71%	0.706	23%	0.228	S	C	*	.	H	α-helix	trans	-61.9	-45.5	177.7	-176.3	-178.4	-68.5	157.1	-5.8	111.6	S394 I399 Q400	S394-R396 PolarHBondContact O-N 3.5Å; R396-I399 PolarHBondContact O-N 3.36Å; R396-Q400 WeakPolarHBondContact O-CG 3.46Å; R396-Q400 PolarHBondContact O-N 3.11Å; R396-Q400 VanDerWaalsContact O-N 3.14Å
397	Y	94.3	Very high	93.8	Very high	18 Å²	18	52 Å²	52	7%	0.071	26%	0.256	C	S	.	.	H	α-helix	trans	-64.1	-44.7	177.5	177.7	-105.6	0	0	0	111	I389 T393 S394 I399 Q400 L401 Y426 F429 D431 R434	I389-Y397 HydrophobicContact CG2-CD1 3.99Å; I389-Y397 HydrophobicContact CG2-CE1 3.87Å; T393-Y397 WeakPolarHBondContact OG1-CD1 3.35Å; S394-Y397 PolarHBondContact O-N 2.9Å; S394-Y397 VanDerWaalsContact O-N 3.15Å; S394-Y397 WeakPolarHBondContact OG-CB 3.36Å; S394-Y397 PolarHBondContact OG-N 3.13Å; S394-Y397 VanDerWaalsContact OG-N 3.16Å; Y397-I399 VanDerWaalsContact C-N 3.33Å; Y397-I399 PolarHBondContact O-N 2.72Å; Y397-Q400 PolarHBondContact O-N 2.78Å; Y397-L401 HydrophobicContact CD1-CD1 4.01Å; Y397-L401 HydrophobicContact CD1-CG 4.41Å; Y397-L401 HydrophobicContact CE1-CD1 3.54Å; Y397-L401 HydrophobicContact CE1-CD2 4.42Å; Y397-L401 HydrophobicContact CE1-CG 4.08Å; Y397-L401 HydrophobicContact CE2-CD2 4.48Å; Y397-L401 WeakPolarHBondContact O-CG 3.48Å; Y397-L401 PolarHBondContact O-N 2.69Å; Y397-Y426 AromaticContact CE1-CD2 3.91Å; Y397-Y426 HydrophobicContact CE1-CD2 3.91Å; Y397-Y426 AromaticContact CE1-CE2 3.9Å; Y397-Y426 HydrophobicContact CE1-CE2 3.9Å; Y397-Y426 WeakPolarHBondContact OH-CD2 3.34Å; Y397-F429 PolarHBondContact OH-O 3.38Å; Y397-D431 HydrophobicContact CD1-CB 4.17Å; Y397-D431 HydrophobicContact CD2-CB 4.18Å; Y397-D431 HydrophobicContact CE1-CB 4.12Å; Y397-D431 HydrophobicContact CE2-CB 4.15Å; Y397-D431 HydrophobicContact CG-CB 4.2Å; Y397-R434 PolarHBondContact OH-NH2 2.84Å
398	A	94.6	Very high	93.7	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.8	-37.9	176.4	0	0	0	0	0	113.2	L367 L386 S394 L395 L401 I402	L367-A398 HydrophobicContact CD2-CB 3.88Å; L386-A398 HydrophobicContact CD1-CB 4.33Å; S394-A398 PolarHBondContact O-N 3.3Å; L395-A398 PolarHBondContact O-N 3.38Å; A398-L401 WeakPolarHBondContact O-CB 3.31Å; A398-L401 PolarHBondContact O-N 3.2Å; A398-I402 PolarHBondContact O-N 3Å
399	I	92.8	Very high	93.7	Very high	31 Å²	31	45.5 Å²	45.5	16%	0.159	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-43.5	175.3	-68.3	167.2	0	0	0	111.2	L367 R370 L395 R396 Y397 L401 I402	L367-I399 HydrophobicContact CD2-CG1 4.1Å; R370-I399 HydrophobicContact CG-CD1 4.13Å; R370-I399 HydrophobicContact CG-CG1 4.13Å; L395-I399 HydrophobicContact CD1-CD1 4.39Å; L395-I399 HydrophobicContact CG-CD1 4.01Å; L395-I399 VanDerWaalsContact O-CG1 3.28Å; L395-I399 WeakPolarHBondContact O-CG1 3.49Å; L395-I399 PolarHBondContact O-N 2.62Å; R396-I399 PolarHBondContact O-N 3.36Å; Y397-I399 VanDerWaalsContact C-N 3.33Å; Y397-I399 PolarHBondContact O-N 2.72Å; I399-L401 PolarHBondContact O-N 3.23Å; I399-I402 VanDerWaalsContact O-CB 3.32Å; I399-I402 WeakPolarHBondContact O-CB 3.11Å; I399-I402 PolarHBondContact O-N 2.75Å
400	Q	93.4	Very high	93.7	Very high	113 Å²	113	52.1 Å²	52.1	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-63.1	-31	176.3	-69.5	173	-16.3	0	0	112.5	R396 Y397 I402 T404	R396-Q400 WeakPolarHBondContact O-CG 3.46Å; R396-Q400 PolarHBondContact O-N 3.11Å; R396-Q400 VanDerWaalsContact O-N 3.14Å; Y397-Q400 PolarHBondContact O-N 2.78Å; Q400-I402 VanDerWaalsContact C-N 3.28Å; Q400-I402 PolarHBondContact O-N 2.84Å; Q400-T404 PolarHBondContact O-N 3.43Å; Q400-T404 PolarHBondContact O-OG1 3.27Å
401	L	95.2	Very high	93.8	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-29.4	173.1	-70.7	-180	0	0	0	112.6	L386 I389 Y397 A398 I399 T404 A405 V425 Y426	L386-L401 HydrophobicContact CD1-CB 3.88Å; L386-L401 HydrophobicContact CD1-CD1 4.11Å; I389-L401 HydrophobicContact CD1-CD1 4.29Å; I389-L401 HydrophobicContact CG2-CD1 3.83Å; Y397-L401 HydrophobicContact CD1-CD1 4.01Å; Y397-L401 HydrophobicContact CD1-CG 4.41Å; Y397-L401 HydrophobicContact CE1-CD1 3.54Å; Y397-L401 HydrophobicContact CE1-CD2 4.42Å; Y397-L401 HydrophobicContact CE1-CG 4.08Å; Y397-L401 HydrophobicContact CE2-CD2 4.48Å; Y397-L401 WeakPolarHBondContact O-CG 3.48Å; Y397-L401 PolarHBondContact O-N 2.69Å; A398-L401 WeakPolarHBondContact O-CB 3.31Å; A398-L401 PolarHBondContact O-N 3.2Å; I399-L401 PolarHBondContact O-N 3.23Å; L401-T404 VanDerWaalsContact CA-OG1 3.31Å; L401-T404 WeakPolarHBondContact CA-OG1 3.32Å; L401-T404 PolarHBondContact O-OG1 2.95Å; L401-A405 WeakPolarHBondContact O-CB 3.2Å; L401-A405 PolarHBondContact O-N 2.97Å; L401-V425 HydrophobicContact CD2-CB 4.18Å; L401-V425 HydrophobicContact CD2-CG1 3.27Å; L401-Y426 HydrophobicContact CD1-CD2 4.36Å
402	I	94.9	Very high	93.8	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-55.4	177	-63	167.9	0	0	0	109.8	L367 R370 V376 L386 A398 I399 Q400 T404 A405 G406	L367-I402 HydrophobicContact CD2-CD1 3.99Å; R370-I402 HydrophobicContact CB-CD1 3.86Å; V376-I402 HydrophobicContact CB-CG2 4.05Å; V376-I402 HydrophobicContact CG1-CG2 4.27Å; V376-I402 HydrophobicContact CG2-CG2 4.16Å; L386-I402 HydrophobicContact CD2-CD1 4.22Å; L386-I402 HydrophobicContact CD2-CG1 3.6Å; A398-I402 PolarHBondContact O-N 3Å; I399-I402 VanDerWaalsContact O-CB 3.32Å; I399-I402 WeakPolarHBondContact O-CB 3.11Å; I399-I402 PolarHBondContact O-N 2.75Å; Q400-I402 VanDerWaalsContact C-N 3.28Å; Q400-I402 PolarHBondContact O-N 2.84Å; I402-T404 VanDerWaalsContact C-N 3.33Å; I402-T404 PolarHBondContact O-N 2.94Å; I402-A405 PolarHBondContact O-N 3.34Å; I402-G406 PolarHBondContact O-N 3.35Å
403	S	92.6	Very high	93.9	Very high	52 Å²	52	64.2 Å²	64.2	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-63.3	-41.5	-176.3	-29.7	0	0	0	0	111.5	E374 G406 L407	E374-S403 WeakPolarHBondContact OE2-CB 3.25Å; E374-S403 PolarHBondContact OE2-OG 2.99Å; S403-G406 PolarHBondContact O-N 2.84Å; S403-L407 WeakPolarHBondContact O-CG 3.5Å; S403-L407 PolarHBondContact O-N 3.27Å; S403-L407 VanDerWaalsContact O-N 3.12Å
404	T	95.1	Very high	93.9	Very high	37 Å²	37	63.3 Å²	63.3	23%	0.227	30%	0.3	C	S	.	.	H	α-helix	trans	-72.4	-37.1	179.9	48	0	0	0	0	112.6	Q400 L401 I402 L407 V408 V425 F429	Q400-T404 PolarHBondContact O-N 3.43Å; Q400-T404 PolarHBondContact O-OG1 3.27Å; L401-T404 VanDerWaalsContact CA-OG1 3.31Å; L401-T404 WeakPolarHBondContact CA-OG1 3.32Å; L401-T404 PolarHBondContact O-OG1 2.95Å; I402-T404 VanDerWaalsContact C-N 3.33Å; I402-T404 PolarHBondContact O-N 2.94Å; T404-L407 PolarHBondContact O-N 3.35Å; T404-V408 WeakPolarHBondContact O-CG2 3.38Å; T404-V408 PolarHBondContact O-N 3.38Å; T404-V408 VanDerWaalsContact O-N 3.08Å; T404-V425 WeakPolarHBondContact OG1-CG1 3.25Å; T404-F429 HydrophobicContact CG2-CE2 4.18Å; T404-F429 HydrophobicContact CG2-CZ 4.5Å
405	A	95.8	Very high	93.8	Very high	3 Å²	3	66.8 Å²	66.8	3%	0.025	32%	0.319	C	S	.	.	H	α-helix	trans	-66.7	-38.5	173	0	0	0	0	0	111.6	L401 I402 L407 V408 C409 V417 I422 V425	L401-A405 WeakPolarHBondContact O-CB 3.2Å; L401-A405 PolarHBondContact O-N 2.97Å; I402-A405 PolarHBondContact O-N 3.34Å; A405-L407 VanDerWaalsContact C-N 3.31Å; A405-L407 PolarHBondContact O-N 2.97Å; A405-V408 PolarHBondContact O-N 2.97Å; A405-C409 WeakPolarHBondContact O-CB 3.28Å; A405-C409 PolarHBondContact O-N 2.78Å; A405-V417 HydrophobicContact CB-CG1 3.8Å; A405-I422 HydrophobicContact CB-CG1 4.18Å; A405-V425 HydrophobicContact CB-CG2 4.33Å
406	G	94.4	Very high	94	Very high	6 Å²	6	69 Å²	69	6%	0.062	33%	0.329	C	S	.	.	H	α-helix	trans	-57.1	-42.7	171.3	0	0	0	0	0	112.5	I402 S403 C409 R410	I402-G406 PolarHBondContact O-N 3.35Å; S403-G406 PolarHBondContact O-N 2.84Å; G406-C409 PolarHBondContact O-N 2.99Å; G406-R410 WeakPolarHBondContact O-CG 3.5Å; G406-R410 PolarHBondContact O-N 3.06Å
407	L	94.4	Very high	94.2	Very high	111 Å²	111	60.2 Å²	60.2	58%	0.581	30%	0.296	S	S	*	.	H	α-helix	trans	-65.3	-41.5	175.4	-70.4	173.5	0	0	0	112.9	S403 T404 A405 R410 K411	S403-L407 WeakPolarHBondContact O-CG 3.5Å; S403-L407 PolarHBondContact O-N 3.27Å; S403-L407 VanDerWaalsContact O-N 3.12Å; T404-L407 PolarHBondContact O-N 3.35Å; A405-L407 VanDerWaalsContact C-N 3.31Å; A405-L407 PolarHBondContact O-N 2.97Å; L407-R410 PolarHBondContact O-N 3.4Å; L407-K411 WeakPolarHBondContact O-CB 3.45Å; L407-K411 PolarHBondContact O-N 3.01Å
408	V	95.5	Very high	94.3	Very high	23 Å²	23	62.3 Å²	62.3	14%	0.139	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-42.2	176.5	172.8	0	0	0	0	111	T404 A405 K411 R412 D421 V425	T404-V408 WeakPolarHBondContact O-CG2 3.38Å; T404-V408 PolarHBondContact O-N 3.38Å; T404-V408 VanDerWaalsContact O-N 3.08Å; A405-V408 PolarHBondContact O-N 2.97Å; V408-K411 WeakPolarHBondContact O-CB 3.5Å; V408-K411 PolarHBondContact O-N 2.68Å; V408-R412 PolarHBondContact O-N 3.48Å; V408-D421 HydrophobicContact CG1-CB 4.14Å; V408-V425 HydrophobicContact CB-CG2 4.26Å; V408-V425 HydrophobicContact CG2-CG2 3.58Å
409	C	95.6	Very high	94.4	Very high	3 Å²	3	63.4 Å²	63.4	2%	0.02	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-48.6	176	-179.4	0	0	0	0	111.4	A405 G406 K411 R412 K413 G414 E416 V417	A405-C409 WeakPolarHBondContact O-CB 3.28Å; A405-C409 PolarHBondContact O-N 2.78Å; G406-C409 PolarHBondContact O-N 2.99Å; C409-K411 VanDerWaalsContact C-N 3.27Å; C409-K411 PolarHBondContact O-N 2.79Å; C409-R412 CarbonylContact O-C 3.59Å; C409-R412 WeakPolarHBondContact O-CA 3.45Å; C409-R412 WeakPolarHBondContact O-CB 3.48Å; C409-R412 PolarHBondContact O-N 2.81Å; C409-K413 PolarHBondContact O-N 3.32Å; C409-K413 VanDerWaalsContact O-N 3.1Å; C409-G414 PolarHBondContact O-N 3.47Å; C409-G414 PolarHBondContact SG-O 3.07Å; C409-G414 VanDerWaalsContact SG-O 3.41Å; C409-E416 PolarHBondContact SG-O 3.32Å; C409-V417 HydrophobicContact CB-CG2 3.84Å
410	R	94	Very high	94.6	Very high	156 Å²	156	68.4 Å²	68.4	59%	0.589	34%	0.335	S	S	*	.	H	α-helix	trans	-58.2	-38.4	174.4	-72.8	178.7	-169.3	177.2	5.1	112.1	G406 L407 R412 K413	G406-R410 WeakPolarHBondContact O-CG 3.5Å; G406-R410 PolarHBondContact O-N 3.06Å; L407-R410 PolarHBondContact O-N 3.4Å; R410-R412 VanDerWaalsContact C-N 3.32Å; R410-R412 PolarHBondContact O-N 3.38Å; R410-K413 WeakPolarHBondContact O-CA 3.38Å; R410-K413 PolarHBondContact O-N 3.19Å
411	K	94.6	Very high	94.7	Very high	172 Å²	172	63.3 Å²	63.3	75%	0.748	31%	0.312	S	S	*	.	H	α-helix	trans	-65.1	-34.3	175.4	-173.3	173.5	-178	173.6	0	112.6	L407 V408 C409 K413	L407-K411 WeakPolarHBondContact O-CB 3.45Å; L407-K411 PolarHBondContact O-N 3.01Å; V408-K411 WeakPolarHBondContact O-CB 3.5Å; V408-K411 PolarHBondContact O-N 2.68Å; C409-K411 VanDerWaalsContact C-N 3.27Å; C409-K411 PolarHBondContact O-N 2.79Å; K411-K413 PolarHBondContact O-N 3.32Å
412	R	93.8	Very high	94.7	Very high	110 Å²	110	63.1 Å²	63.1	42%	0.415	31%	0.311	S	S	.	.	H	α-helix	trans	-74	-7	170.4	-170	174.4	64.4	168.3	-5	112.7	V408 C409 R410 G414 E420 D421	V408-R412 PolarHBondContact O-N 3.48Å; C409-R412 CarbonylContact O-C 3.59Å; C409-R412 WeakPolarHBondContact O-CA 3.45Å; C409-R412 WeakPolarHBondContact O-CB 3.48Å; C409-R412 PolarHBondContact O-N 2.81Å; R410-R412 VanDerWaalsContact C-N 3.32Å; R410-R412 PolarHBondContact O-N 3.38Å; R412-G414 PolarHBondContact O-N 2.83Å; R412-E420 IonicContact NH1-OE2 2.82Å; R412-E420 PolarHBondContact NH1-OE2 3.35Å; R412-D421 IonicContact CZ-OD1 3.56Å; R412-D421 IonicContact CZ-OD2 2.81Å; R412-D421 IonicContact NE-OD1 3.7Å; R412-D421 IonicContact NH2-OD1 3.6Å; R412-D421 IonicContact NH2-OD2 3.4Å; R412-D421 PolarHBondContact NH2-OD2 3.31Å
413	K	94.2	Very high	94.7	Very high	193 Å²	193	69.4 Å²	69.4	84%	0.839	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	29.4	-169.7	-51.8	178.2	178.9	179.1	0	112.7	C409 R410 K411	C409-K413 PolarHBondContact O-N 3.32Å; C409-K413 VanDerWaalsContact O-N 3.1Å; R410-K413 WeakPolarHBondContact O-CA 3.38Å; R410-K413 PolarHBondContact O-N 3.19Å; K411-K413 PolarHBondContact O-N 3.32Å
414	G	91.1	Very high	94.8	Very high	26 Å²	26	73.8 Å²	73.8	27%	0.268	35%	0.347	S	S	.	.			trans	-82.6	154.1	169.5	0	0	0	0	0	111.1	C409 R412	C409-G414 PolarHBondContact O-N 3.47Å; C409-G414 PolarHBondContact SG-O 3.07Å; C409-G414 VanDerWaalsContact SG-O 3.41Å; R412-G414 PolarHBondContact O-N 2.83Å
415	T	91.4	Very high	94.9	Very high	127 Å²	127	72.1 Å²	72.1	78%	0.779	34%	0.336	S	S	*	.	S	Bend	trans	-90.7	-38.3	171.9	50.7	0	0	0	0	111.3
416	E	95.3	Very high	94.9	Very high	75 Å²	75	75 Å²	75	35%	0.35	35%	0.347	S	S	.	.	S	Bend	trans	-113.9	134.1	-176.2	-174.4	-173.9	-149.6	0	0	111.2	S379 C409 Q418	S379-E416 WeakPolarHBondContact CA-OE1 3.35Å; S379-E416 WeakPolarHBondContact CB-OE1 3.49Å; S379-E416 PolarHBondContact N-OE1 3.39Å; C409-E416 PolarHBondContact SG-O 3.32Å; E416-Q418 PolarHBondContact O-N 3.09Å; E416-Q418 PolarHBondContact OE2-NE2 3.14Å; E416-Q418 VanDerWaalsContact OE2-NE2 3.09Å
417	V	96.1	Very high	94.9	Very high	3 Å²	3	78.7 Å²	78.7	2%	0.018	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-69.6	126.3	176.8	176.6	0	0	0	0	110.2	V376 E377 L378 S379 A405 C409 D421 I422	V376-V417 HydrophobicContact CG1-CG2 3.63Å; E377-V417 PolarHBondContact O-N 2.88Å; L378-V417 HydrophobicContact CG-CB 4.03Å; L378-V417 HydrophobicContact CG-CG1 4.37Å; S379-V417 PolarHBondContact N-O 2.87Å; S379-V417 VanDerWaalsContact N-O 3.09Å; S379-V417 PolarHBondContact OG-O 2.75Å; A405-V417 HydrophobicContact CB-CG1 3.8Å; C409-V417 HydrophobicContact CB-CG2 3.84Å; V417-D421 HydrophobicContact CG1-CB 4.08Å; V417-I422 HydrophobicContact CG1-CD1 4.47Å; V417-I422 HydrophobicContact CG1-CG1 4.03Å
418	Q	96.6	Very high	94.9	Very high	62 Å²	62	78.7 Å²	78.7	29%	0.29	37%	0.372	S	S	.	.			trans	-103.9	165.6	179	-60.7	-63.6	-33.8	0	0	111	E416 E420 D421 I422	E416-Q418 PolarHBondContact O-N 3.09Å; E416-Q418 PolarHBondContact OE2-NE2 3.14Å; E416-Q418 VanDerWaalsContact OE2-NE2 3.09Å; Q418-E420 PolarHBondContact O-N 2.99Å; Q418-E420 VanDerWaalsContact O-N 3.17Å; Q418-D421 PolarHBondContact N-OD2 3.1Å; Q418-D421 WeakPolarHBondContact O-CB 3.38Å; Q418-D421 PolarHBondContact O-N 3.39Å; Q418-I422 PolarHBondContact O-N 3.31Å
419	V	96.4	Very high	95	Very high	23 Å²	23	82.6 Å²	82.6	14%	0.139	39%	0.387	C	S	.	.	H	α-helix	trans	-56.4	-34	178	177.3	0	0	0	0	112.1	E381 A382 V385 D421 I422 K423	E381-V419 HydrophobicContact CB-CG2 3.72Å; A382-V419 HydrophobicContact CB-CG2 4.36Å; V385-V419 HydrophobicContact CG2-CG1 4.09Å; V385-V419 HydrophobicContact CG2-CG2 4.28Å; V419-D421 VanDerWaalsContact C-N 3.32Å; V419-D421 PolarHBondContact O-N 3.46Å; V419-I422 PolarHBondContact O-N 2.95Å; V419-K423 HydrophobicContact CG1-CD 4.04Å; V419-K423 HydrophobicContact CG1-CG 4.27Å; V419-K423 WeakPolarHBondContact O-CB 3.22Å; V419-K423 WeakPolarHBondContact O-CG 3.35Å; V419-K423 PolarHBondContact O-N 3.08Å
420	E	95.6	Very high	94.9	Very high	135 Å²	135	86.5 Å²	86.5	63%	0.631	41%	0.407	S	S	*	.	H	α-helix	trans	-61.6	-38.3	177	-62.9	-179.3	166.8	0	0	112.8	R412 Q418 K423 R424	R412-E420 IonicContact NH1-OE2 2.82Å; R412-E420 PolarHBondContact NH1-OE2 3.35Å; Q418-E420 PolarHBondContact O-N 2.99Å; Q418-E420 VanDerWaalsContact O-N 3.17Å; E420-K423 PolarHBondContact O-N 3.44Å; E420-R424 VanDerWaalsContact O-CB 3.32Å; E420-R424 WeakPolarHBondContact O-CB 3.41Å; E420-R424 PolarHBondContact O-N 3.38Å
421	D	96.1	Very high	94.9	Very high	6 Å²	6	79.7 Å²	79.7	3%	0.032	38%	0.383	C	S	.	.	H	α-helix	trans	-67.4	-45.2	179.8	-58.3	-49.8	0	0	0	109.7	V408 R412 V417 Q418 V419 R424 V425	V408-D421 HydrophobicContact CG1-CB 4.14Å; R412-D421 IonicContact CZ-OD1 3.56Å; R412-D421 IonicContact CZ-OD2 2.81Å; R412-D421 IonicContact NE-OD1 3.7Å; R412-D421 IonicContact NH2-OD1 3.6Å; R412-D421 IonicContact NH2-OD2 3.4Å; R412-D421 PolarHBondContact NH2-OD2 3.31Å; V417-D421 HydrophobicContact CG1-CB 4.08Å; Q418-D421 PolarHBondContact N-OD2 3.1Å; Q418-D421 WeakPolarHBondContact O-CB 3.38Å; Q418-D421 PolarHBondContact O-N 3.39Å; V419-D421 VanDerWaalsContact C-N 3.32Å; V419-D421 PolarHBondContact O-N 3.46Å; D421-R424 WeakPolarHBondContact O-CB 3.45Å; D421-R424 PolarHBondContact O-N 3.37Å; D421-V425 WeakPolarHBondContact O-CG2 3.49Å; D421-V425 PolarHBondContact O-N 3.45Å
422	I	95.8	Very high	94.8	Very high	1 Å²	1	78.6 Å²	78.6	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-61.7	-47	175.7	-61.9	-178.7	0	0	0	110.8	A382 V385 L386 I389 A405 V417 Q418 V419 R424 V425 Y426	A382-I422 HydrophobicContact CB-CD1 3.65Å; A382-I422 WeakPolarHBondContact O-CD1 3.37Å; V385-I422 HydrophobicContact CG1-CG2 4.35Å; L386-I422 HydrophobicContact CB-CD1 4.1Å; I389-I422 HydrophobicContact CD1-CG2 3.78Å; A405-I422 HydrophobicContact CB-CG1 4.18Å; V417-I422 HydrophobicContact CG1-CD1 4.47Å; V417-I422 HydrophobicContact CG1-CG1 4.03Å; Q418-I422 PolarHBondContact O-N 3.31Å; V419-I422 PolarHBondContact O-N 2.95Å; I422-R424 VanDerWaalsContact C-N 3.29Å; I422-R424 PolarHBondContact O-N 3.4Å; I422-V425 PolarHBondContact O-N 2.78Å; I422-Y426 VanDerWaalsContact O-CB 3.25Å; I422-Y426 WeakPolarHBondContact O-CB 3.4Å; I422-Y426 PolarHBondContact O-N 3.31Å
423	K	95	Very high	94.7	Very high	134 Å²	134	76.2 Å²	76.2	58%	0.583	38%	0.384	S	S	*	.	H	α-helix	trans	-58.8	-42.1	177.3	-77.2	176.7	177.2	174.3	0	111.7	V419 E420 Y426 S427	V419-K423 HydrophobicContact CG1-CD 4.04Å; V419-K423 HydrophobicContact CG1-CG 4.27Å; V419-K423 WeakPolarHBondContact O-CB 3.22Å; V419-K423 WeakPolarHBondContact O-CG 3.35Å; V419-K423 PolarHBondContact O-N 3.08Å; E420-K423 PolarHBondContact O-N 3.44Å; K423-Y426 PolarHBondContact O-N 3.07Å; K423-S427 PolarHBondContact O-N 2.87Å
424	R	94.9	Very high	94.6	Very high	144 Å²	144	69.8 Å²	69.8	54%	0.543	36%	0.355	S	S	.	.	H	α-helix	trans	-62.4	-48.3	177	-176.4	173.7	-174.4	169.6	6.7	111.1	E420 D421 I422 S427 L428	E420-R424 VanDerWaalsContact O-CB 3.32Å; E420-R424 WeakPolarHBondContact O-CB 3.41Å; E420-R424 PolarHBondContact O-N 3.38Å; D421-R424 WeakPolarHBondContact O-CB 3.45Å; D421-R424 PolarHBondContact O-N 3.37Å; I422-R424 VanDerWaalsContact C-N 3.29Å; I422-R424 PolarHBondContact O-N 3.4Å; R424-S427 PolarHBondContact O-N 2.86Å; R424-S427 PolarHBondContact O-OG 3.41Å; R424-L428 HydrophobicContact CG-CD1 4.37Å; R424-L428 WeakPolarHBondContact O-CG 3.21Å; R424-L428 PolarHBondContact O-N 3.46Å
425	V	96.2	Very high	94.7	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.006	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-43.1	177.9	177.3	0	0	0	0	111.4	L401 T404 A405 V408 D421 I422 S427 L428 F429	L401-V425 HydrophobicContact CD2-CB 4.18Å; L401-V425 HydrophobicContact CD2-CG1 3.27Å; T404-V425 WeakPolarHBondContact OG1-CG1 3.25Å; A405-V425 HydrophobicContact CB-CG2 4.33Å; V408-V425 HydrophobicContact CB-CG2 4.26Å; V408-V425 HydrophobicContact CG2-CG2 3.58Å; D421-V425 WeakPolarHBondContact O-CG2 3.49Å; D421-V425 PolarHBondContact O-N 3.45Å; I422-V425 PolarHBondContact O-N 2.78Å; V425-S427 PolarHBondContact O-N 3.35Å; V425-L428 PolarHBondContact O-N 2.95Å; V425-F429 HydrophobicContact CG1-CD2 3.62Å; V425-F429 HydrophobicContact CG1-CE2 4.08Å; V425-F429 WeakPolarHBondContact O-CD2 3.46Å; V425-F429 PolarHBondContact O-N 3.47Å
426	Y	95.3	Very high	94.7	Very high	63 Å²	63	66.8 Å²	66.8	25%	0.247	34%	0.335	C	S	.	.	H	α-helix	trans	-61.4	-28.6	177.1	-173.1	-98.3	0	0	0	113.1	I389 Y397 L401 I422 K423 R434	I389-Y426 HydrophobicContact CD1-CD2 3.97Å; I389-Y426 HydrophobicContact CD1-CE2 4.4Å; I389-Y426 HydrophobicContact CD1-CG 4.46Å; I389-Y426 HydrophobicContact CG1-CD2 4.42Å; I389-Y426 HydrophobicContact CG1-CE2 4.36Å; I389-Y426 HydrophobicContact CG2-CD2 4.27Å; I389-Y426 HydrophobicContact CG2-CE2 4.07Å; Y397-Y426 AromaticContact CE1-CD2 3.91Å; Y397-Y426 HydrophobicContact CE1-CD2 3.91Å; Y397-Y426 AromaticContact CE1-CE2 3.9Å; Y397-Y426 HydrophobicContact CE1-CE2 3.9Å; Y397-Y426 WeakPolarHBondContact OH-CD2 3.34Å; L401-Y426 HydrophobicContact CD1-CD2 4.36Å; I422-Y426 VanDerWaalsContact O-CB 3.25Å; I422-Y426 WeakPolarHBondContact O-CB 3.4Å; I422-Y426 PolarHBondContact O-N 3.31Å; K423-Y426 PolarHBondContact O-N 3.07Å; Y426-R434 VanDerWaalsContact CZ-NH2 3.27Å; Y426-R434 PolarHBondContact O-NH1 2.75Å; Y426-R434 PolarHBondContact O-NH2 3.03Å; Y426-R434 PolarHBondContact OH-NE 3.46Å
427	S	94.8	Very high	94.5	Very high	84 Å²	84	68.6 Å²	68.6	59%	0.587	34%	0.343	S	S	*	.	H	α-helix	trans	-76	-28.3	172.4	74.9	0	0	0	0	113.5	K423 R424 V425	K423-S427 PolarHBondContact O-N 2.87Å; R424-S427 PolarHBondContact O-N 2.86Å; R424-S427 PolarHBondContact O-OG 3.41Å; V425-S427 PolarHBondContact O-N 3.35Å
428	L	95.4	Very high	94.3	Very high	111 Å²	111	74 Å²	74	58%	0.581	36%	0.364	S	S	*	.	H	α-helix	trans	-84.8	-37.3	-179	-68.9	171.8	0	0	0	112.4	R424 V425	R424-L428 HydrophobicContact CG-CD1 4.37Å; R424-L428 WeakPolarHBondContact O-CG 3.21Å; R424-L428 PolarHBondContact O-N 3.46Å; V425-L428 PolarHBondContact O-N 2.95Å
429	F	95.9	Very high	94	Very high	106 Å²	106	75.8 Å²	75.8	47%	0.465	37%	0.374	S	S	.	.	S	Bend	trans	-114.2	117.6	-176.7	-59.8	-77.5	0	0	0	109.9	Y397 T404 V425 R434	Y397-F429 PolarHBondContact OH-O 3.38Å; T404-F429 HydrophobicContact CG2-CE2 4.18Å; T404-F429 HydrophobicContact CG2-CZ 4.5Å; V425-F429 HydrophobicContact CG1-CD2 3.62Å; V425-F429 HydrophobicContact CG1-CE2 4.08Å; V425-F429 WeakPolarHBondContact O-CD2 3.46Å; V425-F429 PolarHBondContact O-N 3.47Å; F429-R434 PolarHBondContact O-NH2 3.2Å
430	L	94.1	Very high	93.6	Very high	84 Å²	84	81.9 Å²	81.9	44%	0.44	40%	0.398	S	S	.	.			trans	-82.2	145.2	176.1	-57.4	179.1	0	0	0	110.4	R434	L430-R434 HydrophobicContact CB-CB 4.41Å; L430-R434 HydrophobicContact CD2-CB 4.42Å
431	D	94.3	Very high	93.4	Very high	13 Å²	13	81.3 Å²	81.3	7%	0.07	40%	0.396	C	S	.	.			trans	-80	171.6	164.3	61.4	82.5	0	0	0	110.7	T393 Y397 A433 R434 S435	T393-D431 HydrophobicContact CG2-CB 4.07Å; Y397-D431 HydrophobicContact CD1-CB 4.17Å; Y397-D431 HydrophobicContact CD2-CB 4.18Å; Y397-D431 HydrophobicContact CE1-CB 4.12Å; Y397-D431 HydrophobicContact CE2-CB 4.15Å; Y397-D431 HydrophobicContact CG-CB 4.2Å; D431-A433 PolarHBondContact O-N 3.33Å; D431-A433 WeakPolarHBondContact OD1-CB 3.29Å; D431-A433 PolarHBondContact OD1-N 2.79Å; D431-R434 PolarHBondContact O-N 3.25Å; D431-R434 PolarHBondContact OD1-N 3.03Å; D431-R434 IonicContact OD2-CZ 2.95Å; D431-R434 IonicContact OD2-NE 3.78Å; D431-R434 PolarHBondContact OD2-NE 2.86Å; D431-R434 IonicContact OD2-NH2 3.82Å; D431-R434 PolarHBondContact OD2-NH2 2.95Å; D431-R434 VanDerWaalsContact OD2-NH2 3.15Å; D431-S435 VanDerWaalsContact O-CB 3.26Å; D431-S435 WeakPolarHBondContact O-CB 3.43Å; D431-S435 PolarHBondContact O-N 2.94Å
432	E	91.6	Very high	93.1	Very high	149 Å²	149	86.1 Å²	86.1	70%	0.696	41%	0.414	S	S	*	.	H	α-helix	trans	-59.6	-41.5	-176.8	-177.1	-87.5	140.4	0	0	112.7	S435 S436	E432-S435 PolarHBondContact O-N 2.89Å; E432-S436 VanDerWaalsContact O-CB 3.25Å; E432-S436 WeakPolarHBondContact O-CB 3.5Å; E432-S436 PolarHBondContact O-N 3.49Å; E432-S436 PolarHBondContact O-OG 3.26Å; E432-S436 VanDerWaalsContact O-OG 3.06Å; E432-S436 PolarHBondContact OE1-OG 3.22Å
433	A	91.8	Very high	92.7	Very high	61 Å²	61	88.8 Å²	88.8	50%	0.504	43%	0.427	S	S	.	.	H	α-helix	trans	-68	-45.2	-179	0	0	0	0	0	111.5	D431 S436 Q437	D431-A433 PolarHBondContact O-N 3.33Å; D431-A433 WeakPolarHBondContact OD1-CB 3.29Å; D431-A433 PolarHBondContact OD1-N 2.79Å; A433-S436 PolarHBondContact O-N 3.45Å; A433-Q437 PolarHBondContact O-N 3.12Å
434	R	93.1	Very high	92.2	Very high	58 Å²	58	89.5 Å²	89.5	22%	0.219	44%	0.437	C	S	.	.	H	α-helix	trans	-64.3	-39.6	174.6	-75.7	-168.6	-66.6	155.8	2	112.4	Y397 Y426 F429 L430 D431 Q437 Y438	Y397-R434 PolarHBondContact OH-NH2 2.84Å; Y426-R434 VanDerWaalsContact CZ-NH2 3.27Å; Y426-R434 PolarHBondContact O-NH1 2.75Å; Y426-R434 PolarHBondContact O-NH2 3.03Å; Y426-R434 PolarHBondContact OH-NE 3.46Å; F429-R434 PolarHBondContact O-NH2 3.2Å; L430-R434 HydrophobicContact CB-CB 4.41Å; L430-R434 HydrophobicContact CD2-CB 4.42Å; D431-R434 PolarHBondContact O-N 3.25Å; D431-R434 PolarHBondContact OD1-N 3.03Å; D431-R434 IonicContact OD2-CZ 2.95Å; D431-R434 IonicContact OD2-NE 3.78Å; D431-R434 PolarHBondContact OD2-NE 2.86Å; D431-R434 IonicContact OD2-NH2 3.82Å; D431-R434 PolarHBondContact OD2-NH2 2.95Å; D431-R434 VanDerWaalsContact OD2-NH2 3.15Å; R434-Q437 PolarHBondContact O-N 3.25Å; R434-Y438 WeakPolarHBondContact O-CB 3.47Å; R434-Y438 PolarHBondContact O-N 2.79Å
435	S	93.6	Very high	91.9	Very high	48 Å²	48	87.4 Å²	87.4	34%	0.336	45%	0.445	S	S	.	.	H	α-helix	trans	-64.1	-44.2	175.8	-173.4	0	0	0	0	111.4	D431 E432 Q437 Y438 M439	D431-S435 VanDerWaalsContact O-CB 3.26Å; D431-S435 WeakPolarHBondContact O-CB 3.43Å; D431-S435 PolarHBondContact O-N 2.94Å; E432-S435 PolarHBondContact O-N 2.89Å; S435-Q437 VanDerWaalsContact C-N 3.33Å; S435-Q437 PolarHBondContact O-N 3.09Å; S435-Y438 PolarHBondContact O-N 3.43Å; S435-M439 WeakPolarHBondContact O-CG 3.4Å; S435-M439 PolarHBondContact O-N 3.36Å
436	S	91.1	Very high	91.6	Very high	42 Å²	42	91.5 Å²	91.5	29%	0.294	46%	0.462	S	S	.	.	H	α-helix	trans	-63.4	-38.4	176.4	-73.9	0	0	0	0	111.8	E432 A433 M439 K440	E432-S436 VanDerWaalsContact O-CB 3.25Å; E432-S436 WeakPolarHBondContact O-CB 3.5Å; E432-S436 PolarHBondContact O-N 3.49Å; E432-S436 PolarHBondContact O-OG 3.26Å; E432-S436 VanDerWaalsContact O-OG 3.06Å; E432-S436 PolarHBondContact OE1-OG 3.22Å; A433-S436 PolarHBondContact O-N 3.45Å; S436-M439 PolarHBondContact O-N 2.87Å; S436-K440 WeakPolarHBondContact O-CG 3.49Å; S436-K440 PolarHBondContact O-N 2.87Å; S436-K440 VanDerWaalsContact O-N 3.09Å
437	Q	91.9	Very high	91	Very high	112 Å²	112	95.8 Å²	95.8	52%	0.523	49%	0.489	S	S	.	.	H	α-helix	trans	-65.2	-47.7	173.6	-177.2	178.7	-11.6	0	0	111.7	A433 R434 S435 M439 K440 E441	A433-Q437 PolarHBondContact O-N 3.12Å; R434-Q437 PolarHBondContact O-N 3.25Å; S435-Q437 VanDerWaalsContact C-N 3.33Å; S435-Q437 PolarHBondContact O-N 3.09Å; Q437-M439 VanDerWaalsContact C-N 3.28Å; Q437-M439 PolarHBondContact O-N 3.39Å; Q437-K440 WeakPolarHBondContact O-CB 2.99Å; Q437-K440 PolarHBondContact O-N 3.2Å; Q437-K440 VanDerWaalsContact O-N 3.08Å; Q437-E441 WeakPolarHBondContact CG-OE1 3.34Å; Q437-E441 PolarHBondContact NE2-OE1 2.79Å; Q437-E441 WeakPolarHBondContact O-CG 3.36Å; Q437-E441 PolarHBondContact O-N 2.98Å
438	Y	91.3	Very high	90.4	Very high	116 Å²	116	101.2 Å²	101.2	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-57	-43.6	175.7	-174.2	-89	0	0	0	111.1	R434 S435 K440 E441 Y442	R434-Y438 WeakPolarHBondContact O-CB 3.47Å; R434-Y438 PolarHBondContact O-N 2.79Å; S435-Y438 PolarHBondContact O-N 3.43Å; Y438-K440 VanDerWaalsContact C-N 3.3Å; Y438-K440 PolarHBondContact O-N 3.31Å; Y438-E441 PolarHBondContact O-N 3.13Å; Y438-Y442 HydrophobicContact CD1-CD2 4.03Å; Y438-Y442 AromaticContact CD2-CD2 3.97Å; Y438-Y442 HydrophobicContact CD2-CD2 3.97Å; Y438-Y442 AromaticContact CD2-CE2 3.76Å; Y438-Y442 HydrophobicContact CD2-CE2 3.76Å; Y438-Y442 AromaticContact CE1-CD2 3.77Å; Y438-Y442 HydrophobicContact CE1-CD2 3.77Å; Y438-Y442 HydrophobicContact CE1-CE2 4.19Å; Y438-Y442 HydrophobicContact CE1-CG 4.41Å; Y438-Y442 AromaticContact CE2-CD2 3.73Å; Y438-Y442 HydrophobicContact CE2-CD2 3.73Å; Y438-Y442 AromaticContact CE2-CE2 3.31Å; Y438-Y442 HydrophobicContact CE2-CE2 3.31Å; Y438-Y442 HydrophobicContact CG-CD2 4.12Å; Y438-Y442 HydrophobicContact CG-CE2 4.38Å; Y438-Y442 AromaticContact CZ-CD2 3.61Å; Y438-Y442 AromaticContact CZ-CE2 3.54Å; Y438-Y442 WeakPolarHBondContact O-CD2 3.42Å; Y438-Y442 PolarHBondContact O-N 3Å; Y438-Y442 VanDerWaalsContact O-N 3.07Å
439	M	89.8	Confident	89.2	Confident	101 Å²	101	98.7 Å²	98.7	50%	0.498	49%	0.489	S	S	.	.	H	α-helix	trans	-62.2	-35.6	176.5	-77.1	-165.5	72.6	0	0	113.5	S435 S436 Q437 Y442 Q443 F446	S435-M439 WeakPolarHBondContact O-CG 3.4Å; S435-M439 PolarHBondContact O-N 3.36Å; S436-M439 PolarHBondContact O-N 2.87Å; Q437-M439 VanDerWaalsContact C-N 3.28Å; Q437-M439 PolarHBondContact O-N 3.39Å; M439-Y442 CarbonylContact O-C 3.56Å; M439-Q443 VanDerWaalsContact O-CA 3.27Å; M439-Q443 WeakPolarHBondContact O-CA 3.45Å; M439-Q443 PolarHBondContact O-N 3.5Å; M439-F446 HydrophobicContact CB-CE2 4.41Å; M439-F446 HydrophobicContact CE-CD2 4.5Å; M439-F446 HydrophobicContact CG-CE2 4.21Å
440	K	89	Confident	87.9	Confident	150 Å²	150	102 Å²	102	65%	0.652	51%	0.506	S	S	*	.	H	α-helix	trans	-69.5	-41.7	175.2	-73.2	173.3	-177.4	179.8	0	112.2	S436 Q437 Y438 Y442 Q443	S436-K440 WeakPolarHBondContact O-CG 3.49Å; S436-K440 PolarHBondContact O-N 2.87Å; S436-K440 VanDerWaalsContact O-N 3.09Å; Q437-K440 WeakPolarHBondContact O-CB 2.99Å; Q437-K440 PolarHBondContact O-N 3.2Å; Q437-K440 VanDerWaalsContact O-N 3.08Å; Y438-K440 VanDerWaalsContact C-N 3.3Å; Y438-K440 PolarHBondContact O-N 3.31Å; K440-Y442 VanDerWaalsContact C-N 3.28Å; K440-Y442 PolarHBondContact O-N 3.44Å; K440-Q443 VanDerWaalsContact O-CB 3.23Å; K440-Q443 WeakPolarHBondContact O-CB 3.37Å; K440-Q443 PolarHBondContact O-N 3Å
441	E	91.4	Very high	86.2	Confident	123 Å²	123	102.3 Å²	102.3	58%	0.575	51%	0.512	S	S	*	.	H	α-helix	trans	-64.4	-34.5	179	-71.7	173.3	-169.5	0	0	112.1	Q437 Y438	Q437-E441 WeakPolarHBondContact CG-OE1 3.34Å; Q437-E441 PolarHBondContact NE2-OE1 2.79Å; Q437-E441 WeakPolarHBondContact O-CG 3.36Å; Q437-E441 PolarHBondContact O-N 2.98Å; Y438-E441 PolarHBondContact O-N 3.13Å
442	Y	89.4	Confident	84.2	Confident	108 Å²	108	111.3 Å²	111.3	42%	0.424	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104	18.5	178.4	-67.1	-85.1	0	0	0	113.2	Y438 M439 K440 D444 S445 F446	Y438-Y442 HydrophobicContact CD1-CD2 4.03Å; Y438-Y442 AromaticContact CD2-CD2 3.97Å; Y438-Y442 HydrophobicContact CD2-CD2 3.97Å; Y438-Y442 AromaticContact CD2-CE2 3.76Å; Y438-Y442 HydrophobicContact CD2-CE2 3.76Å; Y438-Y442 AromaticContact CE1-CD2 3.77Å; Y438-Y442 HydrophobicContact CE1-CD2 3.77Å; Y438-Y442 HydrophobicContact CE1-CE2 4.19Å; Y438-Y442 HydrophobicContact CE1-CG 4.41Å; Y438-Y442 AromaticContact CE2-CD2 3.73Å; Y438-Y442 HydrophobicContact CE2-CD2 3.73Å; Y438-Y442 AromaticContact CE2-CE2 3.31Å; Y438-Y442 HydrophobicContact CE2-CE2 3.31Å; Y438-Y442 HydrophobicContact CG-CD2 4.12Å; Y438-Y442 HydrophobicContact CG-CE2 4.38Å; Y438-Y442 AromaticContact CZ-CD2 3.61Å; Y438-Y442 AromaticContact CZ-CE2 3.54Å; Y438-Y442 WeakPolarHBondContact O-CD2 3.42Å; Y438-Y442 PolarHBondContact O-N 3Å; Y438-Y442 VanDerWaalsContact O-N 3.07Å; M439-Y442 CarbonylContact O-C 3.56Å; K440-Y442 VanDerWaalsContact C-N 3.28Å; K440-Y442 PolarHBondContact O-N 3.44Å; Y442-D444 PolarHBondContact O-N 3.19Å; Y442-S445 WeakPolarHBondContact O-CA 3.27Å; Y442-S445 WeakPolarHBondContact O-CB 3.47Å; Y442-S445 PolarHBondContact O-N 3.32Å; Y442-F446 WeakPolarHBondContact O-CD2 3.42Å; Y442-F446 PolarHBondContact O-N 3.2Å
443	Q	86.2	Confident	81.9	Confident	57 Å²	57	110.3 Å²	110.3	27%	0.266	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-54	-40.2	-175	177.1	169.7	-8.5	0	0	112.2	M439 K440 S445 F446 N449	M439-Q443 VanDerWaalsContact O-CA 3.27Å; M439-Q443 WeakPolarHBondContact O-CA 3.45Å; M439-Q443 PolarHBondContact O-N 3.5Å; K440-Q443 VanDerWaalsContact O-CB 3.23Å; K440-Q443 WeakPolarHBondContact O-CB 3.37Å; K440-Q443 PolarHBondContact O-N 3Å; Q443-S445 PolarHBondContact O-N 3.45Å; Q443-S445 VanDerWaalsContact O-N 3.16Å; Q443-F446 PolarHBondContact O-N 3.4Å; Q443-N449 HydrophobicContact CG-CB 3.71Å; Q443-N449 PolarHBondContact NE2-O 2.75Å; Q443-N449 WeakPolarHBondContact O-CB 3.36Å; Q443-N449 PolarHBondContact O-ND2 2.93Å; Q443-N449 VanDerWaalsContact O-ND2 3.09Å
444	D	86.3	Confident	79.8	Confident	148 Å²	148	110.8 Å²	110.8	79%	0.791	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-63.1	-22.1	178.7	-66.2	-19.2	0	0	0	113.8	Y442 N449	Y442-D444 PolarHBondContact O-N 3.19Å; D444-N449 WeakPolarHBondContact CA-ND2 3.47Å
445	S	88.5	Confident	77.1	Confident	101 Å²	101	112.7 Å²	112.7	71%	0.706	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-92	-9.3	178	-57.2	0	0	0	0	113.2	Y442 Q443	Y442-S445 WeakPolarHBondContact O-CA 3.27Å; Y442-S445 WeakPolarHBondContact O-CB 3.47Å; Y442-S445 PolarHBondContact O-N 3.32Å; Q443-S445 PolarHBondContact O-N 3.45Å; Q443-S445 VanDerWaalsContact O-N 3.16Å
446	F	88.1	Confident	74.6	Confident	86 Å²	86	119.5 Å²	119.5	38%	0.377	63%	0.625	S	S	.	*	S	Bend	trans	-96.1	146.2	179.6	-69.8	-61.7	0	0	0	111.9	M439 Y442 Q443 N449	M439-F446 HydrophobicContact CB-CE2 4.41Å; M439-F446 HydrophobicContact CE-CD2 4.5Å; M439-F446 HydrophobicContact CG-CE2 4.21Å; Y442-F446 WeakPolarHBondContact O-CD2 3.42Å; Y442-F446 PolarHBondContact O-N 3.2Å; Q443-F446 PolarHBondContact O-N 3.4Å; F446-N449 WeakPolarHBondContact O-CB 3.23Å
447	L	83.9	Confident	71.9	Confident	153 Å²	153	125.2 Å²	125.2	80%	0.801	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	146.6	174.7	-67.1	169.6	0	0	0	110.5	N449	L447-N449 VanDerWaalsContact C-N 3.34Å
448	F	80.8	Confident	69.3	Low	199 Å²	199	126.1 Å²	126.1	87%	0.873	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.2	40.4	-179.1	-47.6	-74.9	0	0	0	113.6	E450	F448-E450 VanDerWaalsContact C-N 3.26Å; F448-E450 PolarHBondContact O-N 2.67Å
449	N	72	Confident	66.6	Low	58 Å²	58	130.2 Å²	130.2	31%	0.31	71%	0.711	S	S	.	*			trans	-81.1	0.6	-180	63.6	-6.2	0	0	0	114.8	Q443 D444 F446 L447 T451	Q443-N449 HydrophobicContact CG-CB 3.71Å; Q443-N449 PolarHBondContact NE2-O 2.75Å; Q443-N449 WeakPolarHBondContact O-CB 3.36Å; Q443-N449 PolarHBondContact O-ND2 2.93Å; Q443-N449 VanDerWaalsContact O-ND2 3.09Å; D444-N449 WeakPolarHBondContact CA-ND2 3.47Å; F446-N449 WeakPolarHBondContact O-CB 3.23Å; L447-N449 VanDerWaalsContact C-N 3.34Å; N449-T451 VanDerWaalsContact C-N 3.34Å; N449-T451 PolarHBondContact O-N 3.04Å
450	E	68.6	Low	65.5	Low	176 Å²	176	131.7 Å²	131.7	82%	0.822	72%	0.722	S	S	*	*			trans	-64.4	92.6	170.5	-65.4	179.1	-179.4	0	0	109.1	F448 Q452	F448-E450 VanDerWaalsContact C-N 3.26Å; F448-E450 PolarHBondContact O-N 2.67Å; E450-Q452 PolarHBondContact O-N 2.96Å
451	T	58.2	Low	64.2	Low	90 Å²	90	130.7 Å²	130.7	55%	0.552	73%	0.725	S	S	*	*			trans	-55.4	125.5	162.5	32.2	0	0	0	0	107.8	N449 T453	N449-T451 VanDerWaalsContact C-N 3.34Å; N449-T451 PolarHBondContact O-N 3.04Å; T451-T453 PolarHBondContact O-N 3.03Å; T451-T453 PolarHBondContact O-OG1 3.46Å
452	Q	50.7	Low	62.7	Low	201 Å²	201	131.1 Å²	131.1	94%	0.939	73%	0.734	S	S	*	*			trans	-63.7	75.6	167.5	-76	-174.9	-10.5	0	0	109.8	E450 G454	E450-Q452 PolarHBondContact O-N 2.96Å; Q452-G454 VanDerWaalsContact C-N 3.29Å; Q452-G454 PolarHBondContact O-N 3.36Å
453	T	44.9	Very low	61.2	Low	129 Å²	129	132.5 Å²	132.5	79%	0.791	75%	0.752	S	S	*	*			trans	-87.5	73	163.6	44.7	0	0	0	0	107.6	T451	T451-T453 PolarHBondContact O-N 3.03Å; T451-T453 PolarHBondContact O-OG1 3.46Å
454	G	47	Very low	59.6	Low	70 Å²	70	137.2 Å²	137.2	72%	0.722	78%	0.782	S	S	*	*			trans	-173.1	70.6	-177.3	0	0	0	0	0	114.6	Q452	Q452-G454 VanDerWaalsContact C-N 3.29Å; Q452-G454 PolarHBondContact O-N 3.36Å
455	A	36.8	Very low	57.8	Low	98 Å²	98	136.5 Å²	136.5	81%	0.81	78%	0.782	S	S	*	*	S	Bend	trans	-174	57.5	149	0	0	0	0	0	111.1
456	M	41.5	Very low	55.6	Low	192 Å²	192	139 Å²	139	95%	0.946	79%	0.787	S	S	*	*			trans	-143.3	65	154.2	-92.9	-168.8	178.2	0	0	106.9
457	D	33.6	Very low	53.1	Low	162 Å²	162	143.1 Å²	143.1	87%	0.866	82%	0.819	S	S	*	*			trans	-103.2	123.2	157.2	-90.2	-28.9	0	0	0	108
458	T	37	Very low	50.6	Low	131 Å²	131	142.3 Å²	142.3	80%	0.804	82%	0.82	S	S	*	*			trans	-48.4	128.3	172.5	43	0	0	0	0	113.2
459	S	35.7	Very low	47.8	Very low	201 Å²	201	137.1 Å²	137.1	100%	1.406	82%	0.815	S	S	*	*			trans	-160.5	0	142.5	-66.4	0	0	0	0	108.6

Retrieved 459 of 459 residues in 480.3 ms (Link to these results)

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