A0A087XIC2_POEFO Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A087XIC2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 483 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	P	31.7	Very low	40.7	Very low	182 Å²	182	110.2 Å²	110.2	100%	1.182	59%	0.593	S	S	*	*				0	87.3	0	23.5	0.2	0	0	0	109.6
2	A	34.7	Very low	40.6	Very low	57 Å²	57	107.2 Å²	107.2	47%	0.471	58%	0.581	S	S	.	*			trans	-103.8	92.3	-175.6	0	0	0	0	0	108.5
3	C	45.1	Very low	40.3	Very low	44 Å²	44	109.1 Å²	109.1	30%	0.297	59%	0.587	S	S	.	*			trans	-59.9	161	172.1	-159.8	0	0	0	0	111.2	E81 R84	C3-E81 PolarHBondContact SG-OE2 3.49Å; C3-R84 PolarHBondContact SG-NH1 3.09Å
4	C	43.9	Very low	39.8	Very low	3 Å²	3	112.5 Å²	112.5	2%	0.02	60%	0.604	C	S	.	*			trans	-24.2	125.7	-177.4	-74.2	0	0	0	0	115.4	L69 R70 F71 H85	C4-L69 HydrophobicContact CB-CD2 4.47Å; C4-R70 WeakPolarHBondContact CA-O 3.43Å; C4-R70 WeakPolarHBondContact CB-O 3.28Å; C4-R70 PolarHBondContact SG-O 3.02Å; C4-F71 PolarHBondContact SG-O 2.83Å; C4-H85 PolarHBondContact O-CE1 3.34Å
5	R	49.5	Very low	39.6	Very low	157 Å²	157	118.9 Å²	118.9	59%	0.592	62%	0.616	S	S	*	*			trans	-101.5	141.5	-175.9	-68.3	-172	-178.2	-170.5	1.6	113.8	R70 F71	R5-R70 PolarHBondContact O-NH2 3.09Å; R5-R70 VanDerWaalsContact O-NH2 3.08Å; R5-F71 HydrophobicContact CB-CD2 4.08Å; R5-F71 HydrophobicContact CB-CE2 4.27Å; R5-F71 HydrophobicContact CG-CD2 4.49Å
6	M	46.4	Very low	39.7	Very low	120 Å²	120	115.6 Å²	115.6	59%	0.591	60%	0.598	S	S	*	*			trans	-75.5	152.9	172.3	-61.4	173.6	69.3	0	0	112.1	R70	M6-R70 PolarHBondContact O-NH2 3.38Å
7	S	43.5	Very low	39.5	Very low	49 Å²	49	118.5 Å²	118.5	34%	0.343	61%	0.614	S	S	.	*			trans	-138.7	125.7	163.5	54.3	0	0	0	0	110.2	D9 R70	S7-D9 PolarHBondContact O-N 3.39Å; S7-R70 PolarHBondContact OG-NH2 3.11Å
8	D	41.4	Very low	39.5	Very low	164 Å²	164	120.9 Å²	120.9	88%	0.877	62%	0.622	S	S	*	*			trans	-86.1	90.6	162.4	-77.1	-29.6	0	0	0	108.8
9	D	38.2	Very low	40	Very low	106 Å²	106	120.8 Å²	120.8	57%	0.567	62%	0.618	S	S	*	*			trans	-106.3	89.5	165.5	-162.1	-4.8	0	0	0	109.4	S7 S11 T12	S7-D9 PolarHBondContact O-N 3.39Å; D9-S11 PolarHBondContact O-N 3.34Å; D9-T12 PolarHBondContact O-N 3.09Å
10	R	37.5	Very low	40.7	Very low	225 Å²	225	119.2 Å²	119.2	85%	0.849	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-14	-176	-104.5	175.6	161	-179.4	-5.5	114
11	S	35.5	Very low	41.6	Very low	105 Å²	105	122.1 Å²	122.1	73%	0.734	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-12.5	-179.1	-164	0	0	0	0	114.3	D9	D9-S11 PolarHBondContact O-N 3.34Å
12	T	39.8	Very low	43.8	Very low	74 Å²	74	114.2 Å²	114.2	45%	0.454	57%	0.567	S	S	.	*	S	Bend	trans	-98.4	-11.9	-179.4	-47.5	0	0	0	0	112.8	D9 L14 R15	D9-T12 PolarHBondContact O-N 3.09Å; T12-L14 PolarHBondContact O-N 3.25Å; T12-L14 VanDerWaalsContact O-N 3.12Å; T12-R15 PolarHBondContact O-N 3.3Å
13	M	36.3	Very low	45.9	Very low	132 Å²	132	117.4 Å²	117.4	65%	0.65	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-62	-18.9	-179.1	-87.3	-169.8	65.6	0	0	115
14	L	33.1	Very low	47.5	Very low	157 Å²	157	119.4 Å²	119.4	82%	0.822	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-84.7	-1	-178	-84.4	162.5	0	0	0	114.7	T12	T12-L14 PolarHBondContact O-N 3.25Å; T12-L14 VanDerWaalsContact O-N 3.12Å
15	R	37.3	Very low	49.6	Very low	209 Å²	209	120.3 Å²	120.3	79%	0.789	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-103.4	-3.8	174.2	-78.4	-169.2	174.3	-169	-1.2	115	T12	T12-R15 PolarHBondContact O-N 3.3Å
16	I	41.3	Very low	51.2	Low	65 Å²	65	114.5 Å²	114.5	33%	0.333	56%	0.561	S	S	.	*	S	Bend	trans	-102.6	-10.3	-165.1	-71.4	156.3	0	0	0	113.2	E18 Q61	I16-E18 PolarHBondContact O-N 3.47Å; I16-Q61 VanDerWaalsContact CG2-NE2 3.26Å
17	L	36.2	Very low	53.1	Low	166 Å²	166	110.4 Å²	110.4	87%	0.869	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	7.8	175.4	-66.5	171.3	0	0	0	113.7
18	E	40.4	Very low	55.4	Low	162 Å²	162	108.1 Å²	108.1	76%	0.757	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	6.6	-165.9	-101.6	178.2	175.2	0	0	116.8	I16 P20	I16-E18 PolarHBondContact O-N 3.47Å; E18-P20 VanDerWaalsContact O-CD 3.22Å; E18-P20 WeakPolarHBondContact O-CD 3.24Å
19	E	48	Very low	57.8	Low	118 Å²	118	103.1 Å²	103.1	55%	0.551	50%	0.497	S	S	*	.			trans	-120.8	81.7	-177.5	-66.5	-171.2	-177.2	0	0	115.4	R21 M22	E19-R21 PolarHBondContact O-N 2.86Å; E19-M22 WeakPolarHBondContact OE2-CE 3.1Å
20	P	54	Low	60.1	Low	88 Å²	88	103.6 Å²	103.6	57%	0.571	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-56.9	-17.4	170.7	-23.6	32	0	0	0	115	E18 M22	E18-P20 VanDerWaalsContact O-CD 3.22Å; E18-P20 WeakPolarHBondContact O-CD 3.24Å; P20-M22 PolarHBondContact O-N 3.09Å
21	R	60.5	Low	62.5	Low	181 Å²	181	94.5 Å²	94.5	68%	0.683	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-72.4	-23.5	-171.3	-60.1	-175.5	176.8	172.9	-0.7	113.9	E19 R23 E24 E27	E19-R21 PolarHBondContact O-N 2.86Å; R21-R23 PolarHBondContact O-N 3.28Å; R21-R23 VanDerWaalsContact O-N 3.08Å; R21-E24 PolarHBondContact O-N 3.21Å; R21-E27 HydrophobicContact CB-CG 3.92Å; R21-E27 WeakPolarHBondContact O-CB 3.5Å; R21-E27 WeakPolarHBondContact O-CG 3.26Å
22	M	77.1	Confident	65.1	Low	17 Å²	17	90 Å²	90	8%	0.084	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-76.3	4.9	-175.5	-61.9	-58.5	163.3	0	0	114.5	E19 P20 E27 R28 T31 F52 F63	E19-M22 WeakPolarHBondContact OE2-CE 3.1Å; P20-M22 PolarHBondContact O-N 3.09Å; M22-E27 HydrophobicContact CE-CG 4.29Å; M22-E27 HydrophobicContact SD-CG 4.08Å; M22-R28 HydrophobicContact CB-CG 4.22Å; M22-R28 VanDerWaalsContact O-CD 3.23Å; M22-R28 WeakPolarHBondContact O-CD 3.31Å; M22-R28 WeakPolarHBondContact O-CG 3.15Å; M22-R28 PolarHBondContact O-NH1 2.87Å; M22-R28 HydrophobicContact SD-CG 4.2Å; M22-T31 HydrophobicContact CE-CG2 3.54Å; M22-T31 HydrophobicContact SD-CG2 3.84Å; M22-F52 HydrophobicContact CB-CD1 4.01Å; M22-F52 HydrophobicContact CB-CE1 4.3Å; M22-F52 HydrophobicContact CE-CD2 4.43Å; M22-F52 HydrophobicContact CG-CD1 3.84Å; M22-F52 HydrophobicContact CG-CD2 4.4Å; M22-F52 HydrophobicContact CG-CE1 4.08Å; M22-F52 HydrophobicContact CG-CG 4.02Å; M22-F52 HydrophobicContact CG-CZ 4.45Å; M22-F52 HydrophobicContact SD-CB 3.82Å; M22-F52 HydrophobicContact SD-CD1 4.22Å; M22-F52 HydrophobicContact SD-CD2 4.25Å; M22-F52 HydrophobicContact SD-CG 3.85Å; M22-F63 HydrophobicContact CB-CB 3.72Å; M22-F63 VanDerWaalsContact O-CB 3.3Å; M22-F63 WeakPolarHBondContact O-CB 3.4Å; M22-F63 WeakPolarHBondContact O-CG 3.06Å
23	R	78	Confident	67.2	Low	123 Å²	123	94 Å²	94	46%	0.464	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-73.5	-26.5	171.7	-68.9	-171	-169	-83.6	-4.3	113	R21 R28 F63 V97 G98 N99 I100	R21-R23 PolarHBondContact O-N 3.28Å; R21-R23 VanDerWaalsContact O-N 3.08Å; R23-R28 PolarHBondContact O-NH1 3.01Å; R23-R28 VanDerWaalsContact O-NH1 3.08Å; R23-F63 HydrophobicContact CG-CD2 4.09Å; R23-F63 HydrophobicContact CG-CE2 4.21Å; R23-V97 PolarHBondContact NH1-O 3.36Å; R23-G98 WeakPolarHBondContact CB-O 3.4Å; R23-N99 PolarHBondContact O-OD1 3.27Å; R23-I100 PolarHBondContact O-N 3.47Å
24	E	80.3	Confident	69.4	Low	87 Å²	87	94.3 Å²	94.3	41%	0.407	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-82	124.5	173.7	-68	177.7	-153.4	0	0	111	R21 A26 E27 R28 I100	R21-E24 PolarHBondContact O-N 3.21Å; E24-A26 PolarHBondContact O-N 3.02Å; E24-E27 HydrophobicContact CB-CB 4.03Å; E24-E27 PolarHBondContact O-N 3.31Å; E24-E27 VanDerWaalsContact O-N 3.11Å; E24-R28 PolarHBondContact O-N 3.47Å; E24-I100 HydrophobicContact CG-CB 4.1Å; E24-I100 HydrophobicContact CG-CD1 3.71Å; E24-I100 HydrophobicContact CG-CG1 4.46Å; E24-I100 HydrophobicContact CG-CG2 4.4Å
25	E	86.7	Confident	72	Confident	22 Å²	22	88.1 Å²	88.1	10%	0.103	41%	0.412	C	S	.	.	H	α-helix	trans	-58.5	-34.4	174.6	-174.2	-175.2	165.6	0	0	111.5	R28 L29 A47 I100 S101 L102	E25-R28 PolarHBondContact O-N 2.91Å; E25-L29 WeakPolarHBondContact O-CB 3.48Å; E25-L29 PolarHBondContact O-N 3.14Å; E25-A47 HydrophobicContact CG-CB 4.4Å; E25-I100 WeakPolarHBondContact CB-O 3.17Å; E25-I100 PolarHBondContact N-O 3.11Å; E25-S101 VanDerWaalsContact OE2-CA 3.22Å; E25-S101 WeakPolarHBondContact OE2-CA 3.41Å; E25-L102 HydrophobicContact CB-CD1 4.4Å; E25-L102 HydrophobicContact CB-CG 4.01Å; E25-L102 HydrophobicContact CG-CB 4.48Å; E25-L102 HydrophobicContact CG-CD1 3.77Å; E25-L102 HydrophobicContact CG-CG 3.87Å; E25-L102 PolarHBondContact OE2-N 3.01Å
26	A	84.5	Confident	73.9	Confident	34 Å²	34	80.5 Å²	80.5	28%	0.281	39%	0.389	S	S	.	.	H	α-helix	trans	-61.9	-43.4	174.5	0	0	0	0	0	113.1	E24 L29 R30 L102	E24-A26 PolarHBondContact O-N 3.02Å; A26-L29 PolarHBondContact O-N 3.48Å; A26-R30 WeakPolarHBondContact O-CG 3.5Å; A26-R30 PolarHBondContact O-N 2.94Å; A26-L102 HydrophobicContact CB-CD2 3.55Å; A26-L102 HydrophobicContact CB-CG 4.44Å
27	E	85.9	Confident	75.5	Confident	35 Å²	35	82.8 Å²	82.8	16%	0.164	42%	0.417	C	S	.	.	H	α-helix	trans	-68.5	-43.2	177.1	-175.5	79.5	-124.2	0	0	110.5	R21 M22 E24 L29 R30 T31	R21-E27 HydrophobicContact CB-CG 3.92Å; R21-E27 WeakPolarHBondContact O-CB 3.5Å; R21-E27 WeakPolarHBondContact O-CG 3.26Å; M22-E27 HydrophobicContact CE-CG 4.29Å; M22-E27 HydrophobicContact SD-CG 4.08Å; E24-E27 HydrophobicContact CB-CB 4.03Å; E24-E27 PolarHBondContact O-N 3.31Å; E24-E27 VanDerWaalsContact O-N 3.11Å; E27-L29 VanDerWaalsContact C-N 3.29Å; E27-L29 PolarHBondContact O-N 3.12Å; E27-R30 WeakPolarHBondContact O-CB 3.08Å; E27-R30 PolarHBondContact O-N 3.35Å; E27-R30 VanDerWaalsContact O-N 3.09Å; E27-R30 IonicContact OE1-CZ 3.06Å; E27-R30 IonicContact OE1-NH1 2.87Å; E27-R30 PolarHBondContact OE1-NH1 3.41Å; E27-R30 IonicContact OE1-NH2 2.58Å; E27-R30 IonicContact OE2-CZ 3.3Å; E27-R30 IonicContact OE2-NH1 3.78Å; E27-R30 PolarHBondContact OE2-NH1 3.01Å; E27-R30 IonicContact OE2-NH2 2.61Å; E27-R30 PolarHBondContact OE2-NH2 3.4Å; E27-T31 PolarHBondContact O-N 2.83Å
28	R	92.2	Very high	77.6	Confident	0 Å²	0	81.8 Å²	81.8	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-57.6	-45.6	174.5	-66.9	-164.6	-61.7	-85	2.9	111.1	M22 R23 E24 E25 R30 T31 F32 A47 F52 N99	M22-R28 HydrophobicContact CB-CG 4.22Å; M22-R28 VanDerWaalsContact O-CD 3.23Å; M22-R28 WeakPolarHBondContact O-CD 3.31Å; M22-R28 WeakPolarHBondContact O-CG 3.15Å; M22-R28 PolarHBondContact O-NH1 2.87Å; M22-R28 HydrophobicContact SD-CG 4.2Å; R23-R28 PolarHBondContact O-NH1 3.01Å; R23-R28 VanDerWaalsContact O-NH1 3.08Å; E24-R28 PolarHBondContact O-N 3.47Å; E25-R28 PolarHBondContact O-N 2.91Å; R28-R30 VanDerWaalsContact C-N 3.28Å; R28-R30 PolarHBondContact O-N 3.3Å; R28-T31 WeakPolarHBondContact O-CB 3.36Å; R28-T31 PolarHBondContact O-N 3.33Å; R28-T31 VanDerWaalsContact O-N 3.09Å; R28-T31 PolarHBondContact O-OG1 2.91Å; R28-F32 WeakPolarHBondContact O-CD2 3.46Å; R28-F32 WeakPolarHBondContact O-CE2 3.32Å; R28-A47 HydrophobicContact CB-CB 4.19Å; R28-A47 PolarHBondContact NE-O 3.47Å; R28-A47 PolarHBondContact NH2-O 3.48Å; R28-F52 HydrophobicContact CB-CB 4.19Å; R28-F52 HydrophobicContact CG-CB 4.13Å; R28-N99 PolarHBondContact NH1-OD1 3.21Å; R28-N99 PolarHBondContact NH2-OD1 3.22Å
29	L	90.3	Very high	79.6	Confident	59 Å²	59	75.1 Å²	75.1	31%	0.309	39%	0.386	S	S	.	.	H	α-helix	trans	-61.4	-37.4	177.6	-171.3	60.5	0	0	0	112.1	E25 A26 E27 T31 F32 A47 L102	E25-L29 WeakPolarHBondContact O-CB 3.48Å; E25-L29 PolarHBondContact O-N 3.14Å; A26-L29 PolarHBondContact O-N 3.48Å; E27-L29 VanDerWaalsContact C-N 3.29Å; E27-L29 PolarHBondContact O-N 3.12Å; L29-T31 PolarHBondContact O-N 2.74Å; L29-F32 WeakPolarHBondContact O-CB 3.42Å; L29-F32 PolarHBondContact O-N 3.38Å; L29-A47 HydrophobicContact CB-CB 4Å; L29-A47 HydrophobicContact CD1-CB 4.07Å; L29-L102 HydrophobicContact CD2-CD1 3.92Å
30	R	88.1	Confident	81.3	Confident	117 Å²	117	71.5 Å²	71.5	44%	0.442	37%	0.373	S	S	.	.	H	α-helix	trans	-61.4	-24.6	175.7	-80.4	-173.9	-80.2	130	-9.4	113.6	A26 E27 R28 F32 Q33	A26-R30 WeakPolarHBondContact O-CG 3.5Å; A26-R30 PolarHBondContact O-N 2.94Å; E27-R30 WeakPolarHBondContact O-CB 3.08Å; E27-R30 PolarHBondContact O-N 3.35Å; E27-R30 VanDerWaalsContact O-N 3.09Å; E27-R30 IonicContact OE1-CZ 3.06Å; E27-R30 IonicContact OE1-NH1 2.87Å; E27-R30 PolarHBondContact OE1-NH1 3.41Å; E27-R30 IonicContact OE1-NH2 2.58Å; E27-R30 IonicContact OE2-CZ 3.3Å; E27-R30 IonicContact OE2-NH1 3.78Å; E27-R30 PolarHBondContact OE2-NH1 3.01Å; E27-R30 IonicContact OE2-NH2 2.61Å; E27-R30 PolarHBondContact OE2-NH2 3.4Å; R28-R30 VanDerWaalsContact C-N 3.28Å; R28-R30 PolarHBondContact O-N 3.3Å; R30-F32 PolarHBondContact O-N 3.21Å; R30-Q33 VanDerWaalsContact O-CG 3.27Å; R30-Q33 WeakPolarHBondContact O-CG 3.29Å; R30-Q33 PolarHBondContact O-NE2 3.13Å
31	T	87.3	Confident	82.9	Confident	34 Å²	34	67.8 Å²	67.8	21%	0.209	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-67.9	-21.6	175.5	69.4	0	0	0	0	113.1	M22 E27 R28 L29 Q33 F52 F53	M22-T31 HydrophobicContact CE-CG2 3.54Å; M22-T31 HydrophobicContact SD-CG2 3.84Å; E27-T31 PolarHBondContact O-N 2.83Å; R28-T31 WeakPolarHBondContact O-CB 3.36Å; R28-T31 PolarHBondContact O-N 3.33Å; R28-T31 VanDerWaalsContact O-N 3.09Å; R28-T31 PolarHBondContact O-OG1 2.91Å; L29-T31 PolarHBondContact O-N 2.74Å; T31-Q33 PolarHBondContact O-N 3.39Å; T31-F52 HydrophobicContact CG2-CB 3.96Å; T31-F52 WeakPolarHBondContact OG1-CB 3.23Å; T31-F53 WeakPolarHBondContact O-CD1 3.4Å; T31-F53 PolarHBondContact OG1-N 3.44Å
32	F	90.3	Very high	84.3	Confident	11 Å²	11	61.8 Å²	61.8	5%	0.048	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-84.4	15.9	-178.3	-66	-91.4	0	0	0	114	R28 L29 R30 N34 W35 S43 L46 A47 F51 F53 V60	R28-F32 WeakPolarHBondContact O-CD2 3.46Å; R28-F32 WeakPolarHBondContact O-CE2 3.32Å; L29-F32 WeakPolarHBondContact O-CB 3.42Å; L29-F32 PolarHBondContact O-N 3.38Å; R30-F32 PolarHBondContact O-N 3.21Å; F32-N34 PolarHBondContact O-N 3.46Å; F32-N34 VanDerWaalsContact O-N 3.14Å; F32-W35 HydrophobicContact CB-CB 3.89Å; F32-W35 HydrophobicContact CD1-CB 3.94Å; F32-W35 AromaticContact CD1-CD2 3.68Å; F32-W35 HydrophobicContact CD1-CD2 3.68Å; F32-W35 AromaticContact CD1-CE3 3.75Å; F32-W35 HydrophobicContact CD1-CE3 3.75Å; F32-W35 AromaticContact CD1-CG 3.78Å; F32-W35 HydrophobicContact CD1-CG 3.78Å; F32-W35 HydrophobicContact CD1-CZ3 4.49Å; F32-W35 HydrophobicContact CE1-CD2 4.11Å; F32-W35 AromaticContact CE1-CE3 3.96Å; F32-W35 HydrophobicContact CE1-CE3 3.96Å; F32-W35 HydrophobicContact CE1-CZ3 4.24Å; F32-W35 HydrophobicContact CG-CB 4.43Å; F32-W35 VanDerWaalsContact O-CB 3.23Å; F32-W35 WeakPolarHBondContact O-CB 3.49Å; F32-W35 PolarHBondContact O-N 3.41Å; F32-S43 VanDerWaalsContact CB-CB 3.45Å; F32-S43 VanDerWaalsContact CG-CB 3.5Å; F32-L46 HydrophobicContact CE1-CB 3.93Å; F32-L46 HydrophobicContact CE1-CD1 3.78Å; F32-L46 HydrophobicContact CE1-CG 4.47Å; F32-L46 HydrophobicContact CE2-CB 4.43Å; F32-L46 HydrophobicContact CZ-CB 3.62Å; F32-L46 HydrophobicContact CZ-CD1 4.36Å; F32-A47 HydrophobicContact CE2-CB 4.27Å; F32-F51 WeakPolarHBondContact CE2-O 3.26Å; F32-F53 HydrophobicContact CD1-CB 3.7Å; F32-F53 HydrophobicContact CD1-CG 4.33Å; F32-F53 HydrophobicContact CD2-CB 4.38Å; F32-F53 HydrophobicContact CE1-CB 3.75Å; F32-F53 HydrophobicContact CE2-CB 4.45Å; F32-F53 HydrophobicContact CG-CB 4.02Å; F32-F53 HydrophobicContact CZ-CB 4.13Å; F32-V60 HydrophobicContact CE1-CG1 3.81Å; F32-V60 HydrophobicContact CZ-CG1 4.11Å
33	Q	84.1	Confident	84.9	Confident	156 Å²	156	62.8 Å²	62.8	73%	0.729	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-53.8	-33.7	177.6	-80.8	168.7	52.4	0	0	113.4	R30 T31	R30-Q33 VanDerWaalsContact O-CG 3.27Å; R30-Q33 WeakPolarHBondContact O-CG 3.29Å; R30-Q33 PolarHBondContact O-NE2 3.13Å; T31-Q33 PolarHBondContact O-N 3.39Å
34	N	82.4	Confident	85.4	Confident	140 Å²	140	58.4 Å²	58.4	75%	0.749	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-109.1	21.5	178.4	-61.5	-33.9	0	0	0	112.5	F32 F53	F32-N34 PolarHBondContact O-N 3.46Å; F32-N34 VanDerWaalsContact O-N 3.14Å; N34-F53 HydrophobicContact CB-CE1 4.42Å
35	W	86.6	Confident	85.9	Confident	27 Å²	27	58.3 Å²	58.3	10%	0.102	34%	0.341	C	S	.	.			trans	-66.6	135.3	175.2	-172.2	-112.1	0	0	0	109.7	F32 A37 A39 V41 L46 F53 D58 V60	F32-W35 HydrophobicContact CB-CB 3.89Å; F32-W35 HydrophobicContact CD1-CB 3.94Å; F32-W35 AromaticContact CD1-CD2 3.68Å; F32-W35 HydrophobicContact CD1-CD2 3.68Å; F32-W35 AromaticContact CD1-CE3 3.75Å; F32-W35 HydrophobicContact CD1-CE3 3.75Å; F32-W35 AromaticContact CD1-CG 3.78Å; F32-W35 HydrophobicContact CD1-CG 3.78Å; F32-W35 HydrophobicContact CD1-CZ3 4.49Å; F32-W35 HydrophobicContact CE1-CD2 4.11Å; F32-W35 AromaticContact CE1-CE3 3.96Å; F32-W35 HydrophobicContact CE1-CE3 3.96Å; F32-W35 HydrophobicContact CE1-CZ3 4.24Å; F32-W35 HydrophobicContact CG-CB 4.43Å; F32-W35 VanDerWaalsContact O-CB 3.23Å; F32-W35 WeakPolarHBondContact O-CB 3.49Å; F32-W35 PolarHBondContact O-N 3.41Å; W35-A37 PolarHBondContact O-N 3.03Å; W35-A39 HydrophobicContact CD2-CB 4.41Å; W35-A39 HydrophobicContact CG-CB 4.49Å; W35-A39 HydrophobicContact CZ2-CB 3.95Å; W35-V41 PolarHBondContact NE1-O 3.01Å; W35-V41 VanDerWaalsContact NE1-O 3.1Å; W35-L46 HydrophobicContact CH2-CD1 3.98Å; W35-L46 HydrophobicContact CZ2-CD1 3.44Å; W35-L46 VanDerWaalsContact CZ2-CD1 3.44Å; W35-F53 HydrophobicContact CE3-CB 4.48Å; W35-F53 HydrophobicContact CE3-CD1 4.33Å; W35-F53 AromaticContact CE3-CD2 3.37Å; W35-F53 HydrophobicContact CE3-CD2 3.37Å; W35-F53 HydrophobicContact CE3-CE1 4.4Å; W35-F53 AromaticContact CE3-CE2 3.51Å; W35-F53 HydrophobicContact CE3-CE2 3.51Å; W35-F53 AromaticContact CE3-CG 3.83Å; W35-F53 HydrophobicContact CE3-CG 3.83Å; W35-F53 HydrophobicContact CE3-CZ 4.03Å; W35-F53 AromaticContact CZ3-CD2 3.4Å; W35-F53 HydrophobicContact CZ3-CD2 3.4Å; W35-F53 AromaticContact CZ3-CE2 3.53Å; W35-F53 HydrophobicContact CZ3-CE2 3.53Å; W35-F53 HydrophobicContact CZ3-CG 4.26Å; W35-F53 HydrophobicContact CZ3-CZ 4.43Å; W35-D58 HydrophobicContact CH2-CB 3.76Å; W35-D58 WeakPolarHBondContact CH2-O 3.42Å; W35-D58 HydrophobicContact CZ3-CB 4.21Å; W35-V60 HydrophobicContact CH2-CG1 3.73Å; W35-V60 HydrophobicContact CZ3-CG1 3.67Å
36	P	78.8	Confident	86.2	Confident	48 Å²	48	57.3 Å²	57.3	31%	0.312	34%	0.336	S	S	.	.			trans	-56.6	132	-176.9	-22.3	31.9	0	0	0	111.4	D38 A39	P36-D38 VanDerWaalsContact CB-OD1 3.24Å; P36-D38 WeakPolarHBondContact CB-OD1 3.45Å; P36-D38 PolarHBondContact O-N 2.8Å; P36-A39 HydrophobicContact CB-CB 4.17Å; P36-A39 WeakPolarHBondContact O-CB 3.39Å; P36-A39 PolarHBondContact O-N 3.14Å
37	A	74.9	Confident	86.5	Confident	113 Å²	113	55.7 Å²	55.7	93%	0.934	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.4	-178.7	0	0	0	0	0	112.6	W35	W35-A37 PolarHBondContact O-N 3.03Å
38	D	79.7	Confident	86.7	Confident	145 Å²	145	60.6 Å²	60.6	78%	0.775	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	8.8	174.1	64.1	-31.9	0	0	0	113	P36	P36-D38 VanDerWaalsContact CB-OD1 3.24Å; P36-D38 WeakPolarHBondContact CB-OD1 3.45Å; P36-D38 PolarHBondContact O-N 2.8Å
39	A	81.8	Confident	86.7	Confident	23 Å²	23	61 Å²	61	19%	0.19	35%	0.347	C	S	.	.			trans	-60.9	139.4	-179.5	0	0	0	0	0	111.4	W35 P36 V41	W35-A39 HydrophobicContact CD2-CB 4.41Å; W35-A39 HydrophobicContact CG-CB 4.49Å; W35-A39 HydrophobicContact CZ2-CB 3.95Å; P36-A39 HydrophobicContact CB-CB 4.17Å; P36-A39 WeakPolarHBondContact O-CB 3.39Å; P36-A39 PolarHBondContact O-N 3.14Å; A39-V41 PolarHBondContact O-N 3.24Å; A39-V41 VanDerWaalsContact O-N 3.13Å
40	P	83	Confident	86.7	Confident	42 Å²	42	58.1 Å²	58.1	27%	0.273	33%	0.332	S	S	.	.	S	Bend	trans	-70	-12.6	-173.9	19.2	-25.3	0	0	0	114.5	W72 Q74	P40-W72 HydrophobicContact CG-CB 3.93Å; P40-W72 WeakPolarHBondContact CG-O 3.32Å; P40-Q74 HydrophobicContact CB-CB 4.15Å
41	V	88.9	Confident	87	Confident	10 Å²	10	52.6 Å²	52.6	6%	0.061	31%	0.311	C	S	.	.	S	Bend	trans	-132.7	137.8	-178.3	-178.4	0	0	0	0	110	W35 A39 L46 W72 D76 P78	W35-V41 PolarHBondContact NE1-O 3.01Å; W35-V41 VanDerWaalsContact NE1-O 3.1Å; A39-V41 PolarHBondContact O-N 3.24Å; A39-V41 VanDerWaalsContact O-N 3.13Å; V41-L46 HydrophobicContact CB-CD1 4.39Å; V41-L46 HydrophobicContact CG1-CD1 4.14Å; V41-L46 HydrophobicContact CG1-CD2 4.14Å; V41-L46 HydrophobicContact CG1-CG 3.86Å; V41-W72 HydrophobicContact CG2-CB 4.09Å; V41-W72 HydrophobicContact CG2-CD2 4.34Å; V41-W72 HydrophobicContact CG2-CE3 3.85Å; V41-W72 HydrophobicContact CG2-CG 4.47Å; V41-D76 HydrophobicContact CG2-CB 4.11Å; V41-P78 HydrophobicContact CG1-CG 3.42Å; V41-P78 VanDerWaalsContact CG1-CG 3.42Å
42	A	89.6	Confident	87.2	Confident	55 Å²	55	52 Å²	52	46%	0.455	31%	0.306	S	S	.	.			trans	-69.9	138.2	-179.6	0	0	0	0	0	112.1	G44 D45 L46	A42-G44 PolarHBondContact O-N 2.99Å; A42-D45 PolarHBondContact O-N 2.9Å; A42-D45 VanDerWaalsContact O-N 3.12Å; A42-L46 PolarHBondContact O-N 2.99Å
43	S	90.5	Very high	87.3	Confident	38 Å²	38	52.3 Å²	52.3	27%	0.266	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-33.3	176.9	51.9	0	0	0	0	113.3	F32 L46 A47	F32-S43 VanDerWaalsContact CB-CB 3.45Å; F32-S43 VanDerWaalsContact CG-CB 3.5Å; S43-L46 PolarHBondContact O-N 3.29Å; S43-A47 WeakPolarHBondContact O-CB 3.01Å; S43-A47 PolarHBondContact O-N 3.22Å
44	G	87.7	Confident	87.4	Confident	30 Å²	30	47.8 Å²	47.8	31%	0.309	29%	0.287	S	S	.	.	H	α-helix	trans	-60.8	-44.7	173.9	0	0	0	0	0	112.8	A42 L46 A47 K48	A42-G44 PolarHBondContact O-N 2.99Å; G44-L46 VanDerWaalsContact C-N 3.34Å; G44-L46 PolarHBondContact O-N 2.82Å; G44-A47 PolarHBondContact O-N 2.74Å; G44-K48 VanDerWaalsContact O-CB 3.24Å; G44-K48 WeakPolarHBondContact O-CB 3.27Å; G44-K48 PolarHBondContact O-N 2.88Å
45	D	90.4	Very high	87.2	Confident	86 Å²	86	43.9 Å²	43.9	46%	0.46	28%	0.28	S	S	.	.	H	α-helix	trans	-70	-34	179.8	-66.1	-41.8	0	0	0	111.9	A42 A49 P78	A42-D45 PolarHBondContact O-N 2.9Å; A42-D45 VanDerWaalsContact O-N 3.12Å; D45-A49 VanDerWaalsContact O-CB 3.26Å; D45-A49 WeakPolarHBondContact O-CB 3.4Å; D45-A49 PolarHBondContact O-N 3.46Å; D45-P78 HydrophobicContact CB-CG 4.1Å
46	L	92.8	Very high	86.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-48.4	173	-68	162	0	0	0	111	F32 W35 V41 A42 S43 G44 K48 A49 G50 F51 V60 W72 P78	F32-L46 HydrophobicContact CE1-CB 3.93Å; F32-L46 HydrophobicContact CE1-CD1 3.78Å; F32-L46 HydrophobicContact CE1-CG 4.47Å; F32-L46 HydrophobicContact CE2-CB 4.43Å; F32-L46 HydrophobicContact CZ-CB 3.62Å; F32-L46 HydrophobicContact CZ-CD1 4.36Å; W35-L46 HydrophobicContact CH2-CD1 3.98Å; W35-L46 HydrophobicContact CZ2-CD1 3.44Å; W35-L46 VanDerWaalsContact CZ2-CD1 3.44Å; V41-L46 HydrophobicContact CB-CD1 4.39Å; V41-L46 HydrophobicContact CG1-CD1 4.14Å; V41-L46 HydrophobicContact CG1-CD2 4.14Å; V41-L46 HydrophobicContact CG1-CG 3.86Å; A42-L46 PolarHBondContact O-N 2.99Å; S43-L46 PolarHBondContact O-N 3.29Å; G44-L46 VanDerWaalsContact C-N 3.34Å; G44-L46 PolarHBondContact O-N 2.82Å; L46-K48 PolarHBondContact O-N 3.46Å; L46-A49 CarbonylContact O-C 3.55Å; L46-A49 PolarHBondContact O-N 2.9Å; L46-G50 PolarHBondContact O-N 3.44Å; L46-F51 HydrophobicContact CB-CB 4.4Å; L46-F51 HydrophobicContact CD2-CD2 4.46Å; L46-F51 WeakPolarHBondContact O-CB 3.39Å; L46-F51 PolarHBondContact O-N 3.16Å; L46-V60 HydrophobicContact CD1-CG1 4.35Å; L46-V60 HydrophobicContact CD2-CG1 4.45Å; L46-V60 HydrophobicContact CD2-CG2 4.21Å; L46-W72 HydrophobicContact CD2-CD2 4.17Å; L46-W72 HydrophobicContact CD2-CE3 4.38Å; L46-W72 HydrophobicContact CD2-CH2 3.63Å; L46-W72 HydrophobicContact CD2-CZ2 3.37Å; L46-W72 HydrophobicContact CD2-CZ3 4.13Å; L46-P78 HydrophobicContact CD2-CB 4Å; L46-P78 HydrophobicContact CD2-CG 3.69Å; L46-P78 HydrophobicContact CG-CG 4.03Å
47	A	92.2	Very high	86.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-42.7	177.1	0	0	0	0	0	112.4	E25 R28 L29 F32 S43 G44 A49 G50 F51	E25-A47 HydrophobicContact CG-CB 4.4Å; R28-A47 HydrophobicContact CB-CB 4.19Å; R28-A47 PolarHBondContact NE-O 3.47Å; R28-A47 PolarHBondContact NH2-O 3.48Å; L29-A47 HydrophobicContact CB-CB 4Å; L29-A47 HydrophobicContact CD1-CB 4.07Å; F32-A47 HydrophobicContact CE2-CB 4.27Å; S43-A47 WeakPolarHBondContact O-CB 3.01Å; S43-A47 PolarHBondContact O-N 3.22Å; G44-A47 PolarHBondContact O-N 2.74Å; A47-A49 VanDerWaalsContact C-N 3.34Å; A47-A49 PolarHBondContact O-N 3.36Å; A47-G50 PolarHBondContact O-N 2.9Å; A47-F51 WeakPolarHBondContact CA-O 3.35Å
48	K	90.1	Very high	87.4	Confident	139 Å²	139	41.9 Å²	41.9	60%	0.604	27%	0.272	S	S	*	.	H	α-helix	trans	-64.1	-36.6	175.5	-173.4	177.5	-179.4	179.9	0	112.4	G44 L46 G50 F91	G44-K48 VanDerWaalsContact O-CB 3.24Å; G44-K48 WeakPolarHBondContact O-CB 3.27Å; G44-K48 PolarHBondContact O-N 2.88Å; L46-K48 PolarHBondContact O-N 3.46Å; K48-G50 PolarHBondContact O-N 3.39Å; K48-F91 WeakPolarHBondContact O-CZ 3.22Å
49	A	92.1	Very high	87.8	Confident	7 Å²	7	38.5 Å²	38.5	6%	0.058	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	11.1	173.2	0	0	0	0	0	114	D45 L46 A47 F51 P78 A79 H82 F91	D45-A49 VanDerWaalsContact O-CB 3.26Å; D45-A49 WeakPolarHBondContact O-CB 3.4Å; D45-A49 PolarHBondContact O-N 3.46Å; L46-A49 CarbonylContact O-C 3.55Å; L46-A49 PolarHBondContact O-N 2.9Å; A47-A49 VanDerWaalsContact C-N 3.34Å; A47-A49 PolarHBondContact O-N 3.36Å; A49-F51 HydrophobicContact CB-CD2 3.92Å; A49-F51 HydrophobicContact CB-CE2 4.07Å; A49-P78 HydrophobicContact CB-CB 3.43Å; A49-P78 VanDerWaalsContact CB-CB 3.43Å; A49-A79 HydrophobicContact CB-CB 4.32Å; A49-H82 PolarHBondContact O-CE1 2.93Å; A49-H82 PolarHBondContact O-ND1 3.43Å; A49-F91 VanDerWaalsContact O-CE1 3.24Å; A49-F91 WeakPolarHBondContact O-CE1 3.31Å
50	G	90.1	Very high	88.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	13.6	171.6	0	0	0	0	0	113.9	L46 A47 K48 C62 F63 F91	L46-G50 PolarHBondContact O-N 3.44Å; A47-G50 PolarHBondContact O-N 2.9Å; K48-G50 PolarHBondContact O-N 3.39Å; G50-C62 VanDerWaalsContact O-CA 3.28Å; G50-C62 WeakPolarHBondContact O-CA 3.36Å; G50-F63 VanDerWaalsContact O-CD1 3.3Å; G50-F63 WeakPolarHBondContact O-CD1 3.41Å; G50-F63 PolarHBondContact O-N 3.23Å; G50-F91 VanDerWaalsContact CA-CE1 3.5Å
51	F	94	Very high	88.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	146.5	-179.3	-63.6	-75	0	0	0	112.9	F32 L46 A47 A49 V60 Q61 C62 L69 W72 P78 H82	F32-F51 WeakPolarHBondContact CE2-O 3.26Å; L46-F51 HydrophobicContact CB-CB 4.4Å; L46-F51 HydrophobicContact CD2-CD2 4.46Å; L46-F51 WeakPolarHBondContact O-CB 3.39Å; L46-F51 PolarHBondContact O-N 3.16Å; A47-F51 WeakPolarHBondContact CA-O 3.35Å; A49-F51 HydrophobicContact CB-CD2 3.92Å; A49-F51 HydrophobicContact CB-CE2 4.07Å; F51-V60 HydrophobicContact CB-CB 3.91Å; F51-V60 HydrophobicContact CB-CG2 3.87Å; F51-V60 HydrophobicContact CD1-CB 4.34Å; F51-V60 HydrophobicContact CD1-CG2 3.69Å; F51-V60 HydrophobicContact CD2-CG2 4.43Å; F51-V60 HydrophobicContact CE1-CG2 4.34Å; F51-V60 HydrophobicContact CG-CB 4.33Å; F51-V60 HydrophobicContact CG-CG2 3.76Å; F51-Q61 CarbonylContact C-O 3.46Å; F51-Q61 VanDerWaalsContact CA-O 3.26Å; F51-Q61 WeakPolarHBondContact CA-O 3.44Å; F51-C62 HydrophobicContact CD1-CB 4.02Å; F51-C62 HydrophobicContact CE1-CB 3.86Å; F51-L69 HydrophobicContact CE1-CD1 4.13Å; F51-L69 HydrophobicContact CE1-CG 4.33Å; F51-L69 HydrophobicContact CE2-CD1 4.36Å; F51-L69 HydrophobicContact CZ-CD1 3.61Å; F51-L69 HydrophobicContact CZ-CG 4.31Å; F51-W72 HydrophobicContact CE2-CH2 4.37Å; F51-P78 HydrophobicContact CD2-CB 4.48Å; F51-P78 HydrophobicContact CE2-CB 4.46Å; F51-H82 HydrophobicContact CE2-CB 3.7Å; F51-H82 AromaticContact CE2-CG 3.77Å; F51-H82 AromaticContact CE2-ND1 3.57Å; F51-H82 HydrophobicContact CZ-CB 3.54Å; F51-H82 AromaticContact CZ-CD2 3.91Å; F51-H82 AromaticContact CZ-CG 3.38Å; F51-H82 AromaticContact CZ-ND1 3.45Å; F51-H82 WeakPolarHBondContact CZ-ND1 3.4Å
52	F	92.3	Very high	88.6	Confident	22 Å²	22	35.2 Å²	35.2	10%	0.096	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.2	166	65.3	-87.9	0	0	0	109.9	M22 R28 T31 L54 V60 Q61 F63	M22-F52 HydrophobicContact CB-CD1 4.01Å; M22-F52 HydrophobicContact CB-CE1 4.3Å; M22-F52 HydrophobicContact CE-CD2 4.43Å; M22-F52 HydrophobicContact CG-CD1 3.84Å; M22-F52 HydrophobicContact CG-CD2 4.4Å; M22-F52 HydrophobicContact CG-CE1 4.08Å; M22-F52 HydrophobicContact CG-CG 4.02Å; M22-F52 HydrophobicContact CG-CZ 4.45Å; M22-F52 HydrophobicContact SD-CB 3.82Å; M22-F52 HydrophobicContact SD-CD1 4.22Å; M22-F52 HydrophobicContact SD-CD2 4.25Å; M22-F52 HydrophobicContact SD-CG 3.85Å; R28-F52 HydrophobicContact CB-CB 4.19Å; R28-F52 HydrophobicContact CG-CB 4.13Å; T31-F52 HydrophobicContact CG2-CB 3.96Å; T31-F52 WeakPolarHBondContact OG1-CB 3.23Å; F52-L54 HydrophobicContact CD2-CD2 4.21Å; F52-L54 HydrophobicContact CE2-CD2 3.59Å; F52-L54 HydrophobicContact CZ-CD2 4.29Å; F52-V60 CarbonylContact O-C 3.51Å; F52-V60 VanDerWaalsContact O-CA 3.26Å; F52-V60 WeakPolarHBondContact O-CA 3.49Å; F52-Q61 WeakPolarHBondContact CD1-O 3.32Å; F52-Q61 HydrophobicContact CE1-CB 3.96Å; F52-Q61 HydrophobicContact CE1-CG 4.09Å; F52-Q61 WeakPolarHBondContact CE1-O 3.36Å; F52-Q61 HydrophobicContact CE2-CB 4.22Å; F52-Q61 HydrophobicContact CZ-CB 3.8Å; F52-Q61 HydrophobicContact CZ-CG 3.97Å; F52-Q61 PolarHBondContact N-O 3.23Å; F52-Q61 PolarHBondContact O-N 2.77Å; F52-F63 HydrophobicContact CD1-CB 4.46Å
53	F	90.6	Very high	88.4	Confident	17 Å²	17	34.2 Å²	34.2	8%	0.075	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	135.4	-176.6	-178.5	-137.4	0	0	0	111.7	T31 F32 N34 W35 G55 G57 K59	T31-F53 WeakPolarHBondContact O-CD1 3.4Å; T31-F53 PolarHBondContact OG1-N 3.44Å; F32-F53 HydrophobicContact CD1-CB 3.7Å; F32-F53 HydrophobicContact CD1-CG 4.33Å; F32-F53 HydrophobicContact CD2-CB 4.38Å; F32-F53 HydrophobicContact CE1-CB 3.75Å; F32-F53 HydrophobicContact CE2-CB 4.45Å; F32-F53 HydrophobicContact CG-CB 4.02Å; F32-F53 HydrophobicContact CZ-CB 4.13Å; N34-F53 HydrophobicContact CB-CE1 4.42Å; W35-F53 HydrophobicContact CE3-CB 4.48Å; W35-F53 HydrophobicContact CE3-CD1 4.33Å; W35-F53 AromaticContact CE3-CD2 3.37Å; W35-F53 HydrophobicContact CE3-CD2 3.37Å; W35-F53 HydrophobicContact CE3-CE1 4.4Å; W35-F53 AromaticContact CE3-CE2 3.51Å; W35-F53 HydrophobicContact CE3-CE2 3.51Å; W35-F53 AromaticContact CE3-CG 3.83Å; W35-F53 HydrophobicContact CE3-CG 3.83Å; W35-F53 HydrophobicContact CE3-CZ 4.03Å; W35-F53 AromaticContact CZ3-CD2 3.4Å; W35-F53 HydrophobicContact CZ3-CD2 3.4Å; W35-F53 AromaticContact CZ3-CE2 3.53Å; W35-F53 HydrophobicContact CZ3-CE2 3.53Å; W35-F53 HydrophobicContact CZ3-CG 4.26Å; W35-F53 HydrophobicContact CZ3-CZ 4.43Å; F53-G55 VanDerWaalsContact C-N 3.34Å; F53-G57 VanDerWaalsContact CE2-O 3.3Å; F53-G57 WeakPolarHBondContact CE2-O 3.36Å; F53-G57 WeakPolarHBondContact CZ-O 3.23Å; F53-K59 WeakPolarHBondContact CD2-O 3.14Å
54	L	86.2	Confident	88	Confident	61 Å²	61	34.4 Å²	34.4	32%	0.319	21%	0.213	S	C	.	.			trans	-88.4	3.3	178.8	-63.2	-177.1	0	0	0	114.1	F52 S56 K59 Q61 I68	F52-L54 HydrophobicContact CD2-CD2 4.21Å; F52-L54 HydrophobicContact CE2-CD2 3.59Å; F52-L54 HydrophobicContact CZ-CD2 4.29Å; L54-S56 VanDerWaalsContact C-N 3.29Å; L54-S56 PolarHBondContact O-N 2.93Å; L54-K59 HydrophobicContact CB-CB 4.31Å; L54-K59 HydrophobicContact CD1-CB 4.24Å; L54-K59 PolarHBondContact N-O 2.86Å; L54-Q61 HydrophobicContact CD1-CB 4.13Å; L54-Q61 HydrophobicContact CD2-CB 3.85Å; L54-Q61 HydrophobicContact CG-CB 4.07Å; L54-I68 HydrophobicContact CD1-CD1 4.03Å; L54-I68 HydrophobicContact CD1-CG1 4.28Å; L54-I68 HydrophobicContact CD1-CG2 4.09Å
55	G	78.8	Confident	87.6	Confident	58 Å²	58	35.3 Å²	35.3	60%	0.598	21%	0.214	S	C	*	.	S	Bend	trans	79.2	1.8	175	0	0	0	0	0	115.6	F53	F53-G55 VanDerWaalsContact C-N 3.34Å
56	S	76.3	Confident	87.1	Confident	59 Å²	59	32.6 Å²	32.6	41%	0.413	21%	0.206	S	C	.	.	S	Bend	trans	-135.9	127.8	178.5	60.2	0	0	0	0	112.5	L54 D58 K59	L54-S56 VanDerWaalsContact C-N 3.29Å; L54-S56 PolarHBondContact O-N 2.93Å; S56-D58 PolarHBondContact O-N 3.34Å; S56-K59 WeakPolarHBondContact O-CB 3.37Å; S56-K59 PolarHBondContact O-N 3.24Å
57	G	82.7	Confident	86.7	Confident	57 Å²	57	32.9 Å²	32.9	59%	0.588	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	-132.1	-175.7	0	0	0	0	0	111.5	F53	F53-G57 VanDerWaalsContact CE2-O 3.3Å; F53-G57 WeakPolarHBondContact CE2-O 3.36Å; F53-G57 WeakPolarHBondContact CZ-O 3.23Å
58	D	86.3	Confident	86.5	Confident	31 Å²	31	34.9 Å²	34.9	17%	0.166	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	25.4	175.5	71	-26.9	0	0	0	112.2	W35 S56 V60 F71 W72	W35-D58 HydrophobicContact CH2-CB 3.76Å; W35-D58 WeakPolarHBondContact CH2-O 3.42Å; W35-D58 HydrophobicContact CZ3-CB 4.21Å; S56-D58 PolarHBondContact O-N 3.34Å; D58-V60 PolarHBondContact O-N 3.44Å; D58-F71 VanDerWaalsContact CG-N 3.3Å; D58-F71 PolarHBondContact OD1-N 2.71Å; D58-F71 WeakPolarHBondContact OD2-CA 3.26Å; D58-F71 PolarHBondContact OD2-N 2.58Å; D58-W72 VanDerWaalsContact O-CD1 3.32Å; D58-W72 PolarHBondContact O-NE1 3.42Å; D58-W72 PolarHBondContact OD2-N 3.04Å
59	K	87.9	Confident	86.3	Confident	73 Å²	73	28.2 Å²	28.2	32%	0.317	19%	0.191	S	C	.	.			trans	-76.9	125.9	-175.9	-64.1	178.5	-176.3	175.8	0	111.3	F53 L54 S56 L69 R70	F53-K59 WeakPolarHBondContact CD2-O 3.14Å; L54-K59 HydrophobicContact CB-CB 4.31Å; L54-K59 HydrophobicContact CD1-CB 4.24Å; L54-K59 PolarHBondContact N-O 2.86Å; S56-K59 WeakPolarHBondContact O-CB 3.37Å; S56-K59 PolarHBondContact O-N 3.24Å; K59-L69 WeakPolarHBondContact CA-O 3.24Å; K59-R70 HydrophobicContact CB-CB 4.44Å; K59-R70 HydrophobicContact CG-CB 3.79Å
60	V	90.8	Very high	86.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.2	176	-54.4	0	0	0	0	110.9	F32 W35 L46 F51 F52 D58 I68 L69 W72	F32-V60 HydrophobicContact CE1-CG1 3.81Å; F32-V60 HydrophobicContact CZ-CG1 4.11Å; W35-V60 HydrophobicContact CH2-CG1 3.73Å; W35-V60 HydrophobicContact CZ3-CG1 3.67Å; L46-V60 HydrophobicContact CD1-CG1 4.35Å; L46-V60 HydrophobicContact CD2-CG1 4.45Å; L46-V60 HydrophobicContact CD2-CG2 4.21Å; F51-V60 HydrophobicContact CB-CB 3.91Å; F51-V60 HydrophobicContact CB-CG2 3.87Å; F51-V60 HydrophobicContact CD1-CB 4.34Å; F51-V60 HydrophobicContact CD1-CG2 3.69Å; F51-V60 HydrophobicContact CD2-CG2 4.43Å; F51-V60 HydrophobicContact CE1-CG2 4.34Å; F51-V60 HydrophobicContact CG-CB 4.33Å; F51-V60 HydrophobicContact CG-CG2 3.76Å; F52-V60 CarbonylContact O-C 3.51Å; F52-V60 VanDerWaalsContact O-CA 3.26Å; F52-V60 WeakPolarHBondContact O-CA 3.49Å; D58-V60 PolarHBondContact O-N 3.44Å; V60-I68 CarbonylContact O-C 3.53Å; V60-I68 VanDerWaalsContact O-CA 3.27Å; V60-I68 WeakPolarHBondContact O-CA 3.41Å; V60-L69 HydrophobicContact CG2-CB 4.23Å; V60-L69 PolarHBondContact N-O 3.02Å; V60-L69 PolarHBondContact O-N 3.01Å; V60-W72 HydrophobicContact CG2-CZ2 3.5Å
61	Q	89.4	Confident	85.9	Confident	6 Å²	6	34.7 Å²	34.7	3%	0.028	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.7	-176.2	-174.8	173.5	-13.4	0	0	111.8	I16 F51 F52 L54 G66 G67 I68	I16-Q61 VanDerWaalsContact CG2-NE2 3.26Å; F51-Q61 CarbonylContact C-O 3.46Å; F51-Q61 VanDerWaalsContact CA-O 3.26Å; F51-Q61 WeakPolarHBondContact CA-O 3.44Å; F52-Q61 WeakPolarHBondContact CD1-O 3.32Å; F52-Q61 HydrophobicContact CE1-CB 3.96Å; F52-Q61 HydrophobicContact CE1-CG 4.09Å; F52-Q61 WeakPolarHBondContact CE1-O 3.36Å; F52-Q61 HydrophobicContact CE2-CB 4.22Å; F52-Q61 HydrophobicContact CZ-CB 3.8Å; F52-Q61 HydrophobicContact CZ-CG 3.97Å; F52-Q61 PolarHBondContact N-O 3.23Å; F52-Q61 PolarHBondContact O-N 2.77Å; L54-Q61 HydrophobicContact CD1-CB 4.13Å; L54-Q61 HydrophobicContact CD2-CB 3.85Å; L54-Q61 HydrophobicContact CG-CB 4.07Å; Q61-G66 WeakPolarHBondContact CG-O 3.27Å; Q61-G66 PolarHBondContact NE2-O 3.31Å; Q61-G67 CarbonylContact C-O 3.6Å; Q61-G67 WeakPolarHBondContact CA-O 3.25Å; Q61-I68 HydrophobicContact CB-CG1 4.01Å; Q61-I68 HydrophobicContact CG-CG1 3.77Å
62	C	90.9	Very high	85.7	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	131.5	177	176.6	0	0	0	0	111.2	G50 F51 C64 C65 G66 G67 H82	G50-C62 VanDerWaalsContact O-CA 3.28Å; G50-C62 WeakPolarHBondContact O-CA 3.36Å; F51-C62 HydrophobicContact CD1-CB 4.02Å; F51-C62 HydrophobicContact CE1-CB 3.86Å; C62-C64 PolarHBondContact O-N 3.17Å; C62-C64 PolarHBondContact SG-N 3.3Å; C62-C65 WeakPolarHBondContact CB-SG 3.28Å; C62-C65 PolarHBondContact SG-N 3.45Å; C62-C65 VanDerWaalsContact SG-SG 3.64Å; C62-G66 WeakPolarHBondContact O-CA 3.36Å; C62-G66 PolarHBondContact O-N 3.36Å; C62-G67 PolarHBondContact N-O 3.38Å; C62-H82 PolarHBondContact SG-CE1 3.38Å; C62-H82 PolarHBondContact SG-NE2 2.97Å
63	F	85.4	Confident	85.5	Confident	33 Å²	33	39 Å²	39	15%	0.145	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-23	175.9	83.3	-88.8	0	0	0	113.9	M22 R23 G50 F52 F91 V97 N99	M22-F63 HydrophobicContact CB-CB 3.72Å; M22-F63 VanDerWaalsContact O-CB 3.3Å; M22-F63 WeakPolarHBondContact O-CB 3.4Å; M22-F63 WeakPolarHBondContact O-CG 3.06Å; R23-F63 HydrophobicContact CG-CD2 4.09Å; R23-F63 HydrophobicContact CG-CE2 4.21Å; G50-F63 VanDerWaalsContact O-CD1 3.3Å; G50-F63 WeakPolarHBondContact O-CD1 3.41Å; G50-F63 PolarHBondContact O-N 3.23Å; F52-F63 HydrophobicContact CD1-CB 4.46Å; F63-F91 HydrophobicContact CE1-CB 4.42Å; F63-F91 HydrophobicContact CE1-CD1 4.26Å; F63-F91 AromaticContact CE1-CD2 3.52Å; F63-F91 HydrophobicContact CE1-CD2 3.52Å; F63-F91 HydrophobicContact CE1-CE1 4.48Å; F63-F91 AromaticContact CE1-CE2 3.75Å; F63-F91 HydrophobicContact CE1-CE2 3.75Å; F63-F91 AromaticContact CE1-CG 3.77Å; F63-F91 HydrophobicContact CE1-CG 3.77Å; F63-F91 HydrophobicContact CE1-CZ 4.23Å; F63-F91 HydrophobicContact CZ-CB 4.35Å; F63-F91 AromaticContact CZ-CD2 3.5Å; F63-F91 HydrophobicContact CZ-CD2 3.5Å; F63-F91 VanDerWaalsContact CZ-CD2 3.5Å; F63-F91 HydrophobicContact CZ-CE2 4Å; F63-F91 AromaticContact CZ-CG 3.99Å; F63-F91 HydrophobicContact CZ-CG 3.99Å; F63-V97 HydrophobicContact CE2-CG2 4Å; F63-V97 HydrophobicContact CZ-CG2 3.7Å; F63-N99 HydrophobicContact CZ-CB 4.02Å
64	C	81.4	Confident	85.2	Confident	43 Å²	43	46.5 Å²	46.5	29%	0.291	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-53.4	-172.7	178.3	0	0	0	0	113.2	C62 F91	C62-C64 PolarHBondContact O-N 3.17Å; C62-C64 PolarHBondContact SG-N 3.3Å; C64-F91 HydrophobicContact CB-CB 3.48Å; C64-F91 VanDerWaalsContact CB-CB 3.48Å; C64-F91 HydrophobicContact CB-CG 4.43Å; C64-F91 PolarHBondContact SG-N 3.3Å
65	C	79	Confident	85	Confident	49 Å²	49	47.2 Å²	47.2	33%	0.331	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-8.9	-179.9	65.5	0	0	0	0	113.2	C62 G67 C89	C62-C65 WeakPolarHBondContact CB-SG 3.28Å; C62-C65 PolarHBondContact SG-N 3.45Å; C62-C65 VanDerWaalsContact SG-SG 3.64Å; C65-G67 PolarHBondContact O-N 3.17Å; C65-G67 PolarHBondContact SG-N 3.3Å; C65-G67 VanDerWaalsContact SG-N 3.36Å; C65-C89 HydrophobicContact CB-CB 3.64Å; C65-C89 VanDerWaalsContact CB-SG 3.56Å; C65-C89 VanDerWaalsContact SG-SG 3.62Å
66	G	81	Confident	85.5	Confident	29 Å²	29	45.8 Å²	45.8	30%	0.299	27%	0.273	S	S	.	.			trans	70.1	3.1	-174	0	0	0	0	0	114.2	Q61 C62	Q61-G66 WeakPolarHBondContact CG-O 3.27Å; Q61-G66 PolarHBondContact NE2-O 3.31Å; C62-G66 WeakPolarHBondContact O-CA 3.36Å; C62-G66 PolarHBondContact O-N 3.36Å
67	G	82.9	Confident	86.2	Confident	6 Å²	6	45.7 Å²	45.7	6%	0.062	27%	0.272	C	S	.	.			trans	-63.9	133.2	-178.3	0	0	0	0	0	112.4	Q61 C62 C65 F86	Q61-G67 CarbonylContact C-O 3.6Å; Q61-G67 WeakPolarHBondContact CA-O 3.25Å; C62-G67 PolarHBondContact N-O 3.38Å; C65-G67 PolarHBondContact O-N 3.17Å; C65-G67 PolarHBondContact SG-N 3.3Å; C65-G67 VanDerWaalsContact SG-N 3.36Å; G67-F86 VanDerWaalsContact CA-CE1 3.42Å
68	I	88.6	Confident	86.7	Confident	41 Å²	41	43.3 Å²	43.3	21%	0.21	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.5	-178.7	-58.7	174.1	0	0	0	109.8	L54 V60 Q61	L54-I68 HydrophobicContact CD1-CD1 4.03Å; L54-I68 HydrophobicContact CD1-CG1 4.28Å; L54-I68 HydrophobicContact CD1-CG2 4.09Å; V60-I68 CarbonylContact O-C 3.53Å; V60-I68 VanDerWaalsContact O-CA 3.27Å; V60-I68 WeakPolarHBondContact O-CA 3.41Å; Q61-I68 HydrophobicContact CB-CG1 4.01Å; Q61-I68 HydrophobicContact CG-CG1 3.77Å
69	L	86.1	Confident	86.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.5	173.6	-67	-178.9	0	0	0	111	C4 F51 K59 V60 W72 E81 H85 F86	C4-L69 HydrophobicContact CB-CD2 4.47Å; F51-L69 HydrophobicContact CE1-CD1 4.13Å; F51-L69 HydrophobicContact CE1-CG 4.33Å; F51-L69 HydrophobicContact CE2-CD1 4.36Å; F51-L69 HydrophobicContact CZ-CD1 3.61Å; F51-L69 HydrophobicContact CZ-CG 4.31Å; K59-L69 WeakPolarHBondContact CA-O 3.24Å; V60-L69 HydrophobicContact CG2-CB 4.23Å; V60-L69 PolarHBondContact N-O 3.02Å; V60-L69 PolarHBondContact O-N 3.01Å; L69-W72 HydrophobicContact CB-CH2 4.44Å; L69-W72 HydrophobicContact CB-CZ2 3.73Å; L69-W72 HydrophobicContact CD1-CH2 3.87Å; L69-W72 HydrophobicContact CD1-CZ2 3.98Å; L69-E81 HydrophobicContact CD1-CB 4.14Å; L69-H85 HydrophobicContact CD2-CB 3.87Å; L69-F86 HydrophobicContact CD2-CE2 3.73Å; L69-F86 HydrophobicContact CG-CE2 3.94Å
70	R	87.6	Confident	86.9	Confident	34 Å²	34	44 Å²	44	13%	0.128	26%	0.262	C	S	.	.			trans	-160.7	171.3	178.8	89.6	-175.5	91.6	103.1	37.5	109.8	C4 R5 M6 S7 K59	C4-R70 WeakPolarHBondContact CA-O 3.43Å; C4-R70 WeakPolarHBondContact CB-O 3.28Å; C4-R70 PolarHBondContact SG-O 3.02Å; R5-R70 PolarHBondContact O-NH2 3.09Å; R5-R70 VanDerWaalsContact O-NH2 3.08Å; M6-R70 PolarHBondContact O-NH2 3.38Å; S7-R70 PolarHBondContact OG-NH2 3.11Å; K59-R70 HydrophobicContact CB-CB 4.44Å; K59-R70 HydrophobicContact CG-CB 3.79Å
71	F	85.6	Confident	86.7	Confident	109 Å²	109	44.3 Å²	44.3	48%	0.478	26%	0.263	S	S	.	.			trans	62.4	51.4	-171.1	-50.6	-62.2	0	0	0	112.1	C4 R5 D58	C4-F71 PolarHBondContact SG-O 2.83Å; R5-F71 HydrophobicContact CB-CD2 4.08Å; R5-F71 HydrophobicContact CB-CE2 4.27Å; R5-F71 HydrophobicContact CG-CD2 4.49Å; D58-F71 VanDerWaalsContact CG-N 3.3Å; D58-F71 PolarHBondContact OD1-N 2.71Å; D58-F71 WeakPolarHBondContact OD2-CA 3.26Å; D58-F71 PolarHBondContact OD2-N 2.58Å
72	W	89.3	Confident	86.8	Confident	12 Å²	12	44 Å²	44	5%	0.045	26%	0.262	C	S	.	.			trans	-64.3	137.5	175.2	-65.6	92.5	0	0	0	110.2	P40 V41 L46 F51 D58 V60 L69 D76 P78 E81	P40-W72 HydrophobicContact CG-CB 3.93Å; P40-W72 WeakPolarHBondContact CG-O 3.32Å; V41-W72 HydrophobicContact CG2-CB 4.09Å; V41-W72 HydrophobicContact CG2-CD2 4.34Å; V41-W72 HydrophobicContact CG2-CE3 3.85Å; V41-W72 HydrophobicContact CG2-CG 4.47Å; L46-W72 HydrophobicContact CD2-CD2 4.17Å; L46-W72 HydrophobicContact CD2-CE3 4.38Å; L46-W72 HydrophobicContact CD2-CH2 3.63Å; L46-W72 HydrophobicContact CD2-CZ2 3.37Å; L46-W72 HydrophobicContact CD2-CZ3 4.13Å; F51-W72 HydrophobicContact CE2-CH2 4.37Å; D58-W72 VanDerWaalsContact O-CD1 3.32Å; D58-W72 PolarHBondContact O-NE1 3.42Å; D58-W72 PolarHBondContact OD2-N 3.04Å; V60-W72 HydrophobicContact CG2-CZ2 3.5Å; L69-W72 HydrophobicContact CB-CH2 4.44Å; L69-W72 HydrophobicContact CB-CZ2 3.73Å; L69-W72 HydrophobicContact CD1-CH2 3.87Å; L69-W72 HydrophobicContact CD1-CZ2 3.98Å; W72-D76 HydrophobicContact CE3-CB 3.9Å; W72-D76 HydrophobicContact CZ3-CB 4.3Å; W72-P78 HydrophobicContact CH2-CB 4.09Å; W72-P78 HydrophobicContact CH2-CG 4.28Å; W72-P78 HydrophobicContact CZ3-CB 4.24Å; W72-P78 HydrophobicContact CZ3-CG 4.04Å; W72-E81 HydrophobicContact CH2-CB 4.33Å; W72-E81 HydrophobicContact CZ3-CB 4.12Å; W72-E81 HydrophobicContact CZ3-CG 4.22Å
73	E	87.9	Confident	86.7	Confident	101 Å²	101	49.9 Å²	49.9	47%	0.472	29%	0.287	S	S	.	.			trans	-113	158	176.7	-65.2	-174.1	158.5	0	0	111.1	G75 D76	E73-G75 PolarHBondContact O-N 2.75Å; E73-D76 PolarHBondContact N-OD2 2.68Å; E73-D76 WeakPolarHBondContact O-CB 3.31Å; E73-D76 PolarHBondContact O-N 2.81Å; E73-D76 VanDerWaalsContact O-N 3.11Å
74	Q	84.8	Confident	86.7	Confident	174 Å²	174	55.2 Å²	55.2	81%	0.813	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	119.1	-178.7	-169.4	134.2	60.4	0	0	110.3	P40	P40-Q74 HydrophobicContact CB-CB 4.15Å
75	G	82.4	Confident	86.4	Confident	76 Å²	76	55.3 Å²	55.3	78%	0.784	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.1	-5.1	-175.1	0	0	0	0	0	114.5	E73	E73-G75 PolarHBondContact O-N 2.75Å
76	D	89.3	Confident	86.5	Confident	28 Å²	28	54.7 Å²	54.7	15%	0.15	29%	0.294	C	S	.	.			trans	-63.7	135.8	172.8	-77.7	-15.5	0	0	0	111.3	V41 W72 E73 P78 E81	V41-D76 HydrophobicContact CG2-CB 4.11Å; W72-D76 HydrophobicContact CE3-CB 3.9Å; W72-D76 HydrophobicContact CZ3-CB 4.3Å; E73-D76 PolarHBondContact N-OD2 2.68Å; E73-D76 WeakPolarHBondContact O-CB 3.31Å; E73-D76 PolarHBondContact O-N 2.81Å; E73-D76 VanDerWaalsContact O-N 3.11Å; D76-P78 WeakPolarHBondContact O-CD 3.25Å; D76-E81 HydrophobicContact CB-CG 4.28Å
77	S	91.5	Very high	86.5	Confident	56 Å²	56	57 Å²	57	39%	0.392	30%	0.304	S	S	.	.			trans	-99.7	115.8	171.3	176.1	0	0	0	0	109.6	A79 V80 E81	S77-A79 VanDerWaalsContact C-N 3.28Å; S77-A79 PolarHBondContact O-N 2.8Å; S77-V80 PolarHBondContact O-N 3.49Å; S77-E81 PolarHBondContact O-N 2.81Å
78	P	92.6	Very high	86	Confident	7 Å²	7	62.4 Å²	62.4	5%	0.045	34%	0.336	C	S	.	.	H	α-helix	trans	-51.2	-42.3	-179.4	-36.2	41.4	0	0	0	114.9	V41 D45 L46 A49 F51 W72 D76 H82	V41-P78 HydrophobicContact CG1-CG 3.42Å; V41-P78 VanDerWaalsContact CG1-CG 3.42Å; D45-P78 HydrophobicContact CB-CG 4.1Å; L46-P78 HydrophobicContact CD2-CB 4Å; L46-P78 HydrophobicContact CD2-CG 3.69Å; L46-P78 HydrophobicContact CG-CG 4.03Å; A49-P78 HydrophobicContact CB-CB 3.43Å; A49-P78 VanDerWaalsContact CB-CB 3.43Å; F51-P78 HydrophobicContact CD2-CB 4.48Å; F51-P78 HydrophobicContact CE2-CB 4.46Å; W72-P78 HydrophobicContact CH2-CB 4.09Å; W72-P78 HydrophobicContact CH2-CG 4.28Å; W72-P78 HydrophobicContact CZ3-CB 4.24Å; W72-P78 HydrophobicContact CZ3-CG 4.04Å; D76-P78 WeakPolarHBondContact O-CD 3.25Å; P78-H82 WeakPolarHBondContact O-CB 3.39Å; P78-H82 PolarHBondContact O-N 3.02Å
79	A	88.6	Confident	85.5	Confident	44 Å²	44	60.6 Å²	60.6	36%	0.364	33%	0.327	S	S	.	.	H	α-helix	trans	-68.9	-36	179.4	0	0	0	0	0	112.5	A49 S77 K83 I92	A49-A79 HydrophobicContact CB-CB 4.32Å; S77-A79 VanDerWaalsContact C-N 3.28Å; S77-A79 PolarHBondContact O-N 2.8Å; A79-K83 WeakPolarHBondContact O-CB 3.45Å; A79-K83 PolarHBondContact O-N 3.4Å; A79-I92 HydrophobicContact CB-CD1 4Å
80	V	89.9	Confident	85	Confident	74 Å²	74	62.7 Å²	62.7	45%	0.448	34%	0.341	S	S	.	.	H	α-helix	trans	-70.5	-47	178.2	177.3	0	0	0	0	110.4	S77 H82 K83 R84	S77-V80 PolarHBondContact O-N 3.49Å; V80-H82 VanDerWaalsContact C-N 3.32Å; V80-H82 PolarHBondContact O-N 3.14Å; V80-K83 PolarHBondContact O-N 3.22Å; V80-R84 WeakPolarHBondContact O-CB 3.27Å; V80-R84 PolarHBondContact O-N 2.86Å
81	E	87.4	Confident	84.8	Confident	7 Å²	7	62.5 Å²	62.5	3%	0.033	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-37	177.6	-63.4	-47.5	128.8	0	0	111.5	C3 L69 W72 D76 S77 K83 R84 H85	C3-E81 PolarHBondContact SG-OE2 3.49Å; L69-E81 HydrophobicContact CD1-CB 4.14Å; W72-E81 HydrophobicContact CH2-CB 4.33Å; W72-E81 HydrophobicContact CZ3-CB 4.12Å; W72-E81 HydrophobicContact CZ3-CG 4.22Å; D76-E81 HydrophobicContact CB-CG 4.28Å; S77-E81 PolarHBondContact O-N 2.81Å; E81-K83 PolarHBondContact O-N 3.19Å; E81-R84 PolarHBondContact O-N 2.9Å; E81-R84 IonicContact OE1-CZ 2.81Å; E81-R84 VanDerWaalsContact OE1-CZ 3.25Å; E81-R84 IonicContact OE1-NH1 3.98Å; E81-R84 PolarHBondContact OE1-NH1 3.47Å; E81-R84 IonicContact OE1-NH2 2.64Å; E81-R84 IonicContact OE2-CZ 3.42Å; E81-R84 IonicContact OE2-NE 2.75Å; E81-R84 IonicContact OE2-NH1 2.88Å; E81-R84 PolarHBondContact OE2-NH1 3.01Å; E81-H85 WeakPolarHBondContact O-CB 3.2Å; E81-H85 PolarHBondContact O-CD2 2.84Å; E81-H85 VanDerWaalsContact O-CD2 3.26Å; E81-H85 PolarHBondContact O-N 2.75Å; E81-H85 IonicContact OE2-CD2 2.79Å; E81-H85 IonicContact OE2-NE2 3.19Å
82	H	91	Very high	84.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-49	171.8	-166.2	167.1	0	0	0	111.6	A49 F51 C62 P78 V80 F86 C89 F91 I92	A49-H82 PolarHBondContact O-CE1 2.93Å; A49-H82 PolarHBondContact O-ND1 3.43Å; F51-H82 HydrophobicContact CE2-CB 3.7Å; F51-H82 AromaticContact CE2-CG 3.77Å; F51-H82 AromaticContact CE2-ND1 3.57Å; F51-H82 HydrophobicContact CZ-CB 3.54Å; F51-H82 AromaticContact CZ-CD2 3.91Å; F51-H82 AromaticContact CZ-CG 3.38Å; F51-H82 AromaticContact CZ-ND1 3.45Å; F51-H82 WeakPolarHBondContact CZ-ND1 3.4Å; C62-H82 PolarHBondContact SG-CE1 3.38Å; C62-H82 PolarHBondContact SG-NE2 2.97Å; P78-H82 WeakPolarHBondContact O-CB 3.39Å; P78-H82 PolarHBondContact O-N 3.02Å; V80-H82 VanDerWaalsContact C-N 3.32Å; V80-H82 PolarHBondContact O-N 3.14Å; H82-F86 CarbonylContact O-C 3.57Å; H82-F86 WeakPolarHBondContact O-CA 3.26Å; H82-F86 PolarHBondContact O-N 3.15Å; H82-C89 PolarHBondContact NE2-SG 3.13Å; H82-F91 AromaticContact CE1-CD1 3.96Å; H82-I92 HydrophobicContact CB-CD1 3.97Å; H82-I92 HydrophobicContact CB-CG1 4.04Å
83	K	87.6	Confident	84.2	Confident	124 Å²	124	62.1 Å²	62.1	54%	0.539	35%	0.345	S	S	.	.	H	α-helix	trans	-67.7	-35.9	178.8	-172.6	174.6	179.1	177.5	0	112.4	A79 V80 E81 P87 I92	A79-K83 WeakPolarHBondContact O-CB 3.45Å; A79-K83 PolarHBondContact O-N 3.4Å; V80-K83 PolarHBondContact O-N 3.22Å; E81-K83 PolarHBondContact O-N 3.19Å; K83-P87 WeakPolarHBondContact O-CA 3.22Å; K83-P87 WeakPolarHBondContact O-CB 3.21Å; K83-I92 HydrophobicContact CB-CG1 3.9Å; K83-I92 HydrophobicContact CB-CG2 4.34Å
84	R	85.4	Confident	83.5	Confident	145 Å²	145	60.6 Å²	60.6	55%	0.547	36%	0.356	S	S	.	.	H	α-helix	trans	-65.8	-46.9	179.1	-177.4	-175.1	-71.6	155.2	2.4	111.5	C3 V80 E81	C3-R84 PolarHBondContact SG-NH1 3.09Å; V80-R84 WeakPolarHBondContact O-CB 3.27Å; V80-R84 PolarHBondContact O-N 2.86Å; E81-R84 PolarHBondContact O-N 2.9Å; E81-R84 IonicContact OE1-CZ 2.81Å; E81-R84 VanDerWaalsContact OE1-CZ 3.25Å; E81-R84 IonicContact OE1-NH1 3.98Å; E81-R84 PolarHBondContact OE1-NH1 3.47Å; E81-R84 IonicContact OE1-NH2 2.64Å; E81-R84 IonicContact OE2-CZ 3.42Å; E81-R84 IonicContact OE2-NE 2.75Å; E81-R84 IonicContact OE2-NH1 2.88Å; E81-R84 PolarHBondContact OE2-NH1 3.01Å
85	H	76.9	Confident	82.7	Confident	45 Å²	45	60.3 Å²	60.3	21%	0.208	35%	0.347	C	S	.	.	H	α-helix	trans	-89.9	-26.9	-174.8	-69.7	-76	0	0	0	113.8	C4 L69 E81	C4-H85 PolarHBondContact O-CE1 3.34Å; L69-H85 HydrophobicContact CD2-CB 3.87Å; E81-H85 WeakPolarHBondContact O-CB 3.2Å; E81-H85 PolarHBondContact O-CD2 2.84Å; E81-H85 VanDerWaalsContact O-CD2 3.26Å; E81-H85 PolarHBondContact O-N 2.75Å; E81-H85 IonicContact OE2-CD2 2.79Å; E81-H85 IonicContact OE2-NE2 3.19Å
86	F	79.2	Confident	82.1	Confident	37 Å²	37	63.9 Å²	63.9	16%	0.162	35%	0.354	C	S	.	.			trans	-131	66.7	177.7	-53.6	-80.8	0	0	0	111.2	G67 L69 H82 T88 C89	G67-F86 VanDerWaalsContact CA-CE1 3.42Å; L69-F86 HydrophobicContact CD2-CE2 3.73Å; L69-F86 HydrophobicContact CG-CE2 3.94Å; H82-F86 CarbonylContact O-C 3.57Å; H82-F86 WeakPolarHBondContact O-CA 3.26Å; H82-F86 PolarHBondContact O-N 3.15Å; F86-T88 PolarHBondContact O-N 3.3Å; F86-T88 VanDerWaalsContact O-N 3.09Å; F86-C89 HydrophobicContact CB-CB 4.27Å; F86-C89 WeakPolarHBondContact O-CB 3.4Å; F86-C89 PolarHBondContact O-N 2.94Å; F86-C89 VanDerWaalsContact O-N 3.1Å
87	P	82.4	Confident	81.3	Confident	76 Å²	76	63.8 Å²	63.8	49%	0.494	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16	-173.6	26.3	-35.7	0	0	0	114.3	K83	K83-P87 WeakPolarHBondContact O-CA 3.22Å; K83-P87 WeakPolarHBondContact O-CB 3.21Å
88	T	73	Confident	80.2	Confident	121 Å²	121	63.3 Å²	63.3	74%	0.742	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	0.2	179.1	55.8	0	0	0	0	113.4	F86 S90	F86-T88 PolarHBondContact O-N 3.3Å; F86-T88 VanDerWaalsContact O-N 3.09Å; T88-S90 PolarHBondContact O-N 2.66Å
89	C	78.1	Confident	79.6	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.014	37%	0.368	C	S	.	.			trans	-64.1	117.5	-178.8	175.6	0	0	0	0	111.3	C65 H82 F86 F91 I92 L93	C65-C89 HydrophobicContact CB-CB 3.64Å; C65-C89 VanDerWaalsContact CB-SG 3.56Å; C65-C89 VanDerWaalsContact SG-SG 3.62Å; H82-C89 PolarHBondContact NE2-SG 3.13Å; F86-C89 HydrophobicContact CB-CB 4.27Å; F86-C89 WeakPolarHBondContact O-CB 3.4Å; F86-C89 PolarHBondContact O-N 2.94Å; F86-C89 VanDerWaalsContact O-N 3.1Å; C89-F91 PolarHBondContact O-N 3.44Å; C89-F91 VanDerWaalsContact O-N 3.17Å; C89-I92 HydrophobicContact CB-CB 4.32Å; C89-I92 HydrophobicContact CB-CG2 3.73Å; C89-I92 WeakPolarHBondContact O-CG2 3.24Å; C89-I92 PolarHBondContact O-N 3.38Å; C89-I92 VanDerWaalsContact O-N 3.12Å; C89-L93 WeakPolarHBondContact O-CB 3.4Å; C89-L93 WeakPolarHBondContact O-CG 3.31Å; C89-L93 PolarHBondContact O-N 3.36Å
90	S	73.8	Confident	79.2	Confident	44 Å²	44	67.7 Å²	67.7	31%	0.308	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-33.3	-179.9	-66.2	0	0	0	0	113.1	T88 R95 V97	T88-S90 PolarHBondContact O-N 2.66Å; S90-R95 WeakPolarHBondContact O-CA 3.3Å; S90-R95 VanDerWaalsContact O-CB 3.24Å; S90-R95 WeakPolarHBondContact O-CB 3.05Å; S90-R95 PolarHBondContact O-N 2.85Å; S90-V97 VanDerWaalsContact CB-CG1 3.45Å
91	F	85.1	Confident	78.7	Confident	31 Å²	31	67.8 Å²	67.8	14%	0.136	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-50.4	174.7	176.3	-102.3	0	0	0	112.4	K48 A49 G50 F63 C64 H82 C89 L93 G94 V97 N99	K48-F91 WeakPolarHBondContact O-CZ 3.22Å; A49-F91 VanDerWaalsContact O-CE1 3.24Å; A49-F91 WeakPolarHBondContact O-CE1 3.31Å; G50-F91 VanDerWaalsContact CA-CE1 3.5Å; F63-F91 HydrophobicContact CE1-CB 4.42Å; F63-F91 HydrophobicContact CE1-CD1 4.26Å; F63-F91 AromaticContact CE1-CD2 3.52Å; F63-F91 HydrophobicContact CE1-CD2 3.52Å; F63-F91 HydrophobicContact CE1-CE1 4.48Å; F63-F91 AromaticContact CE1-CE2 3.75Å; F63-F91 HydrophobicContact CE1-CE2 3.75Å; F63-F91 AromaticContact CE1-CG 3.77Å; F63-F91 HydrophobicContact CE1-CG 3.77Å; F63-F91 HydrophobicContact CE1-CZ 4.23Å; F63-F91 HydrophobicContact CZ-CB 4.35Å; F63-F91 AromaticContact CZ-CD2 3.5Å; F63-F91 HydrophobicContact CZ-CD2 3.5Å; F63-F91 VanDerWaalsContact CZ-CD2 3.5Å; F63-F91 HydrophobicContact CZ-CE2 4Å; F63-F91 AromaticContact CZ-CG 3.99Å; F63-F91 HydrophobicContact CZ-CG 3.99Å; C64-F91 HydrophobicContact CB-CB 3.48Å; C64-F91 VanDerWaalsContact CB-CB 3.48Å; C64-F91 HydrophobicContact CB-CG 4.43Å; C64-F91 PolarHBondContact SG-N 3.3Å; H82-F91 AromaticContact CE1-CD1 3.96Å; C89-F91 PolarHBondContact O-N 3.44Å; C89-F91 VanDerWaalsContact O-N 3.17Å; F91-L93 VanDerWaalsContact C-N 3.26Å; F91-L93 PolarHBondContact O-N 2.83Å; F91-G94 PolarHBondContact O-N 2.77Å; F91-V97 HydrophobicContact CB-CG2 3.86Å; F91-V97 HydrophobicContact CD2-CG2 3.76Å; F91-V97 HydrophobicContact CG-CG2 4.3Å; F91-N99 HydrophobicContact CD2-CB 4.13Å; F91-N99 HydrophobicContact CE2-CB 3.77Å
92	I	85.6	Confident	78.1	Confident	33 Å²	33	71.7 Å²	71.7	17%	0.169	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22	-176.2	-153.2	61.4	0	0	0	112.8	A79 H82 K83 C89 G94	A79-I92 HydrophobicContact CB-CD1 4Å; H82-I92 HydrophobicContact CB-CD1 3.97Å; H82-I92 HydrophobicContact CB-CG1 4.04Å; K83-I92 HydrophobicContact CB-CG1 3.9Å; K83-I92 HydrophobicContact CB-CG2 4.34Å; C89-I92 HydrophobicContact CB-CB 4.32Å; C89-I92 HydrophobicContact CB-CG2 3.73Å; C89-I92 WeakPolarHBondContact O-CG2 3.24Å; C89-I92 PolarHBondContact O-N 3.38Å; C89-I92 VanDerWaalsContact O-N 3.12Å; I92-G94 PolarHBondContact O-N 3.17Å
93	L	75.3	Confident	76.4	Confident	80 Å²	80	76.1 Å²	76.1	42%	0.419	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-0.1	170.1	-67	176.2	0	0	0	113.3	C89 F91 R95	C89-L93 WeakPolarHBondContact O-CB 3.4Å; C89-L93 WeakPolarHBondContact O-CG 3.31Å; C89-L93 PolarHBondContact O-N 3.36Å; F91-L93 VanDerWaalsContact C-N 3.26Å; F91-L93 PolarHBondContact O-N 2.83Å; L93-R95 VanDerWaalsContact C-N 3.34Å; L93-R95 HydrophobicContact CB-CG 4.36Å
94	G	73.3	Confident	74.5	Confident	69 Å²	69	77.4 Å²	77.4	71%	0.711	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	15.7	177.9	0	0	0	0	0	114.7	F91 I92	F91-G94 PolarHBondContact O-N 2.77Å; I92-G94 PolarHBondContact O-N 3.17Å
95	R	68	Low	72.3	Confident	167 Å²	167	74.2 Å²	74.2	63%	0.63	47%	0.466	S	S	*	.			trans	-75.6	151.5	176.3	-54.2	-177	176.5	-154.2	-2.6	110.3	S90 L93 V97	S90-R95 WeakPolarHBondContact O-CA 3.3Å; S90-R95 VanDerWaalsContact O-CB 3.24Å; S90-R95 WeakPolarHBondContact O-CB 3.05Å; S90-R95 PolarHBondContact O-N 2.85Å; L93-R95 VanDerWaalsContact C-N 3.34Å; L93-R95 HydrophobicContact CB-CG 4.36Å; R95-V97 PolarHBondContact O-N 2.97Å
96	T	70.1	Confident	70.3	Confident	152 Å²	152	77.7 Å²	77.7	93%	0.933	50%	0.495	S	S	*	.			trans	-71.3	92.9	178.7	40.7	0	0	0	0	111.3
97	V	71.9	Confident	68.4	Low	26 Å²	26	80.5 Å²	80.5	16%	0.158	52%	0.52	C	S	.	.	S	Bend	trans	-105	17.6	178.6	-61.2	0	0	0	0	112.7	R23 F63 S90 F91 R95	R23-V97 PolarHBondContact NH1-O 3.36Å; F63-V97 HydrophobicContact CE2-CG2 4Å; F63-V97 HydrophobicContact CZ-CG2 3.7Å; S90-V97 VanDerWaalsContact CB-CG1 3.45Å; F91-V97 HydrophobicContact CB-CG2 3.86Å; F91-V97 HydrophobicContact CD2-CG2 3.76Å; F91-V97 HydrophobicContact CG-CG2 4.3Å; R95-V97 PolarHBondContact O-N 2.97Å
98	G	68.9	Low	66.1	Low	46 Å²	46	83.6 Å²	83.6	47%	0.474	53%	0.532	S	S	.	.			trans	67.7	34.5	-177.7	0	0	0	0	0	114	R23	R23-G98 WeakPolarHBondContact CB-O 3.4Å
99	N	80.4	Confident	64.5	Low	46 Å²	46	83.8 Å²	83.8	25%	0.246	54%	0.538	C	S	.	.			trans	-70.5	134.7	169.8	-180	61.9	0	0	0	110.4	R23 R28 F63 F91 S101	R23-N99 PolarHBondContact O-OD1 3.27Å; R28-N99 PolarHBondContact NH1-OD1 3.21Å; R28-N99 PolarHBondContact NH2-OD1 3.22Å; F63-N99 HydrophobicContact CZ-CB 4.02Å; F91-N99 HydrophobicContact CD2-CB 4.13Å; F91-N99 HydrophobicContact CE2-CB 3.77Å; N99-S101 PolarHBondContact ND2-OG 2.95Å
100	I	79.7	Confident	62.7	Low	96 Å²	96	89.6 Å²	89.6	49%	0.492	57%	0.573	S	S	.	*	B	Isolated β-bridge	trans	-112	108	175.7	-58.9	165	0	0	0	107.7	R23 E24 E25	R23-I100 PolarHBondContact O-N 3.47Å; E24-I100 HydrophobicContact CG-CB 4.1Å; E24-I100 HydrophobicContact CG-CD1 3.71Å; E24-I100 HydrophobicContact CG-CG1 4.46Å; E24-I100 HydrophobicContact CG-CG2 4.4Å; E25-I100 WeakPolarHBondContact CB-O 3.17Å; E25-I100 PolarHBondContact N-O 3.11Å
101	S	78.9	Confident	61	Low	76 Å²	76	95.6 Å²	95.6	53%	0.531	60%	0.602	S	S	.	*			trans	-81.5	154.2	-175.3	-52.5	0	0	0	0	112.9	E25 N99 A103	E25-S101 VanDerWaalsContact OE2-CA 3.22Å; E25-S101 WeakPolarHBondContact OE2-CA 3.41Å; N99-S101 PolarHBondContact ND2-OG 2.95Å; S101-A103 VanDerWaalsContact C-N 3.31Å; S101-A103 PolarHBondContact O-N 3.43Å
102	L	74.5	Confident	58.9	Low	89 Å²	89	97.5 Å²	97.5	47%	0.466	63%	0.631	S	S	.	*	S	Bend	trans	-70.4	-14.4	-176.4	-85.5	169.4	0	0	0	115.8	E25 A26 L29	E25-L102 HydrophobicContact CB-CD1 4.4Å; E25-L102 HydrophobicContact CB-CG 4.01Å; E25-L102 HydrophobicContact CG-CB 4.48Å; E25-L102 HydrophobicContact CG-CD1 3.77Å; E25-L102 HydrophobicContact CG-CG 3.87Å; E25-L102 PolarHBondContact OE2-N 3.01Å; A26-L102 HydrophobicContact CB-CD2 3.55Å; A26-L102 HydrophobicContact CB-CG 4.44Å; L29-L102 HydrophobicContact CD2-CD1 3.92Å
103	A	56.8	Low	56.9	Low	93 Å²	93	103.6 Å²	103.6	77%	0.769	66%	0.658	S	S	*	*			trans	-98.1	99.9	-169.7	0	0	0	0	0	114	S101	S101-A103 VanDerWaalsContact C-N 3.31Å; S101-A103 PolarHBondContact O-N 3.43Å
104	V	47.1	Very low	55.2	Low	152 Å²	152	107.2 Å²	107.2	92%	0.921	68%	0.677	S	S	*	*			trans	-118.8	100	149.7	177.7	0	0	0	0	107.6
105	G	38.7	Very low	53.5	Low	78 Å²	78	110 Å²	110	80%	0.804	68%	0.675	S	S	*	*			trans	94.3	106.6	158.5	0	0	0	0	0	119.3
106	S	34.9	Very low	52.4	Low	118 Å²	118	104.4 Å²	104.4	83%	0.825	66%	0.662	S	S	*	*				173.8	122.7	120	-167.6	0	0	0	0	112.5
107	S	39.3	Very low	50.8	Low	96 Å²	96	104.5 Å²	104.5	67%	0.671	65%	0.651	S	S	*	*			trans	26.7	146.3	151.8	-84.5	0	0	0	0	122.9
108	D	34.5	Very low	49.1	Very low	141 Å²	141	109.9 Å²	109.9	75%	0.754	68%	0.679	S	S	*	*			cis	-161.8	131.6	5.5	-90.2	-29.1	0	0	0	109.9
109	S	39.7	Very low	47.5	Very low	124 Å²	124	113.6 Å²	113.6	87%	0.867	68%	0.684	S	S	*	*			trans	-162.4	104.9	134.3	-173.6	0	0	0	0	106.5
110	V	40.1	Very low	45.4	Very low	124 Å²	124	121.8 Å²	121.8	75%	0.752	71%	0.711	S	S	*	*			trans	-72.1	121.9	-177.2	-87.2	0	0	0	0	110.9
111	D	38.7	Very low	43	Very low	170 Å²	170	124.6 Å²	124.6	91%	0.909	72%	0.724	S	S	*	*	S	Bend	trans	-153.5	110.7	131.8	-94.3	-32.2	0	0	0	109.6
112	G	40	Very low	40.8	Very low	72 Å²	72	125.2 Å²	125.2	74%	0.742	73%	0.725	S	S	*	*	S	Bend	trans	118.8	-11.3	153.8	0	0	0	0	0	120.3
113	Q	43.3	Very low	38.9	Very low	160 Å²	160	128.9 Å²	128.9	75%	0.748	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	13.8	-161.5	-145.4	151.5	-21.5	0	0	117.7	S116	Q113-S116 VanDerWaalsContact CG-OG 3.28Å; Q113-S116 WeakPolarHBondContact CG-OG 3.29Å; Q113-S116 PolarHBondContact O-OG 3.25Å
114	L	40.1	Very low	37.7	Very low	156 Å²	156	130.2 Å²	130.2	82%	0.817	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-3.4	170.5	-154.9	68.7	0	0	0	113.7
115	L	38.5	Very low	37.4	Very low	127 Å²	127	129.7 Å²	129.7	67%	0.665	73%	0.728	S	S	*	*	S	Bend	trans	-90.3	-13.6	169	-83	159.6	0	0	0	113.3	Q117 Q119	L115-Q117 PolarHBondContact O-N 2.89Å; L115-Q119 WeakPolarHBondContact O-CB 3.17Å; L115-Q119 PolarHBondContact O-N 2.85Å
116	S	44.1	Very low	37.2	Very low	50 Å²	50	133.8 Å²	133.8	35%	0.35	73%	0.726	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.6	-8.6	-174.1	68.3	0	0	0	0	115.4	Q113 R120	Q113-S116 VanDerWaalsContact CG-OG 3.28Å; Q113-S116 WeakPolarHBondContact CG-OG 3.29Å; Q113-S116 PolarHBondContact O-OG 3.25Å; S116-R120 WeakPolarHBondContact O-CD 3.43Å; S116-R120 VanDerWaalsContact O-CG 3.29Å; S116-R120 WeakPolarHBondContact O-CG 3.18Å
117	Q	37.1	Very low	37.3	Very low	154 Å²	154	130.7 Å²	130.7	72%	0.72	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-23.9	177.3	-83.5	179.7	-10.1	0	0	113.6	L115	L115-Q117 PolarHBondContact O-N 2.89Å
118	L	35	Very low	37.2	Very low	139 Å²	139	132.5 Å²	132.5	73%	0.728	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-9.4	170.9	-73.7	167.2	0	0	0	113.3	M121	L118-M121 HydrophobicContact CD2-CE 4.3Å
119	Q	36.2	Very low	37.6	Very low	124 Å²	124	129.2 Å²	129.2	58%	0.579	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	28.1	169.8	-157.8	163	-14.8	0	0	113.1	L115	L115-Q119 WeakPolarHBondContact O-CB 3.17Å; L115-Q119 PolarHBondContact O-N 2.85Å
120	R	37.1	Very low	38.4	Very low	219 Å²	219	125.8 Å²	125.8	83%	0.826	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	5.2	168.2	-77	-177.1	69.5	123.4	5.1	113.7	S116	S116-R120 WeakPolarHBondContact O-CD 3.43Å; S116-R120 VanDerWaalsContact O-CG 3.29Å; S116-R120 WeakPolarHBondContact O-CG 3.18Å
121	M	28.2	Very low	40	Very low	154 Å²	154	126.8 Å²	126.8	76%	0.759	69%	0.693	S	S	*	*	S	Bend	trans	-110.1	-0.4	174.3	-67.2	-169.4	-75.2	0	0	113.4	L118	L118-M121 HydrophobicContact CD2-CE 4.3Å
122	T	33.5	Very low	42	Very low	90 Å²	90	119.3 Å²	119.3	55%	0.552	66%	0.655	S	S	*	*	S	Bend	trans	-146.1	110	177.7	56.1	0	0	0	0	111.8
123	M	34.5	Very low	44.1	Very low	166 Å²	166	119.5 Å²	119.5	82%	0.818	64%	0.642	S	S	*	*	S	Bend	trans	67.3	120.7	169.3	-47.5	-73	148.8	0	0	114
124	D	32.3	Very low	45.9	Very low	120 Å²	120	113.9 Å²	113.9	64%	0.642	61%	0.614	S	S	*	*			cis	-146.7	135.5	23.7	-66	-48	0	0	0	108.7	Q126	D124-Q126 HydrophobicContact CB-CG 4.18Å; D124-Q126 PolarHBondContact O-N 2.74Å
125	D	40.4	Very low	48.2	Very low	142 Å²	142	109.5 Å²	109.5	76%	0.759	60%	0.595	S	S	*	*				15.6	51.3	89.3	-149.7	26.4	0	0	0	116.2	R370	D125-R370 IonicContact OD2-NH2 3.67Å
126	Q	33.9	Very low	50.7	Low	164 Å²	164	109.1 Å²	109.1	77%	0.766	59%	0.59	S	S	*	*			trans	-118	89.5	151.7	-72.2	-176.1	2.6	0	0	107.7	D124	D124-Q126 HydrophobicContact CB-CG 4.18Å; D124-Q126 PolarHBondContact O-N 2.74Å
127	G	36.8	Very low	52.9	Low	53 Å²	53	108.5 Å²	108.5	55%	0.546	58%	0.582	S	S	.	*			trans	-52.6	163.8	151.2	0	0	0	0	0	109.6	A129	G127-A129 PolarHBondContact O-N 3.41Å
128	T	38	Very low	55.5	Low	133 Å²	133	107.4 Å²	107.4	82%	0.816	58%	0.577	S	S	*	*	S	Bend	trans	-59.5	65.2	152	49.6	0	0	0	0	109.1	G130	T128-G130 PolarHBondContact O-N 2.82Å
129	A	42.3	Very low	58.2	Low	73 Å²	73	104.3 Å²	104.3	60%	0.603	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	118.3	177	0	0	0	0	0	106.7	G127 E205	G127-A129 PolarHBondContact O-N 3.41Å; A129-E205 WeakPolarHBondContact CA-OE1 3.3Å; A129-E205 WeakPolarHBondContact CB-OE1 3.29Å
130	G	56.7	Low	61	Low	52 Å²	52	101.9 Å²	101.9	54%	0.536	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	109.7	-0.9	174.5	0	0	0	0	0	117.7	T128 E205	T128-G130 PolarHBondContact O-N 2.82Å; G130-E205 WeakPolarHBondContact CA-OE2 3.35Å; G130-E205 PolarHBondContact N-OE2 3.44Å
131	Q	72.6	Confident	63.6	Low	144 Å²	144	97 Å²	97	67%	0.673	54%	0.543	S	S	*	.			trans	-112.2	122.7	176.3	-163.2	169.1	-6	0	0	112.3
132	A	81.8	Confident	66.7	Low	13 Å²	13	91.6 Å²	91.6	11%	0.107	52%	0.52	C	S	.	.			trans	-61.3	140.8	176.5	0	0	0	0	0	111.7	Y134 P135 F178 F179	A132-Y134 VanDerWaalsContact C-N 3.26Å; A132-Y134 PolarHBondContact O-N 3.44Å; A132-P135 WeakPolarHBondContact O-CD 3.44Å; A132-F178 HydrophobicContact CB-CD2 3.65Å; A132-F178 HydrophobicContact CB-CE2 3.69Å; A132-F179 HydrophobicContact CB-CD2 3.69Å; A132-F179 HydrophobicContact CB-CE2 4.14Å; A132-F179 HydrophobicContact CB-CG 4.33Å
133	V	82.6	Confident	69.7	Low	77 Å²	77	87.7 Å²	87.7	47%	0.467	50%	0.495	S	S	.	.	S	Bend	trans	-65.1	-31.2	177.6	174.4	0	0	0	0	112.2	F178 F179 D181	V133-F178 PolarHBondContact N-O 2.57Å; V133-F178 VanDerWaalsContact N-O 3.16Å; V133-F179 WeakPolarHBondContact CG2-O 3.4Å; V133-F179 PolarHBondContact N-O 2.86Å; V133-D181 HydrophobicContact CB-CB 4.39Å; V133-D181 HydrophobicContact CG1-CB 4.02Å; V133-D181 HydrophobicContact CG2-CB 4.38Å
134	Y	83.1	Confident	72.5	Confident	41 Å²	41	81.9 Å²	81.9	16%	0.161	47%	0.467	C	S	.	.			trans	-123.1	81.3	175.7	-56.7	-85.7	0	0	0	110	A132 E136 M137 F167 K176 F178 D181	A132-Y134 VanDerWaalsContact C-N 3.26Å; A132-Y134 PolarHBondContact O-N 3.44Å; Y134-E136 PolarHBondContact O-N 3.42Å; Y134-M137 PolarHBondContact O-N 3.25Å; Y134-F167 HydrophobicContact CD1-CZ 4.22Å; Y134-F167 AromaticContact CD2-CE1 3.8Å; Y134-F167 HydrophobicContact CD2-CE1 3.8Å; Y134-F167 HydrophobicContact CD2-CZ 4.1Å; Y134-F167 HydrophobicContact CE1-CZ 4.25Å; Y134-F167 HydrophobicContact CE2-CE1 4.12Å; Y134-F167 HydrophobicContact CE2-CZ 4.11Å; Y134-F167 HydrophobicContact CG-CE1 4.04Å; Y134-F167 HydrophobicContact CG-CZ 4.14Å; Y134-K176 PolarHBondContact OH-NZ 3.15Å; Y134-F178 WeakPolarHBondContact CD2-O 3.26Å; Y134-F178 PolarHBondContact N-O 3.26Å; Y134-D181 HydrophobicContact CE2-CB 4.08Å; Y134-D181 VanDerWaalsContact CE2-OD1 3.24Å; Y134-D181 WeakPolarHBondContact CE2-OD1 3.33Å; Y134-D181 PolarHBondContact OH-OD1 2.63Å
135	P	88.2	Confident	75.3	Confident	65 Å²	65	80.9 Å²	80.9	42%	0.422	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-58	-32.3	-179.2	-24.5	34.7	0	0	0	113.5	A132 M137 E138	A132-P135 WeakPolarHBondContact O-CD 3.44Å; P135-M137 PolarHBondContact O-N 3.06Å; P135-E138 VanDerWaalsContact O-CB 3.25Å; P135-E138 WeakPolarHBondContact O-CB 3.17Å; P135-E138 PolarHBondContact O-N 3.46Å
136	E	89.6	Confident	77.7	Confident	118 Å²	118	75.1 Å²	75.1	55%	0.551	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-64.8	-18.9	176.3	68	-81.5	-167.7	0	0	113.8	Y134 S142	Y134-E136 PolarHBondContact O-N 3.42Å; E136-S142 WeakPolarHBondContact O-CB 3.34Å; E136-S142 PolarHBondContact O-OG 3.41Å
137	M	91.8	Very high	80.4	Confident	38 Å²	38	68 Å²	68	19%	0.187	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-103.9	15.4	179.3	-61.4	-56.2	172.2	0	0	112.7	Y134 P135 R143 T146 F167 F178	Y134-M137 PolarHBondContact O-N 3.25Å; P135-M137 PolarHBondContact O-N 3.06Å; M137-R143 HydrophobicContact CB-CG 4.15Å; M137-R143 WeakPolarHBondContact O-CD 3.37Å; M137-R143 VanDerWaalsContact O-CG 3.28Å; M137-R143 WeakPolarHBondContact O-CG 3.31Å; M137-R143 PolarHBondContact O-NH1 2.99Å; M137-T146 HydrophobicContact CE-CG2 4.02Å; M137-T146 HydrophobicContact SD-CG2 4.1Å; M137-F167 HydrophobicContact CB-CD1 4.15Å; M137-F167 HydrophobicContact CG-CD1 4Å; M137-F167 HydrophobicContact CG-CD2 4.49Å; M137-F167 HydrophobicContact CG-CE1 4.24Å; M137-F167 HydrophobicContact CG-CG 4.14Å; M137-F167 HydrophobicContact SD-CG 4.46Å; M137-F178 HydrophobicContact CB-CB 3.6Å; M137-F178 WeakPolarHBondContact O-CB 3.19Å; M137-F178 WeakPolarHBondContact O-CG 3.38Å
138	E	90	Very high	82.7	Confident	131 Å²	131	72.9 Å²	72.9	61%	0.612	41%	0.41	S	S	*	.			trans	-64.6	-39.8	-179.8	-177.3	172.4	-149.7	0	0	112.6	P135 R143 F178	P135-E138 VanDerWaalsContact O-CB 3.25Å; P135-E138 WeakPolarHBondContact O-CB 3.17Å; P135-E138 PolarHBondContact O-N 3.46Å; E138-R143 PolarHBondContact O-NH1 2.89Å; E138-F178 HydrophobicContact CB-CD2 4.38Å; E138-F178 HydrophobicContact CB-CE2 4.18Å; E138-F178 HydrophobicContact CG-CE2 4.17Å
139	T	92.3	Very high	84.9	Confident	73 Å²	73	70.2 Å²	70.2	45%	0.448	39%	0.391	S	S	.	.	S	Bend	trans	-78.6	142.7	177.4	78.7	0	0	0	0	111.5	D141 S142 R143	T139-D141 VanDerWaalsContact C-N 3.31Å; T139-D141 PolarHBondContact O-N 3.19Å; T139-S142 WeakPolarHBondContact O-CB 3.5Å; T139-S142 PolarHBondContact O-N 3.04Å; T139-S142 VanDerWaalsContact OG1-CB 3.31Å; T139-S142 WeakPolarHBondContact OG1-CB 3.04Å; T139-S142 PolarHBondContact OG1-N 3.5Å; T139-S142 VanDerWaalsContact OG1-N 3.12Å; T139-S142 PolarHBondContact OG1-OG 2.98Å; T139-R143 PolarHBondContact O-N 2.81Å; T139-R143 PolarHBondContact O-NH1 2.83Å
140	E	94.3	Very high	87.1	Confident	73 Å²	73	68.1 Å²	68.1	34%	0.341	37%	0.367	S	S	.	.	H	α-helix	trans	-60.3	-41.7	176	-174.2	177.6	146.5	0	0	111.8	S142 R143 L144 A162 Q163	E140-S142 PolarHBondContact O-N 2.89Å; E140-R143 CarbonylContact O-C 3.51Å; E140-R143 WeakPolarHBondContact O-CA 3.11Å; E140-R143 WeakPolarHBondContact O-CB 3.44Å; E140-R143 PolarHBondContact O-N 2.69Å; E140-L144 HydrophobicContact CG-CD1 4.25Å; E140-L144 HydrophobicContact CG-CG 4.43Å; E140-L144 WeakPolarHBondContact O-CG 3.46Å; E140-L144 PolarHBondContact O-N 3.2Å; E140-A162 HydrophobicContact CG-CB 4.06Å; E140-Q163 VanDerWaalsContact CD-CG 3.45Å; E140-Q163 WeakPolarHBondContact OE1-CG 3.19Å; E140-Q163 PolarHBondContact OE1-NE2 3.11Å; E140-Q163 WeakPolarHBondContact OE2-CG 3.32Å
141	D	93.3	Very high	88.1	Confident	118 Å²	118	66.7 Å²	66.7	63%	0.631	35%	0.349	S	S	*	.	H	α-helix	trans	-59.2	-43.7	177.6	-64.9	-45.5	0	0	0	112.3	T139 R143 L144 T145	T139-D141 VanDerWaalsContact C-N 3.31Å; T139-D141 PolarHBondContact O-N 3.19Å; D141-R143 VanDerWaalsContact C-N 3.26Å; D141-R143 PolarHBondContact O-N 3.42Å; D141-L144 PolarHBondContact O-N 3.43Å; D141-T145 WeakPolarHBondContact O-CG2 3.08Å; D141-T145 PolarHBondContact O-N 3.35Å; D141-T145 VanDerWaalsContact O-N 3.09Å
142	S	92	Very high	88.2	Confident	40 Å²	40	66.7 Å²	66.7	28%	0.28	36%	0.359	S	S	.	.	H	α-helix	trans	-55.4	-44.3	173.2	-71.7	0	0	0	0	110.9	E136 T139 E140 T145	E136-S142 WeakPolarHBondContact O-CB 3.34Å; E136-S142 PolarHBondContact O-OG 3.41Å; T139-S142 WeakPolarHBondContact O-CB 3.5Å; T139-S142 PolarHBondContact O-N 3.04Å; T139-S142 VanDerWaalsContact OG1-CB 3.31Å; T139-S142 WeakPolarHBondContact OG1-CB 3.04Å; T139-S142 PolarHBondContact OG1-N 3.5Å; T139-S142 VanDerWaalsContact OG1-N 3.12Å; T139-S142 PolarHBondContact OG1-OG 2.98Å; E140-S142 PolarHBondContact O-N 2.89Å; S142-T145 PolarHBondContact O-N 3.03Å; S142-T145 PolarHBondContact O-OG1 2.81Å
143	R	96.4	Very high	87.7	Confident	7 Å²	7	74 Å²	74	3%	0.026	39%	0.39	C	S	.	.	H	α-helix	trans	-67.6	-43	179.2	-61.1	-167.3	-65.8	-81.6	0.6	111.7	M137 E138 T139 E140 D141 T145 T146 F147 A162 F167	M137-R143 HydrophobicContact CB-CG 4.15Å; M137-R143 WeakPolarHBondContact O-CD 3.37Å; M137-R143 VanDerWaalsContact O-CG 3.28Å; M137-R143 WeakPolarHBondContact O-CG 3.31Å; M137-R143 PolarHBondContact O-NH1 2.99Å; E138-R143 PolarHBondContact O-NH1 2.89Å; T139-R143 PolarHBondContact O-N 2.81Å; T139-R143 PolarHBondContact O-NH1 2.83Å; E140-R143 CarbonylContact O-C 3.51Å; E140-R143 WeakPolarHBondContact O-CA 3.11Å; E140-R143 WeakPolarHBondContact O-CB 3.44Å; E140-R143 PolarHBondContact O-N 2.69Å; D141-R143 VanDerWaalsContact C-N 3.26Å; D141-R143 PolarHBondContact O-N 3.42Å; R143-T145 VanDerWaalsContact C-N 3.27Å; R143-T145 PolarHBondContact O-N 3.15Å; R143-T146 WeakPolarHBondContact O-CB 3.38Å; R143-T146 PolarHBondContact O-N 2.64Å; R143-T146 PolarHBondContact O-OG1 3.27Å; R143-F147 VanDerWaalsContact O-CD2 3.27Å; R143-F147 WeakPolarHBondContact O-CD2 3.4Å; R143-A162 HydrophobicContact CB-CB 4.12Å; R143-A162 PolarHBondContact NE-O 2.95Å; R143-A162 PolarHBondContact NH2-O 2.79Å; R143-F167 HydrophobicContact CB-CB 3.98Å; R143-F167 HydrophobicContact CG-CB 3.96Å
144	L	93.3	Very high	87.3	Confident	44 Å²	44	71.2 Å²	71.2	23%	0.23	38%	0.376	C	S	.	.	H	α-helix	trans	-57.1	-39.7	177.7	-74.4	171.9	0	0	0	112.4	E140 D141 T146 F147 A162	E140-L144 HydrophobicContact CG-CD1 4.25Å; E140-L144 HydrophobicContact CG-CG 4.43Å; E140-L144 WeakPolarHBondContact O-CG 3.46Å; E140-L144 PolarHBondContact O-N 3.2Å; D141-L144 PolarHBondContact O-N 3.43Å; L144-T146 PolarHBondContact O-N 2.93Å; L144-T146 VanDerWaalsContact O-N 3.09Å; L144-F147 PolarHBondContact O-N 2.9Å; L144-A162 HydrophobicContact CD2-CB 3.45Å; L144-A162 VanDerWaalsContact CD2-CB 3.45Å; L144-A162 HydrophobicContact CG-CB 3.67Å
145	T	92.4	Very high	86.9	Confident	100 Å²	100	71.4 Å²	71.4	61%	0.613	38%	0.383	S	S	*	.	H	α-helix	trans	-60.5	-24.3	178.9	71.4	0	0	0	0	113.2	D141 S142 R143 F147 H148	D141-T145 WeakPolarHBondContact O-CG2 3.08Å; D141-T145 PolarHBondContact O-N 3.35Å; D141-T145 VanDerWaalsContact O-N 3.09Å; S142-T145 PolarHBondContact O-N 3.03Å; S142-T145 PolarHBondContact O-OG1 2.81Å; R143-T145 VanDerWaalsContact C-N 3.27Å; R143-T145 PolarHBondContact O-N 3.15Å; T145-F147 VanDerWaalsContact C-N 3.26Å; T145-F147 PolarHBondContact O-N 3.16Å; T145-H148 PolarHBondContact O-ND1 3.24Å; T145-H148 VanDerWaalsContact O-ND1 3.17Å
146	T	89.3	Confident	86.7	Confident	20 Å²	20	68.7 Å²	68.7	12%	0.123	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-70.6	-22.3	178.1	70.9	0	0	0	0	112.7	M137 R143 L144 H148 F167 Y168	M137-T146 HydrophobicContact CE-CG2 4.02Å; M137-T146 HydrophobicContact SD-CG2 4.1Å; R143-T146 WeakPolarHBondContact O-CB 3.38Å; R143-T146 PolarHBondContact O-N 2.64Å; R143-T146 PolarHBondContact O-OG1 3.27Å; L144-T146 PolarHBondContact O-N 2.93Å; L144-T146 VanDerWaalsContact O-N 3.09Å; T146-H148 VanDerWaalsContact C-N 3.28Å; T146-H148 PolarHBondContact O-N 3.42Å; T146-H148 PolarHBondContact O-ND1 3.16Å; T146-F167 HydrophobicContact CG2-CB 4.1Å; T146-F167 HydrophobicContact CG2-CD2 4.43Å; T146-Y168 WeakPolarHBondContact O-CD1 3.5Å; T146-Y168 PolarHBondContact OG1-N 3.39Å
147	F	91.5	Very high	86.6	Confident	14 Å²	14	69.1 Å²	69.1	6%	0.061	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-85.4	13.4	-176.2	-68.3	-89.3	0	0	0	114.6	R143 L144 T145 N149 W150 P158 L161 A162 Y168 V175	R143-F147 VanDerWaalsContact O-CD2 3.27Å; R143-F147 WeakPolarHBondContact O-CD2 3.4Å; L144-F147 PolarHBondContact O-N 2.9Å; T145-F147 VanDerWaalsContact C-N 3.26Å; T145-F147 PolarHBondContact O-N 3.16Å; F147-N149 PolarHBondContact O-N 2.99Å; F147-W150 HydrophobicContact CB-CB 4.13Å; F147-W150 HydrophobicContact CD1-CB 4.04Å; F147-W150 AromaticContact CD1-CD2 3.7Å; F147-W150 HydrophobicContact CD1-CD2 3.7Å; F147-W150 AromaticContact CD1-CE3 3.64Å; F147-W150 HydrophobicContact CD1-CE3 3.64Å; F147-W150 AromaticContact CD1-CG 3.9Å; F147-W150 HydrophobicContact CD1-CG 3.9Å; F147-W150 HydrophobicContact CD1-CZ3 4.33Å; F147-W150 HydrophobicContact CE1-CD2 4.05Å; F147-W150 AromaticContact CE1-CE3 3.78Å; F147-W150 HydrophobicContact CE1-CE3 3.78Å; F147-W150 HydrophobicContact CE1-CH2 4.44Å; F147-W150 AromaticContact CE1-CZ3 4Å; F147-W150 HydrophobicContact CE1-CZ3 4Å; F147-W150 WeakPolarHBondContact O-CB 3.28Å; F147-W150 PolarHBondContact O-N 3.28Å; F147-P158 HydrophobicContact CB-CB 3.72Å; F147-P158 HydrophobicContact CB-CG 4.02Å; F147-P158 HydrophobicContact CD1-CB 3.89Å; F147-P158 HydrophobicContact CD1-CG 4.13Å; F147-P158 HydrophobicContact CD2-CB 4.15Å; F147-P158 HydrophobicContact CG-CB 3.67Å; F147-P158 HydrophobicContact CG-CG 4.22Å; F147-L161 HydrophobicContact CE1-CB 4.2Å; F147-L161 HydrophobicContact CE1-CD1 3.85Å; F147-L161 HydrophobicContact CZ-CB 3.77Å; F147-L161 HydrophobicContact CZ-CD1 4.29Å; F147-A162 HydrophobicContact CE2-CB 4.37Å; F147-Y168 HydrophobicContact CD1-CG 4.39Å; F147-V175 HydrophobicContact CE1-CG1 3.95Å; F147-V175 HydrophobicContact CZ-CG1 4.15Å
148	H	85.8	Confident	86.6	Confident	156 Å²	156	68.4 Å²	68.4	72%	0.722	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-55.2	-24.6	-178.8	62.9	-83.5	0	0	0	114.6	T145 T146	T145-H148 PolarHBondContact O-ND1 3.24Å; T145-H148 VanDerWaalsContact O-ND1 3.17Å; T146-H148 VanDerWaalsContact C-N 3.28Å; T146-H148 PolarHBondContact O-N 3.42Å; T146-H148 PolarHBondContact O-ND1 3.16Å
149	N	84.4	Confident	86.7	Confident	77 Å²	77	66.2 Å²	66.2	41%	0.412	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-124.1	29.1	177.1	65.4	-31.3	0	0	0	112.7	F147 Y168	F147-N149 PolarHBondContact O-N 2.99Å; N149-Y168 WeakPolarHBondContact OD1-CD1 3.45Å; N149-Y168 WeakPolarHBondContact OD1-CE1 3.39Å
150	W	86.9	Confident	86.7	Confident	29 Å²	29	65.5 Å²	65.5	11%	0.11	35%	0.353	C	S	.	.			trans	-59.8	135	175.5	-174.9	-114.3	0	0	0	111	F147 T152 A154 V156 P158 L161 Y168 D173 V175	F147-W150 HydrophobicContact CB-CB 4.13Å; F147-W150 HydrophobicContact CD1-CB 4.04Å; F147-W150 AromaticContact CD1-CD2 3.7Å; F147-W150 HydrophobicContact CD1-CD2 3.7Å; F147-W150 AromaticContact CD1-CE3 3.64Å; F147-W150 HydrophobicContact CD1-CE3 3.64Å; F147-W150 AromaticContact CD1-CG 3.9Å; F147-W150 HydrophobicContact CD1-CG 3.9Å; F147-W150 HydrophobicContact CD1-CZ3 4.33Å; F147-W150 HydrophobicContact CE1-CD2 4.05Å; F147-W150 AromaticContact CE1-CE3 3.78Å; F147-W150 HydrophobicContact CE1-CE3 3.78Å; F147-W150 HydrophobicContact CE1-CH2 4.44Å; F147-W150 AromaticContact CE1-CZ3 4Å; F147-W150 HydrophobicContact CE1-CZ3 4Å; F147-W150 WeakPolarHBondContact O-CB 3.28Å; F147-W150 PolarHBondContact O-N 3.28Å; W150-T152 PolarHBondContact O-N 3.42Å; W150-A154 HydrophobicContact CD2-CB 4.4Å; W150-A154 HydrophobicContact CZ2-CB 3.65Å; W150-V156 PolarHBondContact NE1-O 3.32Å; W150-V156 VanDerWaalsContact NE1-O 3.11Å; W150-P158 HydrophobicContact CB-CG 4.3Å; W150-P158 HydrophobicContact CG-CG 4.07Å; W150-L161 HydrophobicContact CH2-CD1 3.98Å; W150-L161 HydrophobicContact CZ2-CD1 3.57Å; W150-Y168 HydrophobicContact CE3-CD1 4.43Å; W150-Y168 AromaticContact CE3-CD2 3.41Å; W150-Y168 HydrophobicContact CE3-CD2 3.41Å; W150-Y168 VanDerWaalsContact CE3-CD2 3.41Å; W150-Y168 AromaticContact CE3-CE2 3.6Å; W150-Y168 HydrophobicContact CE3-CE2 3.6Å; W150-Y168 AromaticContact CE3-CG 3.87Å; W150-Y168 HydrophobicContact CE3-CG 3.87Å; W150-Y168 AromaticContact CZ3-CD2 3.4Å; W150-Y168 HydrophobicContact CZ3-CD2 3.4Å; W150-Y168 AromaticContact CZ3-CE2 3.62Å; W150-Y168 HydrophobicContact CZ3-CE2 3.62Å; W150-Y168 HydrophobicContact CZ3-CG 4.24Å; W150-D173 HydrophobicContact CH2-CB 3.65Å; W150-D173 VanDerWaalsContact CH2-O 3.25Å; W150-D173 WeakPolarHBondContact CH2-O 3.27Å; W150-D173 HydrophobicContact CZ2-CB 4.15Å; W150-D173 VanDerWaalsContact CZ3-CA 3.49Å; W150-D173 HydrophobicContact CZ3-CB 4.12Å; W150-V175 HydrophobicContact CH2-CG1 3.64Å; W150-V175 HydrophobicContact CZ3-CG1 3.6Å
151	P	77.9	Confident	86.6	Confident	22 Å²	22	62 Å²	62	14%	0.143	34%	0.337	C	S	.	.			trans	-61.1	135.9	-175.1	-18.2	29.1	0	0	0	111.7	E153 A154 G172	P151-E153 VanDerWaalsContact CB-CD 3.49Å; P151-E153 HydrophobicContact CB-CG 4.02Å; P151-E153 PolarHBondContact O-N 2.89Å; P151-A154 HydrophobicContact CB-CB 4.19Å; P151-A154 HydrophobicContact CG-CB 4.49Å; P151-A154 VanDerWaalsContact O-CB 3.28Å; P151-A154 WeakPolarHBondContact O-CB 3.5Å; P151-A154 PolarHBondContact O-N 3.05Å; P151-A154 VanDerWaalsContact O-N 3.09Å; P151-G172 WeakPolarHBondContact CD-O 3.48Å; P151-G172 WeakPolarHBondContact CG-O 3.45Å
152	T	75.6	Confident	86.7	Confident	144 Å²	144	56.4 Å²	56.4	88%	0.883	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-24.6	-179.8	-45.4	0	0	0	0	111.9	W150 A154	W150-T152 PolarHBondContact O-N 3.42Å; T152-A154 VanDerWaalsContact C-N 3.28Å
153	E	72.1	Confident	86.8	Confident	166 Å²	166	58.5 Å²	58.5	78%	0.776	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-13.7	172.6	63.6	-90.8	-151.1	0	0	113.8	P151 S155	P151-E153 VanDerWaalsContact CB-CD 3.49Å; P151-E153 HydrophobicContact CB-CG 4.02Å; P151-E153 PolarHBondContact O-N 2.89Å; E153-S155 PolarHBondContact O-N 3.32Å
154	A	72.4	Confident	86.7	Confident	19 Å²	19	58.1 Å²	58.1	16%	0.157	31%	0.311	C	S	.	.			trans	-70.4	126.8	176.6	0	0	0	0	0	109.3	W150 P151 T152 V156 D173	W150-A154 HydrophobicContact CD2-CB 4.4Å; W150-A154 HydrophobicContact CZ2-CB 3.65Å; P151-A154 HydrophobicContact CB-CB 4.19Å; P151-A154 HydrophobicContact CG-CB 4.49Å; P151-A154 VanDerWaalsContact O-CB 3.28Å; P151-A154 WeakPolarHBondContact O-CB 3.5Å; P151-A154 PolarHBondContact O-N 3.05Å; P151-A154 VanDerWaalsContact O-N 3.09Å; T152-A154 VanDerWaalsContact C-N 3.28Å; A154-V156 VanDerWaalsContact C-N 3.3Å; A154-V156 PolarHBondContact O-N 3.24Å; A154-D173 HydrophobicContact CB-CB 4.39Å
155	S	75.4	Confident	86.8	Confident	45 Å²	45	56 Å²	56	32%	0.315	30%	0.3	S	S	.	.	S	Bend	trans	-79.6	-12.5	-167.5	60.4	0	0	0	0	114.4	E153 W187 E188 P189	E153-S155 PolarHBondContact O-N 3.32Å; S155-W187 PolarHBondContact OG-O 3.29Å; S155-E188 PolarHBondContact OG-O 3.06Å; S155-P189 VanDerWaalsContact OG-N 3.1Å
156	V	84.1	Confident	86.9	Confident	8 Å²	8	51.3 Å²	51.3	5%	0.048	27%	0.271	C	S	.	.	S	Bend	trans	-108	136.5	-175.9	-177.2	0	0	0	0	110.2	W150 A154 V160 L161 W187 D191 P193	W150-V156 PolarHBondContact NE1-O 3.32Å; W150-V156 VanDerWaalsContact NE1-O 3.11Å; A154-V156 VanDerWaalsContact C-N 3.3Å; A154-V156 PolarHBondContact O-N 3.24Å; V156-V160 HydrophobicContact CG1-CG2 3.65Å; V156-L161 HydrophobicContact CB-CD1 4.33Å; V156-L161 HydrophobicContact CG1-CD1 3.99Å; V156-L161 HydrophobicContact CG1-CD2 4.14Å; V156-L161 HydrophobicContact CG1-CG 3.78Å; V156-W187 HydrophobicContact CG2-CB 3.91Å; V156-W187 HydrophobicContact CG2-CD2 4.36Å; V156-W187 HydrophobicContact CG2-CE3 3.93Å; V156-W187 HydrophobicContact CG2-CG 4.41Å; V156-D191 HydrophobicContact CG2-CB 4.23Å; V156-P193 HydrophobicContact CG1-CG 3.75Å
157	Q	87.8	Confident	87.1	Confident	127 Å²	127	51.2 Å²	51.2	59%	0.593	27%	0.269	S	S	*	.			trans	-74.4	139.1	-177.7	-65	-64.1	-19.9	0	0	111.9	D159 V160 L161	Q157-D159 PolarHBondContact O-N 3.17Å; Q157-V160 HydrophobicContact CB-CG2 4.19Å; Q157-V160 WeakPolarHBondContact O-CG2 3.45Å; Q157-V160 PolarHBondContact O-N 2.85Å; Q157-L161 PolarHBondContact O-N 3.16Å
158	P	91.8	Very high	87.1	Confident	24 Å²	24	51.3 Å²	51.3	16%	0.156	27%	0.269	C	S	.	.	H	α-helix	trans	-52.5	-36.8	175.4	-32.5	39.1	0	0	0	114.8	F147 W150 V160 L161 A162	F147-P158 HydrophobicContact CB-CB 3.72Å; F147-P158 HydrophobicContact CB-CG 4.02Å; F147-P158 HydrophobicContact CD1-CB 3.89Å; F147-P158 HydrophobicContact CD1-CG 4.13Å; F147-P158 HydrophobicContact CD2-CB 4.15Å; F147-P158 HydrophobicContact CG-CB 3.67Å; F147-P158 HydrophobicContact CG-CG 4.22Å; W150-P158 HydrophobicContact CB-CG 4.3Å; W150-P158 HydrophobicContact CG-CG 4.07Å; P158-V160 PolarHBondContact O-N 3.39Å; P158-L161 PolarHBondContact O-N 3.1Å; P158-A162 WeakPolarHBondContact O-CB 3.42Å; P158-A162 PolarHBondContact O-N 3.36Å
159	D	92.1	Very high	87	Confident	85 Å²	85	46 Å²	46	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-46.5	-177.9	-54.4	-73.2	0	0	0	112.3	Q157 L161 A162 Q163	Q157-D159 PolarHBondContact O-N 3.17Å; D159-L161 VanDerWaalsContact C-N 3.33Å; D159-L161 PolarHBondContact O-N 2.86Å; D159-A162 PolarHBondContact O-N 3.06Å; D159-Q163 WeakPolarHBondContact O-CB 3.3Å; D159-Q163 VanDerWaalsContact O-CG 3.24Å; D159-Q163 WeakPolarHBondContact O-CG 3.43Å; D159-Q163 PolarHBondContact O-N 3.24Å
160	V	92.3	Very high	86.7	Confident	57 Å²	57	43.7 Å²	43.7	35%	0.345	24%	0.242	S	C	.	.	H	α-helix	trans	-71.4	-30.4	-179.8	-64.4	0	0	0	0	112.2	V156 Q157 P158 A164 P193	V156-V160 HydrophobicContact CG1-CG2 3.65Å; Q157-V160 HydrophobicContact CB-CG2 4.19Å; Q157-V160 WeakPolarHBondContact O-CG2 3.45Å; Q157-V160 PolarHBondContact O-N 2.85Å; P158-V160 PolarHBondContact O-N 3.39Å; V160-A164 WeakPolarHBondContact O-CB 3.12Å; V160-A164 PolarHBondContact O-N 3.31Å; V160-A164 VanDerWaalsContact O-N 3.13Å; V160-P193 HydrophobicContact CB-CG 4.34Å; V160-P193 HydrophobicContact CG2-CG 3.98Å
161	L	92.6	Very high	86.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-67.5	-48.5	173.2	-72.4	162.4	0	0	0	110.7	F147 W150 V156 Q157 P158 D159 Q163 A164 G165 F166 V175 W187 P193	F147-L161 HydrophobicContact CE1-CB 4.2Å; F147-L161 HydrophobicContact CE1-CD1 3.85Å; F147-L161 HydrophobicContact CZ-CB 3.77Å; F147-L161 HydrophobicContact CZ-CD1 4.29Å; W150-L161 HydrophobicContact CH2-CD1 3.98Å; W150-L161 HydrophobicContact CZ2-CD1 3.57Å; V156-L161 HydrophobicContact CB-CD1 4.33Å; V156-L161 HydrophobicContact CG1-CD1 3.99Å; V156-L161 HydrophobicContact CG1-CD2 4.14Å; V156-L161 HydrophobicContact CG1-CG 3.78Å; Q157-L161 PolarHBondContact O-N 3.16Å; P158-L161 PolarHBondContact O-N 3.1Å; D159-L161 VanDerWaalsContact C-N 3.33Å; D159-L161 PolarHBondContact O-N 2.86Å; L161-Q163 PolarHBondContact O-N 2.75Å; L161-A164 CarbonylContact O-C 3.59Å; L161-A164 PolarHBondContact O-N 3.05Å; L161-G165 PolarHBondContact O-N 2.86Å; L161-F166 HydrophobicContact CB-CB 4.31Å; L161-F166 HydrophobicContact CD2-CD2 4.39Å; L161-F166 WeakPolarHBondContact O-CA 3.38Å; L161-F166 VanDerWaalsContact O-CB 3.29Å; L161-F166 WeakPolarHBondContact O-CB 3.4Å; L161-F166 PolarHBondContact O-N 3.28Å; L161-V175 HydrophobicContact CD1-CG1 4.44Å; L161-V175 HydrophobicContact CD2-CG2 4.35Å; L161-W187 HydrophobicContact CD2-CD2 4.2Å; L161-W187 HydrophobicContact CD2-CE3 4.4Å; L161-W187 HydrophobicContact CD2-CH2 3.65Å; L161-W187 HydrophobicContact CD2-CZ2 3.4Å; L161-W187 VanDerWaalsContact CD2-CZ2 3.4Å; L161-W187 HydrophobicContact CD2-CZ3 4.16Å; L161-P193 HydrophobicContact CD2-CB 4.05Å; L161-P193 HydrophobicContact CD2-CG 3.77Å; L161-P193 HydrophobicContact CG-CG 4.11Å
162	A	95.2	Very high	86.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-44	177.8	0	0	0	0	0	111.8	E140 R143 L144 F147 P158 D159 A164 G165 F166	E140-A162 HydrophobicContact CG-CB 4.06Å; R143-A162 HydrophobicContact CB-CB 4.12Å; R143-A162 PolarHBondContact NE-O 2.95Å; R143-A162 PolarHBondContact NH2-O 2.79Å; L144-A162 HydrophobicContact CD2-CB 3.45Å; L144-A162 VanDerWaalsContact CD2-CB 3.45Å; L144-A162 HydrophobicContact CG-CB 3.67Å; F147-A162 HydrophobicContact CE2-CB 4.37Å; P158-A162 WeakPolarHBondContact O-CB 3.42Å; P158-A162 PolarHBondContact O-N 3.36Å; D159-A162 PolarHBondContact O-N 3.06Å; A162-A164 VanDerWaalsContact C-N 3.32Å; A162-A164 PolarHBondContact O-N 3.46Å; A162-G165 PolarHBondContact O-N 3.11Å; A162-F166 WeakPolarHBondContact CA-O 3.24Å
163	Q	93.9	Very high	86.3	Confident	84 Å²	84	43.5 Å²	43.5	39%	0.393	24%	0.241	S	C	.	.	H	α-helix	trans	-58.4	-42.9	174.8	-74.3	170.1	20	0	0	112	E140 D159 L161 G165 W194	E140-Q163 VanDerWaalsContact CD-CG 3.45Å; E140-Q163 WeakPolarHBondContact OE1-CG 3.19Å; E140-Q163 PolarHBondContact OE1-NE2 3.11Å; E140-Q163 WeakPolarHBondContact OE2-CG 3.32Å; D159-Q163 WeakPolarHBondContact O-CB 3.3Å; D159-Q163 VanDerWaalsContact O-CG 3.24Å; D159-Q163 WeakPolarHBondContact O-CG 3.43Å; D159-Q163 PolarHBondContact O-N 3.24Å; L161-Q163 PolarHBondContact O-N 2.75Å; Q163-G165 PolarHBondContact O-N 3.47Å; Q163-W194 VanDerWaalsContact C-CZ2 3.45Å; Q163-W194 VanDerWaalsContact O-CH2 3.27Å; Q163-W194 WeakPolarHBondContact O-CH2 3.34Å; Q163-W194 WeakPolarHBondContact O-CZ2 3.49Å
164	A	95	Very high	86.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	8.1	176.2	0	0	0	0	0	114.7	V160 L161 A162 F166 P193 W194 H197	V160-A164 WeakPolarHBondContact O-CB 3.12Å; V160-A164 PolarHBondContact O-N 3.31Å; V160-A164 VanDerWaalsContact O-N 3.13Å; L161-A164 CarbonylContact O-C 3.59Å; L161-A164 PolarHBondContact O-N 3.05Å; A162-A164 VanDerWaalsContact C-N 3.32Å; A162-A164 PolarHBondContact O-N 3.46Å; A164-F166 HydrophobicContact CB-CD2 3.83Å; A164-F166 HydrophobicContact CB-CE2 3.99Å; A164-P193 HydrophobicContact CB-CB 3.54Å; A164-W194 VanDerWaalsContact CA-CE2 3.49Å; A164-W194 HydrophobicContact CB-CD2 3.71Å; A164-W194 HydrophobicContact CB-CE3 4.13Å; A164-W194 HydrophobicContact CB-CG 3.97Å; A164-W194 HydrophobicContact CB-CZ2 4.34Å; A164-H197 PolarHBondContact O-CE1 2.8Å; A164-H197 PolarHBondContact O-ND1 3.09Å
165	G	94.3	Very high	87.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	9.1	175.5	0	0	0	0	0	114	L161 A162 Q163 C177 F178	L161-G165 PolarHBondContact O-N 2.86Å; A162-G165 PolarHBondContact O-N 3.11Å; Q163-G165 PolarHBondContact O-N 3.47Å; G165-C177 VanDerWaalsContact O-CA 3.27Å; G165-C177 WeakPolarHBondContact O-CA 3.45Å; G165-F178 WeakPolarHBondContact O-CD1 3.17Å; G165-F178 PolarHBondContact O-N 3.49Å
166	F	95.1	Very high	88	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	140.5	-177.3	-64.8	-74.5	0	0	0	112.9	L161 A162 A164 V175 K176 C177 L184 W187 P193 H197	L161-F166 HydrophobicContact CB-CB 4.31Å; L161-F166 HydrophobicContact CD2-CD2 4.39Å; L161-F166 WeakPolarHBondContact O-CA 3.38Å; L161-F166 VanDerWaalsContact O-CB 3.29Å; L161-F166 WeakPolarHBondContact O-CB 3.4Å; L161-F166 PolarHBondContact O-N 3.28Å; A162-F166 WeakPolarHBondContact CA-O 3.24Å; A164-F166 HydrophobicContact CB-CD2 3.83Å; A164-F166 HydrophobicContact CB-CE2 3.99Å; F166-V175 HydrophobicContact CB-CB 3.96Å; F166-V175 HydrophobicContact CB-CG2 3.92Å; F166-V175 HydrophobicContact CD1-CB 4.28Å; F166-V175 HydrophobicContact CD1-CG2 3.62Å; F166-V175 HydrophobicContact CE1-CG2 4.32Å; F166-V175 HydrophobicContact CG-CB 4.39Å; F166-V175 HydrophobicContact CG-CG2 3.83Å; F166-K176 CarbonylContact C-O 3.53Å; F166-K176 VanDerWaalsContact CA-O 3.26Å; F166-K176 WeakPolarHBondContact CA-O 3.44Å; F166-C177 HydrophobicContact CD1-CB 4.2Å; F166-C177 HydrophobicContact CE1-CB 4.05Å; F166-L184 HydrophobicContact CE1-CD1 4.03Å; F166-L184 HydrophobicContact CE1-CG 4.34Å; F166-L184 HydrophobicContact CE2-CD1 4.37Å; F166-L184 HydrophobicContact CZ-CD1 3.62Å; F166-L184 HydrophobicContact CZ-CG 4.4Å; F166-W187 HydrophobicContact CE2-CH2 4.43Å; F166-P193 HydrophobicContact CD2-CB 4.34Å; F166-P193 HydrophobicContact CE2-CB 4.31Å; F166-H197 HydrophobicContact CE2-CB 3.91Å; F166-H197 AromaticContact CE2-CG 3.98Å; F166-H197 AromaticContact CE2-ND1 3.65Å; F166-H197 HydrophobicContact CZ-CB 3.77Å; F166-H197 AromaticContact CZ-CG 3.63Å; F166-H197 AromaticContact CZ-ND1 3.55Å
167	F	93.3	Very high	88.4	Confident	18 Å²	18	35.4 Å²	35.4	8%	0.079	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	153.2	167.5	70.1	-88.5	0	0	0	110.2	Y134 M137 R143 T146 V175 K176 F178	Y134-F167 HydrophobicContact CD1-CZ 4.22Å; Y134-F167 AromaticContact CD2-CE1 3.8Å; Y134-F167 HydrophobicContact CD2-CE1 3.8Å; Y134-F167 HydrophobicContact CD2-CZ 4.1Å; Y134-F167 HydrophobicContact CE1-CZ 4.25Å; Y134-F167 HydrophobicContact CE2-CE1 4.12Å; Y134-F167 HydrophobicContact CE2-CZ 4.11Å; Y134-F167 HydrophobicContact CG-CE1 4.04Å; Y134-F167 HydrophobicContact CG-CZ 4.14Å; M137-F167 HydrophobicContact CB-CD1 4.15Å; M137-F167 HydrophobicContact CG-CD1 4Å; M137-F167 HydrophobicContact CG-CD2 4.49Å; M137-F167 HydrophobicContact CG-CE1 4.24Å; M137-F167 HydrophobicContact CG-CG 4.14Å; M137-F167 HydrophobicContact SD-CG 4.46Å; R143-F167 HydrophobicContact CB-CB 3.98Å; R143-F167 HydrophobicContact CG-CB 3.96Å; T146-F167 HydrophobicContact CG2-CB 4.1Å; T146-F167 HydrophobicContact CG2-CD2 4.43Å; F167-V175 CarbonylContact O-C 3.52Å; F167-V175 VanDerWaalsContact O-CA 3.28Å; F167-V175 WeakPolarHBondContact O-CA 3.24Å; F167-V175 WeakPolarHBondContact O-CB 3.42Å; F167-K176 HydrophobicContact CD1-CB 4.36Å; F167-K176 WeakPolarHBondContact CD1-O 3.47Å; F167-K176 HydrophobicContact CE1-CB 3.77Å; F167-K176 WeakPolarHBondContact CE1-O 3.35Å; F167-K176 HydrophobicContact CE2-CB 4.41Å; F167-K176 HydrophobicContact CZ-CB 3.81Å; F167-K176 HydrophobicContact CZ-CD 4.37Å; F167-K176 PolarHBondContact N-O 3.15Å; F167-K176 PolarHBondContact O-N 2.91Å; F167-F178 HydrophobicContact CD1-CB 4.37Å
168	Y	91.2	Very high	88.6	Confident	16 Å²	16	29.7 Å²	29.7	6%	0.063	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	136.4	-179.7	-176.3	-137.5	0	0	0	111.9	T146 F147 N149 W150 G170 H171 G172 N174	T146-Y168 WeakPolarHBondContact O-CD1 3.5Å; T146-Y168 PolarHBondContact OG1-N 3.39Å; F147-Y168 HydrophobicContact CD1-CG 4.39Å; N149-Y168 WeakPolarHBondContact OD1-CD1 3.45Å; N149-Y168 WeakPolarHBondContact OD1-CE1 3.39Å; W150-Y168 HydrophobicContact CE3-CD1 4.43Å; W150-Y168 AromaticContact CE3-CD2 3.41Å; W150-Y168 HydrophobicContact CE3-CD2 3.41Å; W150-Y168 VanDerWaalsContact CE3-CD2 3.41Å; W150-Y168 AromaticContact CE3-CE2 3.6Å; W150-Y168 HydrophobicContact CE3-CE2 3.6Å; W150-Y168 AromaticContact CE3-CG 3.87Å; W150-Y168 HydrophobicContact CE3-CG 3.87Å; W150-Y168 AromaticContact CZ3-CD2 3.4Å; W150-Y168 HydrophobicContact CZ3-CD2 3.4Å; W150-Y168 AromaticContact CZ3-CE2 3.62Å; W150-Y168 HydrophobicContact CZ3-CE2 3.62Å; W150-Y168 HydrophobicContact CZ3-CG 4.24Å; Y168-G170 VanDerWaalsContact OH-C 3.31Å; Y168-H171 VanDerWaalsContact CZ-N 3.3Å; Y168-H171 VanDerWaalsContact OH-C 3.29Å; Y168-H171 WeakPolarHBondContact OH-CA 3.14Å; Y168-H171 PolarHBondContact OH-N 3.26Å; Y168-H171 VanDerWaalsContact OH-N 3.15Å; Y168-G172 WeakPolarHBondContact CE2-O 3.32Å; Y168-G172 VanDerWaalsContact CZ-O 3.26Å; Y168-G172 PolarHBondContact OH-N 2.76Å; Y168-G172 PolarHBondContact OH-O 2.95Å; Y168-N174 WeakPolarHBondContact CD2-O 3.3Å
169	T	83.8	Confident	88.5	Confident	44 Å²	44	29.9 Å²	29.9	27%	0.27	17%	0.166	S	C	.	.			trans	-91.2	3.3	179.6	62.1	0	0	0	0	113.8	H171 N174 K176	T169-H171 PolarHBondContact O-ND1 2.86Å; T169-H171 VanDerWaalsContact O-ND1 3.15Å; T169-N174 PolarHBondContact N-O 3.07Å; T169-N174 WeakPolarHBondContact OG1-CB 3.36Å; T169-N174 PolarHBondContact OG1-O 3.45Å; T169-K176 HydrophobicContact CG2-CB 4.11Å; T169-K176 HydrophobicContact CG2-CD 3.85Å; T169-K176 HydrophobicContact CG2-CG 3.67Å
170	G	77.9	Confident	87.8	Confident	29 Å²	29	27.9 Å²	27.9	30%	0.299	16%	0.158	S	C	.	.	S	Bend	trans	87.2	-0.6	174.2	0	0	0	0	0	115.7	Y168	Y168-G170 VanDerWaalsContact OH-C 3.31Å
171	H	73.6	Confident	87.2	Confident	129 Å²	129	25.8 Å²	25.8	60%	0.597	15%	0.145	S	C	*	.	S	Bend	trans	-139.4	132.9	-176	-55.1	76.8	0	0	0	111.7	Y168 T169 N174	Y168-H171 VanDerWaalsContact CZ-N 3.3Å; Y168-H171 VanDerWaalsContact OH-C 3.29Å; Y168-H171 WeakPolarHBondContact OH-CA 3.14Å; Y168-H171 PolarHBondContact OH-N 3.26Å; Y168-H171 VanDerWaalsContact OH-N 3.15Å; T169-H171 PolarHBondContact O-ND1 2.86Å; T169-H171 VanDerWaalsContact O-ND1 3.15Å; H171-N174 WeakPolarHBondContact O-CB 3.48Å; H171-N174 PolarHBondContact O-N 2.85Å
172	G	78.3	Confident	86.4	Confident	38 Å²	38	25.9 Å²	25.9	39%	0.392	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	-138.4	-178	0	0	0	0	0	111.2	P151 Y168	P151-G172 WeakPolarHBondContact CD-O 3.48Å; P151-G172 WeakPolarHBondContact CG-O 3.45Å; Y168-G172 WeakPolarHBondContact CE2-O 3.32Å; Y168-G172 VanDerWaalsContact CZ-O 3.26Å; Y168-G172 PolarHBondContact OH-N 2.76Å; Y168-G172 PolarHBondContact OH-O 2.95Å
173	D	80.1	Confident	85.7	Confident	25 Å²	25	26 Å²	26	13%	0.134	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	28.5	171.2	68.6	-22	0	0	0	111.4	W150 A154 V175 N186 W187	W150-D173 HydrophobicContact CH2-CB 3.65Å; W150-D173 VanDerWaalsContact CH2-O 3.25Å; W150-D173 WeakPolarHBondContact CH2-O 3.27Å; W150-D173 HydrophobicContact CZ2-CB 4.15Å; W150-D173 VanDerWaalsContact CZ3-CA 3.49Å; W150-D173 HydrophobicContact CZ3-CB 4.12Å; A154-D173 HydrophobicContact CB-CB 4.39Å; D173-V175 PolarHBondContact O-N 3.49Å; D173-N186 PolarHBondContact OD1-N 3.33Å; D173-N186 WeakPolarHBondContact OD2-CA 3.31Å; D173-N186 PolarHBondContact OD2-N 2.68Å; D173-W187 VanDerWaalsContact O-CD1 3.31Å; D173-W187 PolarHBondContact O-NE1 3.46Å; D173-W187 PolarHBondContact OD2-N 3.22Å
174	N	81.8	Confident	84.9	Confident	16 Å²	16	22.3 Å²	22.3	9%	0.086	13%	0.13	C	C	.	.			trans	-78.4	124.7	-174.8	-65.9	5.1	0	0	0	110.8	Y168 T169 H171 L184 R185 A462	Y168-N174 WeakPolarHBondContact CD2-O 3.3Å; T169-N174 PolarHBondContact N-O 3.07Å; T169-N174 WeakPolarHBondContact OG1-CB 3.36Å; T169-N174 PolarHBondContact OG1-O 3.45Å; H171-N174 WeakPolarHBondContact O-CB 3.48Å; H171-N174 PolarHBondContact O-N 2.85Å; N174-L184 WeakPolarHBondContact CA-O 3.24Å; N174-R185 HydrophobicContact CB-CB 4.44Å; N174-R185 WeakPolarHBondContact OD1-CB 3.46Å; N174-A462 PolarHBondContact ND2-O 3.41Å
175	V	86.9	Confident	84.3	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	159	176.1	-56.9	0	0	0	0	112	F147 W150 L161 F166 F167 D173 G183 L184 W187	F147-V175 HydrophobicContact CE1-CG1 3.95Å; F147-V175 HydrophobicContact CZ-CG1 4.15Å; W150-V175 HydrophobicContact CH2-CG1 3.64Å; W150-V175 HydrophobicContact CZ3-CG1 3.6Å; L161-V175 HydrophobicContact CD1-CG1 4.44Å; L161-V175 HydrophobicContact CD2-CG2 4.35Å; F166-V175 HydrophobicContact CB-CB 3.96Å; F166-V175 HydrophobicContact CB-CG2 3.92Å; F166-V175 HydrophobicContact CD1-CB 4.28Å; F166-V175 HydrophobicContact CD1-CG2 3.62Å; F166-V175 HydrophobicContact CE1-CG2 4.32Å; F166-V175 HydrophobicContact CG-CB 4.39Å; F166-V175 HydrophobicContact CG-CG2 3.83Å; F167-V175 CarbonylContact O-C 3.52Å; F167-V175 VanDerWaalsContact O-CA 3.28Å; F167-V175 WeakPolarHBondContact O-CA 3.24Å; F167-V175 WeakPolarHBondContact O-CB 3.42Å; D173-V175 PolarHBondContact O-N 3.49Å; V175-G183 VanDerWaalsContact O-CA 3.27Å; V175-G183 WeakPolarHBondContact O-CA 3.12Å; V175-L184 HydrophobicContact CG2-CB 4.17Å; V175-L184 PolarHBondContact N-O 3.41Å; V175-L184 PolarHBondContact O-N 3.39Å; V175-W187 HydrophobicContact CG2-CZ2 3.58Å
176	K	87.8	Confident	83	Confident	51 Å²	51	25.5 Å²	25.5	22%	0.222	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	141.8	176.4	-80.4	-174.7	168.3	-149.7	0	112.2	Y134 F166 F167 T169 D181 G182	Y134-K176 PolarHBondContact OH-NZ 3.15Å; F166-K176 CarbonylContact C-O 3.53Å; F166-K176 VanDerWaalsContact CA-O 3.26Å; F166-K176 WeakPolarHBondContact CA-O 3.44Å; F167-K176 HydrophobicContact CD1-CB 4.36Å; F167-K176 WeakPolarHBondContact CD1-O 3.47Å; F167-K176 HydrophobicContact CE1-CB 3.77Å; F167-K176 WeakPolarHBondContact CE1-O 3.35Å; F167-K176 HydrophobicContact CE2-CB 4.41Å; F167-K176 HydrophobicContact CZ-CB 3.81Å; F167-K176 HydrophobicContact CZ-CD 4.37Å; F167-K176 PolarHBondContact N-O 3.15Å; F167-K176 PolarHBondContact O-N 2.91Å; T169-K176 HydrophobicContact CG2-CB 4.11Å; T169-K176 HydrophobicContact CG2-CD 3.85Å; T169-K176 HydrophobicContact CG2-CG 3.67Å; K176-D181 IonicContact NZ-OD1 3.01Å; K176-D181 PolarHBondContact NZ-OD1 3.37Å; K176-D181 IonicContact NZ-OD2 2.68Å; K176-G182 CarbonylContact C-O 3.56Å; K176-G182 WeakPolarHBondContact CA-O 3.43Å
177	C	91.6	Very high	82.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.5	171	177.2	0	0	0	0	110.6	G165 F166 F179 C180 D181 G182 H197	G165-C177 VanDerWaalsContact O-CA 3.27Å; G165-C177 WeakPolarHBondContact O-CA 3.45Å; F166-C177 HydrophobicContact CD1-CB 4.2Å; F166-C177 HydrophobicContact CE1-CB 4.05Å; C177-F179 PolarHBondContact O-N 2.88Å; C177-F179 PolarHBondContact SG-N 2.93Å; C177-C180 VanDerWaalsContact CB-SG 3.5Å; C177-C180 VanDerWaalsContact SG-SG 3.67Å; C177-D181 WeakPolarHBondContact O-CA 3.41Å; C177-D181 PolarHBondContact O-N 3.44Å; C177-D181 VanDerWaalsContact O-N 3.17Å; C177-G182 PolarHBondContact N-O 2.95Å; C177-H197 PolarHBondContact SG-CE1 2.78Å
178	F	92.8	Very high	81.4	Confident	6 Å²	6	29.8 Å²	29.8	3%	0.026	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.8	177.3	82.4	-81.4	0	0	0	113.1	A132 V133 Y134 M137 E138 G165 F167 F206	A132-F178 HydrophobicContact CB-CD2 3.65Å; A132-F178 HydrophobicContact CB-CE2 3.69Å; V133-F178 PolarHBondContact N-O 2.57Å; V133-F178 VanDerWaalsContact N-O 3.16Å; Y134-F178 WeakPolarHBondContact CD2-O 3.26Å; Y134-F178 PolarHBondContact N-O 3.26Å; M137-F178 HydrophobicContact CB-CB 3.6Å; M137-F178 WeakPolarHBondContact O-CB 3.19Å; M137-F178 WeakPolarHBondContact O-CG 3.38Å; E138-F178 HydrophobicContact CB-CD2 4.38Å; E138-F178 HydrophobicContact CB-CE2 4.18Å; E138-F178 HydrophobicContact CG-CE2 4.17Å; G165-F178 WeakPolarHBondContact O-CD1 3.17Å; G165-F178 PolarHBondContact O-N 3.49Å; F167-F178 HydrophobicContact CD1-CB 4.37Å; F178-F206 HydrophobicContact CE1-CB 4.31Å; F178-F206 AromaticContact CE1-CD1 3.99Å; F178-F206 HydrophobicContact CE1-CD1 3.99Å; F178-F206 AromaticContact CE1-CD2 3.51Å; F178-F206 HydrophobicContact CE1-CD2 3.51Å; F178-F206 HydrophobicContact CE1-CE1 4.2Å; F178-F206 AromaticContact CE1-CE2 3.73Å; F178-F206 HydrophobicContact CE1-CE2 3.73Å; F178-F206 AromaticContact CE1-CG 3.64Å; F178-F206 HydrophobicContact CE1-CG 3.64Å; F178-F206 HydrophobicContact CE1-CZ 4.06Å; F178-F206 HydrophobicContact CZ-CB 4.23Å; F178-F206 AromaticContact CZ-CD2 3.51Å; F178-F206 HydrophobicContact CZ-CD2 3.51Å; F178-F206 HydrophobicContact CZ-CE2 4Å; F178-F206 AromaticContact CZ-CG 3.87Å; F178-F206 HydrophobicContact CZ-CG 3.87Å
179	F	89	Confident	80.6	Confident	28 Å²	28	34.6 Å²	34.6	12%	0.123	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-53.6	-173.8	-159.9	-78.1	0	0	0	112.4	A132 V133 C177 E205 F206	A132-F179 HydrophobicContact CB-CD2 3.69Å; A132-F179 HydrophobicContact CB-CE2 4.14Å; A132-F179 HydrophobicContact CB-CG 4.33Å; V133-F179 WeakPolarHBondContact CG2-O 3.4Å; V133-F179 PolarHBondContact N-O 2.86Å; C177-F179 PolarHBondContact O-N 2.88Å; C177-F179 PolarHBondContact SG-N 2.93Å; F179-E205 HydrophobicContact CD1-CB 4.27Å; F179-E205 HydrophobicContact CE1-CB 3.53Å; F179-E205 HydrophobicContact CE1-CG 3.96Å; F179-E205 HydrophobicContact CZ-CB 3.83Å; F179-E205 HydrophobicContact CZ-CG 4.44Å; F179-E205 WeakPolarHBondContact CZ-OE2 3.2Å; F179-F206 HydrophobicContact CB-CB 3.53Å; F179-F206 HydrophobicContact CB-CG 4.39Å; F179-F206 HydrophobicContact CD1-CB 4.32Å; F179-F206 HydrophobicContact CD2-CB 3.85Å; F179-F206 HydrophobicContact CG-CB 3.62Å
180	C	77.4	Confident	80.2	Confident	43 Å²	43	36.3 Å²	36.3	29%	0.291	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-2.1	-172.1	71.2	0	0	0	0	115	C177 G182 C204	C177-C180 VanDerWaalsContact CB-SG 3.5Å; C177-C180 VanDerWaalsContact SG-SG 3.67Å; C180-G182 PolarHBondContact O-N 3.31Å; C180-G182 VanDerWaalsContact O-N 3.1Å; C180-G182 PolarHBondContact SG-N 2.79Å; C180-G182 VanDerWaalsContact SG-N 3.36Å; C180-C204 HydrophobicContact CB-CB 3.74Å
181	D	80.8	Confident	80.3	Confident	13 Å²	13	37.1 Å²	37.1	7%	0.07	22%	0.223	C	C	.	.			trans	56.3	16.7	-170.6	-166.6	39.5	0	0	0	114	V133 Y134 K176 C177 G183 R479	V133-D181 HydrophobicContact CB-CB 4.39Å; V133-D181 HydrophobicContact CG1-CB 4.02Å; V133-D181 HydrophobicContact CG2-CB 4.38Å; Y134-D181 HydrophobicContact CE2-CB 4.08Å; Y134-D181 VanDerWaalsContact CE2-OD1 3.24Å; Y134-D181 WeakPolarHBondContact CE2-OD1 3.33Å; Y134-D181 PolarHBondContact OH-OD1 2.63Å; K176-D181 IonicContact NZ-OD1 3.01Å; K176-D181 PolarHBondContact NZ-OD1 3.37Å; K176-D181 IonicContact NZ-OD2 2.68Å; C177-D181 WeakPolarHBondContact O-CA 3.41Å; C177-D181 PolarHBondContact O-N 3.44Å; C177-D181 VanDerWaalsContact O-N 3.17Å; D181-G183 PolarHBondContact O-N 3.43Å; D181-R479 IonicContact OD1-NH2 3.34Å; D181-R479 IonicContact OD2-CZ 3.52Å; D181-R479 IonicContact OD2-NE 3.61Å; D181-R479 PolarHBondContact OD2-NE 2.85Å; D181-R479 IonicContact OD2-NH2 3.69Å; D181-R479 PolarHBondContact OD2-NH2 2.99Å
182	G	74.9	Confident	80.8	Confident	2 Å²	2	33.8 Å²	33.8	2%	0.021	21%	0.209	C	C	.	.			trans	-66.3	123.8	175	0	0	0	0	0	111	K176 C177 C180	K176-G182 CarbonylContact C-O 3.56Å; K176-G182 WeakPolarHBondContact CA-O 3.43Å; C177-G182 PolarHBondContact N-O 2.95Å; C180-G182 PolarHBondContact O-N 3.31Å; C180-G182 VanDerWaalsContact O-N 3.1Å; C180-G182 PolarHBondContact SG-N 2.79Å; C180-G182 VanDerWaalsContact SG-N 3.36Å
183	G	79.9	Confident	81.3	Confident	3 Å²	3	32.2 Å²	32.2	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.1	-178.1	0	0	0	0	0	113.2	V175 D181 G476 S477	V175-G183 VanDerWaalsContact O-CA 3.27Å; V175-G183 WeakPolarHBondContact O-CA 3.12Å; D181-G183 PolarHBondContact O-N 3.43Å; G183-G476 VanDerWaalsContact O-CA 3.3Å; G183-G476 WeakPolarHBondContact O-CA 3.34Å; G183-S477 PolarHBondContact N-O 3.05Å; G183-S477 PolarHBondContact O-N 2.78Å
184	L	78.1	Confident	81.7	Confident	6 Å²	6	33 Å²	33	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	153.6	177.2	-65.3	177.4	0	0	0	110.8	F166 N174 V175 W187 E196 W200 F201	F166-L184 HydrophobicContact CE1-CD1 4.03Å; F166-L184 HydrophobicContact CE1-CG 4.34Å; F166-L184 HydrophobicContact CE2-CD1 4.37Å; F166-L184 HydrophobicContact CZ-CD1 3.62Å; F166-L184 HydrophobicContact CZ-CG 4.4Å; N174-L184 WeakPolarHBondContact CA-O 3.24Å; V175-L184 HydrophobicContact CG2-CB 4.17Å; V175-L184 PolarHBondContact N-O 3.41Å; V175-L184 PolarHBondContact O-N 3.39Å; L184-W187 HydrophobicContact CB-CH2 4.41Å; L184-W187 HydrophobicContact CB-CZ2 3.65Å; L184-W187 HydrophobicContact CD1-CH2 3.71Å; L184-W187 HydrophobicContact CD1-CZ2 3.78Å; L184-W187 HydrophobicContact CG-CZ2 4.37Å; L184-E196 HydrophobicContact CD1-CB 3.86Å; L184-W200 HydrophobicContact CD2-CB 4.4Å; L184-W200 HydrophobicContact CD2-CG 4.19Å; L184-F201 HydrophobicContact CD1-CE2 4.27Å; L184-F201 HydrophobicContact CD2-CE2 3.77Å; L184-F201 HydrophobicContact CD2-CZ 4.16Å; L184-F201 HydrophobicContact CG-CE2 3.84Å; L184-F201 HydrophobicContact CG-CZ 4.43Å
185	R	81.4	Confident	81.9	Confident	20 Å²	20	36.5 Å²	36.5	8%	0.075	21%	0.209	C	C	.	.			trans	-160.2	174.7	179.2	68	-176	75.5	-179	2.5	110.5	N174 A461 L464 I474 R475	N174-R185 HydrophobicContact CB-CB 4.44Å; N174-R185 WeakPolarHBondContact OD1-CB 3.46Å; R185-A461 PolarHBondContact NH1-O 2.93Å; R185-A461 PolarHBondContact NH2-O 3.13Å; R185-A461 VanDerWaalsContact NH2-O 3.07Å; R185-L464 PolarHBondContact NH1-O 3.24Å; R185-I474 WeakPolarHBondContact CD-O 3.26Å; R185-I474 WeakPolarHBondContact CG-O 3.42Å; R185-R475 PolarHBondContact N-O 3.39Å; R185-R475 VanDerWaalsContact N-O 3.15Å
186	N	68.2	Low	81.6	Confident	48 Å²	48	38.2 Å²	38.2	26%	0.257	22%	0.217	S	C	.	.			trans	56.6	55.4	-175.5	-60.2	-40.4	0	0	0	112.4	D173 I474	D173-N186 PolarHBondContact OD1-N 3.33Å; D173-N186 WeakPolarHBondContact OD2-CA 3.31Å; D173-N186 PolarHBondContact OD2-N 2.68Å; N186-I474 PolarHBondContact ND2-O 3.05Å
187	W	80.5	Confident	81.4	Confident	18 Å²	18	35.8 Å²	35.8	7%	0.068	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-71.6	124	179.8	-67.8	92.3	0	0	0	112	S155 V156 L161 F166 D173 V175 L184 D191 P193 E196	S155-W187 PolarHBondContact OG-O 3.29Å; V156-W187 HydrophobicContact CG2-CB 3.91Å; V156-W187 HydrophobicContact CG2-CD2 4.36Å; V156-W187 HydrophobicContact CG2-CE3 3.93Å; V156-W187 HydrophobicContact CG2-CG 4.41Å; L161-W187 HydrophobicContact CD2-CD2 4.2Å; L161-W187 HydrophobicContact CD2-CE3 4.4Å; L161-W187 HydrophobicContact CD2-CH2 3.65Å; L161-W187 HydrophobicContact CD2-CZ2 3.4Å; L161-W187 VanDerWaalsContact CD2-CZ2 3.4Å; L161-W187 HydrophobicContact CD2-CZ3 4.16Å; F166-W187 HydrophobicContact CE2-CH2 4.43Å; D173-W187 VanDerWaalsContact O-CD1 3.31Å; D173-W187 PolarHBondContact O-NE1 3.46Å; D173-W187 PolarHBondContact OD2-N 3.22Å; V175-W187 HydrophobicContact CG2-CZ2 3.58Å; L184-W187 HydrophobicContact CB-CH2 4.41Å; L184-W187 HydrophobicContact CB-CZ2 3.65Å; L184-W187 HydrophobicContact CD1-CH2 3.71Å; L184-W187 HydrophobicContact CD1-CZ2 3.78Å; L184-W187 HydrophobicContact CG-CZ2 4.37Å; W187-D191 HydrophobicContact CE3-CB 3.81Å; W187-D191 HydrophobicContact CZ3-CB 4.23Å; W187-P193 HydrophobicContact CH2-CB 4.03Å; W187-P193 HydrophobicContact CH2-CG 4.27Å; W187-P193 HydrophobicContact CZ3-CB 4.2Å; W187-P193 HydrophobicContact CZ3-CG 4.04Å; W187-E196 HydrophobicContact CH2-CB 4.32Å; W187-E196 HydrophobicContact CZ3-CB 4.24Å; W187-E196 HydrophobicContact CZ3-CG 4.29Å
188	E	74.4	Confident	80.8	Confident	90 Å²	90	35.8 Å²	35.8	42%	0.421	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-99	151.6	-177.2	-68.2	176.4	-177.6	0	0	112	S155 G190 D191 R475	S155-E188 PolarHBondContact OG-O 3.06Å; E188-G190 PolarHBondContact O-N 2.85Å; E188-G190 VanDerWaalsContact O-N 3.11Å; E188-D191 PolarHBondContact N-OD2 3.39Å; E188-D191 WeakPolarHBondContact O-CB 3.39Å; E188-D191 PolarHBondContact O-N 3.32Å; E188-R475 IonicContact OE1-CZ 2.57Å; E188-R475 IonicContact OE1-NH2 3.25Å; E188-R475 PolarHBondContact OE1-NH2 3.42Å; E188-R475 IonicContact OE2-NH2 3.95Å
189	P	72.8	Confident	79.9	Confident	117 Å²	117	37.1 Å²	37.1	76%	0.76	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	119.7	177.4	-22	30.9	0	0	0	111.7	S155	S155-P189 VanDerWaalsContact OG-N 3.1Å
190	G	76.4	Confident	79	Confident	80 Å²	80	38.7 Å²	38.7	83%	0.825	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	101	-4.1	-177.8	0	0	0	0	0	114.6	E188 D192	E188-G190 PolarHBondContact O-N 2.85Å; E188-G190 VanDerWaalsContact O-N 3.11Å; G190-D192 PolarHBondContact O-N 2.91Å
191	D	80.1	Confident	79	Confident	45 Å²	45	37.5 Å²	37.5	24%	0.241	21%	0.207	C	C	.	.			trans	-63.4	129.4	172.1	-76.6	-14.3	0	0	0	110.9	V156 W187 E188	V156-D191 HydrophobicContact CG2-CB 4.23Å; W187-D191 HydrophobicContact CE3-CB 3.81Å; W187-D191 HydrophobicContact CZ3-CB 4.23Å; E188-D191 PolarHBondContact N-OD2 3.39Å; E188-D191 WeakPolarHBondContact O-CB 3.39Å; E188-D191 PolarHBondContact O-N 3.32Å
192	D	83.5	Confident	78.9	Confident	60 Å²	60	38.2 Å²	38.2	32%	0.321	21%	0.213	S	C	.	.			trans	-96.7	118	172.2	177.9	-87.5	0	0	0	109.8	G190 W194 Q195 E196	G190-D192 PolarHBondContact O-N 2.91Å; D192-W194 VanDerWaalsContact C-N 3.27Å; D192-W194 PolarHBondContact O-N 2.84Å; D192-W194 WeakPolarHBondContact OD1-CA 3.45Å; D192-W194 VanDerWaalsContact OD1-CB 3.31Å; D192-W194 WeakPolarHBondContact OD1-CB 3.39Å; D192-W194 PolarHBondContact OD1-N 3.39Å; D192-Q195 HydrophobicContact CB-CB 4.05Å; D192-Q195 HydrophobicContact CB-CG 3.98Å; D192-Q195 PolarHBondContact O-N 2.69Å; D192-Q195 VanDerWaalsContact O-N 3.14Å; D192-Q195 WeakPolarHBondContact OD1-CG 3.44Å; D192-Q195 PolarHBondContact OD1-N 3.06Å; D192-E196 PolarHBondContact O-N 3.45Å
193	P	88.6	Confident	79	Confident	4 Å²	4	48.2 Å²	48.2	3%	0.026	25%	0.25	C	C	.	.	H	α-helix	trans	-57.6	-34.6	-178	-31.2	38.7	0	0	0	114.7	V156 V160 L161 A164 F166 W187 H197	V156-P193 HydrophobicContact CG1-CG 3.75Å; V160-P193 HydrophobicContact CB-CG 4.34Å; V160-P193 HydrophobicContact CG2-CG 3.98Å; L161-P193 HydrophobicContact CD2-CB 4.05Å; L161-P193 HydrophobicContact CD2-CG 3.77Å; L161-P193 HydrophobicContact CG-CG 4.11Å; A164-P193 HydrophobicContact CB-CB 3.54Å; F166-P193 HydrophobicContact CD2-CB 4.34Å; F166-P193 HydrophobicContact CE2-CB 4.31Å; W187-P193 HydrophobicContact CH2-CB 4.03Å; W187-P193 HydrophobicContact CH2-CG 4.27Å; W187-P193 HydrophobicContact CZ3-CB 4.2Å; W187-P193 HydrophobicContact CZ3-CG 4.04Å; P193-H197 WeakPolarHBondContact O-CB 3.35Å; P193-H197 PolarHBondContact O-N 3.34Å
194	W	90	Very high	79.1	Confident	41 Å²	41	48.2 Å²	48.2	16%	0.155	25%	0.249	C	C	.	.	H	α-helix	trans	-71.4	-38.3	178.7	-70	104.5	0	0	0	111.9	Q163 A164 D192 A198 F206 L207 R211 Y215	Q163-W194 VanDerWaalsContact C-CZ2 3.45Å; Q163-W194 VanDerWaalsContact O-CH2 3.27Å; Q163-W194 WeakPolarHBondContact O-CH2 3.34Å; Q163-W194 WeakPolarHBondContact O-CZ2 3.49Å; A164-W194 VanDerWaalsContact CA-CE2 3.49Å; A164-W194 HydrophobicContact CB-CD2 3.71Å; A164-W194 HydrophobicContact CB-CE3 4.13Å; A164-W194 HydrophobicContact CB-CG 3.97Å; A164-W194 HydrophobicContact CB-CZ2 4.34Å; D192-W194 VanDerWaalsContact C-N 3.27Å; D192-W194 PolarHBondContact O-N 2.84Å; D192-W194 WeakPolarHBondContact OD1-CA 3.45Å; D192-W194 VanDerWaalsContact OD1-CB 3.31Å; D192-W194 WeakPolarHBondContact OD1-CB 3.39Å; D192-W194 PolarHBondContact OD1-N 3.39Å; W194-A198 WeakPolarHBondContact O-CB 3.16Å; W194-A198 PolarHBondContact O-N 3.36Å; W194-F206 AromaticContact CH2-CE1 3.79Å; W194-F206 HydrophobicContact CH2-CE1 3.79Å; W194-F206 AromaticContact CH2-CZ 3.77Å; W194-F206 HydrophobicContact CH2-CZ 3.77Å; W194-F206 AromaticContact CZ3-CE1 3.81Å; W194-F206 HydrophobicContact CZ3-CE1 3.81Å; W194-F206 HydrophobicContact CZ3-CZ 4.25Å; W194-L207 HydrophobicContact CE3-CD1 3.55Å; W194-L207 HydrophobicContact CZ3-CD1 3.86Å; W194-R211 HydrophobicContact CD2-CG 3.98Å; W194-R211 HydrophobicContact CE3-CG 3.38Å; W194-R211 HydrophobicContact CH2-CG 4.37Å; W194-R211 HydrophobicContact CZ3-CG 3.62Å; W194-Y215 HydrophobicContact CB-CE1 4.4Å; W194-Y215 WeakPolarHBondContact CB-OH 3.49Å
195	Q	84.8	Confident	79.4	Confident	91 Å²	91	50.7 Å²	50.7	43%	0.425	26%	0.261	S	S	.	.	H	α-helix	trans	-67	-47.1	175.6	-68.7	-176.4	52.4	0	0	111.1	D192 H197 A198 K199 Y215 I219	D192-Q195 HydrophobicContact CB-CB 4.05Å; D192-Q195 HydrophobicContact CB-CG 3.98Å; D192-Q195 PolarHBondContact O-N 2.69Å; D192-Q195 VanDerWaalsContact O-N 3.14Å; D192-Q195 WeakPolarHBondContact OD1-CG 3.44Å; D192-Q195 PolarHBondContact OD1-N 3.06Å; Q195-H197 VanDerWaalsContact C-N 3.3Å; Q195-H197 PolarHBondContact O-N 2.6Å; Q195-A198 PolarHBondContact O-N 2.61Å; Q195-A198 VanDerWaalsContact O-N 3.17Å; Q195-K199 WeakPolarHBondContact O-CB 3.39Å; Q195-K199 PolarHBondContact O-N 3.31Å; Q195-Y215 VanDerWaalsContact CG-OH 3.26Å; Q195-Y215 WeakPolarHBondContact CG-OH 3.2Å; Q195-Y215 PolarHBondContact N-OH 3.41Å; Q195-I219 HydrophobicContact CB-CD1 4.4Å; Q195-I219 HydrophobicContact CG-CD1 3.77Å; Q195-I219 HydrophobicContact CG-CG1 4.42Å
196	E	81.6	Confident	79.9	Confident	36 Å²	36	51.1 Å²	51.1	17%	0.168	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-34.9	177.2	-70.4	-59.4	112.3	0	0	111.6	L184 W187 D192 K199 W200	L184-E196 HydrophobicContact CD1-CB 3.86Å; W187-E196 HydrophobicContact CH2-CB 4.32Å; W187-E196 HydrophobicContact CZ3-CB 4.24Å; W187-E196 HydrophobicContact CZ3-CG 4.29Å; D192-E196 PolarHBondContact O-N 3.45Å; E196-K199 VanDerWaalsContact CD-NZ 3.31Å; E196-K199 PolarHBondContact O-N 3.34Å; E196-K199 WeakPolarHBondContact OE1-CD 3.35Å; E196-K199 IonicContact OE1-NZ 3.63Å; E196-K199 PolarHBondContact OE1-NZ 2.97Å; E196-K199 IonicContact OE2-NZ 3.68Å; E196-K199 PolarHBondContact OE2-NZ 3.5Å; E196-W200 PolarHBondContact O-N 3.13Å; E196-W200 VanDerWaalsContact O-N 3.09Å; E196-W200 PolarHBondContact OE2-NE1 2.8Å
197	H	83.1	Confident	80.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-47	171.5	-159.1	158.1	0	0	0	111.4	A164 F166 C177 P193 Q195 F201 C204 L207	A164-H197 PolarHBondContact O-CE1 2.8Å; A164-H197 PolarHBondContact O-ND1 3.09Å; F166-H197 HydrophobicContact CE2-CB 3.91Å; F166-H197 AromaticContact CE2-CG 3.98Å; F166-H197 AromaticContact CE2-ND1 3.65Å; F166-H197 HydrophobicContact CZ-CB 3.77Å; F166-H197 AromaticContact CZ-CG 3.63Å; F166-H197 AromaticContact CZ-ND1 3.55Å; C177-H197 PolarHBondContact SG-CE1 2.78Å; P193-H197 WeakPolarHBondContact O-CB 3.35Å; P193-H197 PolarHBondContact O-N 3.34Å; Q195-H197 VanDerWaalsContact C-N 3.3Å; Q195-H197 PolarHBondContact O-N 2.6Å; H197-F201 AromaticContact CD2-CD2 3.96Å; H197-F201 CarbonylContact O-C 3.59Å; H197-F201 WeakPolarHBondContact O-CA 3.49Å; H197-F201 PolarHBondContact O-N 2.99Å; H197-C204 PolarHBondContact NE2-SG 3.09Å; H197-L207 HydrophobicContact CB-CD1 4.32Å; H197-L207 HydrophobicContact CB-CD2 4.43Å
198	A	79.4	Confident	81.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.9	-36	178.5	0	0	0	0	0	113.6	W194 Q195 L207 Y215 I216 I219 Q220	W194-A198 WeakPolarHBondContact O-CB 3.16Å; W194-A198 PolarHBondContact O-N 3.36Å; Q195-A198 PolarHBondContact O-N 2.61Å; Q195-A198 VanDerWaalsContact O-N 3.17Å; A198-L207 VanDerWaalsContact CA-CD2 3.45Å; A198-L207 HydrophobicContact CB-CD2 3.92Å; A198-Y215 HydrophobicContact CB-CD1 4.39Å; A198-Y215 HydrophobicContact CB-CE1 3.94Å; A198-I216 HydrophobicContact CB-CG1 4.29Å; A198-I216 HydrophobicContact CB-CG2 4.44Å; A198-I219 HydrophobicContact CB-CB 4.14Å; A198-I219 HydrophobicContact CB-CG1 4.43Å; A198-I219 HydrophobicContact CB-CG2 4.04Å; A198-Q220 PolarHBondContact O-NE2 3.09Å
199	K	73.4	Confident	81.7	Confident	35 Å²	35	53.2 Å²	53.2	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-65.2	-44.3	177.8	-179.2	-176.5	177.2	-170.9	0	112.6	Q195 E196 I219 Q220 H223	Q195-K199 WeakPolarHBondContact O-CB 3.39Å; Q195-K199 PolarHBondContact O-N 3.31Å; E196-K199 VanDerWaalsContact CD-NZ 3.31Å; E196-K199 PolarHBondContact O-N 3.34Å; E196-K199 WeakPolarHBondContact OE1-CD 3.35Å; E196-K199 IonicContact OE1-NZ 3.63Å; E196-K199 PolarHBondContact OE1-NZ 2.97Å; E196-K199 IonicContact OE2-NZ 3.68Å; E196-K199 PolarHBondContact OE2-NZ 3.5Å; K199-I219 HydrophobicContact CB-CG2 4.22Å; K199-Q220 VanDerWaalsContact C-NE2 3.31Å; K199-Q220 PolarHBondContact O-NE2 2.94Å; K199-H223 WeakPolarHBondContact CE-CE1 3.48Å; K199-H223 VanDerWaalsContact CE-NE2 3.26Å; K199-H223 WeakPolarHBondContact CE-NE2 3.32Å
200	W	68.9	Low	82.6	Confident	60 Å²	60	50.3 Å²	50.3	23%	0.227	26%	0.256	C	S	.	.	H	α-helix	trans	-99.2	-28	-173.1	-62.1	114.5	0	0	0	114.2	L184 E196 P202 I449 P450	L184-W200 HydrophobicContact CD2-CB 4.4Å; L184-W200 HydrophobicContact CD2-CG 4.19Å; E196-W200 PolarHBondContact O-N 3.13Å; E196-W200 VanDerWaalsContact O-N 3.09Å; E196-W200 PolarHBondContact OE2-NE1 2.8Å; W200-P202 VanDerWaalsContact C-CD 3.46Å; W200-I449 HydrophobicContact CB-CD1 4.21Å; W200-I449 HydrophobicContact CD2-CD1 4.14Å; W200-I449 HydrophobicContact CD2-CG2 3.75Å; W200-I449 HydrophobicContact CE3-CD1 3.92Å; W200-I449 HydrophobicContact CE3-CG1 4.39Å; W200-I449 HydrophobicContact CE3-CG2 3.44Å; W200-I449 VanDerWaalsContact CE3-CG2 3.44Å; W200-I449 HydrophobicContact CG-CD1 4.28Å; W200-I449 HydrophobicContact CH2-CG2 3.35Å; W200-I449 HydrophobicContact CZ2-CG2 3.66Å; W200-I449 HydrophobicContact CZ3-CG2 3.25Å; W200-P450 HydrophobicContact CH2-CB 4.3Å
201	F	77.3	Confident	83.4	Confident	18 Å²	18	51.9 Å²	51.9	8%	0.079	24%	0.237	C	C	.	.			trans	-131.1	59.2	-176.8	-40.5	-84.5	0	0	0	112.5	L184 H197 R203 C204 I449 V478	L184-F201 HydrophobicContact CD1-CE2 4.27Å; L184-F201 HydrophobicContact CD2-CE2 3.77Å; L184-F201 HydrophobicContact CD2-CZ 4.16Å; L184-F201 HydrophobicContact CG-CE2 3.84Å; L184-F201 HydrophobicContact CG-CZ 4.43Å; H197-F201 AromaticContact CD2-CD2 3.96Å; H197-F201 CarbonylContact O-C 3.59Å; H197-F201 WeakPolarHBondContact O-CA 3.49Å; H197-F201 PolarHBondContact O-N 2.99Å; F201-R203 PolarHBondContact O-N 3.38Å; F201-C204 HydrophobicContact CB-CB 4.46Å; F201-C204 WeakPolarHBondContact O-CB 3.42Å; F201-C204 PolarHBondContact O-N 2.97Å; F201-I449 HydrophobicContact CZ-CD1 4.47Å; F201-V478 HydrophobicContact CE1-CG2 3.99Å
202	P	78.8	Confident	83.3	Confident	29 Å²	29	51.1 Å²	51.1	19%	0.188	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-7.4	-174.5	28	-37.6	0	0	0	114.9	W200 I216 Q220	W200-P202 VanDerWaalsContact C-CD 3.46Å; P202-I216 HydrophobicContact CB-CG2 3.45Å; P202-I216 VanDerWaalsContact CB-CG2 3.45Å; P202-Q220 HydrophobicContact CB-CG 4.04Å
203	R	77.3	Confident	83	Confident	211 Å²	211	53 Å²	53	80%	0.796	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.3	5.8	178.2	-61.5	-168.3	-58.8	-78.8	-3.5	113.6	F201 E205	F201-R203 PolarHBondContact O-N 3.38Å; R203-E205 PolarHBondContact O-N 3.46Å
204	C	81.9	Confident	82.4	Confident	3 Å²	3	60 Å²	60	2%	0.02	28%	0.279	C	S	.	.			trans	-66.1	117.4	176.9	175.9	0	0	0	0	109.9	C180 H197 F201 F206 L207 I208	C180-C204 HydrophobicContact CB-CB 3.74Å; H197-C204 PolarHBondContact NE2-SG 3.09Å; F201-C204 HydrophobicContact CB-CB 4.46Å; F201-C204 WeakPolarHBondContact O-CB 3.42Å; F201-C204 PolarHBondContact O-N 2.97Å; C204-F206 PolarHBondContact O-N 3.26Å; C204-L207 HydrophobicContact CB-CB 3.77Å; C204-L207 WeakPolarHBondContact O-CB 3.23Å; C204-L207 PolarHBondContact O-N 3.11Å; C204-L207 VanDerWaalsContact O-N 3.13Å; C204-I208 VanDerWaalsContact O-CG1 3.31Å; C204-I208 WeakPolarHBondContact O-CG1 3.38Å; C204-I208 PolarHBondContact O-N 2.94Å
205	E	85.3	Confident	82.1	Confident	59 Å²	59	60 Å²	60	28%	0.276	28%	0.279	S	S	.	.	H	α-helix	trans	-65.3	-37.7	-177.1	-56.7	-178.4	159.9	0	0	112.2	A129 G130 F179 R203 L207 I208 Q209	A129-E205 WeakPolarHBondContact CA-OE1 3.3Å; A129-E205 WeakPolarHBondContact CB-OE1 3.29Å; G130-E205 WeakPolarHBondContact CA-OE2 3.35Å; G130-E205 PolarHBondContact N-OE2 3.44Å; F179-E205 HydrophobicContact CD1-CB 4.27Å; F179-E205 HydrophobicContact CE1-CB 3.53Å; F179-E205 HydrophobicContact CE1-CG 3.96Å; F179-E205 HydrophobicContact CZ-CB 3.83Å; F179-E205 HydrophobicContact CZ-CG 4.44Å; F179-E205 WeakPolarHBondContact CZ-OE2 3.2Å; R203-E205 PolarHBondContact O-N 3.46Å; E205-L207 VanDerWaalsContact C-N 3.27Å; E205-L207 PolarHBondContact O-N 2.87Å; E205-I208 PolarHBondContact O-N 3.29Å; E205-Q209 WeakPolarHBondContact O-CB 3.22Å; E205-Q209 VanDerWaalsContact O-CG 3.24Å; E205-Q209 WeakPolarHBondContact O-CG 3.38Å; E205-Q209 PolarHBondContact O-N 3.16Å
206	F	92.1	Very high	81.7	Confident	28 Å²	28	55.7 Å²	55.7	12%	0.123	26%	0.259	C	S	.	.	H	α-helix	trans	-55.9	-43.7	171.9	164.8	-98.7	0	0	0	111.8	F178 F179 W194 C204 Q209 S210	F178-F206 HydrophobicContact CE1-CB 4.31Å; F178-F206 AromaticContact CE1-CD1 3.99Å; F178-F206 HydrophobicContact CE1-CD1 3.99Å; F178-F206 AromaticContact CE1-CD2 3.51Å; F178-F206 HydrophobicContact CE1-CD2 3.51Å; F178-F206 HydrophobicContact CE1-CE1 4.2Å; F178-F206 AromaticContact CE1-CE2 3.73Å; F178-F206 HydrophobicContact CE1-CE2 3.73Å; F178-F206 AromaticContact CE1-CG 3.64Å; F178-F206 HydrophobicContact CE1-CG 3.64Å; F178-F206 HydrophobicContact CE1-CZ 4.06Å; F178-F206 HydrophobicContact CZ-CB 4.23Å; F178-F206 AromaticContact CZ-CD2 3.51Å; F178-F206 HydrophobicContact CZ-CD2 3.51Å; F178-F206 HydrophobicContact CZ-CE2 4Å; F178-F206 AromaticContact CZ-CG 3.87Å; F178-F206 HydrophobicContact CZ-CG 3.87Å; F179-F206 HydrophobicContact CB-CB 3.53Å; F179-F206 HydrophobicContact CB-CG 4.39Å; F179-F206 HydrophobicContact CD1-CB 4.32Å; F179-F206 HydrophobicContact CD2-CB 3.85Å; F179-F206 HydrophobicContact CG-CB 3.62Å; W194-F206 AromaticContact CH2-CE1 3.79Å; W194-F206 HydrophobicContact CH2-CE1 3.79Å; W194-F206 AromaticContact CH2-CZ 3.77Å; W194-F206 HydrophobicContact CH2-CZ 3.77Å; W194-F206 AromaticContact CZ3-CE1 3.81Å; W194-F206 HydrophobicContact CZ3-CE1 3.81Å; W194-F206 HydrophobicContact CZ3-CZ 4.25Å; C204-F206 PolarHBondContact O-N 3.26Å; F206-Q209 PolarHBondContact O-N 3.34Å; F206-S210 WeakPolarHBondContact CE2-OG 3.38Å; F206-S210 VanDerWaalsContact O-CB 3.23Å; F206-S210 WeakPolarHBondContact O-CB 3.28Å; F206-S210 PolarHBondContact O-N 3.33Å; F206-S210 PolarHBondContact O-OG 3.32Å
207	L	88.1	Confident	81.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-44.9	178.1	177.9	68.9	0	0	0	111.2	W194 H197 A198 C204 E205 Q209 S210 R211 I216	W194-L207 HydrophobicContact CE3-CD1 3.55Å; W194-L207 HydrophobicContact CZ3-CD1 3.86Å; H197-L207 HydrophobicContact CB-CD1 4.32Å; H197-L207 HydrophobicContact CB-CD2 4.43Å; A198-L207 VanDerWaalsContact CA-CD2 3.45Å; A198-L207 HydrophobicContact CB-CD2 3.92Å; C204-L207 HydrophobicContact CB-CB 3.77Å; C204-L207 WeakPolarHBondContact O-CB 3.23Å; C204-L207 PolarHBondContact O-N 3.11Å; C204-L207 VanDerWaalsContact O-N 3.13Å; E205-L207 VanDerWaalsContact C-N 3.27Å; E205-L207 PolarHBondContact O-N 2.87Å; L207-Q209 VanDerWaalsContact C-N 3.32Å; L207-Q209 PolarHBondContact O-N 2.97Å; L207-S210 PolarHBondContact O-N 3.17Å; L207-R211 HydrophobicContact CD1-CB 4.35Å; L207-R211 HydrophobicContact CD1-CG 3.9Å; L207-R211 PolarHBondContact O-N 2.94Å; L207-I216 HydrophobicContact CD2-CD1 3.93Å; L207-I216 HydrophobicContact CD2-CG1 3.99Å; L207-I216 HydrophobicContact CG-CD1 3.89Å; L207-I216 HydrophobicContact CG-CG1 4.12Å
208	I	84.4	Confident	81	Confident	56 Å²	56	60.4 Å²	60.4	29%	0.287	29%	0.289	S	S	.	.	H	α-helix	trans	-60.2	-43.9	177.5	-65.8	164.3	0	0	0	110.3	C204 E205 G212 I216	C204-I208 VanDerWaalsContact O-CG1 3.31Å; C204-I208 WeakPolarHBondContact O-CG1 3.38Å; C204-I208 PolarHBondContact O-N 2.94Å; E205-I208 PolarHBondContact O-N 3.29Å; I208-G212 WeakPolarHBondContact O-CA 3.21Å; I208-G212 PolarHBondContact O-N 2.92Å; I208-I216 HydrophobicContact CB-CD1 4.21Å; I208-I216 HydrophobicContact CG1-CD1 3.44Å; I208-I216 VanDerWaalsContact CG1-CD1 3.44Å
209	Q	88.9	Confident	80.8	Confident	144 Å²	144	61.8 Å²	61.8	67%	0.673	30%	0.296	S	S	*	.	H	α-helix	trans	-67.8	-39	178	-71.3	172.6	10.2	0	0	112.2	E205 F206 L207	E205-Q209 WeakPolarHBondContact O-CB 3.22Å; E205-Q209 VanDerWaalsContact O-CG 3.24Å; E205-Q209 WeakPolarHBondContact O-CG 3.38Å; E205-Q209 PolarHBondContact O-N 3.16Å; F206-Q209 PolarHBondContact O-N 3.34Å; L207-Q209 VanDerWaalsContact C-N 3.32Å; L207-Q209 PolarHBondContact O-N 2.97Å
210	S	91	Very high	80.9	Confident	56 Å²	56	62.1 Å²	62.1	39%	0.392	30%	0.298	S	S	.	.	H	α-helix	trans	-81.2	-34.5	-174.6	-57.5	0	0	0	0	113.8	F206 L207	F206-S210 WeakPolarHBondContact CE2-OG 3.38Å; F206-S210 VanDerWaalsContact O-CB 3.23Å; F206-S210 WeakPolarHBondContact O-CB 3.28Å; F206-S210 PolarHBondContact O-N 3.33Å; F206-S210 PolarHBondContact O-OG 3.32Å; L207-S210 PolarHBondContact O-N 3.17Å
211	R	92.1	Very high	80.9	Confident	114 Å²	114	63 Å²	63	43%	0.43	31%	0.307	S	S	.	.	H	α-helix	trans	-119	-16.6	-172.6	-58.9	-63.9	-67.3	161.8	-4.6	114.1	W194 L207 Y215	W194-R211 HydrophobicContact CD2-CG 3.98Å; W194-R211 HydrophobicContact CE3-CG 3.38Å; W194-R211 HydrophobicContact CH2-CG 4.37Å; W194-R211 HydrophobicContact CZ3-CG 3.62Å; L207-R211 HydrophobicContact CD1-CB 4.35Å; L207-R211 HydrophobicContact CD1-CG 3.9Å; L207-R211 PolarHBondContact O-N 2.94Å; R211-Y215 HydrophobicContact CB-CD1 3.46Å; R211-Y215 VanDerWaalsContact CB-CD1 3.46Å; R211-Y215 HydrophobicContact CB-CE1 4.04Å; R211-Y215 HydrophobicContact CB-CG 3.9Å; R211-Y215 HydrophobicContact CG-CD1 4.05Å; R211-Y215 HydrophobicContact CG-CE1 4.11Å; R211-Y215 VanDerWaalsContact NH2-CE2 3.27Å; R211-Y215 VanDerWaalsContact O-CB 3.26Å; R211-Y215 WeakPolarHBondContact O-CB 3.43Å
212	G	78.3	Confident	80.3	Confident	29 Å²	29	65 Å²	65	30%	0.299	33%	0.327	S	S	.	.			trans	83	155.7	-177.6	0	0	0	0	0	113.6	I208 E214 Y215 I216	I208-G212 WeakPolarHBondContact O-CA 3.21Å; I208-G212 PolarHBondContact O-N 2.92Å; G212-E214 VanDerWaalsContact C-N 3.34Å; G212-E214 PolarHBondContact O-N 3.33Å; G212-Y215 PolarHBondContact O-N 3.49Å; G212-I216 WeakPolarHBondContact O-CG1 3.45Å; G212-I216 PolarHBondContact O-N 3.1Å
213	Q	78.1	Confident	79.3	Confident	99 Å²	99	65.9 Å²	65.9	46%	0.463	33%	0.329	S	S	.	.	H	α-helix	trans	-65.9	-34.7	-178.5	-168.1	63.3	26.1	0	0	112.8	I216 S217	Q213-I216 PolarHBondContact O-N 3.17Å; Q213-S217 PolarHBondContact O-N 3.45Å; Q213-S217 PolarHBondContact O-OG 3.08Å
214	E	75.5	Confident	78.2	Confident	150 Å²	150	61.1 Å²	61.1	70%	0.701	31%	0.314	S	S	*	.	H	α-helix	trans	-63.4	-43	179.9	-173.5	-178.4	-174	0	0	111.9	G212 I216 S217 N218	G212-E214 VanDerWaalsContact C-N 3.34Å; G212-E214 PolarHBondContact O-N 3.33Å; E214-I216 VanDerWaalsContact C-N 3.29Å; E214-I216 PolarHBondContact O-N 3.18Å; E214-S217 PolarHBondContact O-N 2.88Å; E214-N218 WeakPolarHBondContact O-CB 3.39Å; E214-N218 PolarHBondContact O-N 3.13Å; E214-N218 PolarHBondContact O-ND2 2.9Å
215	Y	84.6	Confident	76.5	Confident	42 Å²	42	66 Å²	66	17%	0.165	34%	0.336	C	S	.	.	H	α-helix	trans	-56.4	-46.5	173.6	173.4	-97.4	0	0	0	111.2	W194 Q195 A198 R211 G212 N218 I219	W194-Y215 HydrophobicContact CB-CE1 4.4Å; W194-Y215 WeakPolarHBondContact CB-OH 3.49Å; Q195-Y215 VanDerWaalsContact CG-OH 3.26Å; Q195-Y215 WeakPolarHBondContact CG-OH 3.2Å; Q195-Y215 PolarHBondContact N-OH 3.41Å; A198-Y215 HydrophobicContact CB-CD1 4.39Å; A198-Y215 HydrophobicContact CB-CE1 3.94Å; R211-Y215 HydrophobicContact CB-CD1 3.46Å; R211-Y215 VanDerWaalsContact CB-CD1 3.46Å; R211-Y215 HydrophobicContact CB-CE1 4.04Å; R211-Y215 HydrophobicContact CB-CG 3.9Å; R211-Y215 HydrophobicContact CG-CD1 4.05Å; R211-Y215 HydrophobicContact CG-CE1 4.11Å; R211-Y215 VanDerWaalsContact NH2-CE2 3.27Å; R211-Y215 VanDerWaalsContact O-CB 3.26Å; R211-Y215 WeakPolarHBondContact O-CB 3.43Å; G212-Y215 PolarHBondContact O-N 3.49Å; Y215-N218 PolarHBondContact O-N 3.44Å; Y215-I219 HydrophobicContact CE1-CG1 4.35Å; Y215-I219 HydrophobicContact CE2-CG1 4.33Å; Y215-I219 WeakPolarHBondContact O-CG1 3.31Å; Y215-I219 PolarHBondContact O-N 2.89Å; Y215-I219 VanDerWaalsContact O-N 3.16Å
216	I	75.4	Confident	74.5	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-65.2	-47.4	-178.9	-60.8	167.8	0	0	0	110.6	A198 P202 L207 I208 G212 Q213 E214 N218 I219 Q220	A198-I216 HydrophobicContact CB-CG1 4.29Å; A198-I216 HydrophobicContact CB-CG2 4.44Å; P202-I216 HydrophobicContact CB-CG2 3.45Å; P202-I216 VanDerWaalsContact CB-CG2 3.45Å; L207-I216 HydrophobicContact CD2-CD1 3.93Å; L207-I216 HydrophobicContact CD2-CG1 3.99Å; L207-I216 HydrophobicContact CG-CD1 3.89Å; L207-I216 HydrophobicContact CG-CG1 4.12Å; I208-I216 HydrophobicContact CB-CD1 4.21Å; I208-I216 HydrophobicContact CG1-CD1 3.44Å; I208-I216 VanDerWaalsContact CG1-CD1 3.44Å; G212-I216 WeakPolarHBondContact O-CG1 3.45Å; G212-I216 PolarHBondContact O-N 3.1Å; Q213-I216 PolarHBondContact O-N 3.17Å; E214-I216 VanDerWaalsContact C-N 3.29Å; E214-I216 PolarHBondContact O-N 3.18Å; I216-N218 VanDerWaalsContact C-N 3.34Å; I216-N218 PolarHBondContact O-N 2.81Å; I216-I219 PolarHBondContact O-N 2.98Å; I216-Q220 HydrophobicContact CG2-CG 4.24Å; I216-Q220 VanDerWaalsContact O-CG 3.3Å; I216-Q220 WeakPolarHBondContact O-CG 3.11Å; I216-Q220 PolarHBondContact O-N 2.78Å
217	S	74.4	Confident	71.8	Confident	45 Å²	45	72.4 Å²	72.4	32%	0.315	39%	0.389	S	S	.	.	H	α-helix	trans	-58.8	-44.7	177.9	-63.9	0	0	0	0	111.5	Q213 E214 I219 Q220 D221	Q213-S217 PolarHBondContact O-N 3.45Å; Q213-S217 PolarHBondContact O-OG 3.08Å; E214-S217 PolarHBondContact O-N 2.88Å; S217-I219 VanDerWaalsContact C-N 3.31Å; S217-I219 PolarHBondContact O-N 3.47Å; S217-Q220 PolarHBondContact O-N 3.26Å; S217-D221 VanDerWaalsContact O-CB 3.32Å; S217-D221 WeakPolarHBondContact O-CB 3.17Å; S217-D221 PolarHBondContact O-N 2.88Å
218	N	76.2	Confident	69.3	Low	90 Å²	90	78.7 Å²	78.7	48%	0.481	42%	0.423	S	S	.	.	H	α-helix	trans	-61	-38.9	178.5	-70.2	-18.3	0	0	0	112.5	E214 Y215 I216 A222	E214-N218 WeakPolarHBondContact O-CB 3.39Å; E214-N218 PolarHBondContact O-N 3.13Å; E214-N218 PolarHBondContact O-ND2 2.9Å; Y215-N218 PolarHBondContact O-N 3.44Å; I216-N218 VanDerWaalsContact C-N 3.34Å; I216-N218 PolarHBondContact O-N 2.81Å; N218-A222 VanDerWaalsContact O-CB 3.23Å; N218-A222 WeakPolarHBondContact O-CB 3.4Å; N218-A222 PolarHBondContact O-N 3.45Å
219	I	74.3	Confident	66.8	Low	29 Å²	29	81.8 Å²	81.8	15%	0.149	44%	0.444	C	S	.	.	H	α-helix	trans	-72.1	-41.4	177	-64.6	-61.3	0	0	0	111.5	Q195 A198 K199 Y215 I216 S217 D221 H223	Q195-I219 HydrophobicContact CB-CD1 4.4Å; Q195-I219 HydrophobicContact CG-CD1 3.77Å; Q195-I219 HydrophobicContact CG-CG1 4.42Å; A198-I219 HydrophobicContact CB-CB 4.14Å; A198-I219 HydrophobicContact CB-CG1 4.43Å; A198-I219 HydrophobicContact CB-CG2 4.04Å; K199-I219 HydrophobicContact CB-CG2 4.22Å; Y215-I219 HydrophobicContact CE1-CG1 4.35Å; Y215-I219 HydrophobicContact CE2-CG1 4.33Å; Y215-I219 WeakPolarHBondContact O-CG1 3.31Å; Y215-I219 PolarHBondContact O-N 2.89Å; Y215-I219 VanDerWaalsContact O-N 3.16Å; I216-I219 PolarHBondContact O-N 2.98Å; S217-I219 VanDerWaalsContact C-N 3.31Å; S217-I219 PolarHBondContact O-N 3.47Å; I219-D221 VanDerWaalsContact C-N 3.34Å; I219-H223 VanDerWaalsContact O-CB 3.24Å; I219-H223 WeakPolarHBondContact O-CB 3.32Å; I219-H223 PolarHBondContact O-N 3.05Å
220	Q	75.1	Confident	64.4	Low	41 Å²	41	83.9 Å²	83.9	19%	0.192	46%	0.456	C	S	.	.	H	α-helix	trans	-59.7	-47	172.9	-69.9	-74.8	-64.2	0	0	110.2	A198 K199 P202 I216 S217 H223 F224	A198-Q220 PolarHBondContact O-NE2 3.09Å; K199-Q220 VanDerWaalsContact C-NE2 3.31Å; K199-Q220 PolarHBondContact O-NE2 2.94Å; P202-Q220 HydrophobicContact CB-CG 4.04Å; I216-Q220 HydrophobicContact CG2-CG 4.24Å; I216-Q220 VanDerWaalsContact O-CG 3.3Å; I216-Q220 WeakPolarHBondContact O-CG 3.11Å; I216-Q220 PolarHBondContact O-N 2.78Å; S217-Q220 PolarHBondContact O-N 3.26Å; Q220-H223 PolarHBondContact O-N 2.92Å; Q220-F224 HydrophobicContact CB-CD2 4.28Å; Q220-F224 WeakPolarHBondContact O-CB 3.35Å; Q220-F224 WeakPolarHBondContact O-CD2 3.35Å; Q220-F224 PolarHBondContact O-N 2.86Å; Q220-F224 VanDerWaalsContact OE1-CE2 3.23Å
221	D	68.8	Low	61.9	Low	79 Å²	79	88.5 Å²	88.5	42%	0.422	48%	0.475	S	S	.	.	H	α-helix	trans	-65.8	-44.8	179.8	-68.3	-19.1	0	0	0	111.3	S217 I219 H223 F224 H225	S217-D221 VanDerWaalsContact O-CB 3.32Å; S217-D221 WeakPolarHBondContact O-CB 3.17Å; S217-D221 PolarHBondContact O-N 2.88Å; I219-D221 VanDerWaalsContact C-N 3.34Å; D221-H223 PolarHBondContact O-N 3.21Å; D221-F224 PolarHBondContact O-N 3.48Å; D221-H225 VanDerWaalsContact O-CA 3.29Å; D221-H225 WeakPolarHBondContact O-CA 3.38Å; D221-H225 WeakPolarHBondContact O-CB 3.24Å; D221-H225 PolarHBondContact O-N 3.4Å; D221-H225 IonicContact OD1-CD2 3.55Å
222	A	66	Low	58.9	Low	59 Å²	59	91.6 Å²	91.6	49%	0.488	50%	0.495	S	S	.	.	H	α-helix	trans	-61.5	-33.4	175.1	0	0	0	0	0	112.4	N218 L226	N218-A222 VanDerWaalsContact O-CB 3.23Å; N218-A222 WeakPolarHBondContact O-CB 3.4Å; N218-A222 PolarHBondContact O-N 3.45Å; A222-L226 WeakPolarHBondContact O-CD1 3.42Å
223	H	57.5	Low	56.6	Low	49 Å²	49	98.8 Å²	98.8	23%	0.227	53%	0.526	C	S	.	.	H	α-helix	trans	-81.7	-33.4	-179.1	-169.5	47.8	0	0	0	113.6	K199 I219 Q220 D221 Q288	K199-H223 WeakPolarHBondContact CE-CE1 3.48Å; K199-H223 VanDerWaalsContact CE-NE2 3.26Å; K199-H223 WeakPolarHBondContact CE-NE2 3.32Å; I219-H223 VanDerWaalsContact O-CB 3.24Å; I219-H223 WeakPolarHBondContact O-CB 3.32Å; I219-H223 PolarHBondContact O-N 3.05Å; Q220-H223 PolarHBondContact O-N 2.92Å; D221-H223 PolarHBondContact O-N 3.21Å; H223-Q288 PolarHBondContact NE2-NE2 3.27Å
224	F	53.5	Low	54.1	Low	111 Å²	111	97.1 Å²	97.1	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-108.3	-16.6	-174.2	-61.5	-67	0	0	0	114.5	Q220 D221	Q220-F224 HydrophobicContact CB-CD2 4.28Å; Q220-F224 WeakPolarHBondContact O-CB 3.35Å; Q220-F224 WeakPolarHBondContact O-CD2 3.35Å; Q220-F224 PolarHBondContact O-N 2.86Å; Q220-F224 VanDerWaalsContact OE1-CE2 3.23Å; D221-F224 PolarHBondContact O-N 3.48Å
225	H	46.8	Very low	51.8	Low	105 Å²	105	96.6 Å²	96.6	49%	0.486	54%	0.542	S	S	.	.			trans	-111.4	17	-176.7	-76.8	-69.1	0	0	0	115.9	D221 G227 D228	D221-H225 VanDerWaalsContact O-CA 3.29Å; D221-H225 WeakPolarHBondContact O-CA 3.38Å; D221-H225 WeakPolarHBondContact O-CB 3.24Å; D221-H225 PolarHBondContact O-N 3.4Å; D221-H225 IonicContact OD1-CD2 3.55Å; H225-G227 PolarHBondContact O-N 3.5Å; H225-D228 PolarHBondContact O-N 3.02Å
226	L	42.7	Very low	49.4	Very low	153 Å²	153	104.1 Å²	104.1	80%	0.801	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	29.4	171.1	-126.9	91	0	0	0	114.5	A222	A222-L226 WeakPolarHBondContact O-CD1 3.42Å
227	G	36.2	Very low	47.1	Very low	69 Å²	69	113.9 Å²	113.9	71%	0.711	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.9	-16.3	174.2	0	0	0	0	0	115.2	H225	H225-G227 PolarHBondContact O-N 3.5Å
228	D	36.1	Very low	44.7	Very low	131 Å²	131	116.8 Å²	116.8	70%	0.701	64%	0.639	S	S	*	*	S	Bend	trans	-119	-2.2	-167.8	-80	-27.4	0	0	0	115.7	H225 M230	H225-D228 PolarHBondContact O-N 3.02Å; D228-M230 PolarHBondContact O-N 3.44Å
229	T	31.9	Very low	42	Very low	121 Å²	121	117.5 Å²	117.5	74%	0.742	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	61.7	180	35.6	0	0	0	0	112.8
230	M	37.2	Very low	39.6	Very low	188 Å²	188	123.9 Å²	123.9	93%	0.926	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143	34.4	157.8	-83.7	-146.9	-171.1	0	0	114.3	D228	D228-M230 PolarHBondContact O-N 3.44Å
231	I	38.9	Very low	37.2	Very low	154 Å²	154	126.4 Å²	126.4	79%	0.79	70%	0.704	S	S	*	*	S	Bend	trans	-149.9	105.1	149.3	-52.8	-170.9	0	0	0	104.2
232	E	29.8	Very low	35	Very low	179 Å²	179	134.4 Å²	134.4	84%	0.836	73%	0.729	S	S	*	*				-165.2	106.5	89.4	-82.7	178.7	170.3	0	0	109.2
233	N	28.8	Very low	32.8	Very low	180 Å²	180	140.2 Å²	140.2	96%	0.963	75%	0.746	S	S	*	*			trans	-93.6	117.4	147.3	-97	-23.1	0	0	0	107.1
234	G	26.7	Very low	31.9	Very low	63 Å²	63	142.5 Å²	142.5	65%	0.649	77%	0.765	S	S	*	*			trans	114.7	104.2	149.7	0	0	0	0	0	118.1
235	T	27.4	Very low	30.5	Very low	139 Å²	139	146.8 Å²	146.8	85%	0.853	79%	0.786	S	S	*	*			trans	72.6	103.2	132.9	32.7	0	0	0	0	121.2
236	K	33.6	Very low	29.4	Very low	201 Å²	201	149.1 Å²	149.1	87%	0.874	80%	0.803	S	S	*	*			trans	15.7	117.2	136.6	-63.4	179.8	179.7	176.4	0	118.3
237	K	26.3	Very low	28.6	Very low	205 Å²	205	150.7 Å²	150.7	89%	0.891	81%	0.808	S	S	*	*				-179.5	122.4	118.3	-101.3	173.8	-177.3	179.1	0	113.8
238	S	24.1	Very low	28.2	Very low	106 Å²	106	154.2 Å²	154.2	74%	0.741	82%	0.815	S	S	*	*			trans	29.2	118.7	137	-146.9	0	0	0	0	121.7
239	C	21.4	Very low	27.7	Very low	106 Å²	106	151.9 Å²	151.9	72%	0.716	82%	0.822	S	S	*	*			trans	11.5	138.7	149.5	46.9	0	0	0	0	122.7
240	I	22.9	Very low	27.7	Very low	163 Å²	163	148.8 Å²	148.8	84%	0.836	81%	0.814	S	S	*	*				-168.5	142	113	-86.2	151	0	0	0	110
241	S	24.1	Very low	27.8	Very low	93 Å²	93	147.3 Å²	147.3	65%	0.65	81%	0.809	S	S	*	*			trans	-40.3	145.1	177.8	54.5	0	0	0	0	119
242	R	22.9	Very low	27.8	Very low	247 Å²	247	142 Å²	142	93%	0.932	79%	0.793	S	S	*	*				176.3	115.1	118.4	-93.9	164.8	-175.9	-158.2	1.7	111.1
243	E	20.5	Very low	28.2	Very low	182 Å²	182	135.4 Å²	135.4	85%	0.85	77%	0.769	S	S	*	*			trans	-98.8	176.7	159.1	-107.5	-164.8	-172.3	0	0	108.7
244	P	38.2	Very low	29.3	Very low	97 Å²	97	130.2 Å²	130.2	63%	0.63	75%	0.747	S	S	*	*			cis	-138.8	149.4	-23	31.5	-14.3	0	0	0	112.4
245	Q	23.8	Very low	30.8	Very low	200 Å²	200	131.3 Å²	131.3	94%	0.935	74%	0.744	S	S	*	*			trans	-144.2	124.7	155.4	-66.2	-166.3	-2.8	0	0	112.6
246	N	24.9	Very low	32.5	Very low	155 Å²	155	125.2 Å²	125.2	83%	0.829	71%	0.708	S	S	*	*			trans	-26.1	140.5	173.3	-74.9	-44.9	0	0	0	117.5
247	M	24.3	Very low	34.6	Very low	186 Å²	186	117 Å²	117	92%	0.916	67%	0.673	S	S	*	*				-171.6	115.5	122.8	-98.7	172	-142	0	0	113.4
248	V	27.9	Very low	36.9	Very low	142 Å²	142	113.2 Å²	113.2	86%	0.861	66%	0.662	S	S	*	*			trans	31.7	110.8	149.3	-175.6	0	0	0	0	119.4
249	G	26.8	Very low	39.7	Very low	82 Å²	82	109.7 Å²	109.7	85%	0.845	64%	0.637	S	S	*	*			trans	-75.4	141	170.5	0	0	0	0	0	114.1
250	G	32.3	Very low	42.5	Very low	56 Å²	56	109.5 Å²	109.5	58%	0.577	64%	0.635	S	S	*	*			trans	171	66.4	174.2	0	0	0	0	0	111.1
251	L	37.6	Very low	45.5	Very low	157 Å²	157	102.7 Å²	102.7	82%	0.822	60%	0.601	S	S	*	*			trans	-133.7	111.6	178.5	-66.7	173	0	0	0	109.7
252	G	39.4	Very low	48.5	Very low	43 Å²	43	98.4 Å²	98.4	44%	0.443	57%	0.571	S	S	.	*	S	Bend	trans	-165.2	-33.1	174	0	0	0	0	0	111.2
253	A	38.9	Very low	51.6	Low	41 Å²	41	90.8 Å²	90.8	34%	0.339	55%	0.546	S	S	.	.	S	Bend	trans	-82.7	-38.1	172.2	0	0	0	0	0	112.8	S255	A253-S255 PolarHBondContact O-N 3.28Å
254	S	51.7	Low	54.6	Low	71 Å²	71	84.9 Å²	84.9	50%	0.497	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-19.2	-171.9	-51.5	0	0	0	0	115.2
255	S	58.7	Low	56.9	Low	85 Å²	85	80.2 Å²	80.2	59%	0.594	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-33.6	-179.4	179.2	0	0	0	0	112.6	A253 M257 L258	A253-S255 PolarHBondContact O-N 3.28Å; S255-M257 VanDerWaalsContact C-N 3.29Å; S255-M257 PolarHBondContact O-N 3.42Å; S255-L258 WeakPolarHBondContact O-CB 3.45Å; S255-L258 PolarHBondContact O-N 3.42Å; S255-L258 VanDerWaalsContact O-N 3.09Å
256	A	62.1	Low	59.8	Low	11 Å²	11	72.7 Å²	72.7	9%	0.091	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-65.3	-33.3	178.3	0	0	0	0	0	112.9	L258 S259 V279 Y289	A256-L258 PolarHBondContact O-N 3.21Å; A256-S259 VanDerWaalsContact O-CB 3.24Å; A256-S259 WeakPolarHBondContact O-CB 3.46Å; A256-S259 PolarHBondContact O-N 3.29Å; A256-S259 VanDerWaalsContact O-N 3.11Å; A256-V279 HydrophobicContact CB-CG1 3.87Å; A256-Y289 HydrophobicContact CB-CD1 3.69Å; A256-Y289 HydrophobicContact CB-CE1 3.29Å
257	M	77.3	Confident	62.6	Low	28 Å²	28	73.5 Å²	73.5	14%	0.138	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-65.1	-19.3	175.4	-69.6	-60.7	-72.5	0	0	113	S255 S259 V262 Q263 L266 E276	S255-M257 VanDerWaalsContact C-N 3.29Å; S255-M257 PolarHBondContact O-N 3.42Å; M257-S259 VanDerWaalsContact C-N 3.34Å; M257-V262 HydrophobicContact CE-CG1 4.19Å; M257-V262 HydrophobicContact SD-CG1 3.92Å; M257-Q263 PolarHBondContact O-NE2 3.44Å; M257-L266 HydrophobicContact CE-CD1 4.18Å; M257-E276 HydrophobicContact CE-CB 3.75Å; M257-E276 HydrophobicContact CE-CG 4.27Å; M257-E276 HydrophobicContact CG-CG 4.33Å; M257-E276 HydrophobicContact SD-CB 3.8Å; M257-E276 HydrophobicContact SD-CG 3.94Å
258	L	75.6	Confident	65.5	Low	127 Å²	127	70.1 Å²	70.1	67%	0.665	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-88.2	-0.6	177.1	-58.2	173.9	0	0	0	113	S255 A256	S255-L258 WeakPolarHBondContact O-CB 3.45Å; S255-L258 PolarHBondContact O-N 3.42Å; S255-L258 VanDerWaalsContact O-N 3.09Å; A256-L258 PolarHBondContact O-N 3.21Å
259	S	83.1	Confident	68.2	Low	31 Å²	31	66.5 Å²	66.5	22%	0.217	43%	0.432	C	S	.	.	S	Bend	trans	-60.2	139.8	177.2	168.3	0	0	0	0	111.4	A256 M257 V261 V262 Q263	A256-S259 VanDerWaalsContact O-CB 3.24Å; A256-S259 WeakPolarHBondContact O-CB 3.46Å; A256-S259 PolarHBondContact O-N 3.29Å; A256-S259 VanDerWaalsContact O-N 3.11Å; M257-S259 VanDerWaalsContact C-N 3.34Å; S259-V261 PolarHBondContact O-N 3.47Å; S259-V261 VanDerWaalsContact O-N 3.15Å; S259-V261 PolarHBondContact OG-N 3.08Å; S259-V262 PolarHBondContact O-N 3.34Å; S259-Q263 WeakPolarHBondContact O-CG 3.5Å; S259-Q263 PolarHBondContact O-N 3.26Å
260	P	79.3	Confident	71	Confident	103 Å²	103	64.4 Å²	64.4	67%	0.669	40%	0.399	S	S	*	.	H	α-helix	trans	-53.9	-33.9	174.8	-26.1	34.3	0	0	0	113.3	T264	P260-T264 WeakPolarHBondContact O-CB 3.22Å; P260-T264 PolarHBondContact O-N 3.47Å; P260-T264 PolarHBondContact O-OG1 2.84Å
261	V	87.1	Confident	73.4	Confident	20 Å²	20	67.8 Å²	67.8	12%	0.121	40%	0.4	C	S	.	.	H	α-helix	trans	-64.8	-49.6	176.9	175.8	0	0	0	0	110.4	S259 T264 V265 S292 V293 L296	S259-V261 PolarHBondContact O-N 3.47Å; S259-V261 VanDerWaalsContact O-N 3.15Å; S259-V261 PolarHBondContact OG-N 3.08Å; V261-T264 PolarHBondContact O-N 2.98Å; V261-V265 WeakPolarHBondContact O-CG2 3.44Å; V261-V265 PolarHBondContact O-N 2.95Å; V261-V265 VanDerWaalsContact O-N 3.16Å; V261-S292 WeakPolarHBondContact CG1-O 3.11Å; V261-V293 HydrophobicContact CG1-CG2 4.16Å; V261-L296 HydrophobicContact CG1-CD2 4.28Å
262	V	86.6	Confident	75.3	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.018	38%	0.381	C	S	.	.	H	α-helix	trans	-66.8	-42.9	-179.7	179.3	0	0	0	0	110.8	M257 S259 T264 V265 L266 V275 V279 L296	M257-V262 HydrophobicContact CE-CG1 4.19Å; M257-V262 HydrophobicContact SD-CG1 3.92Å; S259-V262 PolarHBondContact O-N 3.34Å; V262-T264 VanDerWaalsContact C-N 3.34Å; V262-T264 PolarHBondContact O-N 3.29Å; V262-V265 PolarHBondContact O-N 2.57Å; V262-L266 HydrophobicContact CG1-CD1 4.06Å; V262-L266 HydrophobicContact CG1-CG 4.37Å; V262-L266 VanDerWaalsContact O-CG 3.3Å; V262-L266 WeakPolarHBondContact O-CG 3.33Å; V262-L266 PolarHBondContact O-N 3.13Å; V262-V275 HydrophobicContact CG1-CG1 3.74Å; V262-V279 HydrophobicContact CG1-CG2 4.4Å; V262-V279 HydrophobicContact CG2-CG1 4.45Å; V262-V279 HydrophobicContact CG2-CG2 3.66Å; V262-L296 HydrophobicContact CG2-CD2 4.1Å
263	Q	86.5	Confident	76.9	Confident	86 Å²	86	62.6 Å²	62.6	40%	0.402	38%	0.379	S	S	.	.	H	α-helix	trans	-63.2	-38.2	177	-70.2	-62.7	-45.1	0	0	112.5	M257 S259 L266 Q267	M257-Q263 PolarHBondContact O-NE2 3.44Å; S259-Q263 WeakPolarHBondContact O-CG 3.5Å; S259-Q263 PolarHBondContact O-N 3.26Å; Q263-L266 PolarHBondContact O-N 2.86Å; Q263-Q267 VanDerWaalsContact O-CB 3.31Å; Q263-Q267 WeakPolarHBondContact O-CB 3.46Å; Q263-Q267 PolarHBondContact O-N 3.47Å
264	T	84.6	Confident	78.8	Confident	58 Å²	58	61.9 Å²	61.9	36%	0.356	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-43.3	175.1	-57.3	0	0	0	0	111.1	P260 V261 V262 Q267 M268 V293	P260-T264 WeakPolarHBondContact O-CB 3.22Å; P260-T264 PolarHBondContact O-N 3.47Å; P260-T264 PolarHBondContact O-OG1 2.84Å; V261-T264 PolarHBondContact O-N 2.98Å; V262-T264 VanDerWaalsContact C-N 3.34Å; V262-T264 PolarHBondContact O-N 3.29Å; T264-Q267 PolarHBondContact O-N 2.91Å; T264-M268 VanDerWaalsContact O-CG 3.31Å; T264-M268 WeakPolarHBondContact O-CG 3.48Å; T264-M268 PolarHBondContact O-N 3.36Å; T264-V293 HydrophobicContact CG2-CG1 4.16Å; T264-V293 HydrophobicContact CG2-CG2 3.93Å
265	V	85.8	Confident	80	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-40.8	177.1	175	0	0	0	0	111.7	V261 V262 Q267 M268 F270 V275 V293 L296 V297 V300	V261-V265 WeakPolarHBondContact O-CG2 3.44Å; V261-V265 PolarHBondContact O-N 2.95Å; V261-V265 VanDerWaalsContact O-N 3.16Å; V262-V265 PolarHBondContact O-N 2.57Å; V265-Q267 VanDerWaalsContact C-N 3.3Å; V265-Q267 PolarHBondContact O-N 3.5Å; V265-M268 WeakPolarHBondContact O-CB 3.24Å; V265-M268 PolarHBondContact O-N 3.46Å; V265-M268 VanDerWaalsContact O-N 3.16Å; V265-F270 HydrophobicContact CG1-CB 4.11Å; V265-F270 HydrophobicContact CG1-CD2 3.58Å; V265-F270 HydrophobicContact CG1-CE2 4.35Å; V265-F270 HydrophobicContact CG1-CG 4.12Å; V265-F270 WeakPolarHBondContact O-CD2 3.28Å; V265-V275 HydrophobicContact CG1-CG2 3.99Å; V265-V293 HydrophobicContact CG2-CG1 3.88Å; V265-L296 HydrophobicContact CB-CD2 3.88Å; V265-L296 HydrophobicContact CB-CG 4.29Å; V265-L296 HydrophobicContact CG1-CD2 4.17Å; V265-L296 HydrophobicContact CG1-CG 4.13Å; V265-L296 HydrophobicContact CG2-CB 4.13Å; V265-L296 HydrophobicContact CG2-CD2 3.65Å; V265-L296 HydrophobicContact CG2-CG 3.86Å; V265-V297 HydrophobicContact CG1-CG2 4.41Å; V265-V297 HydrophobicContact CG2-CG2 3.77Å; V265-V300 HydrophobicContact CG1-CG2 4.44Å
266	L	84.5	Confident	80.8	Confident	41 Å²	41	58.6 Å²	58.6	22%	0.215	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-38.6	173.6	-67.7	172.1	0	0	0	111.7	M257 V262 Q263 M268 G269 A272 V275	M257-L266 HydrophobicContact CE-CD1 4.18Å; V262-L266 HydrophobicContact CG1-CD1 4.06Å; V262-L266 HydrophobicContact CG1-CG 4.37Å; V262-L266 VanDerWaalsContact O-CG 3.3Å; V262-L266 WeakPolarHBondContact O-CG 3.33Å; V262-L266 PolarHBondContact O-N 3.13Å; Q263-L266 PolarHBondContact O-N 2.86Å; L266-M268 VanDerWaalsContact C-N 3.27Å; L266-M268 PolarHBondContact O-N 2.85Å; L266-G269 PolarHBondContact O-N 3.24Å; L266-A272 HydrophobicContact CD2-CB 3.76Å; L266-V275 HydrophobicContact CD2-CB 4.06Å; L266-V275 HydrophobicContact CD2-CG1 4.17Å; L266-V275 HydrophobicContact CD2-CG2 4.13Å; L266-V275 HydrophobicContact CG-CG1 4.44Å
267	Q	85.2	Confident	80.8	Confident	172 Å²	172	60.8 Å²	60.8	80%	0.804	35%	0.353	S	S	*	.	H	α-helix	trans	-69	-24.8	176.4	-169.5	171.6	13.5	0	0	112.9	Q263 T264 V265 G269	Q263-Q267 VanDerWaalsContact O-CB 3.31Å; Q263-Q267 WeakPolarHBondContact O-CB 3.46Å; Q263-Q267 PolarHBondContact O-N 3.47Å; T264-Q267 PolarHBondContact O-N 2.91Å; V265-Q267 VanDerWaalsContact C-N 3.3Å; V265-Q267 PolarHBondContact O-N 3.5Å; Q267-G269 PolarHBondContact O-N 3.04Å
268	M	83.8	Confident	80.6	Confident	115 Å²	115	61.1 Å²	61.1	57%	0.567	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.4	170.2	-70.9	170.9	137.5	0	0	113.1	T264 V265 L266 F270 V293 V297	T264-M268 VanDerWaalsContact O-CG 3.31Å; T264-M268 WeakPolarHBondContact O-CG 3.48Å; T264-M268 PolarHBondContact O-N 3.36Å; V265-M268 WeakPolarHBondContact O-CB 3.24Å; V265-M268 PolarHBondContact O-N 3.46Å; V265-M268 VanDerWaalsContact O-N 3.16Å; L266-M268 VanDerWaalsContact C-N 3.27Å; L266-M268 PolarHBondContact O-N 2.85Å; M268-F270 HydrophobicContact CB-CD2 3.89Å; M268-F270 HydrophobicContact CB-CE2 3.89Å; M268-F270 HydrophobicContact SD-CE2 4.43Å; M268-V293 HydrophobicContact CE-CG1 4.32Å; M268-V293 HydrophobicContact SD-CG1 3.99Å; M268-V297 HydrophobicContact SD-CG2 4Å
269	G	84.6	Confident	80.5	Confident	67 Å²	67	55.4 Å²	55.4	69%	0.691	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	8.1	172.4	0	0	0	0	0	115.3	L266 Q267	L266-G269 PolarHBondContact O-N 3.24Å; Q267-G269 PolarHBondContact O-N 3.04Å
270	F	86.2	Confident	79.2	Confident	37 Å²	37	57.2 Å²	57.2	16%	0.162	33%	0.331	C	S	.	.			trans	-69.9	147.2	176.2	-67.5	-74.5	0	0	0	112.1	V265 M268 A272 V275 V297 V300 L301	V265-F270 HydrophobicContact CG1-CB 4.11Å; V265-F270 HydrophobicContact CG1-CD2 3.58Å; V265-F270 HydrophobicContact CG1-CE2 4.35Å; V265-F270 HydrophobicContact CG1-CG 4.12Å; V265-F270 WeakPolarHBondContact O-CD2 3.28Å; M268-F270 HydrophobicContact CB-CD2 3.89Å; M268-F270 HydrophobicContact CB-CE2 3.89Å; M268-F270 HydrophobicContact SD-CE2 4.43Å; F270-A272 PolarHBondContact O-N 3.25Å; F270-V275 HydrophobicContact CB-CG2 3.96Å; F270-V297 HydrophobicContact CE2-CG1 4.25Å; F270-V297 HydrophobicContact CE2-CG2 3.98Å; F270-V297 HydrophobicContact CZ-CG1 4.01Å; F270-V300 HydrophobicContact CB-CG1 4.07Å; F270-V300 HydrophobicContact CD1-CB 4.38Å; F270-V300 HydrophobicContact CD1-CG1 3.26Å; F270-V300 HydrophobicContact CE1-CG1 3.76Å; F270-V300 HydrophobicContact CG-CG1 3.76Å; F270-L301 HydrophobicContact CE1-CD2 3.85Å; F270-L301 HydrophobicContact CE1-CG 4.34Å; F270-L301 HydrophobicContact CZ-CD2 4.15Å; F270-L301 HydrophobicContact CZ-CG 4.42Å
271	E	82.6	Confident	78	Confident	128 Å²	128	54 Å²	54	60%	0.598	31%	0.309	S	S	*	.			trans	-65.5	124	-176.3	-171.2	-177.8	165.7	0	0	111.7	G273 V274 V275	E271-G273 PolarHBondContact O-N 3.02Å; E271-G273 VanDerWaalsContact O-N 3.13Å; E271-V274 HydrophobicContact CB-CG2 4.2Å; E271-V274 PolarHBondContact O-N 3.12Å; E271-V274 VanDerWaalsContact O-N 3.08Å; E271-V275 WeakPolarHBondContact O-CG2 3.48Å; E271-V275 PolarHBondContact O-N 3.31Å; E271-V275 VanDerWaalsContact O-N 3.1Å
272	A	76.8	Confident	76.6	Confident	51 Å²	51	54.3 Å²	54.3	42%	0.421	31%	0.309	S	S	.	.	H	α-helix	trans	-58	-32	-176.1	0	0	0	0	0	114	L266 F270 E276	L266-A272 HydrophobicContact CD2-CB 3.76Å; F270-A272 PolarHBondContact O-N 3.25Å; A272-E276 WeakPolarHBondContact O-CB 3.44Å; A272-E276 PolarHBondContact O-N 3.37Å
273	G	74.8	Confident	75.4	Confident	39 Å²	39	58.9 Å²	58.9	40%	0.402	33%	0.326	S	S	.	.	H	α-helix	trans	-67.6	-39.3	177.6	0	0	0	0	0	113.3	E271 S277	E271-G273 PolarHBondContact O-N 3.02Å; E271-G273 VanDerWaalsContact O-N 3.13Å; G273-S277 WeakPolarHBondContact O-CB 3.44Å; G273-S277 PolarHBondContact O-N 3.08Å
274	V	77.4	Confident	73.5	Confident	26 Å²	26	59 Å²	59	16%	0.158	33%	0.33	C	S	.	.	H	α-helix	trans	-69.4	-46.2	176.9	178.8	0	0	0	0	109.7	E271 E276 S277 L278 V300 A303	E271-V274 HydrophobicContact CB-CG2 4.2Å; E271-V274 PolarHBondContact O-N 3.12Å; E271-V274 VanDerWaalsContact O-N 3.08Å; V274-E276 PolarHBondContact O-N 3.17Å; V274-S277 PolarHBondContact O-N 3.1Å; V274-L278 HydrophobicContact CG1-CD1 3.93Å; V274-L278 WeakPolarHBondContact O-CB 3.09Å; V274-L278 WeakPolarHBondContact O-CG 3.29Å; V274-L278 PolarHBondContact O-N 3.48Å; V274-V300 HydrophobicContact CG1-CG1 4.47Å; V274-A303 HydrophobicContact CG1-CB 4.15Å
275	V	76.8	Confident	71.6	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.3	-45.3	177.5	177.9	0	0	0	0	111.4	V262 V265 L266 F270 E271 L278 V279 L296 V300	V262-V275 HydrophobicContact CG1-CG1 3.74Å; V265-V275 HydrophobicContact CG1-CG2 3.99Å; L266-V275 HydrophobicContact CD2-CB 4.06Å; L266-V275 HydrophobicContact CD2-CG1 4.17Å; L266-V275 HydrophobicContact CD2-CG2 4.13Å; L266-V275 HydrophobicContact CG-CG1 4.44Å; F270-V275 HydrophobicContact CB-CG2 3.96Å; E271-V275 WeakPolarHBondContact O-CG2 3.48Å; E271-V275 PolarHBondContact O-N 3.31Å; E271-V275 VanDerWaalsContact O-N 3.1Å; V275-L278 PolarHBondContact O-N 3.11Å; V275-V279 HydrophobicContact CG1-CG2 4.23Å; V275-V279 WeakPolarHBondContact O-CB 3.49Å; V275-V279 WeakPolarHBondContact O-CG2 3.38Å; V275-V279 PolarHBondContact O-N 3.45Å; V275-L296 HydrophobicContact CG1-CD2 4.25Å; V275-V300 HydrophobicContact CG2-CG2 4.02Å
276	E	76.1	Confident	69.6	Low	87 Å²	87	60.6 Å²	60.6	41%	0.407	34%	0.337	S	S	.	.	H	α-helix	trans	-61.7	-45.2	177.4	-174.4	175.6	-163.4	0	0	111.6	M257 A272 V274 L278 V279 Q280	M257-E276 HydrophobicContact CE-CB 3.75Å; M257-E276 HydrophobicContact CE-CG 4.27Å; M257-E276 HydrophobicContact CG-CG 4.33Å; M257-E276 HydrophobicContact SD-CB 3.8Å; M257-E276 HydrophobicContact SD-CG 3.94Å; A272-E276 WeakPolarHBondContact O-CB 3.44Å; A272-E276 PolarHBondContact O-N 3.37Å; V274-E276 PolarHBondContact O-N 3.17Å; E276-L278 PolarHBondContact O-N 3.46Å; E276-V279 PolarHBondContact O-N 3Å; E276-Q280 VanDerWaalsContact O-CB 3.23Å; E276-Q280 WeakPolarHBondContact O-CB 3.48Å; E276-Q280 PolarHBondContact O-N 3.37Å
277	S	63.3	Low	67.7	Low	57 Å²	57	60.7 Å²	60.7	40%	0.399	35%	0.348	S	S	.	.	H	α-helix	trans	-60.6	-45	176.9	-169.2	0	0	0	0	111.4	G273 V274 Q280 T281	G273-S277 WeakPolarHBondContact O-CB 3.44Å; G273-S277 PolarHBondContact O-N 3.08Å; V274-S277 PolarHBondContact O-N 3.1Å; S277-Q280 PolarHBondContact O-N 2.94Å; S277-T281 WeakPolarHBondContact O-CB 3.49Å; S277-T281 PolarHBondContact O-N 2.91Å; S277-T281 PolarHBondContact O-OG1 2.92Å
278	L	71.5	Confident	66.2	Low	35 Å²	35	55.5 Å²	55.5	18%	0.183	32%	0.324	C	S	.	.	H	α-helix	trans	-68.1	-41.8	-179.7	-73.3	171	0	0	0	112.6	V274 V275 E276 Q280 K282 D299 V300 A303	V274-L278 HydrophobicContact CG1-CD1 3.93Å; V274-L278 WeakPolarHBondContact O-CB 3.09Å; V274-L278 WeakPolarHBondContact O-CG 3.29Å; V274-L278 PolarHBondContact O-N 3.48Å; V275-L278 PolarHBondContact O-N 3.11Å; E276-L278 PolarHBondContact O-N 3.46Å; L278-Q280 VanDerWaalsContact C-N 3.35Å; L278-K282 VanDerWaalsContact O-CB 3.26Å; L278-K282 WeakPolarHBondContact O-CB 3.49Å; L278-K282 PolarHBondContact O-N 3.37Å; L278-D299 HydrophobicContact CD1-CB 4.47Å; L278-V300 HydrophobicContact CD1-CB 4.17Å; L278-V300 HydrophobicContact CD1-CG2 3.56Å; L278-A303 HydrophobicContact CD1-CB 4.17Å
279	V	73.1	Confident	65.9	Low	7 Å²	7	54.4 Å²	54.4	4%	0.042	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-45.1	175.4	172.7	0	0	0	0	110.4	A256 V262 V275 E276 Y283 Y290 L296	A256-V279 HydrophobicContact CB-CG1 3.87Å; V262-V279 HydrophobicContact CG1-CG2 4.4Å; V262-V279 HydrophobicContact CG2-CG1 4.45Å; V262-V279 HydrophobicContact CG2-CG2 3.66Å; V275-V279 HydrophobicContact CG1-CG2 4.23Å; V275-V279 WeakPolarHBondContact O-CB 3.49Å; V275-V279 WeakPolarHBondContact O-CG2 3.38Å; V275-V279 PolarHBondContact O-N 3.45Å; E276-V279 PolarHBondContact O-N 3Å; V279-Y283 WeakPolarHBondContact O-CB 3.43Å; V279-Y283 PolarHBondContact O-N 3.47Å; V279-Y290 HydrophobicContact CG2-CD2 3.92Å; V279-Y290 HydrophobicContact CG2-CE2 4.13Å; V279-L296 HydrophobicContact CG2-CD1 4.27Å; V279-L296 HydrophobicContact CG2-CD2 4.42Å
280	Q	56.5	Low	65.5	Low	70 Å²	70	51.7 Å²	51.7	33%	0.327	28%	0.283	S	S	.	.	H	α-helix	trans	-68.4	-45.2	179.3	-169.8	172.4	8.6	0	0	111.8	E276 S277 L278 Y283 L284	E276-Q280 VanDerWaalsContact O-CB 3.23Å; E276-Q280 WeakPolarHBondContact O-CB 3.48Å; E276-Q280 PolarHBondContact O-N 3.37Å; S277-Q280 PolarHBondContact O-N 2.94Å; L278-Q280 VanDerWaalsContact C-N 3.35Å; Q280-Y283 PolarHBondContact O-N 2.74Å; Q280-L284 HydrophobicContact CG-CD1 3.97Å; Q280-L284 HydrophobicContact CG-CG 4.47Å; Q280-L284 WeakPolarHBondContact O-CB 3.14Å; Q280-L284 VanDerWaalsContact O-CG 3.22Å; Q280-L284 WeakPolarHBondContact O-CG 3.49Å; Q280-L284 PolarHBondContact O-N 3.4Å
281	T	54	Low	65.3	Low	36 Å²	36	55.6 Å²	55.6	22%	0.221	31%	0.309	C	S	.	.	H	α-helix	trans	-62.7	-45.3	178.1	-68.8	0	0	0	0	111	S277 Y283 L284 L285	S277-T281 WeakPolarHBondContact O-CB 3.49Å; S277-T281 PolarHBondContact O-N 2.91Å; S277-T281 PolarHBondContact O-OG1 2.92Å; T281-Y283 PolarHBondContact O-N 2.99Å; T281-L284 PolarHBondContact O-N 2.84Å; T281-L285 HydrophobicContact CG2-CD1 3.58Å; T281-L285 HydrophobicContact CG2-CG 4.17Å; T281-L285 WeakPolarHBondContact O-CB 3.46Å; T281-L285 VanDerWaalsContact O-CG 3.29Å; T281-L285 WeakPolarHBondContact O-CG 3.48Å; T281-L285 PolarHBondContact O-N 3.21Å
282	K	58.6	Low	65.3	Low	26 Å²	26	51.6 Å²	51.6	11%	0.113	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-47.3	176.1	-179.7	171.9	-178.1	159.7	0	112.1	L278 L284 L285 T286 Y290 E295	L278-K282 VanDerWaalsContact O-CB 3.26Å; L278-K282 WeakPolarHBondContact O-CB 3.49Å; L278-K282 PolarHBondContact O-N 3.37Å; K282-L284 VanDerWaalsContact C-N 3.31Å; K282-L284 PolarHBondContact O-N 3.44Å; K282-L285 PolarHBondContact O-N 3.16Å; K282-T286 WeakPolarHBondContact O-CB 3.46Å; K282-T286 PolarHBondContact O-N 2.97Å; K282-T286 PolarHBondContact O-OG1 2.83Å; K282-Y290 HydrophobicContact CB-CD2 4.48Å; K282-Y290 HydrophobicContact CB-CE2 3.75Å; K282-Y290 HydrophobicContact CD-CD1 3.71Å; K282-Y290 HydrophobicContact CD-CD2 3.6Å; K282-Y290 HydrophobicContact CD-CE1 3.47Å; K282-Y290 VanDerWaalsContact CD-CE1 3.47Å; K282-Y290 HydrophobicContact CD-CE2 3.36Å; K282-Y290 HydrophobicContact CD-CG 3.78Å; K282-Y290 HydrophobicContact CG-CE2 4.19Å; K282-Y290 VanDerWaalsContact NZ-CE1 3.29Å; K282-E295 IonicContact NZ-OE1 2.84Å; K282-E295 PolarHBondContact NZ-OE1 3.09Å; K282-E295 IonicContact NZ-OE2 2.67Å; K282-E295 PolarHBondContact NZ-OE2 3.22Å
283	Y	60	Low	65.5	Low	98 Å²	98	51 Å²	51	38%	0.384	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-39.8	178.7	-176.7	-103.3	0	0	0	111.8	V279 Q280 T281 G287 Q288 Y289	V279-Y283 WeakPolarHBondContact O-CB 3.43Å; V279-Y283 PolarHBondContact O-N 3.47Å; Q280-Y283 PolarHBondContact O-N 2.74Å; T281-Y283 PolarHBondContact O-N 2.99Å; Y283-G287 WeakPolarHBondContact O-CA 3.2Å; Y283-G287 PolarHBondContact O-N 3.41Å; Y283-Q288 WeakPolarHBondContact CA-O 3.48Å; Y283-Y289 HydrophobicContact CD1-CE1 4.42Å; Y283-Y289 AromaticContact CD2-CD1 3.72Å; Y283-Y289 HydrophobicContact CD2-CD1 3.72Å; Y283-Y289 HydrophobicContact CD2-CD2 4.19Å; Y283-Y289 AromaticContact CD2-CE1 3.27Å; Y283-Y289 HydrophobicContact CD2-CE1 3.27Å; Y283-Y289 AromaticContact CD2-CE2 3.83Å; Y283-Y289 HydrophobicContact CD2-CE2 3.83Å; Y283-Y289 HydrophobicContact CD2-CG 4.15Å; Y283-Y289 AromaticContact CD2-CZ 3.37Å; Y283-Y289 HydrophobicContact CE2-CD1 4.41Å; Y283-Y289 HydrophobicContact CE2-CD2 4.23Å; Y283-Y289 AromaticContact CE2-CE1 3.72Å; Y283-Y289 HydrophobicContact CE2-CE1 3.72Å; Y283-Y289 AromaticContact CE2-CE2 3.54Å; Y283-Y289 HydrophobicContact CE2-CE2 3.54Å; Y283-Y289 AromaticContact CE2-CZ 3.25Å; Y283-Y289 WeakPolarHBondContact CE2-OH 3.3Å; Y283-Y289 HydrophobicContact CG-CD1 4.24Å; Y283-Y289 AromaticContact CG-CE1 3.68Å; Y283-Y289 HydrophobicContact CG-CE1 3.68Å; Y283-Y289 AromaticContact CZ-CZ 3.87Å
284	L	47.5	Very low	65.4	Low	90 Å²	90	53 Å²	53	47%	0.471	30%	0.295	S	S	.	.	H	α-helix	trans	-69	-37.9	177.7	-72.8	172.4	0	0	0	113.1	Q280 T281 K282 V334	Q280-L284 HydrophobicContact CG-CD1 3.97Å; Q280-L284 HydrophobicContact CG-CG 4.47Å; Q280-L284 WeakPolarHBondContact O-CB 3.14Å; Q280-L284 VanDerWaalsContact O-CG 3.22Å; Q280-L284 WeakPolarHBondContact O-CG 3.49Å; Q280-L284 PolarHBondContact O-N 3.4Å; T281-L284 PolarHBondContact O-N 2.84Å; K282-L284 VanDerWaalsContact C-N 3.31Å; K282-L284 PolarHBondContact O-N 3.44Å; L284-V334 HydrophobicContact CD1-CG2 3.81Å
285	L	43.7	Very low	65.1	Low	52 Å²	52	55.5 Å²	55.5	27%	0.272	31%	0.305	S	S	.	.	H	α-helix	trans	-80.8	-33.7	-178	-70.3	177.2	0	0	0	112.9	T281 K282 C451	T281-L285 HydrophobicContact CG2-CD1 3.58Å; T281-L285 HydrophobicContact CG2-CG 4.17Å; T281-L285 WeakPolarHBondContact O-CB 3.46Å; T281-L285 VanDerWaalsContact O-CG 3.29Å; T281-L285 WeakPolarHBondContact O-CG 3.48Å; T281-L285 PolarHBondContact O-N 3.21Å; K282-L285 PolarHBondContact O-N 3.16Å; L285-C451 VanDerWaalsContact O-CA 3.3Å; L285-C451 WeakPolarHBondContact O-CA 3.37Å
286	T	45.4	Very low	65.4	Low	38 Å²	38	55.5 Å²	55.5	23%	0.233	31%	0.305	C	S	.	.	H	α-helix	trans	-119	-14.9	-170.4	69.5	0	0	0	0	113.9	K282 Q288 P450	K282-T286 WeakPolarHBondContact O-CB 3.46Å; K282-T286 PolarHBondContact O-N 2.97Å; K282-T286 PolarHBondContact O-OG1 2.83Å; T286-Q288 PolarHBondContact O-N 3Å; T286-Q288 PolarHBondContact OG1-N 3.08Å; T286-P450 HydrophobicContact CG2-CG 4.38Å
287	G	44.9	Very low	65.6	Low	43 Å²	43	52.6 Å²	52.6	44%	0.443	29%	0.293	S	S	.	.	S	Bend	trans	71.7	4.3	-171.1	0	0	0	0	0	114.2	Y283	Y283-G287 WeakPolarHBondContact O-CA 3.2Å; Y283-G287 PolarHBondContact O-N 3.41Å
288	Q	52.7	Low	66.2	Low	64 Å²	64	53.8 Å²	53.8	30%	0.299	30%	0.298	S	S	.	.			trans	-116.4	149.4	-173.8	-62.3	-69.7	-39.6	0	0	110.8	H223 Y283 T286	H223-Q288 PolarHBondContact NE2-NE2 3.27Å; Y283-Q288 WeakPolarHBondContact CA-O 3.48Å; T286-Q288 PolarHBondContact O-N 3Å; T286-Q288 PolarHBondContact OG1-N 3.08Å
289	Y	76.9	Confident	66.3	Low	91 Å²	91	54.7 Å²	54.7	36%	0.357	30%	0.303	S	S	.	.			trans	-89.8	162.5	170.7	-63.3	-67.9	0	0	0	110.8	A256 Y283 T291	A256-Y289 HydrophobicContact CB-CD1 3.69Å; A256-Y289 HydrophobicContact CB-CE1 3.29Å; Y283-Y289 HydrophobicContact CD1-CE1 4.42Å; Y283-Y289 AromaticContact CD2-CD1 3.72Å; Y283-Y289 HydrophobicContact CD2-CD1 3.72Å; Y283-Y289 HydrophobicContact CD2-CD2 4.19Å; Y283-Y289 AromaticContact CD2-CE1 3.27Å; Y283-Y289 HydrophobicContact CD2-CE1 3.27Å; Y283-Y289 AromaticContact CD2-CE2 3.83Å; Y283-Y289 HydrophobicContact CD2-CE2 3.83Å; Y283-Y289 HydrophobicContact CD2-CG 4.15Å; Y283-Y289 AromaticContact CD2-CZ 3.37Å; Y283-Y289 HydrophobicContact CE2-CD1 4.41Å; Y283-Y289 HydrophobicContact CE2-CD2 4.23Å; Y283-Y289 AromaticContact CE2-CE1 3.72Å; Y283-Y289 HydrophobicContact CE2-CE1 3.72Å; Y283-Y289 AromaticContact CE2-CE2 3.54Å; Y283-Y289 HydrophobicContact CE2-CE2 3.54Å; Y283-Y289 AromaticContact CE2-CZ 3.25Å; Y283-Y289 WeakPolarHBondContact CE2-OH 3.3Å; Y283-Y289 HydrophobicContact CG-CD1 4.24Å; Y283-Y289 AromaticContact CG-CE1 3.68Å; Y283-Y289 HydrophobicContact CG-CE1 3.68Å; Y283-Y289 AromaticContact CZ-CZ 3.87Å; Y289-T291 PolarHBondContact O-N 3.49Å
290	Y	77.4	Confident	66.7	Low	11 Å²	11	54.4 Å²	54.4	4%	0.043	30%	0.301	C	S	.	.			trans	-65.4	123.3	168.4	-70.7	-88.1	0	0	0	109.8	V279 K282 E295 L296 D299	V279-Y290 HydrophobicContact CG2-CD2 3.92Å; V279-Y290 HydrophobicContact CG2-CE2 4.13Å; K282-Y290 HydrophobicContact CB-CD2 4.48Å; K282-Y290 HydrophobicContact CB-CE2 3.75Å; K282-Y290 HydrophobicContact CD-CD1 3.71Å; K282-Y290 HydrophobicContact CD-CD2 3.6Å; K282-Y290 HydrophobicContact CD-CE1 3.47Å; K282-Y290 VanDerWaalsContact CD-CE1 3.47Å; K282-Y290 HydrophobicContact CD-CE2 3.36Å; K282-Y290 HydrophobicContact CD-CG 3.78Å; K282-Y290 HydrophobicContact CG-CE2 4.19Å; K282-Y290 VanDerWaalsContact NZ-CE1 3.29Å; Y290-E295 HydrophobicContact CD1-CB 4.3Å; Y290-E295 HydrophobicContact CD1-CG 4.1Å; Y290-E295 HydrophobicContact CE1-CG 4.24Å; Y290-L296 HydrophobicContact CD1-CB 3.59Å; Y290-L296 HydrophobicContact CD1-CD1 4.16Å; Y290-L296 HydrophobicContact CD1-CG 4.41Å; Y290-L296 HydrophobicContact CD2-CB 4.41Å; Y290-L296 HydrophobicContact CD2-CD1 3.76Å; Y290-L296 HydrophobicContact CD2-CD2 4.5Å; Y290-L296 HydrophobicContact CD2-CG 4.44Å; Y290-L296 HydrophobicContact CE1-CB 4.04Å; Y290-L296 HydrophobicContact CE1-CD1 4.01Å; Y290-L296 HydrophobicContact CE2-CD1 3.58Å; Y290-L296 HydrophobicContact CG-CB 3.81Å; Y290-L296 HydrophobicContact CG-CD1 4.04Å; Y290-L296 HydrophobicContact CG-CD2 4.46Å; Y290-L296 HydrophobicContact CG-CG 4.31Å; Y290-D299 HydrophobicContact CE1-CB 4.42Å; Y290-D299 WeakPolarHBondContact CE1-OD2 3.48Å; Y290-D299 PolarHBondContact OH-OD2 3.36Å
291	T	81.6	Confident	67.7	Low	118 Å²	118	55.2 Å²	55.2	72%	0.724	31%	0.307	S	S	*	.			trans	-100.4	-13.1	177.6	55.6	0	0	0	0	112.2	Y289	Y289-T291 PolarHBondContact O-N 3.49Å
292	S	82.8	Confident	68.6	Low	45 Å²	45	58.7 Å²	58.7	32%	0.315	32%	0.321	S	S	.	.			trans	-127.6	139.1	177.1	-179.2	0	0	0	0	112.5	V261 S294 E295 L296	V261-S292 WeakPolarHBondContact CG1-O 3.11Å; S292-S294 VanDerWaalsContact C-N 3.29Å; S292-S294 PolarHBondContact O-N 3.1Å; S292-S294 PolarHBondContact OG-N 3.47Å; S292-S294 VanDerWaalsContact OG-N 3.14Å; S292-S294 PolarHBondContact OG-OG 2.94Å; S292-E295 PolarHBondContact O-N 3.19Å; S292-L296 PolarHBondContact O-N 3.08Å
293	V	80.3	Confident	69.2	Low	39 Å²	39	58.9 Å²	58.9	24%	0.236	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-39.2	170.7	176.3	0	0	0	0	110.4	V261 T264 V265 M268 E295 L296 V297	V261-V293 HydrophobicContact CG1-CG2 4.16Å; T264-V293 HydrophobicContact CG2-CG1 4.16Å; T264-V293 HydrophobicContact CG2-CG2 3.93Å; V265-V293 HydrophobicContact CG2-CG1 3.88Å; M268-V293 HydrophobicContact CE-CG1 4.32Å; M268-V293 HydrophobicContact SD-CG1 3.99Å; V293-E295 VanDerWaalsContact C-N 3.29Å; V293-E295 PolarHBondContact O-N 3.35Å; V293-L296 PolarHBondContact O-N 3.12Å; V293-V297 HydrophobicContact CG1-CG2 4Å; V293-V297 WeakPolarHBondContact O-CB 3.45Å; V293-V297 WeakPolarHBondContact O-CG2 3.08Å; V293-V297 PolarHBondContact O-N 3.32Å
294	S	73.5	Confident	70.1	Confident	81 Å²	81	57.6 Å²	57.6	57%	0.566	33%	0.325	S	S	*	.	H	α-helix	trans	-62.7	-37.7	-178.5	65.7	0	0	0	0	112.4	S292 T298	S292-S294 VanDerWaalsContact C-N 3.29Å; S292-S294 PolarHBondContact O-N 3.1Å; S292-S294 PolarHBondContact OG-N 3.47Å; S292-S294 VanDerWaalsContact OG-N 3.14Å; S292-S294 PolarHBondContact OG-OG 2.94Å; S294-T298 WeakPolarHBondContact O-CB 3.47Å; S294-T298 PolarHBondContact O-N 2.96Å; S294-T298 PolarHBondContact O-OG1 3.39Å
295	E	71	Confident	71.3	Confident	77 Å²	77	56.3 Å²	56.3	36%	0.36	32%	0.316	S	S	.	.	H	α-helix	trans	-70.3	-49.4	179.6	-169.4	-171.3	-168.4	0	0	110.6	K282 Y290 S292 V293 V297 T298 D299	K282-E295 IonicContact NZ-OE1 2.84Å; K282-E295 PolarHBondContact NZ-OE1 3.09Å; K282-E295 IonicContact NZ-OE2 2.67Å; K282-E295 PolarHBondContact NZ-OE2 3.22Å; Y290-E295 HydrophobicContact CD1-CB 4.3Å; Y290-E295 HydrophobicContact CD1-CG 4.1Å; Y290-E295 HydrophobicContact CE1-CG 4.24Å; S292-E295 PolarHBondContact O-N 3.19Å; V293-E295 VanDerWaalsContact C-N 3.29Å; V293-E295 PolarHBondContact O-N 3.35Å; E295-V297 VanDerWaalsContact C-N 3.34Å; E295-V297 PolarHBondContact O-N 2.89Å; E295-T298 PolarHBondContact O-N 3.13Å; E295-D299 PolarHBondContact O-N 3.2Å; E295-D299 VanDerWaalsContact O-N 3.11Å
296	L	82.5	Confident	72	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.2	-40.8	177.4	178.9	54.9	0	0	0	112	V261 V262 V265 V275 V279 Y290 S292 V293 T298 D299 V300	V261-L296 HydrophobicContact CG1-CD2 4.28Å; V262-L296 HydrophobicContact CG2-CD2 4.1Å; V265-L296 HydrophobicContact CB-CD2 3.88Å; V265-L296 HydrophobicContact CB-CG 4.29Å; V265-L296 HydrophobicContact CG1-CD2 4.17Å; V265-L296 HydrophobicContact CG1-CG 4.13Å; V265-L296 HydrophobicContact CG2-CB 4.13Å; V265-L296 HydrophobicContact CG2-CD2 3.65Å; V265-L296 HydrophobicContact CG2-CG 3.86Å; V275-L296 HydrophobicContact CG1-CD2 4.25Å; V279-L296 HydrophobicContact CG2-CD1 4.27Å; V279-L296 HydrophobicContact CG2-CD2 4.42Å; Y290-L296 HydrophobicContact CD1-CB 3.59Å; Y290-L296 HydrophobicContact CD1-CD1 4.16Å; Y290-L296 HydrophobicContact CD1-CG 4.41Å; Y290-L296 HydrophobicContact CD2-CB 4.41Å; Y290-L296 HydrophobicContact CD2-CD1 3.76Å; Y290-L296 HydrophobicContact CD2-CD2 4.5Å; Y290-L296 HydrophobicContact CD2-CG 4.44Å; Y290-L296 HydrophobicContact CE1-CB 4.04Å; Y290-L296 HydrophobicContact CE1-CD1 4.01Å; Y290-L296 HydrophobicContact CE2-CD1 3.58Å; Y290-L296 HydrophobicContact CG-CB 3.81Å; Y290-L296 HydrophobicContact CG-CD1 4.04Å; Y290-L296 HydrophobicContact CG-CD2 4.46Å; Y290-L296 HydrophobicContact CG-CG 4.31Å; S292-L296 PolarHBondContact O-N 3.08Å; V293-L296 PolarHBondContact O-N 3.12Å; L296-T298 VanDerWaalsContact C-N 3.34Å; L296-T298 PolarHBondContact O-N 3.2Å; L296-D299 PolarHBondContact O-N 2.97Å; L296-V300 HydrophobicContact CD1-CG2 4.04Å; L296-V300 HydrophobicContact CG-CG2 4.4Å; L296-V300 WeakPolarHBondContact O-CB 3.43Å; L296-V300 WeakPolarHBondContact O-CG2 3.49Å; L296-V300 PolarHBondContact O-N 3.49Å
297	V	81.3	Confident	72.7	Confident	26 Å²	26	62.7 Å²	62.7	16%	0.158	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-39.5	176.2	169.9	0	0	0	0	111.5	V265 M268 F270 V293 E295 D299 V300 L301	V265-V297 HydrophobicContact CG1-CG2 4.41Å; V265-V297 HydrophobicContact CG2-CG2 3.77Å; M268-V297 HydrophobicContact SD-CG2 4Å; F270-V297 HydrophobicContact CE2-CG1 4.25Å; F270-V297 HydrophobicContact CE2-CG2 3.98Å; F270-V297 HydrophobicContact CZ-CG1 4.01Å; V293-V297 HydrophobicContact CG1-CG2 4Å; V293-V297 WeakPolarHBondContact O-CB 3.45Å; V293-V297 WeakPolarHBondContact O-CG2 3.08Å; V293-V297 PolarHBondContact O-N 3.32Å; E295-V297 VanDerWaalsContact C-N 3.34Å; E295-V297 PolarHBondContact O-N 2.89Å; V297-D299 VanDerWaalsContact C-N 3.35Å; V297-D299 PolarHBondContact O-N 3.18Å; V297-V300 PolarHBondContact O-N 2.67Å; V297-L301 HydrophobicContact CG1-CD1 3.78Å; V297-L301 HydrophobicContact CG1-CG 4.17Å; V297-L301 WeakPolarHBondContact O-CB 3.47Å; V297-L301 VanDerWaalsContact O-CG 3.24Å; V297-L301 WeakPolarHBondContact O-CG 3.25Å; V297-L301 PolarHBondContact O-N 2.84Å
298	T	74.6	Confident	73.4	Confident	83 Å²	83	68.6 Å²	68.6	51%	0.509	35%	0.351	S	S	.	.	H	α-helix	trans	-61.4	-46.2	177.8	-58.3	0	0	0	0	110.9	S294 E295 L296 L301 Q302	S294-T298 WeakPolarHBondContact O-CB 3.47Å; S294-T298 PolarHBondContact O-N 2.96Å; S294-T298 PolarHBondContact O-OG1 3.39Å; E295-T298 PolarHBondContact O-N 3.13Å; L296-T298 VanDerWaalsContact C-N 3.34Å; L296-T298 PolarHBondContact O-N 3.2Å; T298-L301 PolarHBondContact O-N 3.47Å; T298-Q302 WeakPolarHBondContact O-CB 3.07Å; T298-Q302 PolarHBondContact O-N 3.26Å
299	D	73.6	Confident	73.4	Confident	54 Å²	54	72 Å²	72	29%	0.289	37%	0.367	S	S	.	.	H	α-helix	trans	-69	-35	-179.9	-69.5	-5.5	0	0	0	112	L278 Y290 E295 L296 V297 A303	L278-D299 HydrophobicContact CD1-CB 4.47Å; Y290-D299 HydrophobicContact CE1-CB 4.42Å; Y290-D299 WeakPolarHBondContact CE1-OD2 3.48Å; Y290-D299 PolarHBondContact OH-OD2 3.36Å; E295-D299 PolarHBondContact O-N 3.2Å; E295-D299 VanDerWaalsContact O-N 3.11Å; L296-D299 PolarHBondContact O-N 2.97Å; V297-D299 VanDerWaalsContact C-N 3.35Å; V297-D299 PolarHBondContact O-N 3.18Å; D299-A303 WeakPolarHBondContact O-CB 3.29Å; D299-A303 PolarHBondContact O-N 3.02Å
300	V	82.2	Confident	72.1	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-65.4	-48.2	173.8	172.9	0	0	0	0	111.3	V265 F270 V274 V275 L278 L296 V297 Q302 A303 E304	V265-V300 HydrophobicContact CG1-CG2 4.44Å; F270-V300 HydrophobicContact CB-CG1 4.07Å; F270-V300 HydrophobicContact CD1-CB 4.38Å; F270-V300 HydrophobicContact CD1-CG1 3.26Å; F270-V300 HydrophobicContact CE1-CG1 3.76Å; F270-V300 HydrophobicContact CG-CG1 3.76Å; V274-V300 HydrophobicContact CG1-CG1 4.47Å; V275-V300 HydrophobicContact CG2-CG2 4.02Å; L278-V300 HydrophobicContact CD1-CB 4.17Å; L278-V300 HydrophobicContact CD1-CG2 3.56Å; L296-V300 HydrophobicContact CD1-CG2 4.04Å; L296-V300 HydrophobicContact CG-CG2 4.4Å; L296-V300 WeakPolarHBondContact O-CB 3.43Å; L296-V300 WeakPolarHBondContact O-CG2 3.49Å; L296-V300 PolarHBondContact O-N 3.49Å; V297-V300 PolarHBondContact O-N 2.67Å; V300-Q302 VanDerWaalsContact C-N 3.28Å; V300-Q302 PolarHBondContact O-N 3.32Å; V300-A303 WeakPolarHBondContact O-CB 3.07Å; V300-A303 PolarHBondContact O-N 3.49Å; V300-A303 VanDerWaalsContact O-N 3.16Å; V300-E304 HydrophobicContact CG1-CG 4.49Å; V300-E304 WeakPolarHBondContact O-CG 3.21Å; V300-E304 PolarHBondContact O-N 3.43Å
301	L	76.8	Confident	70.3	Confident	88 Å²	88	73.1 Å²	73.1	46%	0.461	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-36.7	178.7	-71	173.2	0	0	0	111.8	F270 V297 T298 E305	F270-L301 HydrophobicContact CE1-CD2 3.85Å; F270-L301 HydrophobicContact CE1-CG 4.34Å; F270-L301 HydrophobicContact CZ-CD2 4.15Å; F270-L301 HydrophobicContact CZ-CG 4.42Å; V297-L301 HydrophobicContact CG1-CD1 3.78Å; V297-L301 HydrophobicContact CG1-CG 4.17Å; V297-L301 WeakPolarHBondContact O-CB 3.47Å; V297-L301 VanDerWaalsContact O-CG 3.24Å; V297-L301 WeakPolarHBondContact O-CG 3.25Å; V297-L301 PolarHBondContact O-N 2.84Å; T298-L301 PolarHBondContact O-N 3.47Å; L301-E305 VanDerWaalsContact O-CB 3.26Å; L301-E305 WeakPolarHBondContact O-CB 3.46Å; L301-E305 PolarHBondContact O-N 3.09Å
302	Q	73.1	Confident	68.5	Low	108 Å²	108	72.8 Å²	72.8	51%	0.505	40%	0.401	S	S	.	.	H	α-helix	trans	-66	-42.7	174.2	-176.5	170.1	-11	0	0	111.5	T298 V300 E304 E305 E306	T298-Q302 WeakPolarHBondContact O-CB 3.07Å; T298-Q302 PolarHBondContact O-N 3.26Å; V300-Q302 VanDerWaalsContact C-N 3.28Å; V300-Q302 PolarHBondContact O-N 3.32Å; Q302-E304 PolarHBondContact O-N 3.48Å; Q302-E305 PolarHBondContact O-N 2.93Å; Q302-E306 PolarHBondContact NE2-OE1 3.18Å; Q302-E306 VanDerWaalsContact NE2-OE1 3.09Å; Q302-E306 VanDerWaalsContact O-CG 3.31Å; Q302-E306 WeakPolarHBondContact O-CG 3.42Å; Q302-E306 PolarHBondContact O-N 3.36Å
303	A	72.2	Confident	66.3	Low	30 Å²	30	78.4 Å²	78.4	25%	0.248	43%	0.428	C	S	.	.	H	α-helix	trans	-62.5	-41.9	176.3	0	0	0	0	0	112.2	V274 L278 D299 V300 E306 E307	V274-A303 HydrophobicContact CG1-CB 4.15Å; L278-A303 HydrophobicContact CD1-CB 4.17Å; D299-A303 WeakPolarHBondContact O-CB 3.29Å; D299-A303 PolarHBondContact O-N 3.02Å; V300-A303 WeakPolarHBondContact O-CB 3.07Å; V300-A303 PolarHBondContact O-N 3.49Å; V300-A303 VanDerWaalsContact O-N 3.16Å; A303-E306 PolarHBondContact O-N 2.91Å; A303-E307 PolarHBondContact O-N 2.77Å; A303-E307 VanDerWaalsContact O-N 3.08Å
304	E	78.5	Confident	64.3	Low	71 Å²	71	82 Å²	82	33%	0.332	46%	0.455	S	S	.	.	H	α-helix	trans	-66.5	-38.8	175.6	-71.2	-178.5	156.9	0	0	112.1	V300 Q302 E307 R308	V300-E304 HydrophobicContact CG1-CG 4.49Å; V300-E304 WeakPolarHBondContact O-CG 3.21Å; V300-E304 PolarHBondContact O-N 3.43Å; Q302-E304 PolarHBondContact O-N 3.48Å; E304-E307 PolarHBondContact O-N 2.99Å; E304-R308 WeakPolarHBondContact O-CB 3.48Å; E304-R308 PolarHBondContact O-N 2.6Å
305	E	73.1	Confident	62.6	Low	63 Å²	63	89.5 Å²	89.5	29%	0.294	47%	0.471	S	S	.	.	H	α-helix	trans	-63.8	-42.4	176.2	179.2	57.9	-148.8	0	0	111.9	L301 Q302 E307 R308 Q309	L301-E305 VanDerWaalsContact O-CB 3.26Å; L301-E305 WeakPolarHBondContact O-CB 3.46Å; L301-E305 PolarHBondContact O-N 3.09Å; Q302-E305 PolarHBondContact O-N 2.93Å; E305-E307 VanDerWaalsContact C-N 3.33Å; E305-R308 PolarHBondContact O-N 2.98Å; E305-R308 IonicContact OE1-CZ 3.52Å; E305-R308 VanDerWaalsContact OE1-CZ 3.3Å; E305-R308 IonicContact OE1-NE 2.75Å; E305-R308 IonicContact OE1-NH2 2.66Å; E305-R308 PolarHBondContact OE1-NH2 2.9Å; E305-R308 IonicContact OE2-CZ 2.7Å; E305-R308 IonicContact OE2-NE 3.32Å; E305-R308 PolarHBondContact OE2-NE 3.25Å; E305-R308 IonicContact OE2-NH2 3.36Å; E305-R308 PolarHBondContact OE2-NH2 3.44Å; E305-Q309 VanDerWaalsContact O-CG 3.31Å; E305-Q309 WeakPolarHBondContact O-CG 3.38Å; E305-Q309 PolarHBondContact O-N 3.17Å; E305-Q309 PolarHBondContact OE1-NE2 3.48Å
306	E	56.9	Low	60.7	Low	104 Å²	104	89.2 Å²	89.2	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-65.7	-36.7	176.1	-72.3	174.7	-171.3	0	0	111.7	Q302 A303 Q309 A310	Q302-E306 PolarHBondContact NE2-OE1 3.18Å; Q302-E306 VanDerWaalsContact NE2-OE1 3.09Å; Q302-E306 VanDerWaalsContact O-CG 3.31Å; Q302-E306 WeakPolarHBondContact O-CG 3.42Å; Q302-E306 PolarHBondContact O-N 3.36Å; A303-E306 PolarHBondContact O-N 2.91Å; E306-Q309 PolarHBondContact O-N 3.21Å; E306-A310 PolarHBondContact O-N 2.7Å
307	E	60	Low	58.2	Low	120 Å²	120	96.6 Å²	96.6	56%	0.561	53%	0.528	S	S	*	.	H	α-helix	trans	-70	-34.8	174.8	-158.8	171.2	-147.3	0	0	112.1	A303 E304 E305 A310	A303-E307 PolarHBondContact O-N 2.77Å; A303-E307 VanDerWaalsContact O-N 3.08Å; E304-E307 PolarHBondContact O-N 2.99Å; E305-E307 VanDerWaalsContact C-N 3.33Å; E307-A310 PolarHBondContact O-N 3.32Å
308	R	61.6	Low	55.6	Low	168 Å²	168	104.4 Å²	104.4	63%	0.634	55%	0.554	S	S	*	*	H	α-helix	trans	-69.2	-33.8	174.7	-168.2	179.2	63.8	78.1	-12.7	112.7	E304 E305 A310	E304-R308 WeakPolarHBondContact O-CB 3.48Å; E304-R308 PolarHBondContact O-N 2.6Å; E305-R308 PolarHBondContact O-N 2.98Å; E305-R308 IonicContact OE1-CZ 3.52Å; E305-R308 VanDerWaalsContact OE1-CZ 3.3Å; E305-R308 IonicContact OE1-NE 2.75Å; E305-R308 IonicContact OE1-NH2 2.66Å; E305-R308 PolarHBondContact OE1-NH2 2.9Å; E305-R308 IonicContact OE2-CZ 2.7Å; E305-R308 IonicContact OE2-NE 3.32Å; E305-R308 PolarHBondContact OE2-NE 3.25Å; E305-R308 IonicContact OE2-NH2 3.36Å; E305-R308 PolarHBondContact OE2-NH2 3.44Å; R308-A310 VanDerWaalsContact C-N 3.32Å
309	Q	52.7	Low	53.7	Low	136 Å²	136	105.7 Å²	105.7	64%	0.636	57%	0.574	S	S	*	*	H	α-helix	trans	-75	-19.8	176	-71.4	178.7	20.8	0	0	112.9	E305 E306 G311	E305-Q309 VanDerWaalsContact O-CG 3.31Å; E305-Q309 WeakPolarHBondContact O-CG 3.38Å; E305-Q309 PolarHBondContact O-N 3.17Å; E305-Q309 PolarHBondContact OE1-NE2 3.48Å; E306-Q309 PolarHBondContact O-N 3.21Å; Q309-G311 PolarHBondContact O-N 2.68Å
310	A	48.8	Very low	51.8	Low	80 Å²	80	107 Å²	107	66%	0.661	60%	0.599	S	S	*	*	S	Bend	trans	-79.2	43.6	178	0	0	0	0	0	114.4	E306 E307 R308	E306-A310 PolarHBondContact O-N 2.7Å; E307-A310 PolarHBondContact O-N 3.32Å; R308-A310 VanDerWaalsContact C-N 3.32Å
311	G	39.2	Very low	49.1	Very low	45 Å²	45	113.8 Å²	113.8	46%	0.464	63%	0.629	S	S	.	*			trans	-44.6	173.1	-165.9	0	0	0	0	0	120.9	Q309 N313	Q309-G311 PolarHBondContact O-N 2.68Å; G311-N313 PolarHBondContact O-N 3.45Å
312	P	44.3	Very low	46.6	Very low	110 Å²	110	119.2 Å²	119.2	71%	0.714	65%	0.649	S	S	*	*	S	Bend	trans	-87.1	64.6	-148.1	37.2	-38.4	0	0	0	114.5
313	N	36.2	Very low	44.4	Very low	164 Å²	164	118.9 Å²	118.9	88%	0.877	66%	0.658	S	S	*	*	S	Bend	trans	-98.7	25.3	175.2	-134.7	14.4	0	0	0	114.9	G311	G311-N313 PolarHBondContact O-N 3.45Å
314	S	38.9	Very low	42.4	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	69%	0.686	S	S	*	*			trans	-153.1	38.2	-177.3	43.5	0	0	0	0	114.2
315	R	37.9	Very low	39.8	Very low	238 Å²	238	127.4 Å²	127.4	90%	0.898	69%	0.692	S	S	*	*			trans	-102.4	20.9	178.9	-101.9	-178.4	177.3	165.2	1.2	116.2
316	G	30.1	Very low	37.6	Very low	70 Å²	70	135.3 Å²	135.3	72%	0.722	72%	0.721	S	S	*	*	S	Bend	trans	-112.8	107.5	174.8	0	0	0	0	0	113.4
317	N	29.9	Very low	36.6	Very low	155 Å²	155	132.1 Å²	132.1	83%	0.829	71%	0.71	S	S	*	*	S	Bend	trans	67	87	167.1	-75.1	-12.1	0	0	0	118.8
318	R	27.1	Very low	35.2	Very low	191 Å²	191	129.7 Å²	129.7	72%	0.721	71%	0.706	S	S	*	*				-174.7	107.4	119	-103.7	172.7	-92.4	-154.9	-3	111.1	G320	R318-G320 PolarHBondContact O-N 2.81Å
319	A	35.3	Very low	33.8	Very low	110 Å²	110	127.1 Å²	127.1	91%	0.909	71%	0.709	S	S	*	*	S	Bend	trans	-54.8	128.6	154.7	0	0	0	0	0	108.3
320	G	32.8	Very low	33	Very low	80 Å²	80	124.5 Å²	124.5	83%	0.825	70%	0.697	S	S	*	*	S	Bend	trans	87	50.1	177.1	0	0	0	0	0	116	R318	R318-G320 PolarHBondContact O-N 2.81Å
321	K	25.2	Very low	32.2	Very low	144 Å²	144	125.5 Å²	125.5	63%	0.626	69%	0.687	S	S	*	*			trans	-142.2	118.6	157.7	-83.2	-177.1	177.5	178.4	0	109.1	S323	K321-S323 PolarHBondContact O-N 3.42Å
322	K	25.3	Very low	31.8	Very low	201 Å²	201	131.5 Å²	131.5	87%	0.874	70%	0.696	S	S	*	*			trans	-57.2	126.7	174.7	-70.1	179.8	176.9	-177.6	0	108.8
323	S	26.5	Very low	31.3	Very low	101 Å²	101	132 Å²	132	71%	0.706	69%	0.688	S	S	*	*			trans	-55.4	131.8	-177	-176.7	0	0	0	0	111.1	K321 S325	K321-S323 PolarHBondContact O-N 3.42Å; S323-S325 PolarHBondContact O-N 2.91Å
324	Y	29.7	Very low	31.2	Very low	214 Å²	214	126.7 Å²	126.7	84%	0.839	66%	0.662	S	S	*	*			trans	-83.7	101.8	168.7	-75.1	-94.7	0	0	0	107.9
325	S	24.8	Very low	30.7	Very low	66 Å²	66	124.8 Å²	124.8	46%	0.462	65%	0.646	S	S	.	*			trans	-136.1	134.4	167.4	69.4	0	0	0	0	109.1	S323 S327	S323-S325 PolarHBondContact O-N 2.91Å; S325-S327 WeakPolarHBondContact O-CA 3.3Å; S325-S327 WeakPolarHBondContact O-CB 3.39Å; S325-S327 PolarHBondContact O-N 3.28Å; S325-S327 PolarHBondContact O-OG 2.84Å
326	Y	26.5	Very low	30.5	Very low	229 Å²	229	117.6 Å²	117.6	90%	0.898	62%	0.624	S	S	*	*	S	Bend	trans	31.6	9.8	168	-96.6	-92.7	0	0	0	121.9
327	S	36	Very low	30.6	Very low	37 Å²	37	118.5 Å²	118.5	26%	0.259	61%	0.606	S	S	.	*			trans	-95.4	-15.1	-173	46.2	0	0	0	0	112.8	S325 V329 E330 Q331	S325-S327 WeakPolarHBondContact O-CA 3.3Å; S325-S327 WeakPolarHBondContact O-CB 3.39Å; S325-S327 PolarHBondContact O-N 3.28Å; S325-S327 PolarHBondContact O-OG 2.84Å; S327-V329 VanDerWaalsContact C-N 3.31Å; S327-V329 PolarHBondContact O-N 3.43Å; S327-E330 PolarHBondContact O-N 3.42Å; S327-Q331 VanDerWaalsContact O-CB 3.29Å; S327-Q331 WeakPolarHBondContact O-CB 3.37Å; S327-Q331 PolarHBondContact O-N 3.45Å; S327-Q331 PolarHBondContact O-OE1 3.24Å
328	C	30.2	Very low	30.6	Very low	69 Å²	69	119 Å²	119	47%	0.466	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.4	-21.8	-164.7	-155	0	0	0	0	113.5	R332	C328-R332 VanDerWaalsContact O-CD 3.32Å; C328-R332 WeakPolarHBondContact O-CD 3.27Å; C328-R332 WeakPolarHBondContact O-CG 3.28Å
329	V	32.4	Very low	30.8	Very low	114 Å²	114	116.9 Å²	116.9	69%	0.691	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-36.5	175.7	-173.2	0	0	0	0	111.1	S327	S327-V329 VanDerWaalsContact C-N 3.31Å; S327-V329 PolarHBondContact O-N 3.43Å
330	E	36.1	Very low	30.8	Very low	82 Å²	82	117.2 Å²	117.2	38%	0.383	58%	0.575	S	S	.	*	H	α-helix	trans	-90	-39.2	-175.8	-67.6	-172.4	154.9	0	0	114.3	S327 R332 H333 V334	S327-E330 PolarHBondContact O-N 3.42Å; E330-R332 VanDerWaalsContact C-N 3.26Å; E330-R332 PolarHBondContact O-N 3.23Å; E330-H333 PolarHBondContact O-N 3.29Å; E330-V334 PolarHBondContact O-N 2.93Å
331	Q	31.6	Very low	30.9	Very low	100 Å²	100	115.6 Å²	115.6	47%	0.467	55%	0.549	S	S	.	.	H	α-helix	trans	-66.8	-24.8	175.8	-92.6	81.1	-9.4	0	0	113.1	S327 T335	S327-Q331 VanDerWaalsContact O-CB 3.29Å; S327-Q331 WeakPolarHBondContact O-CB 3.37Å; S327-Q331 PolarHBondContact O-N 3.45Å; S327-Q331 PolarHBondContact O-OE1 3.24Å; Q331-T335 WeakPolarHBondContact O-CB 3.4Å; Q331-T335 PolarHBondContact O-N 3.3Å; Q331-T335 VanDerWaalsContact O-N 3.09Å; Q331-T335 PolarHBondContact O-OG1 3.19Å
332	R	31.7	Very low	31.4	Very low	172 Å²	172	112 Å²	112	65%	0.649	54%	0.537	S	S	*	.	H	α-helix	trans	-66.3	-39.5	175.1	-80.1	-175.6	167.9	168.2	-4.2	111.3	C328 E330 I336	C328-R332 VanDerWaalsContact O-CD 3.32Å; C328-R332 WeakPolarHBondContact O-CD 3.27Å; C328-R332 WeakPolarHBondContact O-CG 3.28Å; E330-R332 VanDerWaalsContact C-N 3.26Å; E330-R332 PolarHBondContact O-N 3.23Å; R332-I336 VanDerWaalsContact O-CD1 3.26Å; R332-I336 WeakPolarHBondContact O-CD1 3.36Å; R332-I336 WeakPolarHBondContact O-CG1 3.49Å; R332-I336 PolarHBondContact O-N 2.81Å
333	H	34.3	Very low	31.8	Very low	119 Å²	119	106 Å²	106	55%	0.551	52%	0.519	S	S	*	.	H	α-helix	trans	-70.4	-38.4	177.4	-74.4	-171	0	0	0	112.7	E330 Y337	E330-H333 PolarHBondContact O-N 3.29Å; H333-Y337 PolarHBondContact O-N 3.09Å
334	V	32.3	Very low	32.1	Very low	53 Å²	53	107.1 Å²	107.1	32%	0.321	52%	0.516	S	S	.	.	H	α-helix	trans	-72.1	-34.9	-179.4	178	0	0	0	0	112.6	L284 E330 R338	L284-V334 HydrophobicContact CD1-CG2 3.81Å; E330-V334 PolarHBondContact O-N 2.93Å; V334-R338 PolarHBondContact O-N 3.19Å
335	T	30.2	Very low	32.2	Very low	76 Å²	76	100.6 Å²	100.6	47%	0.466	50%	0.495	S	S	.	.	H	α-helix	trans	-73	-34.9	178.6	-51.7	0	0	0	0	112.3	Q331 K339	Q331-T335 WeakPolarHBondContact O-CB 3.4Å; Q331-T335 PolarHBondContact O-N 3.3Å; Q331-T335 VanDerWaalsContact O-N 3.09Å; Q331-T335 PolarHBondContact O-OG1 3.19Å; T335-K339 PolarHBondContact O-N 2.88Å
336	I	33.4	Very low	32.6	Very low	86 Å²	86	100.8 Å²	100.8	44%	0.441	50%	0.497	S	S	.	.	H	α-helix	trans	-65.7	-42.5	175.5	-69.8	167.4	0	0	0	110.4	R332 H340	R332-I336 VanDerWaalsContact O-CD1 3.26Å; R332-I336 WeakPolarHBondContact O-CD1 3.36Å; R332-I336 WeakPolarHBondContact O-CG1 3.49Å; R332-I336 PolarHBondContact O-N 2.81Å; I336-H340 PolarHBondContact O-N 3.18Å
337	Y	31.1	Very low	32.8	Very low	89 Å²	89	91.1 Å²	91.1	35%	0.349	47%	0.467	S	S	.	.	I	π-helix	trans	-61.1	-49.8	177.1	-161.6	-90.4	0	0	0	111.9	H333 K339 V341	H333-Y337 PolarHBondContact O-N 3.09Å; Y337-K339 PolarHBondContact O-N 3.27Å; Y337-V341 HydrophobicContact CD2-CG2 4.27Å; Y337-V341 HydrophobicContact CE2-CG1 4.35Å; Y337-V341 WeakPolarHBondContact O-CB 3.04Å; Y337-V341 PolarHBondContact O-N 3.13Å; Y337-V341 VanDerWaalsContact O-N 3.13Å
338	R	30.6	Very low	32.7	Very low	165 Å²	165	94.7 Å²	94.7	62%	0.623	48%	0.482	S	S	*	.	I	π-helix	trans	-72.6	-24.7	-174.5	-153.7	175.6	-170.4	157	1.2	114.8	V334	V334-R338 PolarHBondContact O-N 3.19Å
339	K	31.4	Very low	32.8	Very low	148 Å²	148	95.4 Å²	95.4	64%	0.643	48%	0.481	S	S	*	.	I	π-helix	trans	-92.5	-28	179.2	-86.9	-173.5	174.4	-177.9	0	114.6	T335 Y337	T335-K339 PolarHBondContact O-N 2.88Å; Y337-K339 PolarHBondContact O-N 3.27Å
340	H	35.8	Very low	32.8	Very low	116 Å²	116	96.1 Å²	96.1	54%	0.537	48%	0.476	S	S	.	.	I	π-helix	trans	-122.5	-25	-167.6	-62.1	-71.1	0	0	0	114.8	I336 L344	I336-H340 PolarHBondContact O-N 3.18Å; H340-L344 VanDerWaalsContact O-CD1 3.3Å; H340-L344 WeakPolarHBondContact O-CD1 3.26Å; H340-L344 WeakPolarHBondContact O-CG 3.28Å
341	V	34.5	Very low	32.7	Very low	46 Å²	46	96.9 Å²	96.9	28%	0.279	48%	0.482	S	S	.	.	I	π-helix	trans	-90.1	-41.3	-179.6	-177.4	0	0	0	0	111.3	Y337 L344 L345	Y337-V341 HydrophobicContact CD2-CG2 4.27Å; Y337-V341 HydrophobicContact CE2-CG1 4.35Å; Y337-V341 WeakPolarHBondContact O-CB 3.04Å; Y337-V341 PolarHBondContact O-N 3.13Å; Y337-V341 VanDerWaalsContact O-N 3.13Å; V341-L344 PolarHBondContact O-N 3.45Å; V341-L345 WeakPolarHBondContact O-CB 3.48Å; V341-L345 PolarHBondContact O-N 3.46Å
342	D	34.6	Very low	32.8	Very low	69 Å²	69	97 Å²	97	37%	0.369	49%	0.486	S	S	.	.	H	α-helix	trans	-59.8	-39.7	-179.5	-74.3	-16.1	0	0	0	114.7	S346	D342-S346 WeakPolarHBondContact O-CB 3.34Å; D342-S346 PolarHBondContact O-N 3.03Å; D342-S346 VanDerWaalsContact O-N 3.08Å; D342-S346 PolarHBondContact O-OG 3.32Å
343	P	35.2	Very low	33	Very low	76 Å²	76	93.9 Å²	93.9	49%	0.494	48%	0.482	S	S	.	.	H	α-helix	trans	-73.4	-31.9	177.1	-17.8	32.5	0	0	0	113.5	S346 G347	P343-S346 PolarHBondContact O-N 2.83Å; P343-G347 PolarHBondContact O-N 3.12Å
344	L	32.3	Very low	33	Very low	123 Å²	123	95.3 Å²	95.3	64%	0.644	49%	0.487	S	S	*	.	H	α-helix	trans	-72.6	-37.7	177.5	-69.4	176	0	0	0	111.3	H340 V341 S346 G347 L348	H340-L344 VanDerWaalsContact O-CD1 3.3Å; H340-L344 WeakPolarHBondContact O-CD1 3.26Å; H340-L344 WeakPolarHBondContact O-CG 3.28Å; V341-L344 PolarHBondContact O-N 3.45Å; L344-S346 VanDerWaalsContact C-N 3.33Å; L344-G347 PolarHBondContact O-N 3.21Å; L344-L348 WeakPolarHBondContact O-CB 3.5Å; L344-L348 WeakPolarHBondContact O-CG 3.33Å; L344-L348 PolarHBondContact O-N 3.21Å
345	L	31.6	Very low	33.1	Very low	77 Å²	77	98.5 Å²	98.5	40%	0.403	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-40.8	171.8	-148.3	75.8	0	0	0	110.8	V341 I349	V341-L345 WeakPolarHBondContact O-CB 3.48Å; V341-L345 PolarHBondContact O-N 3.46Å; L345-I349 VanDerWaalsContact O-CD1 3.32Å; L345-I349 WeakPolarHBondContact O-CD1 3.24Å; L345-I349 WeakPolarHBondContact O-CG1 3.3Å; L345-I349 PolarHBondContact O-N 3.42Å; L345-I349 VanDerWaalsContact O-N 3.12Å
346	S	33.1	Very low	33.4	Very low	71 Å²	71	99.5 Å²	99.5	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-36.7	175.1	-60.3	0	0	0	0	112.9	D342 P343 L344 Q350	D342-S346 WeakPolarHBondContact O-CB 3.34Å; D342-S346 PolarHBondContact O-N 3.03Å; D342-S346 VanDerWaalsContact O-N 3.08Å; D342-S346 PolarHBondContact O-OG 3.32Å; P343-S346 PolarHBondContact O-N 2.83Å; L344-S346 VanDerWaalsContact C-N 3.33Å; S346-Q350 PolarHBondContact O-N 3.08Å; S346-Q350 VanDerWaalsContact O-N 3.13Å
347	G	31.6	Very low	33.5	Very low	26 Å²	26	105.8 Å²	105.8	27%	0.268	53%	0.53	S	S	.	.	H	α-helix	trans	-69.5	-41.1	175.7	0	0	0	0	0	113.6	P343 L344 I349 Q350 I351	P343-G347 PolarHBondContact O-N 3.12Å; L344-G347 PolarHBondContact O-N 3.21Å; G347-I349 VanDerWaalsContact C-N 3.33Å; G347-I349 PolarHBondContact O-N 2.89Å; G347-Q350 PolarHBondContact O-N 3.23Å; G347-I351 VanDerWaalsContact O-CG1 3.3Å; G347-I351 WeakPolarHBondContact O-CG1 3.13Å; G347-I351 PolarHBondContact O-N 3.49Å
348	L	31.9	Very low	33.7	Very low	111 Å²	111	109.8 Å²	109.8	58%	0.581	55%	0.552	S	S	*	*	H	α-helix	trans	-66.5	-34.8	175.8	-74.6	166.3	0	0	0	112.2	L344 I351 N352	L344-L348 WeakPolarHBondContact O-CB 3.5Å; L344-L348 WeakPolarHBondContact O-CG 3.33Å; L344-L348 PolarHBondContact O-N 3.21Å; L348-I351 PolarHBondContact O-N 2.95Å; L348-N352 WeakPolarHBondContact O-CB 3.41Å; L348-N352 PolarHBondContact O-N 2.85Å; L348-N352 VanDerWaalsContact O-N 3.1Å
349	I	33.9	Very low	33.7	Very low	85 Å²	85	109.7 Å²	109.7	44%	0.436	56%	0.562	S	S	.	*	H	α-helix	trans	-65.6	-38.5	172	-68.3	164.8	0	0	0	111.1	L345 G347 N353	L345-I349 VanDerWaalsContact O-CD1 3.32Å; L345-I349 WeakPolarHBondContact O-CD1 3.24Å; L345-I349 WeakPolarHBondContact O-CG1 3.3Å; L345-I349 PolarHBondContact O-N 3.42Å; L345-I349 VanDerWaalsContact O-N 3.12Å; G347-I349 VanDerWaalsContact C-N 3.33Å; G347-I349 PolarHBondContact O-N 2.89Å; I349-N353 PolarHBondContact O-N 3.26Å
350	Q	32.7	Very low	33.4	Very low	129 Å²	129	110.6 Å²	110.6	60%	0.603	57%	0.573	S	S	*	*	H	α-helix	trans	-70.6	-36	175.6	-87.9	-178.8	-13.3	0	0	113.8	S346 G347 N353 K354	S346-Q350 PolarHBondContact O-N 3.08Å; S346-Q350 VanDerWaalsContact O-N 3.13Å; G347-Q350 PolarHBondContact O-N 3.23Å; Q350-N353 PolarHBondContact O-N 3.06Å; Q350-K354 WeakPolarHBondContact O-CG 3.33Å; Q350-K354 PolarHBondContact O-N 2.9Å; Q350-K354 VanDerWaalsContact O-N 3.08Å
351	I	34	Very low	33.5	Very low	98 Å²	98	110.2 Å²	110.2	50%	0.503	58%	0.58	S	S	.	*	H	α-helix	trans	-67.1	-41	176.7	-68	164	0	0	0	110.5	G347 L348 N353 K354 N355	G347-I351 VanDerWaalsContact O-CG1 3.3Å; G347-I351 WeakPolarHBondContact O-CG1 3.13Å; G347-I351 PolarHBondContact O-N 3.49Å; L348-I351 PolarHBondContact O-N 2.95Å; I351-N353 VanDerWaalsContact C-N 3.31Å; I351-N353 PolarHBondContact O-N 2.85Å; I351-K354 PolarHBondContact O-N 2.86Å; I351-N355 PolarHBondContact O-N 2.88Å; I351-N355 VanDerWaalsContact O-N 3.09Å
352	N	33.3	Very low	33	Very low	102 Å²	102	115.5 Å²	115.5	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-65.4	-34.5	176.9	-155.8	33.8	0	0	0	112.5	L348 S356	L348-N352 WeakPolarHBondContact O-CB 3.41Å; L348-N352 PolarHBondContact O-N 2.85Å; L348-N352 VanDerWaalsContact O-N 3.1Å; N352-S356 PolarHBondContact O-OG 2.85Å
353	N	35.3	Very low	32.9	Very low	106 Å²	106	123.5 Å²	123.5	57%	0.567	63%	0.632	S	S	*	*	H	α-helix	trans	-73.7	-27.3	174.6	-85.9	-23.9	0	0	0	114	I349 Q350 I351	I349-N353 PolarHBondContact O-N 3.26Å; Q350-N353 PolarHBondContact O-N 3.06Å; I351-N353 VanDerWaalsContact C-N 3.31Å; I351-N353 PolarHBondContact O-N 2.85Å
354	K	34.4	Very low	32.6	Very low	150 Å²	150	124.4 Å²	124.4	65%	0.652	65%	0.646	S	S	*	*	H	α-helix	trans	-78.4	-36.8	175.7	-77	-179.5	180	178.2	0	112.7	Q350 I351 S356 R357	Q350-K354 WeakPolarHBondContact O-CG 3.33Å; Q350-K354 PolarHBondContact O-N 2.9Å; Q350-K354 VanDerWaalsContact O-N 3.08Å; I351-K354 PolarHBondContact O-N 2.86Å; K354-S356 PolarHBondContact O-N 2.91Å; K354-R357 PolarHBondContact O-N 3.11Å
355	N	33.6	Very low	32.2	Very low	120 Å²	120	123.9 Å²	123.9	64%	0.642	65%	0.653	S	S	*	*	H	α-helix	trans	-68.7	-17.6	177.2	-76.1	-7.4	0	0	0	113.5	I351 R357	I351-N355 PolarHBondContact O-N 2.88Å; I351-N355 VanDerWaalsContact O-N 3.09Å; N355-R357 VanDerWaalsContact C-N 3.33Å; N355-R357 PolarHBondContact O-N 3.19Å
356	S	37.1	Very low	32.5	Very low	96 Å²	96	124.8 Å²	124.8	67%	0.671	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-2.7	176.5	-66.7	0	0	0	0	114.8	N352 K354	N352-S356 PolarHBondContact O-OG 2.85Å; K354-S356 PolarHBondContact O-N 2.91Å
357	R	34.8	Very low	32.3	Very low	218 Å²	218	129.3 Å²	129.3	82%	0.823	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-0.5	-173.9	-72.2	-171.3	178.4	177.1	0.1	116.4	K354 N355	K354-R357 PolarHBondContact O-N 3.11Å; N355-R357 VanDerWaalsContact C-N 3.33Å; N355-R357 PolarHBondContact O-N 3.19Å
358	H	35.1	Very low	32.1	Very low	174 Å²	174	134.1 Å²	134.1	81%	0.806	71%	0.709	S	S	*	*	S	Bend	trans	-123.2	24.7	-171.6	-89.6	-68.6	0	0	0	117.1
359	I	31.3	Very low	31.9	Very low	162 Å²	162	135.8 Å²	135.8	83%	0.831	72%	0.724	S	S	*	*			trans	-126.8	101.5	172	-52.6	-176.8	0	0	0	110.2
360	L	26.2	Very low	31.9	Very low	168 Å²	168	140.4 Å²	140.4	88%	0.88	74%	0.736	S	S	*	*			trans	-83.3	159.1	162.8	-86.7	169.1	0	0	0	110.2
361	P	36.8	Very low	31.8	Very low	107 Å²	107	138.6 Å²	138.6	70%	0.695	74%	0.735	S	S	*	*			trans	-100.6	142	-143.6	36.4	-32.3	0	0	0	113.1
362	N	24.5	Very low	31.5	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	74%	0.736	S	S	*	*			trans	-150.6	116.7	144.1	-121.5	-20.5	0	0	0	113.5
363	R	31.3	Very low	31.3	Very low	237 Å²	237	135.3 Å²	135.3	89%	0.894	74%	0.737	S	S	*	*			trans	6.7	115.7	162.6	-76.7	174.3	162.8	163	-4.8	119.2
364	A	29.6	Very low	31.1	Very low	94 Å²	94	136.4 Å²	136.4	78%	0.777	74%	0.738	S	S	*	*				154.8	112	94.5	0	0	0	0	0	111
365	S	24.5	Very low	30.9	Very low	113 Å²	113	135 Å²	135	79%	0.79	74%	0.738	S	S	*	*			trans	143.6	127.2	153.1	57.8	0	0	0	0	109.8
366	A	38.1	Very low	30.7	Very low	96 Å²	96	135.3 Å²	135.3	79%	0.793	73%	0.733	S	S	*	*			trans	-91.5	117.4	-177.4	0	0	0	0	0	109.4
367	Q	28.1	Very low	30.5	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	73%	0.728	S	S	*	*			trans	-150.7	110.8	162	-103.6	116	12.8	0	0	111.8
368	T	27.8	Very low	30.3	Very low	127 Å²	127	128.9 Å²	128.9	78%	0.779	71%	0.708	S	S	*	*			trans	44	92.7	137.7	54.8	0	0	0	0	119.1	R370	T368-R370 PolarHBondContact O-N 3.02Å
369	T	28.6	Very low	30	Very low	145 Å²	145	123.9 Å²	123.9	89%	0.89	69%	0.689	S	S	*	*			trans	-76.1	110.4	156.2	44.4	0	0	0	0	110
370	R	32.9	Very low	29.9	Very low	183 Å²	183	119.1 Å²	119.1	69%	0.691	67%	0.665	S	S	*	*			trans	-71.8	137.2	168.9	-67.9	-176.2	179.5	174.6	-0.2	109.9	D125 T368	D125-R370 IonicContact OD2-NH2 3.67Å; T368-R370 PolarHBondContact O-N 3.02Å
371	P	31.2	Very low	30.2	Very low	90 Å²	90	116.2 Å²	116.2	58%	0.584	65%	0.649	S	S	*	*			trans	-69.7	136.8	-178.7	25.2	-30.1	0	0	0	111.9	A373 E374	P371-A373 PolarHBondContact O-N 3.3Å; P371-E374 PolarHBondContact O-N 3.46Å
372	A	27.3	Very low	29.9	Very low	63 Å²	63	118.1 Å²	118.1	52%	0.521	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.8	4.1	-173.5	0	0	0	0	0	116.5
373	A	29.3	Very low	30.2	Very low	69 Å²	69	112.4 Å²	112.4	57%	0.57	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-35.2	176.6	0	0	0	0	0	112.8	P371 L375 K376	P371-A373 PolarHBondContact O-N 3.3Å; A373-L375 VanDerWaalsContact C-N 3.33Å; A373-L375 PolarHBondContact O-N 2.86Å; A373-K376 WeakPolarHBondContact O-CB 3.3Å; A373-K376 PolarHBondContact O-N 3.21Å; A373-K376 VanDerWaalsContact O-N 3.13Å
374	E	30.4	Very low	30.3	Very low	128 Å²	128	107 Å²	107	60%	0.598	61%	0.605	S	S	*	*	H	α-helix	trans	-70.4	-28.9	-178.4	-68.3	-176.4	147.8	0	0	113	P371 K376	P371-E374 PolarHBondContact O-N 3.46Å; E374-K376 VanDerWaalsContact C-N 3.31Å
375	L	29.8	Very low	30.6	Very low	121 Å²	121	105.3 Å²	105.3	63%	0.634	59%	0.587	S	S	*	*	H	α-helix	trans	-70.4	-25.4	172.8	-94.8	145	0	0	0	112.6	A373 S378 V379	A373-L375 VanDerWaalsContact C-N 3.33Å; A373-L375 PolarHBondContact O-N 2.86Å; L375-S378 PolarHBondContact O-OG 3.08Å; L375-V379 WeakPolarHBondContact O-CB 3.26Å; L375-V379 WeakPolarHBondContact O-CG2 3.47Å; L375-V379 PolarHBondContact O-N 3.46Å
376	K	30.3	Very low	30.9	Very low	126 Å²	126	104.1 Å²	104.1	55%	0.548	57%	0.571	S	S	.	*	H	α-helix	trans	-72.4	-38.8	179.5	-67.2	177.4	-177.8	-178.8	0	112	A373 E374 L380	A373-K376 WeakPolarHBondContact O-CB 3.3Å; A373-K376 PolarHBondContact O-N 3.21Å; A373-K376 VanDerWaalsContact O-N 3.13Å; E374-K376 VanDerWaalsContact C-N 3.31Å; K376-L380 WeakPolarHBondContact O-CB 3.34Å; K376-L380 PolarHBondContact O-N 2.62Å
377	H	33.2	Very low	30.7	Very low	124 Å²	124	102.6 Å²	102.6	57%	0.574	55%	0.554	S	S	*	*	H	α-helix	trans	-76.5	-38.6	-173.6	-157.5	-131.2	0	0	0	113.1	V379 L380 I381	H377-V379 VanDerWaalsContact C-N 3.34Å; H377-V379 PolarHBondContact O-N 2.88Å; H377-L380 PolarHBondContact O-N 3.35Å; H377-I381 PolarHBondContact O-N 2.96Å
378	S	30	Very low	30.9	Very low	56 Å²	56	99.3 Å²	99.3	39%	0.392	55%	0.548	S	S	.	.	H	α-helix	trans	-68.1	-33.2	174.4	65.9	0	0	0	0	112.6	L375 K382	L375-S378 PolarHBondContact O-OG 3.08Å; S378-K382 WeakPolarHBondContact O-CB 3.23Å; S378-K382 VanDerWaalsContact O-CG 3.28Å; S378-K382 WeakPolarHBondContact O-CG 3.2Å; S378-K382 PolarHBondContact O-N 3.23Å
379	V	29	Very low	31.2	Very low	68 Å²	68	95.8 Å²	95.8	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-73.4	-36.5	175.4	172.8	0	0	0	0	111.3	L375 H377 K382 A383	L375-V379 WeakPolarHBondContact O-CB 3.26Å; L375-V379 WeakPolarHBondContact O-CG2 3.47Å; L375-V379 PolarHBondContact O-N 3.46Å; H377-V379 VanDerWaalsContact C-N 3.34Å; H377-V379 PolarHBondContact O-N 2.88Å; V379-K382 PolarHBondContact O-N 3.07Å; V379-A383 WeakPolarHBondContact O-CB 3.32Å; V379-A383 PolarHBondContact O-N 2.89Å
380	L	28.6	Very low	31.1	Very low	62 Å²	62	94 Å²	94	33%	0.325	51%	0.511	S	S	.	.	H	α-helix	trans	-66.1	-39.7	177	-109.1	135.3	0	0	0	113.2	K376 H377 A383 K384	K376-L380 WeakPolarHBondContact O-CB 3.34Å; K376-L380 PolarHBondContact O-N 2.62Å; H377-L380 PolarHBondContact O-N 3.35Å; L380-A383 PolarHBondContact O-N 2.96Å; L380-K384 WeakPolarHBondContact O-CB 3.4Å; L380-K384 WeakPolarHBondContact O-CG 3.46Å; L380-K384 PolarHBondContact O-N 2.93Å
381	I	32.9	Very low	31.2	Very low	107 Å²	107	92.5 Å²	92.5	55%	0.549	52%	0.516	S	S	.	.	H	α-helix	trans	-69.1	-40.2	175.8	-67.5	164.8	0	0	0	110.5	H377 S385	H377-I381 PolarHBondContact O-N 2.96Å; I381-S385 PolarHBondContact O-N 3.38Å; I381-S385 VanDerWaalsContact O-N 3.16Å
382	K	30.6	Very low	31	Very low	148 Å²	148	95.5 Å²	95.5	64%	0.643	52%	0.516	S	S	*	.	H	α-helix	trans	-69.9	-34.2	174.5	-72.4	178.8	178.3	-175.1	0	112.9	S378 V379 S385 L386	S378-K382 WeakPolarHBondContact O-CB 3.23Å; S378-K382 VanDerWaalsContact O-CG 3.28Å; S378-K382 WeakPolarHBondContact O-CG 3.2Å; S378-K382 PolarHBondContact O-N 3.23Å; V379-K382 PolarHBondContact O-N 3.07Å; K382-S385 WeakPolarHBondContact O-CB 3.22Å; K382-S385 PolarHBondContact O-N 3.08Å; K382-L386 PolarHBondContact O-N 3.5Å
383	A	29.9	Very low	30.8	Very low	38 Å²	38	101.9 Å²	101.9	31%	0.314	53%	0.533	S	S	.	.	H	α-helix	trans	-74.3	-36.1	178.6	0	0	0	0	0	112.5	V379 L380 S385 L386 C387	V379-A383 WeakPolarHBondContact O-CB 3.32Å; V379-A383 PolarHBondContact O-N 2.89Å; L380-A383 PolarHBondContact O-N 2.96Å; A383-S385 VanDerWaalsContact C-N 3.34Å; A383-L386 PolarHBondContact O-N 2.97Å; A383-C387 PolarHBondContact O-N 3.17Å
384	K	33.9	Very low	30.8	Very low	124 Å²	124	106.1 Å²	106.1	54%	0.539	55%	0.546	S	S	.	.	H	α-helix	trans	-66.4	-37.2	170.5	-76.7	-178.5	176.5	-174.5	0	111.7	L380 L386 C387	L380-K384 WeakPolarHBondContact O-CB 3.4Å; L380-K384 WeakPolarHBondContact O-CG 3.46Å; L380-K384 PolarHBondContact O-N 2.93Å; K384-L386 VanDerWaalsContact C-N 3.29Å; K384-L386 PolarHBondContact O-N 2.82Å; K384-C387 PolarHBondContact O-N 3.07Å
385	S	35.4	Very low	30.9	Very low	57 Å²	57	104.1 Å²	104.1	40%	0.399	54%	0.538	S	S	.	.	H	α-helix	trans	-63.2	-33.3	170.1	-172.1	0	0	0	0	112.6	I381 K382 A383 V389	I381-S385 PolarHBondContact O-N 3.38Å; I381-S385 VanDerWaalsContact O-N 3.16Å; K382-S385 WeakPolarHBondContact O-CB 3.22Å; K382-S385 PolarHBondContact O-N 3.08Å; A383-S385 VanDerWaalsContact C-N 3.34Å; S385-V389 WeakPolarHBondContact O-CB 3.32Å; S385-V389 WeakPolarHBondContact O-CG2 3.39Å
386	L	31.5	Very low	30.9	Very low	88 Å²	88	106.5 Å²	106.5	46%	0.461	55%	0.547	S	S	.	.	H	α-helix	trans	-80.3	-27.1	177.8	-84.2	158.6	0	0	0	113.8	K382 A383 K384 C388 V389 L390	K382-L386 PolarHBondContact O-N 3.5Å; A383-L386 PolarHBondContact O-N 2.97Å; K384-L386 VanDerWaalsContact C-N 3.29Å; K384-L386 PolarHBondContact O-N 2.82Å; L386-C388 VanDerWaalsContact C-N 3.26Å; L386-C388 PolarHBondContact O-N 3.05Å; L386-V389 HydrophobicContact CD2-CG1 4.46Å; L386-V389 CarbonylContact O-C 3.58Å; L386-V389 PolarHBondContact O-N 3.38Å; L386-L390 HydrophobicContact CD2-CD1 3.98Å; L386-L390 HydrophobicContact CD2-CG 4.18Å; L386-L390 PolarHBondContact O-N 3.05Å
387	C	33	Very low	31	Very low	64 Å²	64	109.5 Å²	109.5	43%	0.432	56%	0.563	S	S	.	*	H	α-helix	trans	-69.2	-26.2	175.8	-163.1	0	0	0	0	112.4	A383 K384	A383-C387 PolarHBondContact O-N 3.17Å; K384-C387 PolarHBondContact O-N 3.07Å
388	C	33.4	Very low	30.9	Very low	98 Å²	98	113.2 Å²	113.2	66%	0.662	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-15.6	168.3	-66.4	0	0	0	0	113.2	L386	L386-C388 VanDerWaalsContact C-N 3.26Å; L386-C388 PolarHBondContact O-N 3.05Å
389	V	33	Very low	31	Very low	52 Å²	52	122.5 Å²	122.5	32%	0.315	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.8	-13.7	-174	169.6	0	0	0	0	113.3	S385 L386	S385-V389 WeakPolarHBondContact O-CB 3.32Å; S385-V389 WeakPolarHBondContact O-CG2 3.39Å; L386-V389 HydrophobicContact CD2-CG1 4.46Å; L386-V389 CarbonylContact O-C 3.58Å; L386-V389 PolarHBondContact O-N 3.38Å
390	L	28.4	Very low	31	Very low	109 Å²	109	124.3 Å²	124.3	57%	0.571	62%	0.622	S	S	*	*			trans	-119	82.9	-179.3	-67.1	177.8	0	0	0	112.4	L386 W392	L386-L390 HydrophobicContact CD2-CD1 3.98Å; L386-L390 HydrophobicContact CD2-CG 4.18Å; L386-L390 PolarHBondContact O-N 3.05Å; L390-W392 HydrophobicContact CB-CB 4.49Å; L390-W392 HydrophobicContact CD2-CB 4.43Å; L390-W392 PolarHBondContact O-N 3.28Å
391	N	34.1	Very low	30.9	Very low	150 Å²	150	129.7 Å²	129.7	80%	0.802	65%	0.65	S	S	*	*			trans	-75.7	43.9	160.3	-149	6.5	0	0	0	111.8
392	W	26.9	Very low	30.5	Very low	154 Å²	154	128.3 Å²	128.3	58%	0.583	66%	0.662	S	S	*	*			trans	-113.9	-12.2	-162	-170.2	-91.5	0	0	0	117.4	L390 V418	L390-W392 HydrophobicContact CB-CB 4.49Å; L390-W392 HydrophobicContact CD2-CB 4.43Å; L390-W392 PolarHBondContact O-N 3.28Å; W392-V418 HydrophobicContact CE3-CG1 3.72Å; W392-V418 HydrophobicContact CH2-CG1 4.02Å; W392-V418 HydrophobicContact CZ3-CB 4.29Å; W392-V418 HydrophobicContact CZ3-CG1 3.22Å
393	F	23.8	Very low	30.3	Very low	197 Å²	197	127 Å²	127	86%	0.864	67%	0.672	S	S	*	*			trans	-117.4	75	-176	-111.3	-89.5	0	0	0	113.4
394	N	28	Very low	30.2	Very low	157 Å²	157	130.5 Å²	130.5	84%	0.84	69%	0.694	S	S	*	*			trans	-147.2	49.8	170.1	-127.8	-16.9	0	0	0	114
395	L	34	Very low	29.9	Very low	86 Å²	86	129.1 Å²	129.1	45%	0.45	71%	0.706	S	S	.	*			trans	-151.4	91.2	165	-97.2	115.1	0	0	0	109.2	R417	L395-R417 HydrophobicContact CD1-CG 4.12Å; L395-R417 HydrophobicContact CD2-CG 4.42Å
396	E	29.9	Very low	29.5	Very low	172 Å²	172	130 Å²	130	80%	0.804	72%	0.723	S	S	*	*	S	Bend	trans	-174.7	27.7	146.3	-134.7	71.3	-117.5	0	0	115.1
397	Q	30.8	Very low	29.3	Very low	189 Å²	189	133 Å²	133	88%	0.883	74%	0.74	S	S	*	*			trans	-149.4	50.7	178.7	-148.6	175.5	65.2	0	0	117
398	E	31.6	Very low	29.1	Very low	201 Å²	201	135.8 Å²	135.8	94%	0.939	76%	0.755	S	S	*	*			trans	-141.4	68.3	152.8	-76.6	-156.6	173.7	0	0	110.8
399	R	31.7	Very low	28.9	Very low	252 Å²	252	141.1 Å²	141.1	95%	0.951	76%	0.762	S	S	*	*			trans	-136.7	70.3	158.7	-153.5	178.9	-175.2	-173.5	1	110.3
400	S	29.9	Very low	28.6	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	79%	0.789	S	S	*	*	S	Bend	trans	-159.6	128.1	153.6	-174.2	0	0	0	0	107.9
401	L	25.6	Very low	28.6	Very low	175 Å²	175	147.1 Å²	147.1	92%	0.916	79%	0.793	S	S	*	*	S	Bend	trans	96.2	74.6	178.3	-49.6	171.8	0	0	0	116.8
402	G	25.5	Very low	28.3	Very low	78 Å²	78	145.4 Å²	145.4	80%	0.804	79%	0.789	S	S	*	*				82.8	90.1	111.1	0	0	0	0	0	121.1
403	S	25.9	Very low	28.5	Very low	120 Å²	120	144.3 Å²	144.3	84%	0.839	80%	0.801	S	S	*	*				55.8	123	123.8	-144.4	0	0	0	0	123.7
404	S	27.6	Very low	28.9	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	80%	0.795	S	S	*	*			trans	79.4	106.1	137.3	-156.8	0	0	0	0	121.1
405	A	27.1	Very low	29.3	Very low	95 Å²	95	140 Å²	140	79%	0.785	79%	0.792	S	S	*	*				163	142.4	102.8	0	0	0	0	0	111.7
406	G	27.6	Very low	29.4	Very low	74 Å²	74	144.5 Å²	144.5	76%	0.763	81%	0.808	S	S	*	*			trans	-44.6	161.8	-167.9	0	0	0	0	0	118.2
407	N	27.5	Very low	30	Very low	151 Å²	151	143.9 Å²	143.9	81%	0.807	80%	0.799	S	S	*	*				-173.7	149	60.4	-137.5	17.6	0	0	0	112.3
408	T	29.1	Very low	30.7	Very low	124 Å²	124	137.5 Å²	137.5	76%	0.761	77%	0.772	S	S	*	*			trans	47.8	101.9	152.7	52.7	0	0	0	0	121.8
409	R	29.1	Very low	31.4	Very low	210 Å²	210	135.5 Å²	135.5	79%	0.792	76%	0.76	S	S	*	*			trans	-34.2	132.4	162.5	-70.2	164.7	159.9	147.9	1.1	118	E411	R409-E411 HydrophobicContact CB-CG 4.26Å; R409-E411 WeakPolarHBondContact CD-OE1 3.22Å; R409-E411 HydrophobicContact CG-CG 4.06Å; R409-E411 IonicContact CZ-OE1 3.51Å; R409-E411 IonicContact NE-OE1 2.75Å; R409-E411 PolarHBondContact NE-OE1 3.32Å; R409-E411 IonicContact NH2-OE1 3.6Å
410	T	27.6	Very low	32.2	Very low	144 Å²	144	130 Å²	130	88%	0.883	75%	0.75	S	S	*	*				-123.9	110.4	127.5	35.3	0	0	0	0	106.7	T412	T410-T412 PolarHBondContact O-N 2.87Å
411	E	28.4	Very low	33.4	Very low	142 Å²	142	127.2 Å²	127.2	66%	0.664	73%	0.725	S	S	*	*			trans	-82.5	106.3	-174.3	-67.5	-176	171	0	0	110	R409	R409-E411 HydrophobicContact CB-CG 4.26Å; R409-E411 WeakPolarHBondContact CD-OE1 3.22Å; R409-E411 HydrophobicContact CG-CG 4.06Å; R409-E411 IonicContact CZ-OE1 3.51Å; R409-E411 IonicContact NE-OE1 2.75Å; R409-E411 PolarHBondContact NE-OE1 3.32Å; R409-E411 IonicContact NH2-OE1 3.6Å
412	T	27.5	Very low	35.7	Very low	115 Å²	115	121.6 Å²	121.6	71%	0.706	70%	0.7	S	S	*	*			trans	-70.9	141.1	154.3	47.1	0	0	0	0	108.9	T410 I414	T410-T412 PolarHBondContact O-N 2.87Å; T412-I414 PolarHBondContact O-N 2.94Å
413	P	30	Very low	37.4	Very low	131 Å²	131	122.8 Å²	122.8	85%	0.851	69%	0.694	S	S	*	*			trans	-63.3	115.4	-177.5	-14.6	27.6	0	0	0	110.5
414	I	32.2	Very low	39.4	Very low	144 Å²	144	124.4 Å²	124.4	74%	0.738	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-69.6	134	172.5	-61	166.4	0	0	0	107.8	T412 K416	T412-I414 PolarHBondContact O-N 2.94Å; I414-K416 PolarHBondContact O-N 3.25Å
415	P	36.7	Very low	41.2	Very low	120 Å²	120	122 Å²	122	78%	0.779	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-58.8	123.7	172.8	-19	30.2	0	0	0	110
416	K	36.1	Very low	42.9	Very low	180 Å²	180	120.7 Å²	120.7	78%	0.783	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-61.1	135.7	-178.5	-66.2	-178.4	-179.5	178.3	0	110.4	I414 Q421	I414-K416 PolarHBondContact O-N 3.25Å; K416-Q421 PolarHBondContact O-NE2 3.19Å
417	R	42.1	Very low	44.3	Very low	159 Å²	159	122 Å²	122	60%	0.6	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-52.5	136.3	176.3	-72.6	178.3	173.2	-176	-7.1	110.5	L395 K419 D420	L395-R417 HydrophobicContact CD1-CG 4.12Å; L395-R417 HydrophobicContact CD2-CG 4.42Å; R417-K419 PolarHBondContact O-N 3.02Å; R417-K419 VanDerWaalsContact O-N 3.08Å; R417-D420 PolarHBondContact O-N 3.36Å
418	V	45.6	Very low	46.2	Very low	54 Å²	54	120.9 Å²	120.9	33%	0.327	62%	0.618	S	S	.	*	G	3₁₀ helix	trans	-58.8	-23.1	178.5	-173.4	0	0	0	0	112.7	W392 D420	W392-V418 HydrophobicContact CE3-CG1 3.72Å; W392-V418 HydrophobicContact CH2-CG1 4.02Å; W392-V418 HydrophobicContact CZ3-CB 4.29Å; W392-V418 HydrophobicContact CZ3-CG1 3.22Å; V418-D420 PolarHBondContact O-N 3.02Å
419	K	46.4	Very low	47.8	Very low	160 Å²	160	118 Å²	118	70%	0.696	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-71.4	-10.2	177	-69.2	-177.4	178.7	174.9	0	114.6	R417	R417-K419 PolarHBondContact O-N 3.02Å; R417-K419 VanDerWaalsContact O-N 3.08Å
420	D	49.4	Very low	49.3	Very low	135 Å²	135	110.6 Å²	110.6	72%	0.722	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-115.9	7.8	-178.9	-67.1	-38.2	0	0	0	113.6	R417 V418	R417-D420 PolarHBondContact O-N 3.36Å; V418-D420 PolarHBondContact O-N 3.02Å
421	Q	55.1	Low	51.1	Low	47 Å²	47	109.7 Å²	109.7	22%	0.22	56%	0.557	C	S	.	*			trans	-87.4	133.6	-179.1	-66.5	179	8.6	0	0	110.5	K416	K416-Q421 PolarHBondContact O-NE2 3.19Å
422	S	72.4	Confident	52.8	Low	57 Å²	57	108.4 Å²	108.4	40%	0.399	55%	0.551	S	S	.	*			trans	-62.3	149.8	174	63.1	0	0	0	0	109.8	E424 E425 L426	S422-E424 PolarHBondContact O-N 2.7Å; S422-E424 VanDerWaalsContact O-N 3.09Å; S422-E425 PolarHBondContact O-N 3.35Å; S422-E425 PolarHBondContact OG-N 2.84Å; S422-L426 PolarHBondContact O-N 3.48Å
423	P	62.2	Low	54.5	Low	103 Å²	103	106.7 Å²	106.7	67%	0.669	54%	0.535	S	S	*	.	H	α-helix	trans	-52	-32.8	175.3	-27.9	35.3	0	0	0	113.2	L427	P423-L427 WeakPolarHBondContact O-CB 3.26Å; P423-L427 VanDerWaalsContact O-CG 3.25Å; P423-L427 WeakPolarHBondContact O-CG 3.2Å; P423-L427 PolarHBondContact O-N 3.05Å
424	E	67.1	Low	56.5	Low	155 Å²	155	106.1 Å²	106.1	72%	0.724	52%	0.516	S	S	*	.	H	α-helix	trans	-66.2	-40	177	-63	173.9	178.6	0	0	112.9	S422 L427 R428	S422-E424 PolarHBondContact O-N 2.7Å; S422-E424 VanDerWaalsContact O-N 3.09Å; E424-L427 PolarHBondContact O-N 3.35Å; E424-R428 PolarHBondContact O-N 3.1Å
425	E	66.6	Low	58.6	Low	63 Å²	63	100.5 Å²	100.5	29%	0.294	49%	0.488	S	S	.	.	H	α-helix	trans	-71.1	-38.2	180	-166.8	71.8	-174.3	0	0	111.2	S422 R428 Q429	S422-E425 PolarHBondContact O-N 3.35Å; S422-E425 PolarHBondContact OG-N 2.84Å; E425-R428 PolarHBondContact O-N 3.13Å; E425-R428 IonicContact OE1-CZ 3.91Å; E425-R428 VanDerWaalsContact OE1-CZ 3.32Å; E425-R428 IonicContact OE1-NH1 2.99Å; E425-R428 PolarHBondContact OE1-NH1 3.05Å; E425-R428 IonicContact OE1-NH2 3.14Å; E425-R428 PolarHBondContact OE1-NH2 3.5Å; E425-R428 IonicContact OE2-CZ 2.78Å; E425-R428 IonicContact OE2-NH1 2.6Å; E425-R428 PolarHBondContact OE2-NH1 3.39Å; E425-R428 IonicContact OE2-NH2 3.75Å; E425-Q429 WeakPolarHBondContact O-CG 3.5Å; E425-Q429 PolarHBondContact O-N 3.41Å
426	L	61.4	Low	60.7	Low	67 Å²	67	94.8 Å²	94.8	35%	0.351	45%	0.451	S	S	.	.	H	α-helix	trans	-65.8	-42.8	174.6	-178.4	63.1	0	0	0	111.4	S422 R428 Q429 L430	S422-L426 PolarHBondContact O-N 3.48Å; L426-R428 VanDerWaalsContact C-N 3.3Å; L426-R428 PolarHBondContact O-N 3.41Å; L426-Q429 PolarHBondContact O-N 3.17Å; L426-L430 HydrophobicContact CD1-CD1 4.44Å; L426-L430 HydrophobicContact CD1-CG 4.46Å; L426-L430 HydrophobicContact CG-CD1 4.14Å; L426-L430 WeakPolarHBondContact O-CB 3.43Å; L426-L430 VanDerWaalsContact O-CG 3.29Å; L426-L430 WeakPolarHBondContact O-CG 3Å; L426-L430 PolarHBondContact O-N 3.12Å
427	L	58.8	Low	62.9	Low	100 Å²	100	89.8 Å²	89.8	52%	0.524	43%	0.43	S	S	.	.	H	α-helix	trans	-60.9	-41.3	174.2	-75.6	170.4	0	0	0	111.4	P423 E424 L430 Q431	P423-L427 WeakPolarHBondContact O-CB 3.26Å; P423-L427 VanDerWaalsContact O-CG 3.25Å; P423-L427 WeakPolarHBondContact O-CG 3.2Å; P423-L427 PolarHBondContact O-N 3.05Å; E424-L427 PolarHBondContact O-N 3.35Å; L427-L430 PolarHBondContact O-N 2.84Å; L427-Q431 WeakPolarHBondContact O-CB 3.26Å; L427-Q431 VanDerWaalsContact O-CG 3.25Å; L427-Q431 WeakPolarHBondContact O-CG 3.22Å; L427-Q431 PolarHBondContact O-N 3.39Å
428	R	66.3	Low	64.9	Low	129 Å²	129	85.7 Å²	85.7	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.9	-160.4	-179.5	82.1	-136.2	-7.1	112	E424 E425 L426 Q431 E432	E424-R428 PolarHBondContact O-N 3.1Å; E425-R428 PolarHBondContact O-N 3.13Å; E425-R428 IonicContact OE1-CZ 3.91Å; E425-R428 VanDerWaalsContact OE1-CZ 3.32Å; E425-R428 IonicContact OE1-NH1 2.99Å; E425-R428 PolarHBondContact OE1-NH1 3.05Å; E425-R428 IonicContact OE1-NH2 3.14Å; E425-R428 PolarHBondContact OE1-NH2 3.5Å; E425-R428 IonicContact OE2-CZ 2.78Å; E425-R428 IonicContact OE2-NH1 2.6Å; E425-R428 PolarHBondContact OE2-NH1 3.39Å; E425-R428 IonicContact OE2-NH2 3.75Å; L426-R428 VanDerWaalsContact C-N 3.3Å; L426-R428 PolarHBondContact O-N 3.41Å; R428-Q431 PolarHBondContact O-N 3.27Å; R428-E432 WeakPolarHBondContact O-CB 3.07Å; R428-E432 PolarHBondContact O-N 3.27Å
429	Q	63	Low	66.5	Low	63 Å²	63	85.5 Å²	85.5	29%	0.294	42%	0.423	S	S	.	.	H	α-helix	trans	-63.8	-46.1	176.1	-75.1	175.1	1.2	0	0	112	E425 L426 Q431 E432 E433	E425-Q429 WeakPolarHBondContact O-CG 3.5Å; E425-Q429 PolarHBondContact O-N 3.41Å; L426-Q429 PolarHBondContact O-N 3.17Å; Q429-Q431 VanDerWaalsContact C-N 3.3Å; Q429-Q431 PolarHBondContact O-N 2.91Å; Q429-E432 PolarHBondContact O-N 2.88Å; Q429-E433 WeakPolarHBondContact O-CB 3.4Å; Q429-E433 WeakPolarHBondContact O-CG 3.39Å; Q429-E433 PolarHBondContact O-N 2.87Å
430	L	61.3	Low	68.1	Low	54 Å²	54	84 Å²	84	28%	0.283	42%	0.42	S	S	.	.	H	α-helix	trans	-63.8	-36.4	177.8	-70.2	171.6	0	0	0	112.2	L426 L427 R434	L426-L430 HydrophobicContact CD1-CD1 4.44Å; L426-L430 HydrophobicContact CD1-CG 4.46Å; L426-L430 HydrophobicContact CG-CD1 4.14Å; L426-L430 WeakPolarHBondContact O-CB 3.43Å; L426-L430 VanDerWaalsContact O-CG 3.29Å; L426-L430 WeakPolarHBondContact O-CG 3Å; L426-L430 PolarHBondContact O-N 3.12Å; L427-L430 PolarHBondContact O-N 2.84Å; L430-R434 WeakPolarHBondContact O-CD 3.34Å; L430-R434 WeakPolarHBondContact O-CG 3.47Å; L430-R434 PolarHBondContact O-N 3.11Å
431	Q	63.7	Low	69.5	Low	126 Å²	126	82.3 Å²	82.3	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-65.8	-49.5	172.4	-76.5	173.5	-17.1	0	0	110.6	L427 R428 Q429 E433 R434 T435	L427-Q431 WeakPolarHBondContact O-CB 3.26Å; L427-Q431 VanDerWaalsContact O-CG 3.25Å; L427-Q431 WeakPolarHBondContact O-CG 3.22Å; L427-Q431 PolarHBondContact O-N 3.39Å; R428-Q431 PolarHBondContact O-N 3.27Å; Q429-Q431 VanDerWaalsContact C-N 3.3Å; Q429-Q431 PolarHBondContact O-N 2.91Å; Q431-E433 VanDerWaalsContact C-N 3.35Å; Q431-E433 PolarHBondContact O-N 3.4Å; Q431-R434 CarbonylContact O-C 3.53Å; Q431-R434 PolarHBondContact O-N 3.01Å; Q431-T435 PolarHBondContact O-N 3.22Å; Q431-T435 PolarHBondContact O-OG1 2.9Å
432	E	65.7	Low	70.6	Confident	114 Å²	114	84.7 Å²	84.7	53%	0.533	42%	0.42	S	S	.	.	H	α-helix	trans	-57.6	-46	179.3	-173.3	176.2	175.7	0	0	111.6	R428 Q429 R434 T435 K437	R428-E432 WeakPolarHBondContact O-CB 3.07Å; R428-E432 PolarHBondContact O-N 3.27Å; Q429-E432 PolarHBondContact O-N 2.88Å; E432-R434 PolarHBondContact O-N 2.86Å; E432-T435 PolarHBondContact O-N 3.42Å; E432-T435 VanDerWaalsContact O-N 3.17Å; E432-K437 PolarHBondContact O-NZ 3.41Å
433	E	62.5	Low	70.8	Confident	80 Å²	80	87.1 Å²	87.1	37%	0.374	43%	0.428	S	S	.	.	H	α-helix	trans	-58.2	-33.3	176.1	-75.7	176.6	178.6	0	0	113.1	Q429 Q431	Q429-E433 WeakPolarHBondContact O-CB 3.4Å; Q429-E433 WeakPolarHBondContact O-CG 3.39Å; Q429-E433 PolarHBondContact O-N 2.87Å; Q431-E433 VanDerWaalsContact C-N 3.35Å; Q431-E433 PolarHBondContact O-N 3.4Å
434	R	72.4	Confident	71.5	Confident	118 Å²	118	82.5 Å²	82.5	45%	0.445	40%	0.398	S	S	.	.	H	α-helix	trans	-92.5	-2.2	-178.9	-64.3	173	-174.2	-153.1	-0.3	113.5	L430 Q431 E432 L443 V444	L430-R434 WeakPolarHBondContact O-CD 3.34Å; L430-R434 WeakPolarHBondContact O-CG 3.47Å; L430-R434 PolarHBondContact O-N 3.11Å; Q431-R434 CarbonylContact O-C 3.53Å; Q431-R434 PolarHBondContact O-N 3.01Å; E432-R434 PolarHBondContact O-N 2.86Å; R434-L443 HydrophobicContact CB-CD2 4.06Å; R434-L443 CarbonylContact O-C 3.53Å; R434-L443 VanDerWaalsContact O-CA 3.25Å; R434-L443 WeakPolarHBondContact O-CA 3.37Å; R434-L443 WeakPolarHBondContact O-CD2 3.22Å; R434-V444 PolarHBondContact O-N 3.03Å
435	T	75.9	Confident	71.8	Confident	27 Å²	27	76.4 Å²	76.4	17%	0.166	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-92.6	139.7	179.8	-62	0	0	0	0	111.6	Q431 E432 K437 M440	Q431-T435 PolarHBondContact O-N 3.22Å; Q431-T435 PolarHBondContact O-OG1 2.9Å; E432-T435 PolarHBondContact O-N 3.42Å; E432-T435 VanDerWaalsContact O-N 3.17Å; T435-K437 WeakPolarHBondContact O-CD 3.4Å; T435-K437 WeakPolarHBondContact O-CE 3.49Å; T435-K437 PolarHBondContact O-N 3.41Å; T435-M440 WeakPolarHBondContact CG2-O 3.24Å
436	C	81.3	Confident	72.2	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	36%	0.361	C	S	.	.			trans	-55.8	125.3	177.3	171.6	0	0	0	0	111.2	V438 C439 M440 K442 V456 C457	C436-V438 PolarHBondContact O-N 2.99Å; C436-V438 VanDerWaalsContact O-N 3.09Å; C436-V438 PolarHBondContact SG-N 3.32Å; C436-V438 VanDerWaalsContact SG-N 3.43Å; C436-C439 VanDerWaalsContact CB-SG 3.56Å; C436-M440 WeakPolarHBondContact O-CA 3.39Å; C436-M440 PolarHBondContact O-N 2.95Å; C436-K442 WeakPolarHBondContact CB-O 3.38Å; C436-K442 PolarHBondContact N-O 3.48Å; C436-V456 VanDerWaalsContact SG-CA 3.55Å; C436-C457 HydrophobicContact CB-CB 3.94Å; C436-C457 PolarHBondContact SG-N 2.7Å; C436-C457 VanDerWaalsContact SG-N 3.37Å
437	K	82.3	Confident	72.8	Confident	75 Å²	75	72.5 Å²	72.5	33%	0.326	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	5.1	-176.8	-52.2	-55.3	-178	178.1	0	115	E432 T435 M440 V455	E432-K437 PolarHBondContact O-NZ 3.41Å; T435-K437 WeakPolarHBondContact O-CD 3.4Å; T435-K437 WeakPolarHBondContact O-CE 3.49Å; T435-K437 PolarHBondContact O-N 3.41Å; K437-M440 HydrophobicContact CB-CE 4.49Å; K437-M440 HydrophobicContact CD-SD 4.43Å; K437-M440 WeakPolarHBondContact O-CE 3.48Å; K437-V455 HydrophobicContact CB-CG2 3.77Å; K437-V455 HydrophobicContact CG-CG2 3.51Å; K437-V455 PolarHBondContact N-O 3.21Å
438	V	82.5	Confident	73.3	Confident	72 Å²	72	67.7 Å²	67.7	44%	0.436	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-58.8	179.4	176.1	0	0	0	0	110.7	C436 V456 C460 L464 P468	C436-V438 PolarHBondContact O-N 2.99Å; C436-V438 VanDerWaalsContact O-N 3.09Å; C436-V438 PolarHBondContact SG-N 3.32Å; C436-V438 VanDerWaalsContact SG-N 3.43Å; V438-V456 HydrophobicContact CB-CG1 4.31Å; V438-V456 HydrophobicContact CG2-CG1 3.56Å; V438-C460 HydrophobicContact CB-CB 3.93Å; V438-C460 HydrophobicContact CG1-CB 4Å; V438-L464 HydrophobicContact CG2-CD1 4.09Å; V438-P468 HydrophobicContact CG2-CG 4.32Å
439	C	80	Confident	73.1	Confident	51 Å²	51	62.1 Å²	62.1	35%	0.345	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-17.4	176.2	59.9	0	0	0	0	113.3	C436 D441 C457 C460	C436-C439 VanDerWaalsContact CB-SG 3.56Å; C439-D441 HydrophobicContact CB-CB 4.27Å; C439-D441 PolarHBondContact O-N 3.3Å; C439-C457 VanDerWaalsContact SG-SG 3.69Å; C439-C460 VanDerWaalsContact CB-SG 3.54Å; C439-C460 VanDerWaalsContact SG-SG 3.69Å
440	M	79.3	Confident	72.6	Confident	128 Å²	128	61.1 Å²	61.1	63%	0.631	31%	0.309	S	S	*	.	S	Bend	trans	53.7	23	-174	-58.6	-63.1	-167.8	0	0	113.9	T435 C436 K437	T435-M440 WeakPolarHBondContact CG2-O 3.24Å; C436-M440 WeakPolarHBondContact O-CA 3.39Å; C436-M440 PolarHBondContact O-N 2.95Å; K437-M440 HydrophobicContact CB-CE 4.49Å; K437-M440 HydrophobicContact CD-SD 4.43Å; K437-M440 WeakPolarHBondContact O-CE 3.48Å
441	D	79.7	Confident	72.6	Confident	100 Å²	100	59.2 Å²	59.2	54%	0.535	30%	0.299	S	S	.	.	S	Bend	trans	-122.8	-66.5	-172.9	168.8	33.6	0	0	0	110.6	C439	C439-D441 HydrophobicContact CB-CB 4.27Å; C439-D441 PolarHBondContact O-N 3.3Å
442	K	79.1	Confident	72.5	Confident	97 Å²	97	55.5 Å²	55.5	42%	0.422	30%	0.295	S	S	.	.	S	Bend	trans	-79.6	154.9	-174.2	-57.5	-177.7	-169.9	-172.9	0	111.9	C436 C457 D459	C436-K442 WeakPolarHBondContact CB-O 3.38Å; C436-K442 PolarHBondContact N-O 3.48Å; K442-C457 HydrophobicContact CB-CB 3.55Å; K442-C457 HydrophobicContact CD-CB 4.48Å; K442-D459 VanDerWaalsContact CD-OD2 3.24Å; K442-D459 WeakPolarHBondContact CD-OD2 3.23Å; K442-D459 WeakPolarHBondContact CE-OD2 3.18Å; K442-D459 IonicContact NZ-OD2 3.58Å; K442-D459 PolarHBondContact NZ-OD2 3.32Å
443	L	74.8	Confident	72.7	Confident	107 Å²	107	52.5 Å²	52.5	56%	0.56	28%	0.281	S	S	*	.	B	Isolated β-bridge	trans	-63.2	145.9	173.4	-64.3	177.8	0	0	0	111.7	R434 S445 C457	R434-L443 HydrophobicContact CB-CD2 4.06Å; R434-L443 CarbonylContact O-C 3.53Å; R434-L443 VanDerWaalsContact O-CA 3.25Å; R434-L443 WeakPolarHBondContact O-CA 3.37Å; R434-L443 WeakPolarHBondContact O-CD2 3.22Å; L443-S445 PolarHBondContact O-N 3.06Å; L443-C457 WeakPolarHBondContact O-CA 3.43Å; L443-C457 VanDerWaalsContact O-CB 3.22Å; L443-C457 WeakPolarHBondContact O-CB 3.1Å
444	V	78.8	Confident	73.4	Confident	6 Å²	6	51.2 Å²	51.2	4%	0.036	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-59.9	130.6	168.1	-61.1	0	0	0	0	108.8	R434 L454 V455 V456 M482	R434-V444 PolarHBondContact O-N 3.03Å; V444-L454 HydrophobicContact CB-CD1 3.98Å; V444-L454 HydrophobicContact CB-CG 4.05Å; V444-L454 HydrophobicContact CG2-CD1 4.08Å; V444-L454 HydrophobicContact CG2-CD2 4.09Å; V444-L454 HydrophobicContact CG2-CG 3.76Å; V444-V455 WeakPolarHBondContact CG1-O 3.43Å; V444-V456 WeakPolarHBondContact CA-O 3.3Å; V444-M482 HydrophobicContact CG2-CE 3.81Å; V444-M482 HydrophobicContact CG2-SD 4.05Å; V444-M482 WeakPolarHBondContact O-CE 3.25Å
445	S	72.6	Confident	73.8	Confident	27 Å²	27	46 Å²	46	19%	0.189	26%	0.257	C	S	.	.			trans	-145.8	1.9	-176.6	71.8	0	0	0	0	112.5	L443 V456 G458 R479 A480	L443-S445 PolarHBondContact O-N 3.06Å; S445-V456 PolarHBondContact N-O 3.09Å; S445-G458 PolarHBondContact OG-N 2.66Å; S445-G458 VanDerWaalsContact OG-N 3.11Å; S445-R479 CarbonylContact O-C 3.57Å; S445-R479 VanDerWaalsContact O-CA 3.32Å; S445-R479 WeakPolarHBondContact O-CA 3.43Å; S445-A480 PolarHBondContact O-N 3.35Å
446	I	75.2	Confident	73.9	Confident	10 Å²	10	44.7 Å²	44.7	5%	0.051	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.4	-175.4	-60.2	-63.9	0	0	0	110.9	F448 L454 V456 A461 V478	I446-F448 HydrophobicContact CG2-CD1 4.14Å; I446-F448 HydrophobicContact CG2-CE1 4.07Å; I446-L454 WeakPolarHBondContact O-CA 3.48Å; I446-L454 VanDerWaalsContact O-CD1 3.28Å; I446-L454 WeakPolarHBondContact O-CD1 3.29Å; I446-V456 HydrophobicContact CB-CG2 4.2Å; I446-V456 PolarHBondContact N-O 3.37Å; I446-V456 VanDerWaalsContact N-O 3.08Å; I446-A461 HydrophobicContact CB-CB 4.04Å; I446-A461 HydrophobicContact CG1-CB 3.8Å; I446-A461 HydrophobicContact CG2-CB 3.75Å; I446-V478 WeakPolarHBondContact CA-O 3.27Å
447	V	74.3	Confident	73.9	Confident	38 Å²	38	44.8 Å²	44.8	23%	0.23	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.2	167.7	179.2	0	0	0	0	108.4	L454 S477 V478 A480	V447-L454 HydrophobicContact CG2-CB 4.22Å; V447-L454 HydrophobicContact CG2-CD1 4.18Å; V447-S477 WeakPolarHBondContact O-CA 3.24Å; V447-V478 PolarHBondContact N-O 3.3Å; V447-V478 PolarHBondContact O-N 3.08Å; V447-A480 HydrophobicContact CG2-CB 4.02Å
448	F	69.9	Low	73.5	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	141.3	175.3	-68.9	-48.3	0	0	0	112.7	I446 C451 G452 H453 V455 V456 A461 L464 C467 I474	I446-F448 HydrophobicContact CG2-CD1 4.14Å; I446-F448 HydrophobicContact CG2-CE1 4.07Å; F448-C451 PolarHBondContact O-N 3.36Å; F448-G452 WeakPolarHBondContact O-CA 3.33Å; F448-G452 PolarHBondContact O-N 3.09Å; F448-H453 PolarHBondContact N-O 2.58Å; F448-H453 VanDerWaalsContact N-O 3.17Å; F448-V455 HydrophobicContact CD2-CG1 4.17Å; F448-V455 HydrophobicContact CE2-CG1 3.91Å; F448-V456 HydrophobicContact CE1-CG2 4.1Å; F448-V456 HydrophobicContact CE2-CG1 4.49Å; F448-V456 HydrophobicContact CE2-CG2 3.76Å; F448-V456 HydrophobicContact CZ-CG2 3.33Å; F448-A461 HydrophobicContact CE1-CB 3.9Å; F448-A461 HydrophobicContact CZ-CB 4.26Å; F448-L464 HydrophobicContact CE2-CD1 4.17Å; F448-L464 HydrophobicContact CZ-CB 4.3Å; F448-L464 HydrophobicContact CZ-CD1 3.74Å; F448-C467 HydrophobicContact CD2-CB 4.37Å; F448-I474 HydrophobicContact CB-CG1 4.23Å; F448-I474 HydrophobicContact CB-CG2 4.37Å; F448-I474 HydrophobicContact CD1-CB 4.34Å; F448-I474 HydrophobicContact CD1-CD1 3.71Å; F448-I474 HydrophobicContact CD1-CG1 3.88Å; F448-I474 HydrophobicContact CD1-CG2 3.48Å; F448-I474 VanDerWaalsContact CD1-CG2 3.48Å; F448-I474 HydrophobicContact CD2-CD1 3.96Å; F448-I474 HydrophobicContact CD2-CG1 4.24Å; F448-I474 HydrophobicContact CE1-CD1 3.54Å; F448-I474 HydrophobicContact CE1-CG1 4.23Å; F448-I474 HydrophobicContact CE1-CG2 4.01Å; F448-I474 HydrophobicContact CE2-CD1 3.79Å; F448-I474 HydrophobicContact CG-CD1 3.91Å; F448-I474 HydrophobicContact CG-CG1 3.87Å; F448-I474 HydrophobicContact CG-CG2 4.15Å; F448-I474 HydrophobicContact CZ-CD1 3.55Å
449	I	61.5	Low	73.4	Confident	12 Å²	12	43.7 Å²	43.7	6%	0.062	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.6	174.3	-63.5	174.1	0	0	0	108.9	W200 F201 R475 G476 V478	W200-I449 HydrophobicContact CB-CD1 4.21Å; W200-I449 HydrophobicContact CD2-CD1 4.14Å; W200-I449 HydrophobicContact CD2-CG2 3.75Å; W200-I449 HydrophobicContact CE3-CD1 3.92Å; W200-I449 HydrophobicContact CE3-CG1 4.39Å; W200-I449 HydrophobicContact CE3-CG2 3.44Å; W200-I449 VanDerWaalsContact CE3-CG2 3.44Å; W200-I449 HydrophobicContact CG-CD1 4.28Å; W200-I449 HydrophobicContact CH2-CG2 3.35Å; W200-I449 HydrophobicContact CZ2-CG2 3.66Å; W200-I449 HydrophobicContact CZ3-CG2 3.25Å; F201-I449 HydrophobicContact CZ-CD1 4.47Å; I449-R475 PolarHBondContact O-N 3.35Å; I449-G476 PolarHBondContact N-O 3.09Å; I449-G476 PolarHBondContact O-N 2.99Å; I449-V478 HydrophobicContact CD1-CG2 3.68Å; I449-V478 HydrophobicContact CG1-CG2 4.1Å
450	P	52.9	Low	73.5	Confident	42 Å²	42	42.1 Å²	42.1	27%	0.273	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.1	-7.6	1.2	34.2	-35.1	0	0	0	114.3	W200 T286 G452	W200-P450 HydrophobicContact CH2-CB 4.3Å; T286-P450 HydrophobicContact CG2-CG 4.38Å; P450-G452 VanDerWaalsContact C-N 3.27Å; P450-G452 PolarHBondContact O-N 3.26Å; P450-G452 VanDerWaalsContact O-N 3.13Å
451	C	61.3	Low	73.6	Confident	13 Å²	13	36.1 Å²	36.1	9%	0.088	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-13.2	-163.9	72	0	0	0	0	116.2	L285 F448 H453 C470 A472	L285-C451 VanDerWaalsContact O-CA 3.3Å; L285-C451 WeakPolarHBondContact O-CA 3.37Å; F448-C451 PolarHBondContact O-N 3.36Å; C451-H453 PolarHBondContact O-N 3.31Å; C451-C470 VanDerWaalsContact CB-SG 3.54Å; C451-A472 HydrophobicContact CB-CB 4.01Å
452	G	60.3	Low	73.5	Confident	48 Å²	48	33.5 Å²	33.5	50%	0.495	20%	0.204	S	C	.	.			trans	72.3	5.8	175.3	0	0	0	0	0	116.1	F448 P450	F448-G452 WeakPolarHBondContact O-CA 3.33Å; F448-G452 PolarHBondContact O-N 3.09Å; P450-G452 VanDerWaalsContact C-N 3.27Å; P450-G452 PolarHBondContact O-N 3.26Å; P450-G452 VanDerWaalsContact O-N 3.13Å
453	H	71.2	Confident	73.5	Confident	51 Å²	51	34 Å²	34	24%	0.236	22%	0.221	C	C	.	.			trans	-76.7	126.9	-177.7	-72.7	108.3	0	0	0	111.9	F448 C451 C470	F448-H453 PolarHBondContact N-O 2.58Å; F448-H453 VanDerWaalsContact N-O 3.17Å; C451-H453 PolarHBondContact O-N 3.31Å; H453-C470 VanDerWaalsContact CE1-SG 3.58Å; H453-C470 PolarHBondContact ND1-SG 3.36Å
454	L	75.9	Confident	73.7	Confident	54 Å²	54	30.7 Å²	30.7	28%	0.283	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	94.7	172.8	177.6	60.4	0	0	0	109.4	V444 I446 V447 A480 M482	V444-L454 HydrophobicContact CB-CD1 3.98Å; V444-L454 HydrophobicContact CB-CG 4.05Å; V444-L454 HydrophobicContact CG2-CD1 4.08Å; V444-L454 HydrophobicContact CG2-CD2 4.09Å; V444-L454 HydrophobicContact CG2-CG 3.76Å; I446-L454 WeakPolarHBondContact O-CA 3.48Å; I446-L454 VanDerWaalsContact O-CD1 3.28Å; I446-L454 WeakPolarHBondContact O-CD1 3.29Å; V447-L454 HydrophobicContact CG2-CB 4.22Å; V447-L454 HydrophobicContact CG2-CD1 4.18Å; L454-A480 HydrophobicContact CD1-CB 4.18Å; L454-M482 HydrophobicContact CD2-SD 3.9Å
455	V	81.3	Confident	73.6	Confident	7 Å²	7	38.9 Å²	38.9	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	-15.6	-168.7	62	0	0	0	0	114.1	K437 V444 F448 P468 I469	K437-V455 HydrophobicContact CB-CG2 3.77Å; K437-V455 HydrophobicContact CG-CG2 3.51Å; K437-V455 PolarHBondContact N-O 3.21Å; V444-V455 WeakPolarHBondContact CG1-O 3.43Å; F448-V455 HydrophobicContact CD2-CG1 4.17Å; F448-V455 HydrophobicContact CE2-CG1 3.91Å; V455-P468 HydrophobicContact CG1-CG 4.35Å; V455-I469 HydrophobicContact CB-CD1 4.42Å; V455-I469 HydrophobicContact CB-CG1 3.95Å; V455-I469 HydrophobicContact CG1-CG1 4.15Å; V455-I469 HydrophobicContact CG2-CD1 3.64Å; V455-I469 HydrophobicContact CG2-CG1 3.69Å
456	V	78.1	Confident	73.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	160.9	-177.6	-60	0	0	0	0	113.8	C436 V438 V444 S445 I446 F448 C460 A461 L464 P468	C436-V456 VanDerWaalsContact SG-CA 3.55Å; V438-V456 HydrophobicContact CB-CG1 4.31Å; V438-V456 HydrophobicContact CG2-CG1 3.56Å; V444-V456 WeakPolarHBondContact CA-O 3.3Å; S445-V456 PolarHBondContact N-O 3.09Å; I446-V456 HydrophobicContact CB-CG2 4.2Å; I446-V456 PolarHBondContact N-O 3.37Å; I446-V456 VanDerWaalsContact N-O 3.08Å; F448-V456 HydrophobicContact CE1-CG2 4.1Å; F448-V456 HydrophobicContact CE2-CG1 4.49Å; F448-V456 HydrophobicContact CE2-CG2 3.76Å; F448-V456 HydrophobicContact CZ-CG2 3.33Å; V456-C460 HydrophobicContact CB-CB 4.13Å; V456-C460 HydrophobicContact CG1-CB 4.46Å; V456-A461 HydrophobicContact CG2-CB 3.78Å; V456-L464 HydrophobicContact CG1-CD1 3.76Å; V456-L464 HydrophobicContact CG2-CD1 4.38Å; V456-P468 HydrophobicContact CG1-CG 4.35Å
457	C	80.3	Confident	73.7	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.02	25%	0.245	C	C	.	.			trans	-78.1	169.6	168.9	69.3	0	0	0	0	111.5	C436 C439 K442 L443 D459 C460 A461	C436-C457 HydrophobicContact CB-CB 3.94Å; C436-C457 PolarHBondContact SG-N 2.7Å; C436-C457 VanDerWaalsContact SG-N 3.37Å; C439-C457 VanDerWaalsContact SG-SG 3.69Å; K442-C457 HydrophobicContact CB-CB 3.55Å; K442-C457 HydrophobicContact CD-CB 4.48Å; L443-C457 WeakPolarHBondContact O-CA 3.43Å; L443-C457 VanDerWaalsContact O-CB 3.22Å; L443-C457 WeakPolarHBondContact O-CB 3.1Å; C457-D459 VanDerWaalsContact C-N 3.3Å; C457-D459 PolarHBondContact O-N 2.75Å; C457-C460 PolarHBondContact O-N 3.42Å; C457-C460 PolarHBondContact SG-N 3.47Å; C457-A461 WeakPolarHBondContact O-CB 3.42Å; C457-A461 PolarHBondContact O-N 3.05Å; C457-A461 VanDerWaalsContact O-N 3.11Å
458	G	74.8	Confident	73.8	Confident	28 Å²	28	43.1 Å²	43.1	29%	0.289	25%	0.253	S	S	.	.	H	α-helix	trans	-52.1	-43.4	178.1	0	0	0	0	0	114.4	S445	S445-G458 PolarHBondContact OG-N 2.66Å; S445-G458 VanDerWaalsContact OG-N 3.11Å
459	D	81.2	Confident	74	Confident	95 Å²	95	47.9 Å²	47.9	51%	0.508	28%	0.277	S	S	.	.	H	α-helix	trans	-74.5	-44.6	-174	-50.1	-45.3	0	0	0	111.6	K442 C457 A461 A462	K442-D459 VanDerWaalsContact CD-OD2 3.24Å; K442-D459 WeakPolarHBondContact CD-OD2 3.23Å; K442-D459 WeakPolarHBondContact CE-OD2 3.18Å; K442-D459 IonicContact NZ-OD2 3.58Å; K442-D459 PolarHBondContact NZ-OD2 3.32Å; C457-D459 VanDerWaalsContact C-N 3.3Å; C457-D459 PolarHBondContact O-N 2.75Å; D459-A461 PolarHBondContact O-N 2.58Å; D459-A462 PolarHBondContact O-N 2.87Å
460	C	81.9	Confident	74	Confident	19 Å²	19	49 Å²	49	13%	0.128	29%	0.285	C	S	.	.	H	α-helix	trans	-66.5	-28	178	-69.6	0	0	0	0	112.5	V438 C439 V456 C457 A462 S463 L464	V438-C460 HydrophobicContact CB-CB 3.93Å; V438-C460 HydrophobicContact CG1-CB 4Å; C439-C460 VanDerWaalsContact CB-SG 3.54Å; C439-C460 VanDerWaalsContact SG-SG 3.69Å; V456-C460 HydrophobicContact CB-CB 4.13Å; V456-C460 HydrophobicContact CG1-CB 4.46Å; C457-C460 PolarHBondContact O-N 3.42Å; C457-C460 PolarHBondContact SG-N 3.47Å; C460-A462 PolarHBondContact O-N 2.98Å; C460-S463 PolarHBondContact O-N 3.46Å; C460-L464 WeakPolarHBondContact O-CG 3.47Å
461	A	81.6	Confident	75.1	Confident	2 Å²	2	57 Å²	57	2%	0.017	31%	0.31	C	S	.	.	H	α-helix	trans	-64.1	-27.9	177.3	0	0	0	0	0	113.4	R185 I446 F448 V456 C457 D459 S463	R185-A461 PolarHBondContact NH1-O 2.93Å; R185-A461 PolarHBondContact NH2-O 3.13Å; R185-A461 VanDerWaalsContact NH2-O 3.07Å; I446-A461 HydrophobicContact CB-CB 4.04Å; I446-A461 HydrophobicContact CG1-CB 3.8Å; I446-A461 HydrophobicContact CG2-CB 3.75Å; F448-A461 HydrophobicContact CE1-CB 3.9Å; F448-A461 HydrophobicContact CZ-CB 4.26Å; V456-A461 HydrophobicContact CG2-CB 3.78Å; C457-A461 WeakPolarHBondContact O-CB 3.42Å; C457-A461 PolarHBondContact O-N 3.05Å; C457-A461 VanDerWaalsContact O-N 3.11Å; D459-A461 PolarHBondContact O-N 2.58Å; A461-S463 VanDerWaalsContact C-N 3.32Å; A461-S463 PolarHBondContact O-N 3.33Å
462	A	75.9	Confident	75	Confident	44 Å²	44	57.6 Å²	57.6	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-65.5	-36.5	-178.7	0	0	0	0	0	112.1	N174 D459 C460	N174-A462 PolarHBondContact ND2-O 3.41Å; D459-A462 PolarHBondContact O-N 2.87Å; C460-A462 PolarHBondContact O-N 2.98Å
463	S	79.4	Confident	75.2	Confident	109 Å²	109	58.9 Å²	58.9	76%	0.762	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-4	-174.3	-50.9	0	0	0	0	114.5	C460 A461	C460-S463 PolarHBondContact O-N 3.46Å; A461-S463 VanDerWaalsContact C-N 3.32Å; A461-S463 PolarHBondContact O-N 3.33Å
464	L	79.1	Confident	75.3	Confident	36 Å²	36	56.5 Å²	56.5	19%	0.188	30%	0.303	C	S	.	.			trans	-97.7	131.8	-176	-69.8	174.1	0	0	0	112.5	R185 V438 F448 V456 C460 P468 I474	R185-L464 PolarHBondContact NH1-O 3.24Å; V438-L464 HydrophobicContact CG2-CD1 4.09Å; F448-L464 HydrophobicContact CE2-CD1 4.17Å; F448-L464 HydrophobicContact CZ-CB 4.3Å; F448-L464 HydrophobicContact CZ-CD1 3.74Å; V456-L464 HydrophobicContact CG1-CD1 3.76Å; V456-L464 HydrophobicContact CG2-CD1 4.38Å; C460-L464 WeakPolarHBondContact O-CG 3.47Å; L464-P468 HydrophobicContact CD1-CG 3.76Å; L464-I474 HydrophobicContact CB-CD1 3.82Å
465	R	77	Confident	74.6	Confident	178 Å²	178	59.2 Å²	59.2	67%	0.672	31%	0.31	S	S	*	.	S	Bend	trans	-99.1	-26	171.7	-63.5	-170.3	179.9	-153.8	-0.5	113.6	I474	R465-I474 PolarHBondContact O-N 3.14Å
466	H	74.6	Confident	73.8	Confident	103 Å²	103	58.9 Å²	58.9	48%	0.477	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-125.6	146.4	178.8	-59.9	92.3	0	0	0	110.5	P468 R471 A472 I474	H466-P468 WeakPolarHBondContact O-CD 3.39Å; H466-R471 PolarHBondContact CD2-O 3.29Å; H466-R471 VanDerWaalsContact CD2-O 3.29Å; H466-A472 CarbonylContact C-O 3.46Å; H466-A472 WeakPolarHBondContact CA-O 3.43Å; H466-I474 WeakPolarHBondContact O-CD1 3.25Å
467	C	74.6	Confident	73.5	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.014	31%	0.312	C	S	.	.			trans	-62.9	127.9	175.8	179.7	0	0	0	0	110.5	F448 I469 C470 R471 A472	F448-C467 HydrophobicContact CD2-CB 4.37Å; C467-I469 PolarHBondContact O-N 3.46Å; C467-I469 VanDerWaalsContact O-N 3.13Å; C467-I469 PolarHBondContact SG-N 3.22Å; C467-C470 VanDerWaalsContact CB-SG 3.57Å; C467-R471 WeakPolarHBondContact O-CA 3.44Å; C467-R471 PolarHBondContact O-N 3.02Å; C467-A472 PolarHBondContact N-O 2.99Å
468	P	75.9	Confident	72.8	Confident	60 Å²	60	62 Å²	62	39%	0.39	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.3	177.7	-25.2	34.8	0	0	0	114.7	V438 V455 V456 L464 H466	V438-P468 HydrophobicContact CG2-CG 4.32Å; V455-P468 HydrophobicContact CG1-CG 4.35Å; V456-P468 HydrophobicContact CG1-CG 4.35Å; L464-P468 HydrophobicContact CD1-CG 3.76Å; H466-P468 WeakPolarHBondContact O-CD 3.39Å
469	I	75.6	Confident	72.3	Confident	99 Å²	99	65.4 Å²	65.4	51%	0.508	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-57.4	-177.8	-56.9	-56.6	0	0	0	111.3	V455 C467	V455-I469 HydrophobicContact CB-CD1 4.42Å; V455-I469 HydrophobicContact CB-CG1 3.95Å; V455-I469 HydrophobicContact CG1-CG1 4.15Å; V455-I469 HydrophobicContact CG2-CD1 3.64Å; V455-I469 HydrophobicContact CG2-CG1 3.69Å; C467-I469 PolarHBondContact O-N 3.46Å; C467-I469 VanDerWaalsContact O-N 3.13Å; C467-I469 PolarHBondContact SG-N 3.22Å
470	C	61.7	Low	71.4	Confident	35 Å²	35	62.2 Å²	62.2	24%	0.236	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-0.5	-171.3	65.2	0	0	0	0	114.1	C451 H453 C467 A472	C451-C470 VanDerWaalsContact CB-SG 3.54Å; H453-C470 VanDerWaalsContact CE1-SG 3.58Å; H453-C470 PolarHBondContact ND1-SG 3.36Å; C467-C470 VanDerWaalsContact CB-SG 3.57Å; C470-A472 PolarHBondContact O-N 3.33Å; C470-A472 VanDerWaalsContact SG-CB 3.59Å
471	R	74.5	Confident	70.1	Confident	210 Å²	210	70 Å²	70	79%	0.792	35%	0.35	S	S	*	.			trans	59.7	3.7	-177.6	-55.9	-178.9	179.4	170.3	-0.4	116	H466 C467	H466-R471 PolarHBondContact CD2-O 3.29Å; H466-R471 VanDerWaalsContact CD2-O 3.29Å; C467-R471 WeakPolarHBondContact O-CA 3.44Å; C467-R471 PolarHBondContact O-N 3.02Å
472	A	60.3	Low	68.7	Low	27 Å²	27	73.9 Å²	73.9	22%	0.223	37%	0.369	C	S	.	.			trans	-56.1	142.8	172.3	0	0	0	0	0	111.6	C451 H466 C467 C470 I474	C451-A472 HydrophobicContact CB-CB 4.01Å; H466-A472 CarbonylContact C-O 3.46Å; H466-A472 WeakPolarHBondContact CA-O 3.43Å; C467-A472 PolarHBondContact N-O 2.99Å; C470-A472 PolarHBondContact O-N 3.33Å; C470-A472 VanDerWaalsContact SG-CB 3.59Å; A472-I474 PolarHBondContact O-N 2.91Å
473	V	63.4	Low	66.9	Low	74 Å²	74	80.8 Å²	80.8	45%	0.448	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-62.8	129.7	175	180	0	0	0	0	109.5	R475	V473-R475 PolarHBondContact O-N 3.22Å
474	I	73.3	Confident	66.3	Low	1 Å²	1	79.4 Å²	79.4	1%	0.005	40%	0.397	C	S	.	.			trans	-85.3	108.8	-179.2	-62	163.6	0	0	0	108.7	R185 N186 F448 L464 R465 H466 A472 G476	R185-I474 WeakPolarHBondContact CD-O 3.26Å; R185-I474 WeakPolarHBondContact CG-O 3.42Å; N186-I474 PolarHBondContact ND2-O 3.05Å; F448-I474 HydrophobicContact CB-CG1 4.23Å; F448-I474 HydrophobicContact CB-CG2 4.37Å; F448-I474 HydrophobicContact CD1-CB 4.34Å; F448-I474 HydrophobicContact CD1-CD1 3.71Å; F448-I474 HydrophobicContact CD1-CG1 3.88Å; F448-I474 HydrophobicContact CD1-CG2 3.48Å; F448-I474 VanDerWaalsContact CD1-CG2 3.48Å; F448-I474 HydrophobicContact CD2-CD1 3.96Å; F448-I474 HydrophobicContact CD2-CG1 4.24Å; F448-I474 HydrophobicContact CE1-CD1 3.54Å; F448-I474 HydrophobicContact CE1-CG1 4.23Å; F448-I474 HydrophobicContact CE1-CG2 4.01Å; F448-I474 HydrophobicContact CE2-CD1 3.79Å; F448-I474 HydrophobicContact CG-CD1 3.91Å; F448-I474 HydrophobicContact CG-CG1 3.87Å; F448-I474 HydrophobicContact CG-CG2 4.15Å; F448-I474 HydrophobicContact CZ-CD1 3.55Å; L464-I474 HydrophobicContact CB-CD1 3.82Å; R465-I474 PolarHBondContact O-N 3.14Å; H466-I474 WeakPolarHBondContact O-CD1 3.25Å; A472-I474 PolarHBondContact O-N 2.91Å; I474-G476 WeakPolarHBondContact CG2-O 3.46Å
475	R	62.2	Low	65.6	Low	112 Å²	112	81.7 Å²	81.7	42%	0.423	41%	0.408	S	S	.	.			trans	-91.5	-16.4	175.5	-69.6	-168.7	162.6	-178.2	-7.2	113.6	R185 E188 I449 V473	R185-R475 PolarHBondContact N-O 3.39Å; R185-R475 VanDerWaalsContact N-O 3.15Å; E188-R475 IonicContact OE1-CZ 2.57Å; E188-R475 IonicContact OE1-NH2 3.25Å; E188-R475 PolarHBondContact OE1-NH2 3.42Å; E188-R475 IonicContact OE2-NH2 3.95Å; I449-R475 PolarHBondContact O-N 3.35Å; V473-R475 PolarHBondContact O-N 3.22Å
476	G	63.9	Low	65	Low	0 Å²	0	76.3 Å²	76.3	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	174.9	178.4	0	0	0	0	0	112.8	G183 I449 I474	G183-G476 VanDerWaalsContact O-CA 3.3Å; G183-G476 WeakPolarHBondContact O-CA 3.34Å; I449-G476 PolarHBondContact N-O 3.09Å; I449-G476 PolarHBondContact O-N 2.99Å; I474-G476 WeakPolarHBondContact CG2-O 3.46Å
477	S	71.8	Confident	64.4	Low	12 Å²	12	74.8 Å²	74.8	8%	0.084	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	135.8	-179.6	53.6	0	0	0	0	111.5	G183 V447	G183-S477 PolarHBondContact N-O 3.05Å; G183-S477 PolarHBondContact O-N 2.78Å; V447-S477 WeakPolarHBondContact O-CA 3.24Å
478	V	67.1	Low	63.8	Low	55 Å²	55	79.3 Å²	79.3	33%	0.333	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.5	175.6	-167.7	0	0	0	0	109.3	F201 I446 V447 I449 A480	F201-V478 HydrophobicContact CE1-CG2 3.99Å; I446-V478 WeakPolarHBondContact CA-O 3.27Å; V447-V478 PolarHBondContact N-O 3.3Å; V447-V478 PolarHBondContact O-N 3.08Å; I449-V478 HydrophobicContact CD1-CG2 3.68Å; I449-V478 HydrophobicContact CG1-CG2 4.1Å; V478-A480 PolarHBondContact O-N 2.75Å
479	R	63.8	Low	62.9	Low	101 Å²	101	80.6 Å²	80.6	38%	0.381	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.8	170.1	-168	-178.1	-60.9	-131.9	4.5	110.1	D181 S445 F481	D181-R479 IonicContact OD1-NH2 3.34Å; D181-R479 IonicContact OD2-CZ 3.52Å; D181-R479 IonicContact OD2-NE 3.61Å; D181-R479 PolarHBondContact OD2-NE 2.85Å; D181-R479 IonicContact OD2-NH2 3.69Å; D181-R479 PolarHBondContact OD2-NH2 2.99Å; S445-R479 CarbonylContact O-C 3.57Å; S445-R479 VanDerWaalsContact O-CA 3.32Å; S445-R479 WeakPolarHBondContact O-CA 3.43Å; R479-F481 HydrophobicContact CG-CZ 4.33Å
480	A	62.7	Low	62	Low	28 Å²	28	79.3 Å²	79.3	23%	0.231	41%	0.407	C	S	.	.			trans	-94.9	134.3	171.7	0	0	0	0	0	110.4	S445 V447 L454 V478	S445-A480 PolarHBondContact O-N 3.35Å; V447-A480 HydrophobicContact CG2-CB 4.02Å; L454-A480 HydrophobicContact CD1-CB 4.18Å; V478-A480 PolarHBondContact O-N 2.75Å
481	F	54.2	Low	62.1	Low	181 Å²	181	82.7 Å²	82.7	79%	0.794	42%	0.42	S	S	*	.			trans	-102.5	106.4	170.9	-59.3	-83.6	0	0	0	108	R479	R479-F481 HydrophobicContact CG-CZ 4.33Å
482	M	51.2	Low	61	Low	85 Å²	85	72.1 Å²	72.1	42%	0.419	39%	0.389	S	S	.	.			trans	-86.9	117.3	175.5	-61.7	-175	-62.1	0	0	108.2	V444 L454	V444-M482 HydrophobicContact CG2-CE 3.81Å; V444-M482 HydrophobicContact CG2-SD 4.05Å; V444-M482 WeakPolarHBondContact O-CE 3.25Å; L454-M482 HydrophobicContact CD2-SD 3.9Å
483	S	38.6	Very low	61.1	Low	189 Å²	189	76.2 Å²	76.2	100%	1.322	40%	0.404	S	S	*	.			trans	-86	0	178.9	59.1	0	0	0	0	112.8

Retrieved 483 of 483 residues in 78.9 ms (Link to these results)

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