A0A096NJM0_PAPAN Loading...

Group 3 secretory phospholipase A2

AlphaFold DB , UniProt , Accession A0A096NJM0, Species PAPAN (Papio anubis, Olive baboon), Gene PLA2G3, Length 509 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.5	Very low	33	Very low	246 Å²	246	151.1 Å²	151.1	100%	1.212	84%	0.84	S	S	*	*				0	84.5	0	-57.3	-69.5	-86.7	0	0	106.7
2	G	30.1	Very low	33.4	Very low	64 Å²	64	143.4 Å²	143.4	66%	0.66	82%	0.821	S	S	*	*			cis	115.7	116	25.7	0	0	0	0	0	108.5
3	V	29.4	Very low	33.7	Very low	138 Å²	138	147.6 Å²	147.6	84%	0.836	82%	0.824	S	S	*	*			trans	73.2	111.8	144.6	-159.4	0	0	0	0	113.4
4	L	30.8	Very low	33.8	Very low	154 Å²	154	149.5 Å²	149.5	81%	0.806	83%	0.83	S	S	*	*			cis	-168.1	77.6	40.2	-160.5	81.5	0	0	0	111.2
5	E	32.6	Very low	33.4	Very low	210 Å²	210	144.5 Å²	144.5	98%	0.981	83%	0.827	S	S	*	*			trans	-94.4	93.7	159	-86.9	-167.1	155.3	0	0	108.3
6	G	38.3	Very low	33.2	Very low	53 Å²	53	143.2 Å²	143.2	55%	0.546	82%	0.822	S	S	.	*			trans	179.2	96	179.3	0	0	0	0	0	111.6
7	L	31.1	Very low	33	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	82%	0.82	S	S	*	*			trans	146.9	50.6	152.5	-78.4	158.5	0	0	0	112.5
8	F	32.9	Very low	32.9	Very low	229 Å²	229	141.7 Å²	141.7	100%	1.004	82%	0.822	S	S	*	*	S	Bend	trans	-106.6	76.9	151.5	-100.1	-83.4	0	0	0	107.9
9	G	32.8	Very low	32.8	Very low	54 Å²	54	138.5 Å²	138.5	56%	0.557	82%	0.823	S	S	*	*	S	Bend	trans	179	109.4	179.7	0	0	0	0	0	110.6
10	M	35.3	Very low	32.6	Very low	181 Å²	181	135 Å²	135	89%	0.892	82%	0.817	S	S	*	*	S	Bend	trans	76.2	87.7	170.5	-54.8	-60.3	-147.7	0	0	116.8
11	L	30.9	Very low	32.9	Very low	170 Å²	170	132 Å²	132	89%	0.89	80%	0.802	S	S	*	*				-170.2	63.3	125.4	-94.2	157.6	0	0	0	108.5
12	G	38.3	Very low	33.2	Very low	59 Å²	59	126.1 Å²	126.1	61%	0.608	78%	0.782	S	S	*	*			trans	-65.3	147.6	146.6	0	0	0	0	0	107.9
13	F	37.8	Very low	34.2	Very low	198 Å²	198	126.7 Å²	126.7	87%	0.868	78%	0.78	S	S	*	*			trans	87.3	79.7	-174.8	-53.6	-76.8	0	0	0	116
14	L	34.6	Very low	35.6	Very low	174 Å²	174	122.5 Å²	122.5	91%	0.911	75%	0.753	S	S	*	*				167.5	82.4	125	-90.1	154.8	0	0	0	108.8
15	G	27.2	Very low	37	Very low	75 Å²	75	122.9 Å²	122.9	77%	0.773	75%	0.75	S	S	*	*			trans	-128.3	89.7	167.5	0	0	0	0	0	107.7	A17	G15-A17 PolarHBondContact O-N 3.34Å; G15-A17 VanDerWaalsContact O-N 3.17Å
16	V	30.2	Very low	38.8	Very low	123 Å²	123	114.4 Å²	114.4	75%	0.745	71%	0.709	S	S	*	*			trans	-42.7	118.6	173.8	173.9	0	0	0	0	109.2	L18	V16-L18 VanDerWaalsContact C-N 3.26Å; V16-L18 PolarHBondContact O-N 3.29Å
17	A	31	Very low	40.4	Very low	96 Å²	96	118.6 Å²	118.6	79%	0.793	71%	0.71	S	S	*	*			trans	-62.3	95.4	165.1	0	0	0	0	0	107.2	G15 G19	G15-A17 PolarHBondContact O-N 3.34Å; G15-A17 VanDerWaalsContact O-N 3.17Å; A17-G19 VanDerWaalsContact C-N 3.32Å; A17-G19 PolarHBondContact O-N 3.01Å
18	L	29.9	Very low	42.8	Very low	164 Å²	164	119.1 Å²	119.1	86%	0.859	70%	0.7	S	S	*	*			trans	-59.5	105.2	159.5	-81	162.2	0	0	0	105.4	V16 G20	V16-L18 VanDerWaalsContact C-N 3.26Å; V16-L18 PolarHBondContact O-N 3.29Å; L18-G20 PolarHBondContact O-N 3.4Å
19	G	31.9	Very low	45.6	Very low	81 Å²	81	110 Å²	110	84%	0.835	66%	0.663	S	S	*	*			trans	-60.1	87.6	170.3	0	0	0	0	0	109.1	A17	A17-G19 VanDerWaalsContact C-N 3.32Å; A17-G19 PolarHBondContact O-N 3.01Å
20	G	28	Very low	48.3	Very low	68 Å²	68	109.7 Å²	109.7	70%	0.701	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-81	117.2	161.2	0	0	0	0	0	107.7	L18	L18-G20 PolarHBondContact O-N 3.4Å
21	S	39.7	Very low	50.8	Low	72 Å²	72	101.6 Å²	101.6	50%	0.503	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-47.6	142.4	162.6	-64.4	0	0	0	0	109.8	A23 E116	S21-A23 PolarHBondContact O-N 3.41Å; S21-E116 WeakPolarHBondContact CB-OE1 3.04Å
22	P	44.4	Very low	53.6	Low	122 Å²	122	93.5 Å²	93.5	79%	0.792	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-63.7	116.2	177.8	17.4	-16.5	0	0	0	108.2	L24	P22-L24 PolarHBondContact O-N 2.78Å
23	A	50.9	Low	55.7	Low	76 Å²	76	91.3 Å²	91.3	63%	0.628	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-52	128.4	173	0	0	0	0	0	108.9	S21 H25	S21-A23 PolarHBondContact O-N 3.41Å; A23-H25 PolarHBondContact O-N 3.08Å
24	L	58.4	Low	57.8	Low	50 Å²	50	83.7 Å²	83.7	26%	0.262	52%	0.515	S	S	.	.			trans	-58.5	111.3	173.9	-88.2	101.5	0	0	0	108.5	P22 W26 W73 W115	P22-L24 PolarHBondContact O-N 2.78Å; L24-W26 HydrophobicContact CB-CE3 3.98Å; L24-W26 HydrophobicContact CB-CZ3 3.82Å; L24-W26 HydrophobicContact CD2-CE3 4.4Å; L24-W26 HydrophobicContact CD2-CZ3 4.25Å; L24-W73 HydrophobicContact CD1-CE3 4.49Å; L24-W73 HydrophobicContact CD1-CH2 4.5Å; L24-W73 HydrophobicContact CD1-CZ3 3.73Å; L24-W73 HydrophobicContact CD2-CE3 3.96Å; L24-W73 HydrophobicContact CD2-CZ3 3.95Å; L24-W73 HydrophobicContact CG-CZ3 4.5Å; L24-W115 HydrophobicContact CD1-CG 4.42Å
25	H	60.1	Low	59.6	Low	162 Å²	162	78.4 Å²	78.4	75%	0.75	49%	0.485	S	S	*	.			trans	-109	83.4	-179	-160.8	-66	0	0	0	109.5	A23	A23-H25 PolarHBondContact O-N 3.08Å
26	W	72.1	Confident	61.9	Low	32 Å²	32	78.8 Å²	78.8	12%	0.121	47%	0.474	C	S	.	.			trans	-75.4	126.2	169.3	47.5	76.6	0	0	0	109.7	L24 T29 F47 A49 I58 L111 P112 W115	L24-W26 HydrophobicContact CB-CE3 3.98Å; L24-W26 HydrophobicContact CB-CZ3 3.82Å; L24-W26 HydrophobicContact CD2-CE3 4.4Å; L24-W26 HydrophobicContact CD2-CZ3 4.25Å; W26-T29 HydrophobicContact CG-CG2 4.39Å; W26-F47 HydrophobicContact CZ2-CZ 4.3Å; W26-A49 HydrophobicContact CB-CB 3.98Å; W26-A49 HydrophobicContact CG-CB 4.24Å; W26-I58 HydrophobicContact CD2-CD1 4.27Å; W26-I58 HydrophobicContact CE3-CD1 3.74Å; W26-I58 HydrophobicContact CH2-CD1 4.23Å; W26-I58 HydrophobicContact CZ3-CD1 3.74Å; W26-L111 HydrophobicContact CH2-CB 4.15Å; W26-L111 HydrophobicContact CH2-CD2 4.44Å; W26-L111 HydrophobicContact CZ2-CB 3.9Å; W26-L111 HydrophobicContact CZ2-CD2 4.37Å; W26-P112 HydrophobicContact CH2-CB 4.06Å; W26-P112 HydrophobicContact CH2-CG 3.72Å; W26-P112 HydrophobicContact CZ2-CB 4.2Å; W26-P112 VanDerWaalsContact CZ2-CD 3.48Å; W26-P112 HydrophobicContact CZ2-CG 3.35Å; W26-P112 HydrophobicContact CZ3-CG 4.46Å; W26-W115 HydrophobicContact CH2-CE3 4.22Å
27	Y	70.6	Confident	63.7	Low	142 Å²	142	74.8 Å²	74.8	56%	0.557	45%	0.45	S	S	*	.	S	Bend	trans	-92.9	-10.8	-177.7	63.5	-93.4	0	0	0	113.1	K50 D51	Y27-K50 HydrophobicContact CE2-CD 4.5Å; Y27-K50 PolarHBondContact N-O 3.48Å; Y27-K50 WeakPolarHBondContact OH-CD 3.49Å; Y27-K50 WeakPolarHBondContact OH-CE 3.42Å; Y27-D51 WeakPolarHBondContact CE1-O 3.5Å; Y27-D51 PolarHBondContact OH-O 2.93Å
28	R	82.8	Confident	65.5	Low	174 Å²	174	76.1 Å²	76.1	66%	0.657	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.6	134.8	177.2	-161.1	172.9	-174.9	-176.7	0.2	111.6	K50	R28-K50 HydrophobicContact CB-CB 4.35Å; R28-K50 PolarHBondContact O-N 2.86Å
29	T	90.3	Very high	67.6	Low	37 Å²	37	71.7 Å²	71.7	23%	0.227	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	147.9	173.1	65	0	0	0	0	110.8	W26 H32 F47 L48 L108	W26-T29 HydrophobicContact CG-CG2 4.39Å; T29-H32 WeakPolarHBondContact CB-NE2 3.34Å; T29-H32 PolarHBondContact OG1-NE2 2.93Å; T29-F47 HydrophobicContact CG2-CD2 3.69Å; T29-F47 HydrophobicContact CG2-CE2 3.53Å; T29-L48 CarbonylContact C-O 3.56Å; T29-L48 VanDerWaalsContact CA-O 3.24Å; T29-L48 WeakPolarHBondContact CA-O 3.14Å; T29-L108 HydrophobicContact CG2-CD2 4.42Å
30	S	90.4	Very high	69.7	Low	48 Å²	48	68.1 Å²	68.1	34%	0.336	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	164.9	-179.8	53.1	0	0	0	0	111.3	L48	S30-L48 PolarHBondContact N-O 3.24Å; S30-L48 PolarHBondContact O-N 2.81Å
31	C	88.1	Confident	71.7	Confident	10 Å²	10	67.6 Å²	67.6	7%	0.068	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.3	54.4	173.5	-59.9	0	0	0	0	113	L33 L48 Y83 C87 F96	C31-L33 PolarHBondContact O-N 3.2Å; C31-L48 HydrophobicContact CB-CD1 4.06Å; C31-L48 HydrophobicContact CB-CG 4.4Å; C31-Y83 HydrophobicContact CB-CD1 4.22Å; C31-Y83 HydrophobicContact CB-CE1 3.68Å; C31-Y83 VanDerWaalsContact O-CE1 3.23Å; C31-Y83 WeakPolarHBondContact O-CE1 3.14Å; C31-Y83 PolarHBondContact O-OH 2.95Å; C31-C87 WeakPolarHBondContact CA-SG 3.13Å; C31-C87 HydrophobicContact CB-CB 3.42Å; C31-C87 VanDerWaalsContact CB-CB 3.42Å; C31-C87 WeakPolarHBondContact CB-SG 3.32Å; C31-C87 WeakPolarHBondContact SG-CB 3.45Å; C31-C87 CovalentContact SG-SG 2.02Å; C31-C87 PolarHBondContact SG-SG 3.46Å; C31-F96 HydrophobicContact CB-CD1 4.25Å
32	H	88.4	Confident	73.3	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	116.5	-175.8	-45.3	87.9	0	0	0	109.8	T29 L45 S46 F47 I97 L104	T29-H32 WeakPolarHBondContact CB-NE2 3.34Å; T29-H32 PolarHBondContact OG1-NE2 2.93Å; H32-L45 HydrophobicContact CB-CD1 4.11Å; H32-S46 CarbonylContact C-O 3.49Å; H32-S46 WeakPolarHBondContact CA-O 3.48Å; H32-F47 HydrophobicContact CB-CB 4.43Å; H32-I97 HydrophobicContact CB-CB 4.22Å; H32-I97 WeakPolarHBondContact CB-O 3.38Å; H32-I97 PolarHBondContact N-O 3.01Å; H32-I97 PolarHBondContact ND1-O 3.04Å; H32-I97 WeakPolarHBondContact O-CB 3.38Å; H32-I97 PolarHBondContact O-N 2.79Å; H32-L104 HydrophobicContact CB-CD2 3.78Å
33	L	83	Confident	74.7	Confident	13 Å²	13	59.5 Å²	59.5	7%	0.068	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.3	173.9	178.1	69.6	0	0	0	108.1	C31 L45 S46 Y83 S95 F96 F174 I228	C31-L33 PolarHBondContact O-N 3.2Å; L33-L45 WeakPolarHBondContact O-CA 3.22Å; L33-S46 PolarHBondContact N-O 3.05Å; L33-S46 PolarHBondContact O-N 3.5Å; L33-Y83 WeakPolarHBondContact CB-OH 3.47Å; L33-S95 VanDerWaalsContact CD1-O 3.32Å; L33-S95 WeakPolarHBondContact CD1-O 3.47Å; L33-F96 HydrophobicContact CB-CD1 3.99Å; L33-F96 HydrophobicContact CB-CE1 3.88Å; L33-F174 HydrophobicContact CD2-CZ 4.28Å; L33-I228 HydrophobicContact CD1-CD1 4.5Å; L33-I228 HydrophobicContact CD2-CD1 3.45Å; L33-I228 VanDerWaalsContact CD2-CD1 3.45Å
34	T	82.5	Confident	76.1	Confident	37 Å²	37	56 Å²	56	23%	0.227	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	142.6	179	55.2	0	0	0	0	110.9	L42 S44 L45 I97 L104	T34-L42 HydrophobicContact CG2-CD2 3.6Å; T34-S44 VanDerWaalsContact CA-O 3.31Å; T34-S44 WeakPolarHBondContact CA-O 3.48Å; T34-L45 HydrophobicContact CG2-CD1 3.72Å; T34-I97 HydrophobicContact CG2-CD1 3.96Å; T34-I97 WeakPolarHBondContact OG1-CD1 3.46Å; T34-L104 HydrophobicContact CG2-CD1 4.31Å; T34-L104 HydrophobicContact CG2-CD2 4.41Å
35	K	71.1	Confident	77.3	Confident	63 Å²	63	53.6 Å²	53.6	27%	0.274	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.9	166.3	-167.8	159.6	-179.6	176.4	0	110.4	G43 S44 V173 F174	K35-G43 CarbonylContact O-C 3.53Å; K35-G43 WeakPolarHBondContact O-CA 3.37Å; K35-G43 PolarHBondContact O-N 2.96Å; K35-S44 WeakPolarHBondContact CB-OG 3.35Å; K35-S44 PolarHBondContact N-O 3.49Å; K35-S44 PolarHBondContact O-N 2.87Å; K35-V173 HydrophobicContact CB-CG1 4.21Å; K35-V173 HydrophobicContact CD-CB 4.15Å; K35-V173 HydrophobicContact CD-CG1 3.36Å; K35-V173 WeakPolarHBondContact CE-O 3.42Å; K35-V173 HydrophobicContact CG-CG1 3.6Å; K35-V173 PolarHBondContact NZ-O 3.08Å; K35-F174 HydrophobicContact CB-CE1 4.31Å; K35-F174 HydrophobicContact CB-CZ 4.4Å; K35-F174 HydrophobicContact CD-CD1 3.61Å; K35-F174 HydrophobicContact CD-CE1 3.35Å; K35-F174 HydrophobicContact CD-CZ 4.11Å; K35-F174 HydrophobicContact CG-CE1 4.43Å
36	P	76.3	Confident	78.6	Confident	84 Å²	84	46.1 Å²	46.1	55%	0.545	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	151.4	179.5	30	-34.7	0	0	0	111.1	P41	P36-P41 WeakPolarHBondContact CA-O 3.48Å
37	V	68.3	Low	79.4	Confident	39 Å²	39	44.6 Å²	44.6	24%	0.236	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	158.3	165.7	-65.8	0	0	0	0	108.6	G39 N40	V37-G39 PolarHBondContact O-N 3.22Å; V37-G39 VanDerWaalsContact O-N 3.12Å; V37-N40 HydrophobicContact CG2-CB 3.78Å; V37-N40 PolarHBondContact N-O 3.12Å; V37-N40 CarbonylContact O-C 3.4Å; V37-N40 PolarHBondContact O-N 3.33Å
38	P	68.4	Low	80.3	Confident	124 Å²	124	38 Å²	38	81%	0.805	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.5	122.4	176.6	-26.8	35.3	0	0	0	111.4	N40 A64	P38-N40 VanDerWaalsContact C-N 3.34Å; P38-N40 PolarHBondContact O-N 2.97Å; P38-A64 WeakPolarHBondContact O-CB 3.28Å
39	G	73.1	Confident	80.6	Confident	71 Å²	71	29.9 Å²	29.9	73%	0.732	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	84	-9	-178.5	0	0	0	0	0	116.4	V37	V37-G39 PolarHBondContact O-N 3.22Å; V37-G39 VanDerWaalsContact O-N 3.12Å
40	N	77	Confident	80.5	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.027	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	111.3	176.5	179.1	8.5	0	0	0	112	V37 P38 L42 G43 W62 D63 R66	V37-N40 HydrophobicContact CG2-CB 3.78Å; V37-N40 PolarHBondContact N-O 3.12Å; V37-N40 CarbonylContact O-C 3.4Å; V37-N40 PolarHBondContact O-N 3.33Å; P38-N40 VanDerWaalsContact C-N 3.34Å; P38-N40 PolarHBondContact O-N 2.97Å; N40-L42 PolarHBondContact ND2-O 2.95Å; N40-L42 PolarHBondContact O-N 3.44Å; N40-L42 PolarHBondContact OD1-N 2.02Å; N40-G43 PolarHBondContact O-N 3.23Å; N40-W62 WeakPolarHBondContact ND2-CB 3.38Å; N40-D63 PolarHBondContact ND2-O 3.16Å; N40-R66 HydrophobicContact CB-CG 4.48Å
41	P	69.4	Low	80.1	Confident	58 Å²	58	32.1 Å²	32.1	38%	0.377	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	-18.4	-179.3	27.6	-34.1	0	0	0	113.5	P36 E103	P36-P41 WeakPolarHBondContact CA-O 3.48Å; P41-E103 WeakPolarHBondContact CG-OE2 2.9Å
42	L	74	Confident	79.3	Confident	23 Å²	23	36.2 Å²	36.2	12%	0.12	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	48.2	177.3	-62.1	173.4	0	0	0	110.6	T34 N40 S44 W62 E103 L104 A107	T34-L42 HydrophobicContact CG2-CD2 3.6Å; N40-L42 PolarHBondContact ND2-O 2.95Å; N40-L42 PolarHBondContact O-N 3.44Å; N40-L42 PolarHBondContact OD1-N 2.02Å; L42-S44 PolarHBondContact O-N 3.43Å; L42-W62 VanDerWaalsContact O-CE3 3.27Å; L42-E103 HydrophobicContact CD1-CB 4.27Å; L42-L104 HydrophobicContact CD2-CB 4.42Å; L42-L104 HydrophobicContact CD2-CD1 4.14Å; L42-A107 HydrophobicContact CD1-CB 3.73Å
43	G	72.9	Confident	78.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	-38.1	177.7	0	0	0	0	0	113	K35 N40 R61 W62	K35-G43 CarbonylContact O-C 3.53Å; K35-G43 WeakPolarHBondContact O-CA 3.37Å; K35-G43 PolarHBondContact O-N 2.96Å; N40-G43 PolarHBondContact O-N 3.23Å; G43-R61 WeakPolarHBondContact O-CA 2.91Å; G43-R61 WeakPolarHBondContact O-CG 3.37Å; G43-W62 PolarHBondContact O-N 2.93Å
44	S	80.2	Confident	78.3	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	148.9	167.7	68	0	0	0	0	111.9	T34 K35 L42 A60	T34-S44 VanDerWaalsContact CA-O 3.31Å; T34-S44 WeakPolarHBondContact CA-O 3.48Å; K35-S44 WeakPolarHBondContact CB-OG 3.35Å; K35-S44 PolarHBondContact N-O 3.49Å; K35-S44 PolarHBondContact O-N 2.87Å; L42-S44 PolarHBondContact O-N 3.43Å; S44-A60 CarbonylContact C-O 3.59Å; S44-A60 WeakPolarHBondContact CA-O 3.4Å
45	L	85.3	Confident	78.5	Confident	0 Å²	0	46 Å²	46	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	124.5	178.9	176	59.1	0	0	0	110	H32 L33 T34 F47 H59 A60 W62 L104 L108	H32-L45 HydrophobicContact CB-CD1 4.11Å; L33-L45 WeakPolarHBondContact O-CA 3.22Å; T34-L45 HydrophobicContact CG2-CD1 3.72Å; L45-F47 HydrophobicContact CD1-CD1 4.34Å; L45-F47 HydrophobicContact CD2-CD1 4.04Å; L45-F47 HydrophobicContact CD2-CE1 4.09Å; L45-F47 HydrophobicContact CG-CD1 3.79Å; L45-F47 HydrophobicContact CG-CE1 4.23Å; L45-H59 CarbonylContact O-C 3.5Å; L45-H59 WeakPolarHBondContact O-CA 3.39Å; L45-H59 PolarHBondContact O-ND1 2.84Å; L45-H59 VanDerWaalsContact O-ND1 3.09Å; L45-A60 PolarHBondContact N-O 3.33Å; L45-A60 PolarHBondContact O-N 2.78Å; L45-W62 HydrophobicContact CB-CH2 4.13Å; L45-W62 HydrophobicContact CB-CZ3 3.68Å; L45-W62 HydrophobicContact CD2-CH2 4.28Å; L45-L104 HydrophobicContact CD1-CD1 3.5Å; L45-L104 VanDerWaalsContact CD1-CD1 3.5Å; L45-L104 HydrophobicContact CD2-CD1 3.49Å; L45-L104 VanDerWaalsContact CD2-CD1 3.49Å; L45-L104 HydrophobicContact CG-CD1 4.11Å; L45-L108 HydrophobicContact CD2-CD2 3.8Å; L45-L108 HydrophobicContact CD2-CG 4.25Å
46	S	86.6	Confident	79.1	Confident	6 Å²	6	43.8 Å²	43.8	4%	0.042	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.9	167.5	-56.9	0	0	0	0	109.5	H32 L33 I58 H59 Y83	H32-S46 CarbonylContact C-O 3.49Å; H32-S46 WeakPolarHBondContact CA-O 3.48Å; L33-S46 PolarHBondContact N-O 3.05Å; L33-S46 PolarHBondContact O-N 3.5Å; S46-I58 CarbonylContact C-O 3.53Å; S46-I58 VanDerWaalsContact CA-O 3.27Å; S46-I58 WeakPolarHBondContact CA-O 3.47Å; S46-H59 PolarHBondContact OG-ND1 2.8Å; S46-Y83 VanDerWaalsContact C-OH 3.24Å; S46-Y83 WeakPolarHBondContact CB-OH 3.49Å; S46-Y83 PolarHBondContact O-OH 3.34Å
47	F	89.6	Confident	79.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	156.4	-179.8	63.5	-77.2	0	0	0	111.9	W26 T29 H32 L45 A49 I58 L108 L111	W26-F47 HydrophobicContact CZ2-CZ 4.3Å; T29-F47 HydrophobicContact CG2-CD2 3.69Å; T29-F47 HydrophobicContact CG2-CE2 3.53Å; H32-F47 HydrophobicContact CB-CB 4.43Å; L45-F47 HydrophobicContact CD1-CD1 4.34Å; L45-F47 HydrophobicContact CD2-CD1 4.04Å; L45-F47 HydrophobicContact CD2-CE1 4.09Å; L45-F47 HydrophobicContact CG-CD1 3.79Å; L45-F47 HydrophobicContact CG-CE1 4.23Å; F47-A49 HydrophobicContact CD2-CB 4.3Å; F47-A49 HydrophobicContact CE2-CB 3.96Å; F47-I58 HydrophobicContact CD1-CB 4.15Å; F47-I58 HydrophobicContact CD1-CG2 4.22Å; F47-I58 HydrophobicContact CD2-CB 4.44Å; F47-I58 HydrophobicContact CE1-CB 3.74Å; F47-I58 HydrophobicContact CE1-CG2 3.41Å; F47-I58 VanDerWaalsContact CE1-CG2 3.41Å; F47-I58 HydrophobicContact CE2-CB 4.05Å; F47-I58 HydrophobicContact CE2-CD1 4.01Å; F47-I58 HydrophobicContact CE2-CG1 4.44Å; F47-I58 HydrophobicContact CE2-CG2 4.32Å; F47-I58 HydrophobicContact CZ-CB 3.69Å; F47-I58 HydrophobicContact CZ-CD1 3.96Å; F47-I58 HydrophobicContact CZ-CG1 4.36Å; F47-I58 HydrophobicContact CZ-CG2 3.48Å; F47-I58 VanDerWaalsContact CZ-CG2 3.48Å; F47-I58 PolarHBondContact N-O 2.95Å; F47-I58 PolarHBondContact O-N 3.08Å; F47-L108 HydrophobicContact CD1-CD2 3.97Å; F47-L108 HydrophobicContact CD2-CD2 3.97Å; F47-L108 HydrophobicContact CE1-CD2 3.7Å; F47-L108 HydrophobicContact CE2-CD2 3.7Å; F47-L108 HydrophobicContact CG-CD2 4.08Å; F47-L108 HydrophobicContact CZ-CD2 3.55Å; F47-L111 HydrophobicContact CE1-CD2 3.69Å; F47-L111 HydrophobicContact CZ-CD2 3.81Å
48	L	89.4	Confident	80.2	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	124.7	170.1	-67.7	168.6	0	0	0	109	T29 S30 C31 L55 T56 L57 T80 Y83	T29-L48 CarbonylContact C-O 3.56Å; T29-L48 VanDerWaalsContact CA-O 3.24Å; T29-L48 WeakPolarHBondContact CA-O 3.14Å; S30-L48 PolarHBondContact N-O 3.24Å; S30-L48 PolarHBondContact O-N 2.81Å; C31-L48 HydrophobicContact CB-CD1 4.06Å; C31-L48 HydrophobicContact CB-CG 4.4Å; L48-L55 HydrophobicContact CB-CD2 4.3Å; L48-L55 HydrophobicContact CB-CG 4.34Å; L48-L55 HydrophobicContact CD1-CD2 3.84Å; L48-L55 HydrophobicContact CD2-CD2 3.89Å; L48-L55 HydrophobicContact CD2-CG 4.3Å; L48-L55 HydrophobicContact CG-CD2 4.21Å; L48-T56 CarbonylContact C-O 3.6Å; L48-T56 WeakPolarHBondContact CA-O 3.49Å; L48-L57 HydrophobicContact CD2-CB 4.12Å; L48-L57 HydrophobicContact CD2-CD1 4.18Å; L48-T80 HydrophobicContact CD2-CG2 4.26Å; L48-Y83 HydrophobicContact CD1-CD1 3.72Å; L48-Y83 HydrophobicContact CD1-CE1 4.32Å; L48-Y83 HydrophobicContact CD2-CD1 3.89Å; L48-Y83 HydrophobicContact CG-CD1 3.53Å; L48-Y83 HydrophobicContact CG-CE1 3.89Å
49	A	89.2	Confident	80.8	Confident	3 Å²	3	33.6 Å²	33.6	3%	0.025	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.2	170.9	0	0	0	0	0	109.6	W26 F47 T56 I58	W26-A49 HydrophobicContact CB-CB 3.98Å; W26-A49 HydrophobicContact CG-CB 4.24Å; F47-A49 HydrophobicContact CD2-CB 4.3Å; F47-A49 HydrophobicContact CE2-CB 3.96Å; A49-T56 PolarHBondContact N-O 3.19Å; A49-T56 PolarHBondContact O-N 3.01Å; A49-I58 HydrophobicContact CB-CD1 3.39Å; A49-I58 HydrophobicContact CB-CG1 3.91Å
50	K	87.8	Confident	81.3	Confident	94 Å²	94	30.2 Å²	30.2	41%	0.409	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.9	174.1	-164.5	177.9	-179.8	178	0	109.9	Y27 R28 G54 L55	Y27-K50 HydrophobicContact CE2-CD 4.5Å; Y27-K50 PolarHBondContact N-O 3.48Å; Y27-K50 WeakPolarHBondContact OH-CD 3.49Å; Y27-K50 WeakPolarHBondContact OH-CE 3.42Å; R28-K50 HydrophobicContact CB-CB 4.35Å; R28-K50 PolarHBondContact O-N 2.86Å; K50-G54 WeakPolarHBondContact CA-O 3.38Å; K50-L55 HydrophobicContact CB-CD1 4.02Å; K50-L55 HydrophobicContact CD-CD1 4.41Å; K50-L55 HydrophobicContact CG-CD1 4.16Å
51	D	81.1	Confident	81.4	Confident	38 Å²	38	33.8 Å²	33.8	20%	0.203	19%	0.189	C	C	.	.			trans	-125.2	-162.7	174.5	65.9	14.1	0	0	0	110.9	Y27 Q53 G54	Y27-D51 WeakPolarHBondContact CE1-O 3.5Å; Y27-D51 PolarHBondContact OH-O 2.93Å; D51-Q53 VanDerWaalsContact C-N 3.26Å; D51-Q53 WeakPolarHBondContact OD1-CA 3.04Å; D51-Q53 WeakPolarHBondContact OD1-CB 3.22Å; D51-Q53 PolarHBondContact OD1-N 2.84Å; D51-Q53 PolarHBondContact OD1-OE1 3.2Å; D51-Q53 PolarHBondContact OD2-OE1 2.97Å; D51-G54 PolarHBondContact N-O 3.08Å; D51-G54 VanDerWaalsContact N-O 3.08Å; D51-G54 PolarHBondContact OD1-N 2.81Å
52	A	72.5	Confident	82	Confident	95 Å²	95	31.9 Å²	31.9	79%	0.785	17%	0.174	S	C	*	.	S	Bend	trans	-76.9	-14.8	178.8	0	0	0	0	0	112.7
53	Q	68.6	Low	82.2	Confident	163 Å²	163	32.3 Å²	32.3	76%	0.762	18%	0.177	S	C	*	.	S	Bend	trans	-98.6	-27.4	-174	-66.9	77.2	1.9	0	0	111.7	D51	D51-Q53 VanDerWaalsContact C-N 3.26Å; D51-Q53 WeakPolarHBondContact OD1-CA 3.04Å; D51-Q53 WeakPolarHBondContact OD1-CB 3.22Å; D51-Q53 PolarHBondContact OD1-N 2.84Å; D51-Q53 PolarHBondContact OD1-OE1 3.2Å; D51-Q53 PolarHBondContact OD2-OE1 2.97Å
54	G	80.2	Confident	82.5	Confident	30 Å²	30	34.7 Å²	34.7	31%	0.309	20%	0.196	S	C	.	.			trans	159.2	-157.7	176.3	0	0	0	0	0	114.1	K50 D51	K50-G54 WeakPolarHBondContact CA-O 3.38Å; D51-G54 PolarHBondContact N-O 3.08Å; D51-G54 VanDerWaalsContact N-O 3.08Å; D51-G54 PolarHBondContact OD1-N 2.81Å
55	L	86.8	Confident	82.7	Confident	65 Å²	65	42 Å²	42	34%	0.34	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.6	169.8	-151.4	82	0	0	0	107.7	L48 K50	L48-L55 HydrophobicContact CB-CD2 4.3Å; L48-L55 HydrophobicContact CB-CG 4.34Å; L48-L55 HydrophobicContact CD1-CD2 3.84Å; L48-L55 HydrophobicContact CD2-CD2 3.89Å; L48-L55 HydrophobicContact CD2-CG 4.3Å; L48-L55 HydrophobicContact CG-CD2 4.21Å; K50-L55 HydrophobicContact CB-CD1 4.02Å; K50-L55 HydrophobicContact CD-CD1 4.41Å; K50-L55 HydrophobicContact CG-CD1 4.16Å
56	T	85.4	Confident	82.4	Confident	16 Å²	16	49.3 Å²	49.3	10%	0.098	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134	-178.6	-57.7	0	0	0	0	108.9	L48 A49 I58 W73 E74	L48-T56 CarbonylContact C-O 3.6Å; L48-T56 WeakPolarHBondContact CA-O 3.49Å; A49-T56 PolarHBondContact N-O 3.19Å; A49-T56 PolarHBondContact O-N 3.01Å; T56-I58 HydrophobicContact CG2-CG1 4.37Å; T56-W73 HydrophobicContact CG2-CB 3.71Å; T56-W73 HydrophobicContact CG2-CG 4.28Å; T56-E74 CarbonylContact C-O 3.58Å; T56-E74 WeakPolarHBondContact CA-O 3.42Å; T56-E74 VanDerWaalsContact CG2-O 3.31Å; T56-E74 WeakPolarHBondContact CG2-O 3.47Å
57	L	82.9	Confident	82.2	Confident	16 Å²	16	57.5 Å²	57.5	8%	0.084	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	118	171.8	176.9	62.3	0	0	0	108.8	L48 W73 E74 L79 T80 Y83	L48-L57 HydrophobicContact CD2-CB 4.12Å; L48-L57 HydrophobicContact CD2-CD1 4.18Å; L57-W73 CarbonylContact O-C 3.58Å; L57-W73 VanDerWaalsContact O-CA 3.31Å; L57-W73 WeakPolarHBondContact O-CA 3.33Å; L57-E74 HydrophobicContact CB-CB 4.37Å; L57-E74 PolarHBondContact N-O 2.66Å; L57-E74 PolarHBondContact O-N 3.47Å; L57-L79 HydrophobicContact CD2-CD2 4.18Å; L57-L79 HydrophobicContact CD2-CG 4.18Å; L57-T80 HydrophobicContact CB-CG2 4.06Å; L57-Y83 HydrophobicContact CD1-CD1 3.86Å; L57-Y83 HydrophobicContact CD1-CD2 3.72Å; L57-Y83 HydrophobicContact CD1-CE1 3.85Å; L57-Y83 HydrophobicContact CD1-CE2 3.73Å; L57-Y83 HydrophobicContact CD1-CG 3.78Å; L57-Y83 HydrophobicContact CD2-CD2 4.13Å; L57-Y83 HydrophobicContact CD2-CG 4.4Å
58	I	83.2	Confident	81.6	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	138.6	178.9	-62.9	-171.2	0	0	0	109.3	W26 S46 F47 A49 T56 W73 L111 W115	W26-I58 HydrophobicContact CD2-CD1 4.27Å; W26-I58 HydrophobicContact CE3-CD1 3.74Å; W26-I58 HydrophobicContact CH2-CD1 4.23Å; W26-I58 HydrophobicContact CZ3-CD1 3.74Å; S46-I58 CarbonylContact C-O 3.53Å; S46-I58 VanDerWaalsContact CA-O 3.27Å; S46-I58 WeakPolarHBondContact CA-O 3.47Å; F47-I58 HydrophobicContact CD1-CB 4.15Å; F47-I58 HydrophobicContact CD1-CG2 4.22Å; F47-I58 HydrophobicContact CD2-CB 4.44Å; F47-I58 HydrophobicContact CE1-CB 3.74Å; F47-I58 HydrophobicContact CE1-CG2 3.41Å; F47-I58 VanDerWaalsContact CE1-CG2 3.41Å; F47-I58 HydrophobicContact CE2-CB 4.05Å; F47-I58 HydrophobicContact CE2-CD1 4.01Å; F47-I58 HydrophobicContact CE2-CG1 4.44Å; F47-I58 HydrophobicContact CE2-CG2 4.32Å; F47-I58 HydrophobicContact CZ-CB 3.69Å; F47-I58 HydrophobicContact CZ-CD1 3.96Å; F47-I58 HydrophobicContact CZ-CG1 4.36Å; F47-I58 HydrophobicContact CZ-CG2 3.48Å; F47-I58 VanDerWaalsContact CZ-CG2 3.48Å; F47-I58 PolarHBondContact N-O 2.95Å; F47-I58 PolarHBondContact O-N 3.08Å; A49-I58 HydrophobicContact CB-CD1 3.39Å; A49-I58 HydrophobicContact CB-CG1 3.91Å; T56-I58 HydrophobicContact CG2-CG1 4.37Å; I58-W73 HydrophobicContact CG1-CB 4.38Å; I58-L111 HydrophobicContact CG2-CD2 4.21Å; I58-W115 HydrophobicContact CG2-CH2 3.63Å; I58-W115 HydrophobicContact CG2-CZ3 3.63Å
59	H	82.3	Confident	80.9	Confident	13 Å²	13	63.8 Å²	63.8	6%	0.06	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	142.9	169.4	-178.9	64.1	0	0	0	112.4	L45 S46 C71 S72 P154 G155	L45-H59 CarbonylContact O-C 3.5Å; L45-H59 WeakPolarHBondContact O-CA 3.39Å; L45-H59 PolarHBondContact O-ND1 2.84Å; L45-H59 VanDerWaalsContact O-ND1 3.09Å; S46-H59 PolarHBondContact OG-ND1 2.8Å; H59-C71 CarbonylContact O-C 3.59Å; H59-C71 WeakPolarHBondContact O-CA 3.38Å; H59-C71 VanDerWaalsContact O-CB 3.29Å; H59-C71 WeakPolarHBondContact O-CB 3.37Å; H59-S72 PolarHBondContact N-O 3.07Å; H59-S72 PolarHBondContact O-N 2.94Å; H59-P154 HydrophobicContact CB-CB 3.8Å; H59-P154 HydrophobicContact CB-CG 3.31Å; H59-P154 VanDerWaalsContact CD2-CA 3.45Å; H59-P154 WeakPolarHBondContact CD2-CA 3.43Å; H59-P154 VanDerWaalsContact CD2-CB 3.49Å; H59-P154 WeakPolarHBondContact CD2-CB 3.34Å; H59-P154 VanDerWaalsContact CE1-CB 3.5Å; H59-P154 WeakPolarHBondContact CE1-CB 3.04Å; H59-P154 WeakPolarHBondContact ND1-CB 3.32Å; H59-P154 WeakPolarHBondContact NE2-CA 3.46Å; H59-G155 PolarHBondContact NE2-N 3.45Å
60	A	82.1	Confident	79.9	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	147.3	175	0	0	0	0	0	111.7	S44 L45 W62 L68 A70 C71 L111	S44-A60 CarbonylContact C-O 3.59Å; S44-A60 WeakPolarHBondContact CA-O 3.4Å; L45-A60 PolarHBondContact N-O 3.33Å; L45-A60 PolarHBondContact O-N 2.78Å; A60-W62 HydrophobicContact CB-CE3 4.4Å; A60-W62 HydrophobicContact CB-CH2 3.28Å; A60-W62 HydrophobicContact CB-CZ2 3.93Å; A60-W62 HydrophobicContact CB-CZ3 3.55Å; A60-W62 WeakPolarHBondContact O-CZ3 3.42Å; A60-L68 HydrophobicContact CB-CD1 3.9Å; A60-A70 CarbonylContact C-O 3.59Å; A60-A70 WeakPolarHBondContact CA-O 3.47Å; A60-C71 HydrophobicContact CB-CB 4.04Å; A60-L111 HydrophobicContact CB-CD1 3.7Å; A60-L111 HydrophobicContact CB-CD2 3.95Å; A60-L111 HydrophobicContact CB-CG 4.28Å
61	R	80.8	Confident	79.3	Confident	81 Å²	81	62.3 Å²	62.3	31%	0.306	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.9	-179.4	-172.2	178.7	70.6	138.1	-0.9	111	G43 Q69 A70	G43-R61 WeakPolarHBondContact O-CA 2.91Å; G43-R61 WeakPolarHBondContact O-CG 3.37Å; R61-Q69 PolarHBondContact O-N 2.04Å; R61-A70 PolarHBondContact N-O 3.17Å; R61-A70 PolarHBondContact O-N 3.31Å
62	W	82.1	Confident	78.9	Confident	17 Å²	17	62.4 Å²	62.4	6%	0.064	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	153.7	176.7	-64.3	-98.9	0	0	0	111.5	N40 L42 G43 L45 A60 R67 L68 L111	N40-W62 WeakPolarHBondContact ND2-CB 3.38Å; L42-W62 VanDerWaalsContact O-CE3 3.27Å; G43-W62 PolarHBondContact O-N 2.93Å; L45-W62 HydrophobicContact CB-CH2 4.13Å; L45-W62 HydrophobicContact CB-CZ3 3.68Å; L45-W62 HydrophobicContact CD2-CH2 4.28Å; A60-W62 HydrophobicContact CB-CE3 4.4Å; A60-W62 HydrophobicContact CB-CH2 3.28Å; A60-W62 HydrophobicContact CB-CZ2 3.93Å; A60-W62 HydrophobicContact CB-CZ3 3.55Å; A60-W62 WeakPolarHBondContact O-CZ3 3.42Å; W62-R67 CarbonylContact C-O 3.59Å; W62-R67 VanDerWaalsContact CA-O 3.22Å; W62-R67 WeakPolarHBondContact CA-O 3.02Å; W62-L68 HydrophobicContact CD2-CD1 4.09Å; W62-L68 HydrophobicContact CG-CD1 4.47Å; W62-L68 HydrophobicContact CH2-CD1 4.5Å; W62-L68 HydrophobicContact CZ2-CD1 3.85Å; W62-L111 HydrophobicContact CH2-CD1 4.02Å; W62-L111 HydrophobicContact CH2-CD2 4.49Å; W62-L111 HydrophobicContact CH2-CG 4.07Å; W62-L111 HydrophobicContact CZ2-CD1 3.62Å; W62-L111 HydrophobicContact CZ2-CG 3.92Å
63	D	76.6	Confident	78.9	Confident	33 Å²	33	63 Å²	63	18%	0.176	31%	0.307	C	S	.	.			trans	-77.8	-179.6	168.2	70.4	10.9	0	0	0	112.3	N40 H65 R66 R67 Q69	N40-D63 PolarHBondContact ND2-O 3.16Å; D63-H65 PolarHBondContact O-N 3.05Å; D63-H65 VanDerWaalsContact OD1-CA 3.25Å; D63-H65 WeakPolarHBondContact OD1-CA 3.36Å; D63-H65 WeakPolarHBondContact OD1-CB 3.41Å; D63-H65 PolarHBondContact OD1-N 3.31Å; D63-R66 PolarHBondContact O-N 2.93Å; D63-R66 PolarHBondContact OD1-N 2.71Å; D63-R67 PolarHBondContact N-O 3.1Å; D63-R67 WeakPolarHBondContact OD1-CB 3.2Å; D63-R67 PolarHBondContact OD1-N 2.86Å; D63-Q69 HydrophobicContact CB-CG 4.06Å
64	A	79.8	Confident	79	Confident	49 Å²	49	57.5 Å²	57.5	41%	0.405	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-22.1	175.8	0	0	0	0	0	113.2	P38 R66	P38-A64 WeakPolarHBondContact O-CB 3.28Å; A64-R66 VanDerWaalsContact C-N 3.34Å
65	H	83.6	Confident	78.6	Confident	155 Å²	155	61.5 Å²	61.5	72%	0.718	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	11.7	178.5	-54.3	92.7	0	0	0	112.6	D63 R67	D63-H65 PolarHBondContact O-N 3.05Å; D63-H65 VanDerWaalsContact OD1-CA 3.25Å; D63-H65 WeakPolarHBondContact OD1-CA 3.36Å; D63-H65 WeakPolarHBondContact OD1-CB 3.41Å; D63-H65 PolarHBondContact OD1-N 3.31Å; H65-R67 HydrophobicContact CB-CG 4.3Å; H65-R67 PolarHBondContact O-N 3.47Å
66	R	80.4	Confident	77.8	Confident	154 Å²	154	61.6 Å²	61.6	58%	0.581	29%	0.294	S	S	*	.			trans	60.3	29.3	-177.7	-59.8	-174.2	-106.5	-132.2	-2.6	113.7	N40 D63 A64	N40-R66 HydrophobicContact CB-CG 4.48Å; D63-R66 PolarHBondContact O-N 2.93Å; D63-R66 PolarHBondContact OD1-N 2.71Å; A64-R66 VanDerWaalsContact C-N 3.34Å
67	R	81.5	Confident	77.3	Confident	178 Å²	178	64.7 Å²	64.7	67%	0.672	32%	0.315	S	S	*	.			trans	-91.3	129.6	171.3	-57.2	179.5	63.7	165.7	-1	109.9	W62 D63 H65 Q69	W62-R67 CarbonylContact C-O 3.59Å; W62-R67 VanDerWaalsContact CA-O 3.22Å; W62-R67 WeakPolarHBondContact CA-O 3.02Å; D63-R67 PolarHBondContact N-O 3.1Å; D63-R67 WeakPolarHBondContact OD1-CB 3.2Å; D63-R67 PolarHBondContact OD1-N 2.86Å; H65-R67 HydrophobicContact CB-CG 4.3Å; H65-R67 PolarHBondContact O-N 3.47Å; R67-Q69 PolarHBondContact O-N 3.18Å
68	L	77.4	Confident	76.1	Confident	36 Å²	36	68.8 Å²	68.8	19%	0.188	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	119	179.1	-172.3	69.5	0	0	0	109.5	A60 W62 C71 L111 Q114 C118	A60-L68 HydrophobicContact CB-CD1 3.9Å; W62-L68 HydrophobicContact CD2-CD1 4.09Å; W62-L68 HydrophobicContact CG-CD1 4.47Å; W62-L68 HydrophobicContact CH2-CD1 4.5Å; W62-L68 HydrophobicContact CZ2-CD1 3.85Å; L68-C71 HydrophobicContact CD1-CB 4.4Å; L68-C71 HydrophobicContact CD2-CB 4.47Å; L68-L111 HydrophobicContact CD1-CD1 4.04Å; L68-L111 HydrophobicContact CD2-CD1 4.25Å; L68-Q114 HydrophobicContact CD2-CB 3.88Å; L68-C118 VanDerWaalsContact CD2-SG 3.58Å
69	Q	73.9	Confident	75.2	Confident	101 Å²	101	69.8 Å²	69.8	47%	0.472	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-33.9	179.7	-72.3	-159.6	-20.8	0	0	112.8	R61 D63 R67	R61-Q69 PolarHBondContact O-N 2.04Å; D63-Q69 HydrophobicContact CB-CG 4.06Å; R67-Q69 PolarHBondContact O-N 3.18Å
70	A	69.7	Low	75	Confident	43 Å²	43	69.5 Å²	69.5	36%	0.355	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	146.8	-178.9	0	0	0	0	0	110.3	A60 R61	A60-A70 CarbonylContact C-O 3.59Å; A60-A70 WeakPolarHBondContact CA-O 3.47Å; R61-A70 PolarHBondContact N-O 3.17Å; R61-A70 PolarHBondContact O-N 3.31Å
71	C	74.8	Confident	74.7	Confident	22 Å²	22	72.5 Å²	72.5	15%	0.149	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	153.5	166.5	76.6	0	0	0	0	112.2	H59 A60 L68 W115 C118	H59-C71 CarbonylContact O-C 3.59Å; H59-C71 WeakPolarHBondContact O-CA 3.38Å; H59-C71 VanDerWaalsContact O-CB 3.29Å; H59-C71 WeakPolarHBondContact O-CB 3.37Å; A60-C71 HydrophobicContact CB-CB 4.04Å; L68-C71 HydrophobicContact CD1-CB 4.4Å; L68-C71 HydrophobicContact CD2-CB 4.47Å; C71-W115 HydrophobicContact CB-CE3 4.21Å; C71-W115 HydrophobicContact CB-CH2 3.76Å; C71-W115 HydrophobicContact CB-CZ2 4.45Å; C71-W115 HydrophobicContact CB-CZ3 3.63Å; C71-W115 VanDerWaalsContact SG-CD2 3.59Å; C71-W115 VanDerWaalsContact SG-CH2 3.58Å; C71-W115 WeakPolarHBondContact SG-CZ3 3.2Å; C71-C118 HydrophobicContact CB-CB 4.19Å; C71-C118 WeakPolarHBondContact CB-SG 3.49Å; C71-C118 PolarHBondContact N-SG 2.91Å; C71-C118 WeakPolarHBondContact SG-CB 3.34Å; C71-C118 CovalentContact SG-SG 2Å; C71-C118 PolarHBondContact SG-SG 3.03Å
72	S	71.9	Confident	73.9	Confident	41 Å²	41	69.5 Å²	69.5	29%	0.287	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	156	-178.2	58.5	0	0	0	0	111.4	H59 W115	H59-S72 PolarHBondContact N-O 3.07Å; H59-S72 PolarHBondContact O-N 2.94Å; S72-W115 WeakPolarHBondContact O-CH2 3.4Å
73	W	74.1	Confident	73.6	Confident	107 Å²	107	69.2 Å²	69.2	41%	0.405	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	148.8	171.7	71.5	58	0	0	0	110	L24 T56 L57 I58 W115	L24-W73 HydrophobicContact CD1-CE3 4.49Å; L24-W73 HydrophobicContact CD1-CH2 4.5Å; L24-W73 HydrophobicContact CD1-CZ3 3.73Å; L24-W73 HydrophobicContact CD2-CE3 3.96Å; L24-W73 HydrophobicContact CD2-CZ3 3.95Å; L24-W73 HydrophobicContact CG-CZ3 4.5Å; T56-W73 HydrophobicContact CG2-CB 3.71Å; T56-W73 HydrophobicContact CG2-CG 4.28Å; L57-W73 CarbonylContact O-C 3.58Å; L57-W73 VanDerWaalsContact O-CA 3.31Å; L57-W73 WeakPolarHBondContact O-CA 3.33Å; I58-W73 HydrophobicContact CG1-CB 4.38Å; W73-W115 HydrophobicContact CB-CZ2 4.14Å; W73-W115 HydrophobicContact CD2-CZ2 4.21Å; W73-W115 AromaticContact CE3-CE2 3.46Å; W73-W115 VanDerWaalsContact CE3-CE2 3.46Å; W73-W115 AromaticContact CE3-CZ2 3.44Å; W73-W115 HydrophobicContact CE3-CZ2 3.44Å; W73-W115 VanDerWaalsContact CE3-CZ2 3.44Å; W73-W115 AromaticContact CE3-NE1 3.12Å; W73-W115 AromaticContact CZ3-CD1 3.71Å; W73-W115 AromaticContact CZ3-CE2 3.78Å; W73-W115 HydrophobicContact CZ3-CZ2 4.22Å; W73-W115 AromaticContact CZ3-NE1 2.93Å
74	E	69.1	Low	73.9	Confident	47 Å²	47	68.3 Å²	68.3	22%	0.22	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	124.3	174.7	-73.1	-59	156.9	0	0	111.2	T56 L57 L79 W151	T56-E74 CarbonylContact C-O 3.58Å; T56-E74 WeakPolarHBondContact CA-O 3.42Å; T56-E74 VanDerWaalsContact CG2-O 3.31Å; T56-E74 WeakPolarHBondContact CG2-O 3.47Å; L57-E74 HydrophobicContact CB-CB 4.37Å; L57-E74 PolarHBondContact N-O 2.66Å; L57-E74 PolarHBondContact O-N 3.47Å; E74-L79 HydrophobicContact CB-CD2 3.97Å; E74-L79 HydrophobicContact CG-CD2 4.11Å; E74-W151 HydrophobicContact CG-CZ2 3.81Å; E74-W151 WeakPolarHBondContact OE1-CZ2 3.49Å; E74-W151 PolarHBondContact OE1-NE1 3.36Å
75	D	72.3	Confident	73.7	Confident	115 Å²	115	67.8 Å²	67.8	62%	0.615	35%	0.348	S	S	*	.			trans	-104.3	10.5	-178.7	64.8	-9.8	0	0	0	112.9	P77	D75-P77 WeakPolarHBondContact O-CD 3.5Å
76	E	70.4	Confident	73	Confident	66 Å²	66	60.9 Å²	60.9	31%	0.308	32%	0.317	S	S	.	.			trans	-64.6	119.1	177.6	-170.2	172	-160.8	0	0	110.6	E78 L79 T80	E76-E78 VanDerWaalsContact C-N 3.3Å; E76-E78 PolarHBondContact O-N 3.2Å; E76-L79 HydrophobicContact CB-CB 4.07Å; E76-L79 HydrophobicContact CG-CB 4.43Å; E76-L79 PolarHBondContact O-N 3.12Å; E76-T80 WeakPolarHBondContact O-CG2 3.46Å; E76-T80 PolarHBondContact O-N 3.26Å; E76-T80 PolarHBondContact O-OG1 3.35Å
77	P	73.8	Confident	73.1	Confident	82 Å²	82	53.6 Å²	53.6	53%	0.532	29%	0.29	S	S	.	.	H	α-helix	trans	-66	-33	-171.1	20.7	-26.8	0	0	0	112.4	D75 T80 A81	D75-P77 WeakPolarHBondContact O-CD 3.5Å; P77-T80 WeakPolarHBondContact CA-OG1 3.31Å; P77-T80 PolarHBondContact O-OG1 2.71Å; P77-T80 VanDerWaalsContact O-OG1 3.08Å; P77-A81 WeakPolarHBondContact O-CB 3.46Å; P77-A81 PolarHBondContact O-N 2.77Å
78	E	59	Low	73.1	Confident	102 Å²	102	49 Å²	49	48%	0.477	28%	0.284	S	S	.	.	H	α-helix	trans	-70.2	-40.2	177.5	-62.9	76.2	-168	0	0	111.9	E76 A82 V239	E76-E78 VanDerWaalsContact C-N 3.3Å; E76-E78 PolarHBondContact O-N 3.2Å; E78-A82 VanDerWaalsContact O-CB 3.32Å; E78-A82 WeakPolarHBondContact O-CB 3.32Å; E78-A82 PolarHBondContact O-N 2.9Å; E78-V239 HydrophobicContact CB-CG1 3.62Å
79	L	62.8	Low	72.6	Confident	23 Å²	23	53 Å²	53	12%	0.12	30%	0.302	C	S	.	.	H	α-helix	trans	-69.4	-44.5	177.9	-176.8	64.3	0	0	0	111.6	L57 E74 E76 A81 A82 Y83	L57-L79 HydrophobicContact CD2-CD2 4.18Å; L57-L79 HydrophobicContact CD2-CG 4.18Å; E74-L79 HydrophobicContact CB-CD2 3.97Å; E74-L79 HydrophobicContact CG-CD2 4.11Å; E76-L79 HydrophobicContact CB-CB 4.07Å; E76-L79 HydrophobicContact CG-CB 4.43Å; E76-L79 PolarHBondContact O-N 3.12Å; L79-A81 VanDerWaalsContact C-N 3.34Å; L79-A82 PolarHBondContact O-N 2.71Å; L79-Y83 WeakPolarHBondContact O-CB 3.46Å; L79-Y83 PolarHBondContact O-N 3.16Å
80	T	78.8	Confident	72.3	Confident	8 Å²	8	49.1 Å²	49.1	5%	0.049	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-37.1	176.9	54.4	0	0	0	0	111.7	L48 L57 E76 P77 G84	L48-T80 HydrophobicContact CD2-CG2 4.26Å; L57-T80 HydrophobicContact CB-CG2 4.06Å; E76-T80 WeakPolarHBondContact O-CG2 3.46Å; E76-T80 PolarHBondContact O-N 3.26Å; E76-T80 PolarHBondContact O-OG1 3.35Å; P77-T80 WeakPolarHBondContact CA-OG1 3.31Å; P77-T80 PolarHBondContact O-OG1 2.71Å; P77-T80 VanDerWaalsContact O-OG1 3.08Å; T80-G84 PolarHBondContact O-N 2.95Å
81	A	76.2	Confident	71.7	Confident	62 Å²	62	53.3 Å²	53.3	51%	0.512	31%	0.306	S	S	.	.	H	α-helix	trans	-66.1	-44.4	172.3	0	0	0	0	0	112.3	P77 L79 G84 A85	P77-A81 WeakPolarHBondContact O-CB 3.46Å; P77-A81 PolarHBondContact O-N 2.77Å; L79-A81 VanDerWaalsContact C-N 3.34Å; A81-G84 PolarHBondContact O-N 3.03Å; A81-A85 WeakPolarHBondContact O-CB 3.45Å; A81-A85 PolarHBondContact O-N 3.2Å
82	A	64.6	Low	70.5	Confident	18 Å²	18	56.8 Å²	56.8	15%	0.149	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-48.7	177.3	0	0	0	0	0	111.4	E78 L79 G84 A85 L86 V239	E78-A82 VanDerWaalsContact O-CB 3.32Å; E78-A82 WeakPolarHBondContact O-CB 3.32Å; E78-A82 PolarHBondContact O-N 2.9Å; L79-A82 PolarHBondContact O-N 2.71Å; A82-G84 VanDerWaalsContact C-N 3.33Å; A82-G84 PolarHBondContact O-N 3.41Å; A82-A85 PolarHBondContact O-N 3.4Å; A82-L86 WeakPolarHBondContact O-CD1 3.21Å; A82-L86 WeakPolarHBondContact O-CG 3.47Å; A82-L86 PolarHBondContact O-N 2.91Å; A82-V239 HydrophobicContact CB-CG2 4.48Å
83	Y	75.6	Confident	69.8	Low	11 Å²	11	60.4 Å²	60.4	4%	0.043	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-40.1	176.6	-172.4	-83.9	0	0	0	112.2	C31 L33 S46 L48 L57 L79 L86 C87 F96	C31-Y83 HydrophobicContact CB-CD1 4.22Å; C31-Y83 HydrophobicContact CB-CE1 3.68Å; C31-Y83 VanDerWaalsContact O-CE1 3.23Å; C31-Y83 WeakPolarHBondContact O-CE1 3.14Å; C31-Y83 PolarHBondContact O-OH 2.95Å; L33-Y83 WeakPolarHBondContact CB-OH 3.47Å; S46-Y83 VanDerWaalsContact C-OH 3.24Å; S46-Y83 WeakPolarHBondContact CB-OH 3.49Å; S46-Y83 PolarHBondContact O-OH 3.34Å; L48-Y83 HydrophobicContact CD1-CD1 3.72Å; L48-Y83 HydrophobicContact CD1-CE1 4.32Å; L48-Y83 HydrophobicContact CD2-CD1 3.89Å; L48-Y83 HydrophobicContact CG-CD1 3.53Å; L48-Y83 HydrophobicContact CG-CE1 3.89Å; L57-Y83 HydrophobicContact CD1-CD1 3.86Å; L57-Y83 HydrophobicContact CD1-CD2 3.72Å; L57-Y83 HydrophobicContact CD1-CE1 3.85Å; L57-Y83 HydrophobicContact CD1-CE2 3.73Å; L57-Y83 HydrophobicContact CD1-CG 3.78Å; L57-Y83 HydrophobicContact CD2-CD2 4.13Å; L57-Y83 HydrophobicContact CD2-CG 4.4Å; L79-Y83 WeakPolarHBondContact O-CB 3.46Å; L79-Y83 PolarHBondContact O-N 3.16Å; Y83-L86 PolarHBondContact O-N 2.87Å; Y83-C87 WeakPolarHBondContact O-CB 3.33Å; Y83-C87 PolarHBondContact O-N 3.09Å; Y83-F96 AromaticContact CE1-CE1 3.87Å; Y83-F96 HydrophobicContact CE1-CE1 3.87Å; Y83-F96 AromaticContact CE2-CE1 3.96Å; Y83-F96 HydrophobicContact CE2-CE1 3.96Å; Y83-F96 HydrophobicContact CE2-CZ 4.43Å; Y83-F96 AromaticContact CZ-CE1 3.54Å
84	G	81.9	Confident	69.5	Low	15 Å²	15	60.3 Å²	60.3	16%	0.155	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-40.9	174.9	0	0	0	0	0	113.3	T80 A81 A82 S88	T80-G84 PolarHBondContact O-N 2.95Å; A81-G84 PolarHBondContact O-N 3.03Å; A82-G84 VanDerWaalsContact C-N 3.33Å; A82-G84 PolarHBondContact O-N 3.41Å; G84-S88 WeakPolarHBondContact O-CB 3.42Å; G84-S88 PolarHBondContact O-N 3.33Å; G84-S88 PolarHBondContact O-OG 3Å
85	A	75.8	Confident	69.5	Low	37 Å²	37	59.6 Å²	59.6	31%	0.306	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-47.4	174.7	0	0	0	0	0	110.8	A81 A82 C87 S88 H89 W283	A81-A85 WeakPolarHBondContact O-CB 3.45Å; A81-A85 PolarHBondContact O-N 3.2Å; A82-A85 PolarHBondContact O-N 3.4Å; A85-C87 VanDerWaalsContact C-N 3.35Å; A85-C87 PolarHBondContact O-N 2.84Å; A85-S88 WeakPolarHBondContact O-CB 3.41Å; A85-S88 PolarHBondContact O-N 2.77Å; A85-H89 PolarHBondContact O-CD2 2.83Å; A85-H89 PolarHBondContact O-N 2.79Å; A85-W283 HydrophobicContact CB-CH2 3.91Å; A85-W283 HydrophobicContact CB-CZ3 4.19Å
86	L	69.5	Low	69.9	Low	10 Å²	10	54.6 Å²	54.6	5%	0.052	33%	0.332	C	S	.	.	H	α-helix	trans	-54.7	-50.5	176.7	-76.2	154.3	0	0	0	112.1	A82 Y83 S88 H89 D90 F96 I231 W283	A82-L86 WeakPolarHBondContact O-CD1 3.21Å; A82-L86 WeakPolarHBondContact O-CG 3.47Å; A82-L86 PolarHBondContact O-N 2.91Å; Y83-L86 PolarHBondContact O-N 2.87Å; L86-S88 VanDerWaalsContact C-N 3.3Å; L86-S88 PolarHBondContact O-N 2.98Å; L86-H89 PolarHBondContact O-N 3.32Å; L86-D90 WeakPolarHBondContact O-CB 3.19Å; L86-D90 PolarHBondContact O-N 2.79Å; L86-F96 HydrophobicContact CB-CE2 4.38Å; L86-F96 HydrophobicContact CB-CZ 4.31Å; L86-I231 HydrophobicContact CD1-CB 3.9Å; L86-I231 HydrophobicContact CD1-CD1 3.66Å; L86-I231 HydrophobicContact CD1-CG1 3.36Å; L86-I231 HydrophobicContact CD1-CG2 3.73Å; L86-I231 HydrophobicContact CD2-CG1 4.05Å; L86-I231 HydrophobicContact CG-CG1 4.29Å; L86-W283 HydrophobicContact CB-CH2 4.41Å; L86-W283 HydrophobicContact CD2-CD2 4.3Å; L86-W283 VanDerWaalsContact CD2-CE2 3.46Å; L86-W283 HydrophobicContact CD2-CH2 3.83Å; L86-W283 HydrophobicContact CD2-CZ2 3.23Å; L86-W283 HydrophobicContact CG-CH2 3.73Å; L86-W283 HydrophobicContact CG-CZ2 3.56Å
87	C	82.6	Confident	70.5	Confident	2 Å²	2	54 Å²	54	1%	0.014	33%	0.33	C	S	.	.	H	α-helix	trans	-57.4	-40.8	175.1	165.9	0	0	0	0	113.1	C31 Y83 A85 H89 F96 H98	C31-C87 WeakPolarHBondContact CA-SG 3.13Å; C31-C87 HydrophobicContact CB-CB 3.42Å; C31-C87 VanDerWaalsContact CB-CB 3.42Å; C31-C87 WeakPolarHBondContact CB-SG 3.32Å; C31-C87 WeakPolarHBondContact SG-CB 3.45Å; C31-C87 CovalentContact SG-SG 2.02Å; C31-C87 PolarHBondContact SG-SG 3.46Å; Y83-C87 WeakPolarHBondContact O-CB 3.33Å; Y83-C87 PolarHBondContact O-N 3.09Å; A85-C87 VanDerWaalsContact C-N 3.35Å; A85-C87 PolarHBondContact O-N 2.84Å; C87-H89 VanDerWaalsContact C-N 3.27Å; C87-H89 PolarHBondContact O-N 3.25Å; C87-F96 HydrophobicContact CB-CD1 3.98Å; C87-F96 HydrophobicContact CB-CD2 4.37Å; C87-F96 HydrophobicContact CB-CE1 4.17Å; C87-F96 HydrophobicContact CB-CG 4.08Å; C87-F96 HydrophobicContact CB-CZ 4.46Å; C87-H98 PolarHBondContact O-CE1 3.2Å; C87-H98 VanDerWaalsContact O-CE1 3.3Å; C87-H98 PolarHBondContact O-NE2 2.95Å; C87-H98 PolarHBondContact SG-CE1 2.99Å
88	S	80.9	Confident	70.8	Confident	80 Å²	80	55.5 Å²	55.5	56%	0.559	33%	0.33	S	S	*	.	H	α-helix	trans	-69.1	-28	-179.6	-55.6	0	0	0	0	112.7	G84 A85 L86	G84-S88 WeakPolarHBondContact O-CB 3.42Å; G84-S88 PolarHBondContact O-N 3.33Å; G84-S88 PolarHBondContact O-OG 3Å; A85-S88 WeakPolarHBondContact O-CB 3.41Å; A85-S88 PolarHBondContact O-N 2.77Å; L86-S88 VanDerWaalsContact C-N 3.3Å; L86-S88 PolarHBondContact O-N 2.98Å
89	H	66.7	Low	71.9	Confident	122 Å²	122	54.6 Å²	54.6	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-101.7	-5	-175.9	-74.2	-80.9	0	0	0	113.9	A85 L86 C87 T91 W283	A85-H89 PolarHBondContact O-CD2 2.83Å; A85-H89 PolarHBondContact O-N 2.79Å; L86-H89 PolarHBondContact O-N 3.32Å; C87-H89 VanDerWaalsContact C-N 3.27Å; C87-H89 PolarHBondContact O-N 3.25Å; H89-T91 PolarHBondContact O-N 3.32Å; H89-W283 HydrophobicContact CB-CD2 4.49Å; H89-W283 HydrophobicContact CB-CE3 3.37Å; H89-W283 HydrophobicContact CB-CZ3 3.68Å; H89-W283 AromaticContact CD2-CE3 3.98Å; H89-W283 AromaticContact CD2-CZ3 3.55Å; H89-W283 AromaticContact CG-CE3 3.71Å; H89-W283 AromaticContact CG-CZ3 3.75Å
90	D	67.5	Low	72.9	Confident	18 Å²	18	55 Å²	55	10%	0.096	34%	0.344	C	S	.	.			trans	-80.5	38.7	177.7	-166.6	47.9	0	0	0	113.6	L86 A92 R93 S95 F96	L86-D90 WeakPolarHBondContact O-CB 3.19Å; L86-D90 PolarHBondContact O-N 2.79Å; D90-A92 VanDerWaalsContact C-N 3.25Å; D90-A92 PolarHBondContact O-N 2.89Å; D90-R93 WeakPolarHBondContact OD1-CB 3.43Å; D90-S95 PolarHBondContact OD1-OG 2.83Å; D90-S95 VanDerWaalsContact OD2-CA 3.23Å; D90-S95 WeakPolarHBondContact OD2-CA 3.36Å; D90-S95 WeakPolarHBondContact OD2-CB 3.38Å; D90-S95 PolarHBondContact OD2-N 3.29Å; D90-S95 PolarHBondContact OD2-OG 3.22Å; D90-F96 HydrophobicContact CB-CD2 3.56Å; D90-F96 HydrophobicContact CB-CE2 4.09Å; D90-F96 WeakPolarHBondContact OD2-CD2 3.16Å; D90-F96 PolarHBondContact OD2-N 3.45Å; D90-F96 VanDerWaalsContact OD2-N 3.14Å
91	T	57.7	Low	73.2	Confident	131 Å²	131	56.3 Å²	56.3	80%	0.804	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-19.9	-178.3	38.6	0	0	0	0	113.4	H89	H89-T91 PolarHBondContact O-N 3.32Å
92	A	48.6	Very low	73.6	Confident	96 Å²	96	58 Å²	58	79%	0.793	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-24.8	-174.2	0	0	0	0	0	115.3	D90	D90-A92 VanDerWaalsContact C-N 3.25Å; D90-A92 PolarHBondContact O-N 2.89Å
93	R	58.5	Low	74.5	Confident	117 Å²	117	61.7 Å²	61.7	44%	0.442	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-9.3	-174.8	-64.3	173.2	154.8	-179.5	-13.5	113.9	D90 S95 R225	D90-R93 WeakPolarHBondContact OD1-CB 3.43Å; R93-S95 PolarHBondContact O-N 3.18Å; R93-S95 VanDerWaalsContact O-N 3.09Å; R93-R225 PolarHBondContact NH2-O 3.49Å
94	S	66.4	Low	75.1	Confident	105 Å²	105	61.6 Å²	61.6	73%	0.734	38%	0.379	S	S	*	.			trans	47.2	37.5	179.7	61.7	0	0	0	0	113.7
95	S	70.9	Confident	75.4	Confident	31 Å²	31	66.1 Å²	66.1	22%	0.217	40%	0.396	C	S	.	.			trans	-73.6	-34.5	176	-31.9	0	0	0	0	110.4	L33 D90 R93	L33-S95 VanDerWaalsContact CD1-O 3.32Å; L33-S95 WeakPolarHBondContact CD1-O 3.47Å; D90-S95 PolarHBondContact OD1-OG 2.83Å; D90-S95 VanDerWaalsContact OD2-CA 3.23Å; D90-S95 WeakPolarHBondContact OD2-CA 3.36Å; D90-S95 WeakPolarHBondContact OD2-CB 3.38Å; D90-S95 PolarHBondContact OD2-N 3.29Å; D90-S95 PolarHBondContact OD2-OG 3.22Å; R93-S95 PolarHBondContact O-N 3.18Å; R93-S95 VanDerWaalsContact O-N 3.09Å
96	F	80.1	Confident	75.8	Confident	10 Å²	10	72.1 Å²	72.1	4%	0.044	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.3	176.9	-67.2	-89.5	0	0	0	112.6	C31 L33 Y83 L86 C87 D90 H98	C31-F96 HydrophobicContact CB-CD1 4.25Å; L33-F96 HydrophobicContact CB-CD1 3.99Å; L33-F96 HydrophobicContact CB-CE1 3.88Å; Y83-F96 AromaticContact CE1-CE1 3.87Å; Y83-F96 HydrophobicContact CE1-CE1 3.87Å; Y83-F96 AromaticContact CE2-CE1 3.96Å; Y83-F96 HydrophobicContact CE2-CE1 3.96Å; Y83-F96 HydrophobicContact CE2-CZ 4.43Å; Y83-F96 AromaticContact CZ-CE1 3.54Å; L86-F96 HydrophobicContact CB-CE2 4.38Å; L86-F96 HydrophobicContact CB-CZ 4.31Å; C87-F96 HydrophobicContact CB-CD1 3.98Å; C87-F96 HydrophobicContact CB-CD2 4.37Å; C87-F96 HydrophobicContact CB-CE1 4.17Å; C87-F96 HydrophobicContact CB-CG 4.08Å; C87-F96 HydrophobicContact CB-CZ 4.46Å; D90-F96 HydrophobicContact CB-CD2 3.56Å; D90-F96 HydrophobicContact CB-CE2 4.09Å; D90-F96 WeakPolarHBondContact OD2-CD2 3.16Å; D90-F96 PolarHBondContact OD2-N 3.45Å; D90-F96 VanDerWaalsContact OD2-N 3.14Å; F96-H98 PolarHBondContact O-CD2 3.46Å
97	I	82.1	Confident	76.5	Confident	54 Å²	54	72.2 Å²	72.2	28%	0.277	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	108.3	173	-56.8	171	0	0	0	108.4	H32 T34 A99 L104	H32-I97 HydrophobicContact CB-CB 4.22Å; H32-I97 WeakPolarHBondContact CB-O 3.38Å; H32-I97 PolarHBondContact N-O 3.01Å; H32-I97 PolarHBondContact ND1-O 3.04Å; H32-I97 WeakPolarHBondContact O-CB 3.38Å; H32-I97 PolarHBondContact O-N 2.79Å; T34-I97 HydrophobicContact CG2-CD1 3.96Å; T34-I97 WeakPolarHBondContact OG1-CD1 3.46Å; I97-A99 VanDerWaalsContact CG2-O 3.25Å; I97-A99 WeakPolarHBondContact CG2-O 3.35Å; I97-L104 HydrophobicContact CB-CD2 4.45Å; I97-L104 HydrophobicContact CD1-CD2 4.27Å; I97-L104 HydrophobicContact CG2-CD2 4.11Å
98	H	79.5	Confident	76.7	Confident	114 Å²	114	72.7 Å²	72.7	53%	0.528	42%	0.416	S	S	.	.	S	Bend	trans	-85.7	-28.6	176.4	-63.3	-87.9	0	0	0	112.8	C87 F96	C87-H98 PolarHBondContact O-CE1 3.2Å; C87-H98 VanDerWaalsContact O-CE1 3.3Å; C87-H98 PolarHBondContact O-NE2 2.95Å; C87-H98 PolarHBondContact SG-CE1 2.99Å; F96-H98 PolarHBondContact O-CD2 3.46Å
99	A	83.3	Confident	76.9	Confident	83 Å²	83	72.5 Å²	72.5	69%	0.686	42%	0.419	S	S	*	.	S	Bend	trans	-115.5	100.9	176.6	0	0	0	0	0	109.6	I97 G101	I97-A99 VanDerWaalsContact CG2-O 3.25Å; I97-A99 WeakPolarHBondContact CG2-O 3.35Å; A99-G101 PolarHBondContact O-N 3Å
100	P	83.6	Confident	77.7	Confident	32 Å²	32	69.1 Å²	69.1	21%	0.208	41%	0.407	C	S	.	.			trans	-70.9	126.2	-175.6	27.9	-33.4	0	0	0	111.1	L104 Q105 L108	P100-L104 HydrophobicContact CB-CB 4.13Å; P100-L104 HydrophobicContact CB-CD2 3.58Å; P100-L104 HydrophobicContact CB-CG 3.73Å; P100-Q105 HydrophobicContact CB-CG 4.06Å; P100-Q105 HydrophobicContact CG-CG 4.1Å; P100-Q105 PolarHBondContact O-NE2 3.21Å; P100-L108 HydrophobicContact CB-CD1 4.43Å
101	G	84.9	Confident	78.3	Confident	35 Å²	35	68.2 Å²	68.2	36%	0.361	40%	0.402	S	S	.	.			trans	-70.6	175.4	171.4	0	0	0	0	0	113.2	A99 E103 L104 Q105	A99-G101 PolarHBondContact O-N 3Å; G101-E103 VanDerWaalsContact C-N 3.3Å; G101-E103 PolarHBondContact O-N 3.49Å; G101-L104 PolarHBondContact O-N 3.49Å; G101-L104 VanDerWaalsContact O-N 3.16Å; G101-Q105 WeakPolarHBondContact O-CG 3.32Å; G101-Q105 PolarHBondContact O-N 3.01Å
102	P	84.8	Confident	79.5	Confident	96 Å²	96	63.4 Å²	63.4	62%	0.623	37%	0.373	S	S	*	.	H	α-helix	trans	-62.1	-33.2	-170.9	23.3	-33.8	0	0	0	113.9	R106	P102-R106 PolarHBondContact O-N 3Å; P102-R106 VanDerWaalsContact O-N 3.11Å
103	E	84.4	Confident	80.7	Confident	97 Å²	97	63.5 Å²	63.5	45%	0.453	37%	0.367	S	S	.	.	H	α-helix	trans	-68	-45.7	176.5	-64.4	-167.8	151.2	0	0	112.1	P41 L42 G101 R106 A107	P41-E103 WeakPolarHBondContact CG-OE2 2.9Å; L42-E103 HydrophobicContact CD1-CB 4.27Å; G101-E103 VanDerWaalsContact C-N 3.3Å; G101-E103 PolarHBondContact O-N 3.49Å; E103-R106 PolarHBondContact O-N 3.15Å; E103-A107 PolarHBondContact O-N 3.34Å; E103-A107 VanDerWaalsContact O-N 3.07Å
104	L	86.7	Confident	81.5	Confident	8 Å²	8	61 Å²	61	4%	0.042	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-40	178.7	176.9	54.7	0	0	0	111.3	H32 T34 L42 L45 I97 P100 G101 R106 A107 L108	H32-L104 HydrophobicContact CB-CD2 3.78Å; T34-L104 HydrophobicContact CG2-CD1 4.31Å; T34-L104 HydrophobicContact CG2-CD2 4.41Å; L42-L104 HydrophobicContact CD2-CB 4.42Å; L42-L104 HydrophobicContact CD2-CD1 4.14Å; L45-L104 HydrophobicContact CD1-CD1 3.5Å; L45-L104 VanDerWaalsContact CD1-CD1 3.5Å; L45-L104 HydrophobicContact CD2-CD1 3.49Å; L45-L104 VanDerWaalsContact CD2-CD1 3.49Å; L45-L104 HydrophobicContact CG-CD1 4.11Å; I97-L104 HydrophobicContact CB-CD2 4.45Å; I97-L104 HydrophobicContact CD1-CD2 4.27Å; I97-L104 HydrophobicContact CG2-CD2 4.11Å; P100-L104 HydrophobicContact CB-CB 4.13Å; P100-L104 HydrophobicContact CB-CD2 3.58Å; P100-L104 HydrophobicContact CB-CG 3.73Å; G101-L104 PolarHBondContact O-N 3.49Å; G101-L104 VanDerWaalsContact O-N 3.16Å; L104-R106 VanDerWaalsContact C-N 3.31Å; L104-R106 PolarHBondContact O-N 3.06Å; L104-A107 PolarHBondContact O-N 3.36Å; L104-L108 HydrophobicContact CD1-CD1 4.25Å; L104-L108 HydrophobicContact CD1-CG 4.15Å; L104-L108 HydrophobicContact CG-CD1 4.1Å; L104-L108 HydrophobicContact CG-CG 4.48Å; L104-L108 WeakPolarHBondContact O-CB 3.5Å; L104-L108 WeakPolarHBondContact O-CG 3.37Å; L104-L108 PolarHBondContact O-N 3.05Å
105	Q	88.2	Confident	81.8	Confident	110 Å²	110	56.6 Å²	56.6	51%	0.514	33%	0.328	S	S	.	.	H	α-helix	trans	-59.1	-42.2	173.7	-73.1	175.4	-8.3	0	0	111.9	P100 G101 L108 A109	P100-Q105 HydrophobicContact CB-CG 4.06Å; P100-Q105 HydrophobicContact CG-CG 4.1Å; P100-Q105 PolarHBondContact O-NE2 3.21Å; G101-Q105 WeakPolarHBondContact O-CG 3.32Å; G101-Q105 PolarHBondContact O-N 3.01Å; Q105-L108 PolarHBondContact O-N 3.45Å; Q105-A109 WeakPolarHBondContact O-CB 3.39Å; Q105-A109 PolarHBondContact O-N 3.46Å
106	R	85.4	Confident	81.4	Confident	163 Å²	163	58.7 Å²	58.7	62%	0.615	34%	0.335	S	S	*	.	H	α-helix	trans	-62.5	-44.6	175.9	-167.3	-176.5	-61.7	146.1	2	111.3	P102 E103 L104 A109 T110	P102-R106 PolarHBondContact O-N 3Å; P102-R106 VanDerWaalsContact O-N 3.11Å; E103-R106 PolarHBondContact O-N 3.15Å; L104-R106 VanDerWaalsContact C-N 3.31Å; L104-R106 PolarHBondContact O-N 3.06Å; R106-A109 PolarHBondContact O-N 3.26Å; R106-T110 VanDerWaalsContact O-CG2 3.3Å; R106-T110 WeakPolarHBondContact O-CG2 3.34Å; R106-T110 PolarHBondContact O-N 2.88Å; R106-T110 PolarHBondContact O-OG1 3.17Å; R106-T110 VanDerWaalsContact O-OG1 3.13Å
107	A	83.6	Confident	80.6	Confident	12 Å²	12	62.5 Å²	62.5	10%	0.099	37%	0.368	C	S	.	.	H	α-helix	trans	-60.7	-47.5	176.5	0	0	0	0	0	111.9	L42 E103 L104 A109 T110 L111	L42-A107 HydrophobicContact CD1-CB 3.73Å; E103-A107 PolarHBondContact O-N 3.34Å; E103-A107 VanDerWaalsContact O-N 3.07Å; L104-A107 PolarHBondContact O-N 3.36Å; A107-A109 VanDerWaalsContact C-N 3.3Å; A107-A109 PolarHBondContact O-N 3.28Å; A107-T110 PolarHBondContact O-N 3.41Å; A107-T110 PolarHBondContact O-OG1 2.99Å; A107-L111 PolarHBondContact O-N 3.08Å
108	L	87.4	Confident	79.4	Confident	13 Å²	13	61.8 Å²	61.8	7%	0.068	37%	0.367	C	S	.	.	H	α-helix	trans	-60.5	-36.4	177.1	-71.3	170	0	0	0	113	T29 L45 F47 P100 L104 Q105 P112	T29-L108 HydrophobicContact CG2-CD2 4.42Å; L45-L108 HydrophobicContact CD2-CD2 3.8Å; L45-L108 HydrophobicContact CD2-CG 4.25Å; F47-L108 HydrophobicContact CD1-CD2 3.97Å; F47-L108 HydrophobicContact CD2-CD2 3.97Å; F47-L108 HydrophobicContact CE1-CD2 3.7Å; F47-L108 HydrophobicContact CE2-CD2 3.7Å; F47-L108 HydrophobicContact CG-CD2 4.08Å; F47-L108 HydrophobicContact CZ-CD2 3.55Å; P100-L108 HydrophobicContact CB-CD1 4.43Å; L104-L108 HydrophobicContact CD1-CD1 4.25Å; L104-L108 HydrophobicContact CD1-CG 4.15Å; L104-L108 HydrophobicContact CG-CD1 4.1Å; L104-L108 HydrophobicContact CG-CG 4.48Å; L104-L108 WeakPolarHBondContact O-CB 3.5Å; L104-L108 WeakPolarHBondContact O-CG 3.37Å; L104-L108 PolarHBondContact O-N 3.05Å; Q105-L108 PolarHBondContact O-N 3.45Å; L108-P112 VanDerWaalsContact O-CD 3.28Å; L108-P112 WeakPolarHBondContact O-CD 3.49Å
109	A	84.5	Confident	78.2	Confident	75 Å²	75	62.5 Å²	62.5	62%	0.62	37%	0.365	S	S	*	.	H	α-helix	trans	-73.3	-31.3	177.3	0	0	0	0	0	113	Q105 R106 A107	Q105-A109 WeakPolarHBondContact O-CB 3.39Å; Q105-A109 PolarHBondContact O-N 3.46Å; R106-A109 PolarHBondContact O-N 3.26Å; A107-A109 VanDerWaalsContact C-N 3.3Å; A107-A109 PolarHBondContact O-N 3.28Å
110	T	83.1	Confident	76.3	Confident	51 Å²	51	60.9 Å²	60.9	31%	0.313	36%	0.357	S	S	.	.	H	α-helix	trans	-89.1	-16.4	-179.9	61.3	0	0	0	0	114.1	R106 A107 S113 Q114	R106-T110 VanDerWaalsContact O-CG2 3.3Å; R106-T110 WeakPolarHBondContact O-CG2 3.34Å; R106-T110 PolarHBondContact O-N 2.88Å; R106-T110 PolarHBondContact O-OG1 3.17Å; R106-T110 VanDerWaalsContact O-OG1 3.13Å; A107-T110 PolarHBondContact O-N 3.41Å; A107-T110 PolarHBondContact O-OG1 2.99Å; T110-S113 PolarHBondContact O-OG 3.06Å; T110-Q114 PolarHBondContact O-N 3.35Å; T110-Q114 PolarHBondContact O-NE2 3.23Å
111	L	81.3	Confident	74	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-60.2	-47.4	-179.7	-116.6	-33	0	0	0	114	W26 F47 I58 A60 W62 L68 A107 S113 Q114 W115	W26-L111 HydrophobicContact CH2-CB 4.15Å; W26-L111 HydrophobicContact CH2-CD2 4.44Å; W26-L111 HydrophobicContact CZ2-CB 3.9Å; W26-L111 HydrophobicContact CZ2-CD2 4.37Å; F47-L111 HydrophobicContact CE1-CD2 3.69Å; F47-L111 HydrophobicContact CZ-CD2 3.81Å; I58-L111 HydrophobicContact CG2-CD2 4.21Å; A60-L111 HydrophobicContact CB-CD1 3.7Å; A60-L111 HydrophobicContact CB-CD2 3.95Å; A60-L111 HydrophobicContact CB-CG 4.28Å; W62-L111 HydrophobicContact CH2-CD1 4.02Å; W62-L111 HydrophobicContact CH2-CD2 4.49Å; W62-L111 HydrophobicContact CH2-CG 4.07Å; W62-L111 HydrophobicContact CZ2-CD1 3.62Å; W62-L111 HydrophobicContact CZ2-CG 3.92Å; L68-L111 HydrophobicContact CD1-CD1 4.04Å; L68-L111 HydrophobicContact CD2-CD1 4.25Å; A107-L111 PolarHBondContact O-N 3.08Å; L111-S113 VanDerWaalsContact C-N 3.28Å; L111-S113 PolarHBondContact O-N 3.45Å; L111-Q114 PolarHBondContact O-N 3.07Å; L111-W115 HydrophobicContact CD1-CE3 4.27Å; L111-W115 HydrophobicContact CD1-CZ3 4.37Å; L111-W115 HydrophobicContact CD2-CE3 4.45Å; L111-W115 HydrophobicContact CD2-CZ3 4.1Å; L111-W115 PolarHBondContact O-N 3.34Å
112	P	81.6	Confident	71.5	Confident	30 Å²	30	72 Å²	72	20%	0.195	41%	0.408	C	S	.	.	H	α-helix	trans	-59.4	-38.2	-176	-18.4	24.6	0	0	0	113.2	W26 L108 W115	W26-P112 HydrophobicContact CH2-CB 4.06Å; W26-P112 HydrophobicContact CH2-CG 3.72Å; W26-P112 HydrophobicContact CZ2-CB 4.2Å; W26-P112 VanDerWaalsContact CZ2-CD 3.48Å; W26-P112 HydrophobicContact CZ2-CG 3.35Å; W26-P112 HydrophobicContact CZ3-CG 4.46Å; L108-P112 VanDerWaalsContact O-CD 3.28Å; L108-P112 WeakPolarHBondContact O-CD 3.49Å; P112-W115 WeakPolarHBondContact O-CB 3.27Å; P112-W115 PolarHBondContact O-N 3.33Å
113	S	74.8	Confident	69.3	Low	97 Å²	97	74.6 Å²	74.6	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-75.5	-26.5	-178.5	59.8	0	0	0	0	112.8	T110 L111 W115	T110-S113 PolarHBondContact O-OG 3.06Å; L111-S113 VanDerWaalsContact C-N 3.28Å; L111-S113 PolarHBondContact O-N 3.45Å; S113-W115 VanDerWaalsContact C-N 3.32Å
114	Q	75.6	Confident	66.7	Low	65 Å²	65	75 Å²	75	30%	0.304	43%	0.426	S	S	.	.	H	α-helix	trans	-85.8	-7.8	173.6	-66.7	178	57.6	0	0	112.5	L68 T110 L111 E116 A117	L68-Q114 HydrophobicContact CD2-CB 3.88Å; T110-Q114 PolarHBondContact O-N 3.35Å; T110-Q114 PolarHBondContact O-NE2 3.23Å; L111-Q114 PolarHBondContact O-N 3.07Å; Q114-E116 PolarHBondContact O-N 2.88Å; Q114-A117 VanDerWaalsContact O-CB 3.27Å; Q114-A117 WeakPolarHBondContact O-CB 3.44Å; Q114-A117 PolarHBondContact O-N 2.92Å; Q114-A117 VanDerWaalsContact O-N 3.09Å
115	W	71.7	Confident	64.3	Low	13 Å²	13	80.4 Å²	80.4	5%	0.049	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-66.1	-34.3	-170.4	-162.4	-86.9	0	0	0	113.8	L24 W26 I58 C71 S72 W73 L111 P112 S113 A117 C118	L24-W115 HydrophobicContact CD1-CG 4.42Å; W26-W115 HydrophobicContact CH2-CE3 4.22Å; I58-W115 HydrophobicContact CG2-CH2 3.63Å; I58-W115 HydrophobicContact CG2-CZ3 3.63Å; C71-W115 HydrophobicContact CB-CE3 4.21Å; C71-W115 HydrophobicContact CB-CH2 3.76Å; C71-W115 HydrophobicContact CB-CZ2 4.45Å; C71-W115 HydrophobicContact CB-CZ3 3.63Å; C71-W115 VanDerWaalsContact SG-CD2 3.59Å; C71-W115 VanDerWaalsContact SG-CH2 3.58Å; C71-W115 WeakPolarHBondContact SG-CZ3 3.2Å; S72-W115 WeakPolarHBondContact O-CH2 3.4Å; W73-W115 HydrophobicContact CB-CZ2 4.14Å; W73-W115 HydrophobicContact CD2-CZ2 4.21Å; W73-W115 AromaticContact CE3-CE2 3.46Å; W73-W115 VanDerWaalsContact CE3-CE2 3.46Å; W73-W115 AromaticContact CE3-CZ2 3.44Å; W73-W115 HydrophobicContact CE3-CZ2 3.44Å; W73-W115 VanDerWaalsContact CE3-CZ2 3.44Å; W73-W115 AromaticContact CE3-NE1 3.12Å; W73-W115 AromaticContact CZ3-CD1 3.71Å; W73-W115 AromaticContact CZ3-CE2 3.78Å; W73-W115 HydrophobicContact CZ3-CZ2 4.22Å; W73-W115 AromaticContact CZ3-NE1 2.93Å; L111-W115 HydrophobicContact CD1-CE3 4.27Å; L111-W115 HydrophobicContact CD1-CZ3 4.37Å; L111-W115 HydrophobicContact CD2-CE3 4.45Å; L111-W115 HydrophobicContact CD2-CZ3 4.1Å; L111-W115 PolarHBondContact O-N 3.34Å; P112-W115 WeakPolarHBondContact O-CB 3.27Å; P112-W115 PolarHBondContact O-N 3.33Å; S113-W115 VanDerWaalsContact C-N 3.32Å; W115-A117 PolarHBondContact O-N 2.86Å; W115-C118 WeakPolarHBondContact O-CB 3.43Å; W115-C118 PolarHBondContact O-N 3.37Å
116	E	63.8	Low	61.9	Low	75 Å²	75	80.7 Å²	80.7	35%	0.35	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-62.1	-23.5	176.1	-68.4	-65.6	180	0	0	112.4	S21 Q114 C118 R119	S21-E116 WeakPolarHBondContact CB-OE1 3.04Å; Q114-E116 PolarHBondContact O-N 2.88Å; E116-C118 PolarHBondContact O-N 3.46Å; E116-R119 WeakPolarHBondContact O-CB 3.46Å; E116-R119 PolarHBondContact O-N 2.85Å; E116-R119 IonicContact OE1-NH2 3.09Å; E116-R119 PolarHBondContact OE1-NH2 2.8Å; E116-R119 IonicContact OE2-CZ 3.09Å; E116-R119 IonicContact OE2-NE 3.34Å; E116-R119 PolarHBondContact OE2-NE 3.49Å; E116-R119 IonicContact OE2-NH2 2.71Å; E116-R119 PolarHBondContact OE2-NH2 2.91Å
117	A	61.6	Low	59.7	Low	89 Å²	89	76.4 Å²	76.4	74%	0.736	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-72.3	-15.4	173.9	0	0	0	0	0	113.5	Q114 W115	Q114-A117 VanDerWaalsContact O-CB 3.27Å; Q114-A117 WeakPolarHBondContact O-CB 3.44Å; Q114-A117 PolarHBondContact O-N 2.92Å; Q114-A117 VanDerWaalsContact O-N 3.09Å; W115-A117 PolarHBondContact O-N 2.86Å
118	C	58.9	Low	57.2	Low	40 Å²	40	80.4 Å²	80.4	27%	0.27	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-86.2	-15	173	-61	0	0	0	0	113.1	L68 C71 W115 E116 G120	L68-C118 VanDerWaalsContact CD2-SG 3.58Å; C71-C118 HydrophobicContact CB-CB 4.19Å; C71-C118 WeakPolarHBondContact CB-SG 3.49Å; C71-C118 PolarHBondContact N-SG 2.91Å; C71-C118 WeakPolarHBondContact SG-CB 3.34Å; C71-C118 CovalentContact SG-SG 2Å; C71-C118 PolarHBondContact SG-SG 3.03Å; W115-C118 WeakPolarHBondContact O-CB 3.43Å; W115-C118 PolarHBondContact O-N 3.37Å; E116-C118 PolarHBondContact O-N 3.46Å; C118-G120 PolarHBondContact O-N 3.44Å
119	R	53.2	Low	54.6	Low	128 Å²	128	91.5 Å²	91.5	48%	0.483	56%	0.562	S	S	.	*	S	Bend	trans	-72.2	101.7	167.3	-156	-172.9	-57.6	-107.2	4.2	105.7	E116	E116-R119 WeakPolarHBondContact O-CB 3.46Å; E116-R119 PolarHBondContact O-N 2.85Å; E116-R119 IonicContact OE1-NH2 3.09Å; E116-R119 PolarHBondContact OE1-NH2 2.8Å; E116-R119 IonicContact OE2-CZ 3.09Å; E116-R119 IonicContact OE2-NE 3.34Å; E116-R119 PolarHBondContact OE2-NE 3.49Å; E116-R119 IonicContact OE2-NH2 2.71Å; E116-R119 PolarHBondContact OE2-NH2 2.91Å
120	G	43.6	Very low	52.2	Low	49 Å²	49	97 Å²	97	51%	0.505	57%	0.572	S	S	.	*	P	Polyproline II helix	trans	-49.1	155.9	173.2	0	0	0	0	0	110.8	C118 E122	C118-G120 PolarHBondContact O-N 3.44Å; G120-E122 PolarHBondContact O-N 3.13Å; G120-E122 VanDerWaalsContact O-N 3.14Å
121	P	35.6	Very low	49.9	Very low	131 Å²	131	104.1 Å²	104.1	85%	0.851	60%	0.599	S	S	*	*	S	Bend	trans	-50.6	125	-171.8	18.3	-30.2	0	0	0	110.8	E123	P121-E123 PolarHBondContact O-N 2.93Å
122	E	32.7	Very low	47.5	Very low	171 Å²	171	115.3 Å²	115.3	80%	0.799	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-49.7	123.8	-177.5	-81.6	-166.2	140.8	0	0	110.8	G120 S124	G120-E122 PolarHBondContact O-N 3.13Å; G120-E122 VanDerWaalsContact O-N 3.14Å; E122-S124 PolarHBondContact O-N 2.82Å
123	E	38.1	Very low	45.2	Very low	149 Å²	149	118.5 Å²	118.5	70%	0.696	67%	0.67	S	S	*	*			trans	-62.3	109.8	165.4	-70.9	-170.6	152.5	0	0	108.4	P121 R146	P121-E123 PolarHBondContact O-N 2.93Å; E123-R146 IonicContact OE1-CZ 3.7Å; E123-R146 IonicContact OE1-NH1 3.61Å; E123-R146 IonicContact OE1-NH2 2.86Å; E123-R146 PolarHBondContact OE1-NH2 3.47Å
124	S	29.9	Very low	43.4	Very low	107 Å²	107	119.2 Å²	119.2	75%	0.748	68%	0.682	S	S	*	*			trans	-53.9	139.6	165.2	-80.3	0	0	0	0	109.7	E122 A126	E122-S124 PolarHBondContact O-N 2.82Å; S124-A126 PolarHBondContact O-N 3.45Å
125	P	36	Very low	41.2	Very low	121 Å²	121	119.6 Å²	119.6	79%	0.786	70%	0.703	S	S	*	*			trans	-55.9	133.1	-175.4	-20.9	29.8	0	0	0	111.1	G127	P125-G127 PolarHBondContact O-N 2.94Å
126	A	36.9	Very low	39.8	Very low	116 Å²	116	128.1 Å²	128.1	96%	0.959	74%	0.744	S	S	*	*	S	Bend	trans	-53.6	96.7	173	0	0	0	0	0	110.6	S124	S124-A126 PolarHBondContact O-N 3.45Å
127	G	39.4	Very low	38.4	Very low	73 Å²	73	130.6 Å²	130.6	75%	0.753	77%	0.769	S	S	*	*			trans	-173.2	38.2	-168.9	0	0	0	0	0	116.8	P125	P125-G127 PolarHBondContact O-N 2.94Å
128	A	31.3	Very low	37	Very low	95 Å²	95	129.8 Å²	129.8	79%	0.785	77%	0.769	S	S	*	*			trans	-163.4	84.7	156.5	0	0	0	0	0	111	K130	A128-K130 VanDerWaalsContact C-N 3.26Å; A128-K130 PolarHBondContact O-N 2.83Å
129	R	33.4	Very low	35.7	Very low	247 Å²	247	134.3 Å²	134.3	93%	0.932	80%	0.796	S	S	*	*			trans	-74.2	80.3	168.3	-163	177.3	-168	171.5	3.2	108.9	K131	R129-K131 PolarHBondContact O-N 3.13Å
130	K	34.8	Very low	34.9	Very low	191 Å²	191	134.7 Å²	134.7	83%	0.83	82%	0.815	S	S	*	*			trans	-78.9	103.3	160.8	-103.8	-180	178.7	175.2	0	107.7	A128 R132	A128-K130 VanDerWaalsContact C-N 3.26Å; A128-K130 PolarHBondContact O-N 2.83Å; K130-R132 PolarHBondContact O-N 3.03Å; K130-R132 VanDerWaalsContact O-N 3.12Å
131	K	34.1	Very low	34.3	Very low	199 Å²	199	135.5 Å²	135.5	87%	0.865	82%	0.823	S	S	*	*			trans	-51.8	114.4	163.1	-101.4	-179	170	-178.1	0	107.6	R129	R129-K131 PolarHBondContact O-N 3.13Å
132	R	31.1	Very low	34.5	Very low	235 Å²	235	132.8 Å²	132.8	89%	0.887	82%	0.819	S	S	*	*			trans	-105.7	132	156.1	-80.1	-172.7	177.9	176.9	0.1	108.2	K130	K130-R132 PolarHBondContact O-N 3.03Å; K130-R132 VanDerWaalsContact O-N 3.12Å
133	A	33	Very low	34.4	Very low	98 Å²	98	127.8 Å²	127.8	81%	0.81	81%	0.814	S	S	*	*			trans	-64	149.6	-175.6	0	0	0	0	0	111.2	G135	A133-G135 PolarHBondContact O-N 3.39Å
134	A	36.5	Very low	34.4	Very low	112 Å²	112	129.9 Å²	129.9	93%	0.926	82%	0.823	S	S	*	*			trans	-61.6	119	169	0	0	0	0	0	109.5
135	G	30.1	Very low	34.7	Very low	73 Å²	73	132.7 Å²	132.7	75%	0.753	82%	0.824	S	S	*	*			trans	-129.4	118.3	166	0	0	0	0	0	107.9	A133	A133-G135 PolarHBondContact O-N 3.39Å
136	Q	41	Very low	35.1	Very low	192 Å²	192	136.4 Å²	136.4	90%	0.897	82%	0.823	S	S	*	*			trans	-71.4	130.4	175.5	-64.8	170	10	0	0	109.6
137	S	36.1	Very low	35.5	Very low	126 Å²	126	136.6 Å²	136.6	88%	0.881	80%	0.804	S	S	*	*			trans	160.5	132.3	136.6	40.6	0	0	0	0	112.2
138	G	31.8	Very low	35.8	Very low	72 Å²	72	142.7 Å²	142.7	74%	0.742	81%	0.809	S	S	*	*			trans	104.5	105.7	148.6	0	0	0	0	0	120
139	V	30.1	Very low	37.1	Very low	135 Å²	135	147.5 Å²	147.5	82%	0.818	81%	0.807	S	S	*	*			trans	72.8	122.6	150	-166.6	0	0	0	0	119.1	G141	V139-G141 PolarHBondContact O-N 3.38Å
140	P	37.7	Very low	38.3	Very low	136 Å²	136	136.4 Å²	136.4	88%	0.883	77%	0.77	S	S	*	*			trans	-82.6	80.7	172.9	33.9	-29.7	0	0	0	110.4
141	G	30.3	Very low	39.8	Very low	66 Å²	66	132.2 Å²	132.2	68%	0.68	75%	0.749	S	S	*	*			trans	-80.7	122.1	163.5	0	0	0	0	0	109.5	V139 G143	V139-G141 PolarHBondContact O-N 3.38Å; G141-G143 PolarHBondContact O-N 3.39Å
142	G	40.9	Very low	41.7	Very low	75 Å²	75	123.7 Å²	123.7	77%	0.773	71%	0.714	S	S	*	*			trans	-43.7	102	-172.6	0	0	0	0	0	114.2	H144	G142-H144 PolarHBondContact O-N 3.02Å
143	G	29.4	Very low	43.7	Very low	66 Å²	66	114.1 Å²	114.1	68%	0.68	68%	0.679	S	S	*	*			trans	-67.2	114.8	160.7	0	0	0	0	0	107.2	G141 Q145	G141-G143 PolarHBondContact O-N 3.39Å; G143-Q145 VanDerWaalsContact C-N 3.28Å; G143-Q145 PolarHBondContact O-N 2.73Å
144	H	38.5	Very low	45.2	Very low	192 Å²	192	110.4 Å²	110.4	89%	0.889	65%	0.647	S	S	*	*			trans	-53.1	102	161.1	-72.9	-81.3	0	0	0	106.7	G142 R146	G142-H144 PolarHBondContact O-N 3.02Å; H144-R146 PolarHBondContact O-N 3.21Å; H144-R146 VanDerWaalsContact O-N 3.08Å
145	Q	35.6	Very low	46.8	Very low	166 Å²	166	105.5 Å²	105.5	78%	0.776	61%	0.607	S	S	*	*			trans	-54.4	121.6	166.4	-76.5	-169.9	6	0	0	105.3	G143 E147	G143-Q145 VanDerWaalsContact C-N 3.28Å; G143-Q145 PolarHBondContact O-N 2.73Å; Q145-E147 PolarHBondContact O-N 3.1Å
146	R	44.2	Very low	49.2	Very low	200 Å²	200	102.2 Å²	102.2	76%	0.755	57%	0.572	S	S	*	*			trans	-68	85.8	172.1	-173.4	175.8	179.5	-169.6	-5.4	106.3	E123 H144 K148	E123-R146 IonicContact OE1-CZ 3.7Å; E123-R146 IonicContact OE1-NH1 3.61Å; E123-R146 IonicContact OE1-NH2 2.86Å; E123-R146 PolarHBondContact OE1-NH2 3.47Å; H144-R146 PolarHBondContact O-N 3.21Å; H144-R146 VanDerWaalsContact O-N 3.08Å; R146-K148 PolarHBondContact O-N 2.87Å; R146-K148 VanDerWaalsContact O-N 3.16Å
147	E	46	Very low	51.3	Low	120 Å²	120	94 Å²	94	56%	0.561	53%	0.534	S	S	*	.			trans	-60.7	115.6	170.2	-75.6	171.1	177.1	0	0	107	Q145 R149	Q145-E147 PolarHBondContact O-N 3.1Å; E147-R149 PolarHBondContact O-N 2.04Å
148	K	45.6	Very low	54	Low	201 Å²	201	88.8 Å²	88.8	87%	0.874	50%	0.495	S	S	*	.			trans	-68.5	93.7	166.8	-73.1	-178.9	178.8	179.4	0	106.2	R146 G150	R146-K148 PolarHBondContact O-N 2.87Å; R146-K148 VanDerWaalsContact O-N 3.16Å; K148-G150 PolarHBondContact O-N 2.83Å
149	R	57.8	Low	56.7	Low	196 Å²	196	85.9 Å²	85.9	74%	0.74	46%	0.464	S	S	*	.			trans	-59.3	125.3	174.1	-66.7	-175.6	-177.5	-168.2	-1.3	108.7	E147	E147-R149 PolarHBondContact O-N 2.04Å
150	G	59.9	Low	59.3	Low	14 Å²	14	81.1 Å²	81.1	14%	0.144	44%	0.442	C	S	.	.			trans	-64.3	158.3	174.5	0	0	0	0	0	111.4	K148 V161 D163 S164	K148-G150 PolarHBondContact O-N 2.83Å; G150-V161 CarbonylContact C-O 3.54Å; G150-V161 WeakPolarHBondContact CA-O 3.48Å; G150-D163 WeakPolarHBondContact CA-O 3.21Å; G150-D163 PolarHBondContact N-O 3.18Å; G150-S164 PolarHBondContact O-OG 2.77Å
151	W	65.8	Low	61	Low	102 Å²	102	77.5 Å²	77.5	39%	0.386	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	113.2	172.3	175.9	86.6	0	0	0	108.3	E74 G160 V161	E74-W151 HydrophobicContact CG-CZ2 3.81Å; E74-W151 WeakPolarHBondContact OE1-CZ2 3.49Å; E74-W151 PolarHBondContact OE1-NE1 3.36Å; W151-G160 CarbonylContact O-C 3.6Å; W151-G160 WeakPolarHBondContact O-CA 3.13Å; W151-V161 HydrophobicContact CE3-CG2 4.42Å; W151-V161 PolarHBondContact N-O 3.21Å; W151-V161 PolarHBondContact O-N 3.15Å
152	T	73.9	Confident	63.2	Low	21 Å²	21	76.2 Å²	76.2	13%	0.129	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	151.5	-176.3	61	0	0	0	0	110.7	T156 L157 C159 G162	T152-T156 PolarHBondContact OG1-O 2.75Å; T152-L157 VanDerWaalsContact CG2-O 3.23Å; T152-L157 WeakPolarHBondContact CG2-O 3.32Å; T152-C159 CarbonylContact C-O 3.51Å; T152-G162 WeakPolarHBondContact CG2-O 3.35Å
153	M	72.5	Confident	65.1	Low	33 Å²	33	75.6 Å²	75.6	16%	0.163	38%	0.383	C	S	.	.			trans	-54.9	132	175	176.8	-173.4	-85.3	0	0	108.3	G155 T156 C159 I228 I231 V232	M153-G155 PolarHBondContact O-N 2.89Å; M153-T156 HydrophobicContact CB-CG2 4.21Å; M153-T156 WeakPolarHBondContact CB-OG1 3.33Å; M153-T156 HydrophobicContact CG-CG2 4.42Å; M153-T156 PolarHBondContact N-OG1 2.9Å; M153-T156 WeakPolarHBondContact O-CA 3.45Å; M153-T156 WeakPolarHBondContact O-CB 3.05Å; M153-T156 PolarHBondContact O-N 2.89Å; M153-T156 PolarHBondContact O-OG1 2.76Å; M153-T156 HydrophobicContact SD-CG2 4.4Å; M153-C159 HydrophobicContact CB-CB 4.05Å; M153-C159 WeakPolarHBondContact CB-O 3.33Å; M153-C159 PolarHBondContact N-O 2.83Å; M153-I228 HydrophobicContact SD-CG2 4.07Å; M153-I231 HydrophobicContact CE-CB 4.06Å; M153-I231 HydrophobicContact CE-CG2 3.57Å; M153-V232 HydrophobicContact CE-CB 4.41Å; M153-V232 HydrophobicContact CE-CG2 3.53Å; M153-V232 HydrophobicContact SD-CG2 3.5Å; M153-V232 WeakPolarHBondContact SD-CG2 3.36Å
154	P	65.7	Low	67.5	Low	21 Å²	21	74.2 Å²	74.2	14%	0.136	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-27.1	121.6	163	-46	47	0	0	0	116.6	H59 T156 F174	H59-P154 HydrophobicContact CB-CB 3.8Å; H59-P154 HydrophobicContact CB-CG 3.31Å; H59-P154 VanDerWaalsContact CD2-CA 3.45Å; H59-P154 WeakPolarHBondContact CD2-CA 3.43Å; H59-P154 VanDerWaalsContact CD2-CB 3.49Å; H59-P154 WeakPolarHBondContact CD2-CB 3.34Å; H59-P154 VanDerWaalsContact CE1-CB 3.5Å; H59-P154 WeakPolarHBondContact CE1-CB 3.04Å; H59-P154 WeakPolarHBondContact ND1-CB 3.32Å; H59-P154 WeakPolarHBondContact NE2-CA 3.46Å; P154-T156 PolarHBondContact O-N 2.93Å; P154-F174 VanDerWaalsContact O-CD2 3.32Å; P154-F174 WeakPolarHBondContact O-CD2 3.32Å; P154-F174 VanDerWaalsContact O-CE2 3.23Å; P154-F174 WeakPolarHBondContact O-CE2 3.11Å
155	G	69.1	Low	69.6	Low	8 Å²	8	65.5 Å²	65.5	8%	0.082	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	5.4	-179.9	0	0	0	0	0	115.6	H59 M153 G172 V173 F174	H59-G155 PolarHBondContact NE2-N 3.45Å; M153-G155 PolarHBondContact O-N 2.89Å; G155-G172 CarbonylContact O-C 3.43Å; G155-V173 PolarHBondContact O-N 3.01Å; G155-F174 PolarHBondContact O-N 3.05Å
156	T	81.4	Confident	71.4	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.025	31%	0.314	C	S	.	.			trans	-119.4	155	172.1	76.7	0	0	0	0	109.5	T152 M153 P154 C159 F174 D178	T152-T156 PolarHBondContact OG1-O 2.75Å; M153-T156 HydrophobicContact CB-CG2 4.21Å; M153-T156 WeakPolarHBondContact CB-OG1 3.33Å; M153-T156 HydrophobicContact CG-CG2 4.42Å; M153-T156 PolarHBondContact N-OG1 2.9Å; M153-T156 WeakPolarHBondContact O-CA 3.45Å; M153-T156 WeakPolarHBondContact O-CB 3.05Å; M153-T156 PolarHBondContact O-N 2.89Å; M153-T156 PolarHBondContact O-OG1 2.76Å; M153-T156 HydrophobicContact SD-CG2 4.4Å; P154-T156 PolarHBondContact O-N 2.93Å; T156-C159 HydrophobicContact CG2-CB 4.13Å; T156-C159 WeakPolarHBondContact OG1-CB 3.38Å; T156-F174 HydrophobicContact CG2-CB 4.19Å; T156-F174 HydrophobicContact CG2-CD2 4.25Å; T156-D178 VanDerWaalsContact CB-OD1 3.23Å; T156-D178 WeakPolarHBondContact CB-OD1 3.41Å; T156-D178 HydrophobicContact CG2-CB 4.25Å
157	L	85.4	Confident	73.2	Confident	19 Å²	19	54.6 Å²	54.6	10%	0.099	30%	0.299	C	S	.	.	S	Bend	trans	-109.1	-10	176.7	-60.4	177.6	0	0	0	112.9	T152 D163 S164 A165 E170 D178	T152-L157 VanDerWaalsContact CG2-O 3.23Å; T152-L157 WeakPolarHBondContact CG2-O 3.32Å; L157-D163 CarbonylContact O-C 3.57Å; L157-D163 VanDerWaalsContact O-CA 3.27Å; L157-D163 WeakPolarHBondContact O-CA 3.48Å; L157-D163 VanDerWaalsContact O-CB 3.31Å; L157-D163 WeakPolarHBondContact O-CB 3.09Å; L157-S164 PolarHBondContact O-N 3.13Å; L157-A165 HydrophobicContact CB-CB 3.98Å; L157-A165 HydrophobicContact CD1-CB 4.24Å; L157-E170 HydrophobicContact CD1-CB 4.06Å; L157-E170 HydrophobicContact CD1-CG 3.55Å; L157-D178 PolarHBondContact N-OD1 3.49Å; L157-D178 PolarHBondContact N-OD2 3.03Å
158	W	91.9	Very high	74.9	Confident	17 Å²	17	52.4 Å²	52.4	6%	0.064	30%	0.296	C	S	.	.	S	Bend	trans	-126.3	-21.4	-173.3	-58.6	87.7	0	0	0	113	G160 D163 A165 E170 D178 C181 R182	W158-G160 PolarHBondContact O-N 3.23Å; W158-D163 HydrophobicContact CD2-CB 4.14Å; W158-D163 HydrophobicContact CE3-CB 3.71Å; W158-D163 HydrophobicContact CZ3-CB 4Å; W158-A165 HydrophobicContact CH2-CB 4.3Å; W158-A165 HydrophobicContact CZ2-CB 3.56Å; W158-E170 PolarHBondContact NE1-O 2.03Å; W158-D178 WeakPolarHBondContact CA-OD1 3.23Å; W158-D178 VanDerWaalsContact CB-OD1 3.32Å; W158-D178 WeakPolarHBondContact CB-OD1 3.27Å; W158-D178 PolarHBondContact N-OD1 3.42Å; W158-C181 HydrophobicContact CB-CB 3.92Å; W158-R182 HydrophobicContact CB-CB 3.97Å; W158-R182 HydrophobicContact CD2-CB 3.58Å; W158-R182 HydrophobicContact CD2-CG 3.48Å; W158-R182 VanDerWaalsContact CD2-CG 3.48Å; W158-R182 HydrophobicContact CE3-CB 4.03Å; W158-R182 HydrophobicContact CE3-CG 3.72Å; W158-R182 HydrophobicContact CG-CB 3.53Å; W158-R182 HydrophobicContact CG-CG 3.99Å; W158-R182 HydrophobicContact CH2-CG 4.11Å; W158-R182 HydrophobicContact CZ2-CG 3.86Å; W158-R182 HydrophobicContact CZ3-CG 4.02Å
159	C	89.6	Confident	76.8	Confident	12 Å²	12	47 Å²	47	8%	0.081	28%	0.284	C	S	.	.	S	Bend	trans	-78.6	77.8	-176.3	-58.1	0	0	0	0	112.8	T152 M153 T156 P177 C181 V232	T152-C159 CarbonylContact C-O 3.51Å; M153-C159 HydrophobicContact CB-CB 4.05Å; M153-C159 WeakPolarHBondContact CB-O 3.33Å; M153-C159 PolarHBondContact N-O 2.83Å; T156-C159 HydrophobicContact CG2-CB 4.13Å; T156-C159 WeakPolarHBondContact OG1-CB 3.38Å; C159-P177 PolarHBondContact SG-O 3.33Å; C159-P177 VanDerWaalsContact SG-O 3.41Å; C159-C181 WeakPolarHBondContact CA-SG 3.45Å; C159-C181 HydrophobicContact CB-CB 3.78Å; C159-C181 WeakPolarHBondContact CB-SG 3.49Å; C159-C181 WeakPolarHBondContact SG-CB 3.3Å; C159-C181 CovalentContact SG-SG 2.02Å; C159-C181 PolarHBondContact SG-SG 3.14Å; C159-V232 HydrophobicContact CB-CG2 4.44Å
160	G	83.8	Confident	78	Confident	34 Å²	34	41.2 Å²	41.2	35%	0.351	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	172.3	-148	171.4	0	0	0	0	0	114.9	W151 W158 G162	W151-G160 CarbonylContact O-C 3.6Å; W151-G160 WeakPolarHBondContact O-CA 3.13Å; W158-G160 PolarHBondContact O-N 3.23Å; G160-G162 PolarHBondContact O-N 2.92Å
161	V	72.9	Confident	79.4	Confident	60 Å²	60	42.6 Å²	42.6	36%	0.364	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	97.4	179.7	-177.2	0	0	0	0	109.2	G150 W151 F205	G150-V161 CarbonylContact C-O 3.54Å; G150-V161 WeakPolarHBondContact CA-O 3.48Å; W151-V161 HydrophobicContact CE3-CG2 4.42Å; W151-V161 PolarHBondContact N-O 3.21Å; W151-V161 PolarHBondContact O-N 3.15Å; V161-F205 HydrophobicContact CG2-CD2 4.26Å
162	G	77.6	Confident	80	Confident	39 Å²	39	38.2 Å²	38.2	40%	0.402	26%	0.256	S	S	.	.	S	Bend	trans	74.8	-171	-169.3	0	0	0	0	0	111.4	T152 G160	T152-G162 WeakPolarHBondContact CG2-O 3.35Å; G160-G162 PolarHBondContact O-N 2.92Å
163	D	81.6	Confident	80.2	Confident	63 Å²	63	38.9 Å²	38.9	34%	0.337	26%	0.26	S	S	.	.			trans	-123.1	157.7	-178.1	70.5	95.2	0	0	0	112.5	G150 L157 W158 A165	G150-D163 WeakPolarHBondContact CA-O 3.21Å; G150-D163 PolarHBondContact N-O 3.18Å; L157-D163 CarbonylContact O-C 3.57Å; L157-D163 VanDerWaalsContact O-CA 3.27Å; L157-D163 WeakPolarHBondContact O-CA 3.48Å; L157-D163 VanDerWaalsContact O-CB 3.31Å; L157-D163 WeakPolarHBondContact O-CB 3.09Å; W158-D163 HydrophobicContact CD2-CB 4.14Å; W158-D163 HydrophobicContact CE3-CB 3.71Å; W158-D163 HydrophobicContact CZ3-CB 4Å; D163-A165 PolarHBondContact OD1-N 3.36Å
164	S	79.1	Confident	80.7	Confident	36 Å²	36	38.1 Å²	38.1	25%	0.252	26%	0.256	S	S	.	.			trans	-111.7	10.8	175.3	-80.1	0	0	0	0	112	G150 L157	G150-S164 PolarHBondContact O-OG 2.77Å; L157-S164 PolarHBondContact O-N 3.13Å
165	A	82.3	Confident	81.7	Confident	10 Å²	10	43.4 Å²	43.4	8%	0.083	28%	0.279	C	S	.	.			trans	-76.3	133.4	-176.2	0	0	0	0	0	110.4	L157 W158 D163 N167 E170	L157-A165 HydrophobicContact CB-CB 3.98Å; L157-A165 HydrophobicContact CD1-CB 4.24Å; W158-A165 HydrophobicContact CH2-CB 4.3Å; W158-A165 HydrophobicContact CZ2-CB 3.56Å; D163-A165 PolarHBondContact OD1-N 3.36Å; A165-N167 WeakPolarHBondContact CB-O 3.26Å; A165-N167 PolarHBondContact O-N 2.84Å; A165-E170 HydrophobicContact CB-CB 4.36Å
166	G	73.7	Confident	82.7	Confident	54 Å²	54	44 Å²	44	56%	0.557	28%	0.284	S	S	*	.	S	Bend	trans	-74.5	-19.3	174.3	0	0	0	0	0	112.4	E170	G166-E170 WeakPolarHBondContact CA-OE2 3.42Å; G166-E170 PolarHBondContact N-OE2 3.18Å
167	N	82.2	Confident	83.1	Confident	83 Å²	83	43.9 Å²	43.9	44%	0.444	28%	0.284	S	S	.	.	S	Bend	trans	-147.9	160.1	173.6	70.5	70.2	0	0	0	111.8	A165 S169 E170	A165-N167 WeakPolarHBondContact CB-O 3.26Å; A165-N167 PolarHBondContact O-N 2.84Å; N167-S169 PolarHBondContact O-N 3.06Å; N167-S169 VanDerWaalsContact O-N 3.12Å; N167-S169 WeakPolarHBondContact OD1-CA 3.43Å; N167-S169 WeakPolarHBondContact OD1-CB 3.35Å; N167-S169 PolarHBondContact OD1-N 3.29Å; N167-E170 WeakPolarHBondContact O-CB 3.37Å; N167-E170 PolarHBondContact O-N 2.88Å; N167-E170 PolarHBondContact OD1-N 3.26Å
168	S	82.2	Confident	83.5	Confident	73 Å²	73	43 Å²	43	51%	0.51	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18	-176.9	64.2	0	0	0	0	114.7	R182 R186	S168-R182 WeakPolarHBondContact O-CD 3.41Å; S168-R182 PolarHBondContact O-NH1 3.14Å; S168-R186 PolarHBondContact O-NH2 3.07Å
169	S	84.9	Confident	83.6	Confident	89 Å²	89	45.4 Å²	45.4	62%	0.622	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-17.3	-178.7	-58.9	0	0	0	0	112.7	N167 R182	N167-S169 PolarHBondContact O-N 3.06Å; N167-S169 VanDerWaalsContact O-N 3.12Å; N167-S169 WeakPolarHBondContact OD1-CA 3.43Å; N167-S169 WeakPolarHBondContact OD1-CB 3.35Å; N167-S169 PolarHBondContact OD1-N 3.29Å; S169-R182 VanDerWaalsContact C-NH1 3.28Å; S169-R182 PolarHBondContact O-NH1 3.44Å
170	E	83.6	Confident	84	Confident	74 Å²	74	44.9 Å²	44.9	35%	0.346	29%	0.289	S	S	.	.			trans	-65.9	137.5	-177.7	-157.8	-179.3	172.7	0	0	110.2	L157 W158 A165 G166 N167	L157-E170 HydrophobicContact CD1-CB 4.06Å; L157-E170 HydrophobicContact CD1-CG 3.55Å; W158-E170 PolarHBondContact NE1-O 2.03Å; A165-E170 HydrophobicContact CB-CB 4.36Å; G166-E170 WeakPolarHBondContact CA-OE2 3.42Å; G166-E170 PolarHBondContact N-OE2 3.18Å; N167-E170 WeakPolarHBondContact O-CB 3.37Å; N167-E170 PolarHBondContact O-N 2.88Å; N167-E170 PolarHBondContact OD1-N 3.26Å
171	L	87.6	Confident	84.6	Confident	43 Å²	43	43.5 Å²	43.5	23%	0.225	27%	0.274	C	S	.	.			trans	-127.5	147.4	172.2	-66.1	175.2	0	0	0	107.9	Q175 D178 L179	L171-Q175 HydrophobicContact CB-CG 4.23Å; L171-Q175 HydrophobicContact CD1-CB 4.33Å; L171-D178 HydrophobicContact CD2-CB 4.3Å; L171-L179 HydrophobicContact CD1-CB 4.09Å; L171-L179 HydrophobicContact CD1-CD1 4.35Å; L171-L179 HydrophobicContact CD2-CB 4.33Å
172	G	78.6	Confident	85.6	Confident	10 Å²	10	42.5 Å²	42.5	10%	0.103	26%	0.264	C	S	.	.			trans	-69.5	-176.4	173.9	0	0	0	0	0	112.1	G155 F174 Q175 D178	G155-G172 CarbonylContact O-C 3.43Å; G172-F174 PolarHBondContact O-N 3.02Å; G172-Q175 WeakPolarHBondContact O-CG 3.04Å; G172-Q175 PolarHBondContact O-N 2.89Å; G172-D178 WeakPolarHBondContact CA-OD2 3.46Å; G172-D178 PolarHBondContact N-OD2 3.16Å
173	V	79.1	Confident	86.5	Confident	34 Å²	34	44.5 Å²	44.5	21%	0.206	26%	0.263	C	S	.	.	S	Bend	trans	-60.7	-38.7	-178.4	-158.9	0	0	0	0	110.2	K35 G155 Q175	K35-V173 HydrophobicContact CB-CG1 4.21Å; K35-V173 HydrophobicContact CD-CB 4.15Å; K35-V173 HydrophobicContact CD-CG1 3.36Å; K35-V173 WeakPolarHBondContact CE-O 3.42Å; K35-V173 HydrophobicContact CG-CG1 3.6Å; K35-V173 PolarHBondContact NZ-O 3.08Å; G155-V173 PolarHBondContact O-N 3.01Å; V173-Q175 VanDerWaalsContact C-N 3.34Å; V173-Q175 PolarHBondContact O-N 3.49Å; V173-Q175 VanDerWaalsContact O-N 3.16Å
174	F	82.7	Confident	87.2	Confident	18 Å²	18	42 Å²	42	8%	0.079	25%	0.249	C	C	.	.	S	Bend	trans	-86.9	68	174.6	-55.2	-64.4	0	0	0	111.9	L33 K35 P154 G155 T156 G172 G176 P177 D178 I228	L33-F174 HydrophobicContact CD2-CZ 4.28Å; K35-F174 HydrophobicContact CB-CE1 4.31Å; K35-F174 HydrophobicContact CB-CZ 4.4Å; K35-F174 HydrophobicContact CD-CD1 3.61Å; K35-F174 HydrophobicContact CD-CE1 3.35Å; K35-F174 HydrophobicContact CD-CZ 4.11Å; K35-F174 HydrophobicContact CG-CE1 4.43Å; P154-F174 VanDerWaalsContact O-CD2 3.32Å; P154-F174 WeakPolarHBondContact O-CD2 3.32Å; P154-F174 VanDerWaalsContact O-CE2 3.23Å; P154-F174 WeakPolarHBondContact O-CE2 3.11Å; G155-F174 PolarHBondContact O-N 3.05Å; T156-F174 HydrophobicContact CG2-CB 4.19Å; T156-F174 HydrophobicContact CG2-CD2 4.25Å; G172-F174 PolarHBondContact O-N 3.02Å; F174-G176 VanDerWaalsContact C-N 3.28Å; F174-G176 PolarHBondContact O-N 3.48Å; F174-G176 VanDerWaalsContact O-N 3.16Å; F174-P177 HydrophobicContact CB-CG 3.67Å; F174-P177 VanDerWaalsContact O-CD 3.27Å; F174-P177 WeakPolarHBondContact O-CD 3.37Å; F174-P177 WeakPolarHBondContact O-CG 3.37Å; F174-D178 WeakPolarHBondContact O-CB 3.44Å; F174-D178 PolarHBondContact O-N 3.22Å; F174-I228 HydrophobicContact CB-CG2 4.21Å; F174-I228 HydrophobicContact CD1-CB 4.34Å; F174-I228 HydrophobicContact CD1-CG1 3.77Å; F174-I228 HydrophobicContact CD1-CG2 4.24Å; F174-I228 HydrophobicContact CD2-CG2 3.98Å; F174-I228 HydrophobicContact CE1-CD1 4.15Å; F174-I228 HydrophobicContact CE1-CG1 3.7Å; F174-I228 HydrophobicContact CE2-CG2 4.41Å; F174-I228 HydrophobicContact CG-CB 4.47Å; F174-I228 HydrophobicContact CG-CG1 4.31Å; F174-I228 HydrophobicContact CG-CG2 3.91Å; F174-I228 HydrophobicContact CZ-CD1 4.23Å; F174-I228 HydrophobicContact CZ-CG1 4.2Å
175	Q	85.8	Confident	87.8	Confident	132 Å²	132	43 Å²	43	62%	0.617	25%	0.251	S	S	*	.	H	α-helix	trans	-52.8	-39.1	-173.1	-64.5	-178.9	5.8	0	0	114.7	L171 G172 V173 L179	L171-Q175 HydrophobicContact CB-CG 4.23Å; L171-Q175 HydrophobicContact CD1-CB 4.33Å; G172-Q175 WeakPolarHBondContact O-CG 3.04Å; G172-Q175 PolarHBondContact O-N 2.89Å; V173-Q175 VanDerWaalsContact C-N 3.34Å; V173-Q175 PolarHBondContact O-N 3.49Å; V173-Q175 VanDerWaalsContact O-N 3.16Å; Q175-L179 WeakPolarHBondContact O-CB 3.39Å; Q175-L179 PolarHBondContact O-N 3.16Å
176	G	90.1	Very high	88.3	Confident	19 Å²	19	48.3 Å²	48.3	20%	0.196	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-66.7	-179.9	0	0	0	0	0	113.5	F174 D178 L179 C180	F174-G176 VanDerWaalsContact C-N 3.28Å; F174-G176 PolarHBondContact O-N 3.48Å; F174-G176 VanDerWaalsContact O-N 3.16Å; G176-D178 PolarHBondContact O-N 3.11Å; G176-L179 PolarHBondContact O-N 3.32Å; G176-C180 PolarHBondContact O-N 2.04Å; G176-C180 PolarHBondContact O-SG 2.84Å
177	P	90.2	Very high	89.4	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.019	24%	0.244	C	C	.	.	H	α-helix	trans	-60.3	-36.1	177	19.6	-30.2	0	0	0	112.4	C159 F174 L179 C180 C181 L221 I228 S229 V232	C159-P177 PolarHBondContact SG-O 3.33Å; C159-P177 VanDerWaalsContact SG-O 3.41Å; F174-P177 HydrophobicContact CB-CG 3.67Å; F174-P177 VanDerWaalsContact O-CD 3.27Å; F174-P177 WeakPolarHBondContact O-CD 3.37Å; F174-P177 WeakPolarHBondContact O-CG 3.37Å; P177-L179 VanDerWaalsContact C-N 3.34Å; P177-L179 PolarHBondContact O-N 3.44Å; P177-C180 WeakPolarHBondContact O-CB 3.26Å; P177-C180 PolarHBondContact O-N 2.89Å; P177-C180 VanDerWaalsContact O-N 3.14Å; P177-C181 PolarHBondContact O-N 2.84Å; P177-C181 PolarHBondContact O-SG 2.99Å; P177-L221 HydrophobicContact CB-CD2 4.18Å; P177-I228 HydrophobicContact CG-CB 4.17Å; P177-I228 HydrophobicContact CG-CG2 3.87Å; P177-S229 WeakPolarHBondContact CB-OG 3.47Å; P177-S229 WeakPolarHBondContact CD-OG 3.36Å; P177-V232 HydrophobicContact CB-CG2 4.11Å
178	D	93.5	Very high	90	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-67.8	-34.3	-179.1	-159.3	33.5	0	0	0	112.9	T156 L157 W158 L171 G172 F174 G176 C181 R182	T156-D178 VanDerWaalsContact CB-OD1 3.23Å; T156-D178 WeakPolarHBondContact CB-OD1 3.41Å; T156-D178 HydrophobicContact CG2-CB 4.25Å; L157-D178 PolarHBondContact N-OD1 3.49Å; L157-D178 PolarHBondContact N-OD2 3.03Å; W158-D178 WeakPolarHBondContact CA-OD1 3.23Å; W158-D178 VanDerWaalsContact CB-OD1 3.32Å; W158-D178 WeakPolarHBondContact CB-OD1 3.27Å; W158-D178 PolarHBondContact N-OD1 3.42Å; L171-D178 HydrophobicContact CD2-CB 4.3Å; G172-D178 WeakPolarHBondContact CA-OD2 3.46Å; G172-D178 PolarHBondContact N-OD2 3.16Å; F174-D178 WeakPolarHBondContact O-CB 3.44Å; F174-D178 PolarHBondContact O-N 3.22Å; G176-D178 PolarHBondContact O-N 3.11Å; D178-C181 PolarHBondContact O-N 3.16Å; D178-R182 WeakPolarHBondContact O-CB 3.25Å; D178-R182 PolarHBondContact O-N 3.14Å
179	L	95.4	Very high	90.6	Very high	68 Å²	68	47.4 Å²	47.4	36%	0.356	25%	0.25	S	S	.	.	H	α-helix	trans	-63.3	-42.6	170.2	176.4	143.7	0	0	0	111.2	L171 Q175 G176 P177 R182 E183	L171-L179 HydrophobicContact CD1-CB 4.09Å; L171-L179 HydrophobicContact CD1-CD1 4.35Å; L171-L179 HydrophobicContact CD2-CB 4.33Å; Q175-L179 WeakPolarHBondContact O-CB 3.39Å; Q175-L179 PolarHBondContact O-N 3.16Å; G176-L179 PolarHBondContact O-N 3.32Å; P177-L179 VanDerWaalsContact C-N 3.34Å; P177-L179 PolarHBondContact O-N 3.44Å; L179-R182 PolarHBondContact O-N 2.97Å; L179-E183 PolarHBondContact O-N 3.29Å
180	C	97.1	Very high	91	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.007	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-44.3	176.8	-60.9	0	0	0	0	111.5	G176 P177 E183 H184 F217 C220 L221	G176-C180 PolarHBondContact O-N 2.04Å; G176-C180 PolarHBondContact O-SG 2.84Å; P177-C180 WeakPolarHBondContact O-CB 3.26Å; P177-C180 PolarHBondContact O-N 2.89Å; P177-C180 VanDerWaalsContact O-N 3.14Å; C180-E183 PolarHBondContact O-N 3Å; C180-H184 WeakPolarHBondContact O-CB 3.12Å; C180-H184 PolarHBondContact O-N 3.41Å; C180-F217 HydrophobicContact CB-CD2 3.9Å; C180-F217 HydrophobicContact CB-CE2 3.87Å; C180-F217 WeakPolarHBondContact O-CD2 3.38Å; C180-C220 WeakPolarHBondContact CA-SG 3.38Å; C180-C220 HydrophobicContact CB-CB 3.75Å; C180-C220 WeakPolarHBondContact CB-SG 3.47Å; C180-C220 WeakPolarHBondContact SG-CB 2.98Å; C180-C220 CovalentContact SG-SG 2.04Å; C180-C220 PolarHBondContact SG-SG 3.19Å; C180-L221 HydrophobicContact CB-CD2 3.87Å; C180-L221 HydrophobicContact CB-CG 4.23Å
181	C	95.6	Very high	91.1	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.034	22%	0.215	C	C	.	.	H	α-helix	trans	-65	-42.2	177.5	-61.3	0	0	0	0	112	W158 C159 P177 D178 E183 H184 D185 F217	W158-C181 HydrophobicContact CB-CB 3.92Å; C159-C181 WeakPolarHBondContact CA-SG 3.45Å; C159-C181 HydrophobicContact CB-CB 3.78Å; C159-C181 WeakPolarHBondContact CB-SG 3.49Å; C159-C181 WeakPolarHBondContact SG-CB 3.3Å; C159-C181 CovalentContact SG-SG 2.02Å; C159-C181 PolarHBondContact SG-SG 3.14Å; P177-C181 PolarHBondContact O-N 2.84Å; P177-C181 PolarHBondContact O-SG 2.99Å; D178-C181 PolarHBondContact O-N 3.16Å; C181-E183 VanDerWaalsContact C-N 3.32Å; C181-E183 PolarHBondContact O-N 3.44Å; C181-H184 WeakPolarHBondContact O-CB 3.05Å; C181-H184 PolarHBondContact O-N 3.34Å; C181-H184 VanDerWaalsContact O-N 3.13Å; C181-D185 PolarHBondContact O-N 3.39Å; C181-F217 HydrophobicContact CB-CE2 4.47Å
182	R	95.2	Very high	90.9	Very high	39 Å²	39	41.8 Å²	41.8	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-41.1	175.6	-176	175.8	76.1	179.7	-4.7	113	W158 S168 S169 D178 L179 H184 R186	W158-R182 HydrophobicContact CB-CB 3.97Å; W158-R182 HydrophobicContact CD2-CB 3.58Å; W158-R182 HydrophobicContact CD2-CG 3.48Å; W158-R182 VanDerWaalsContact CD2-CG 3.48Å; W158-R182 HydrophobicContact CE3-CB 4.03Å; W158-R182 HydrophobicContact CE3-CG 3.72Å; W158-R182 HydrophobicContact CG-CB 3.53Å; W158-R182 HydrophobicContact CG-CG 3.99Å; W158-R182 HydrophobicContact CH2-CG 4.11Å; W158-R182 HydrophobicContact CZ2-CG 3.86Å; W158-R182 HydrophobicContact CZ3-CG 4.02Å; S168-R182 WeakPolarHBondContact O-CD 3.41Å; S168-R182 PolarHBondContact O-NH1 3.14Å; S169-R182 VanDerWaalsContact C-NH1 3.28Å; S169-R182 PolarHBondContact O-NH1 3.44Å; D178-R182 WeakPolarHBondContact O-CB 3.25Å; D178-R182 PolarHBondContact O-N 3.14Å; L179-R182 PolarHBondContact O-N 2.97Å; R182-H184 VanDerWaalsContact C-N 3.32Å; R182-R186 VanDerWaalsContact CG-CZ 3.5Å; R182-R186 WeakPolarHBondContact O-CG 3.18Å; R182-R186 PolarHBondContact O-N 3.37Å
183	E	95.6	Very high	90.9	Very high	80 Å²	80	43.7 Å²	43.7	37%	0.374	23%	0.23	S	C	.	.	H	α-helix	trans	-66	-39.5	176	-164.7	-166.3	141.1	0	0	111	L179 C180 C181 R186 R216	L179-E183 PolarHBondContact O-N 3.29Å; C180-E183 PolarHBondContact O-N 3Å; C181-E183 VanDerWaalsContact C-N 3.32Å; C181-E183 PolarHBondContact O-N 3.44Å; E183-R186 PolarHBondContact O-N 3.19Å; E183-R216 IonicContact OE1-CZ 2.87Å; E183-R216 IonicContact OE1-NE 3.65Å; E183-R216 PolarHBondContact OE1-NE 2.91Å; E183-R216 IonicContact OE1-NH2 3.87Å; E183-R216 PolarHBondContact OE1-NH2 3.18Å
184	H	95.8	Very high	90.6	Very high	12 Å²	12	47.7 Å²	47.7	6%	0.056	25%	0.25	C	C	.	.	H	α-helix	trans	-65.8	-43.9	177.4	-177.9	-107.6	0	0	0	112.9	C180 C181 R182 R186 C187 D214 F217 F236	C180-H184 WeakPolarHBondContact O-CB 3.12Å; C180-H184 PolarHBondContact O-N 3.41Å; C181-H184 WeakPolarHBondContact O-CB 3.05Å; C181-H184 PolarHBondContact O-N 3.34Å; C181-H184 VanDerWaalsContact O-N 3.13Å; R182-H184 VanDerWaalsContact C-N 3.32Å; H184-R186 PolarHBondContact O-N 3.33Å; H184-R186 VanDerWaalsContact O-N 3.16Å; H184-C187 WeakPolarHBondContact O-CB 3.45Å; H184-C187 PolarHBondContact O-N 2.62Å; H184-D214 IonicContact CD2-OD1 2.66Å; H184-D214 IonicContact CE1-OD1 3.18Å; H184-D214 IonicContact NE2-OD1 3.1Å; H184-D214 PolarHBondContact NE2-OD1 3.03Å; H184-F217 HydrophobicContact CB-CB 4.13Å; H184-F217 HydrophobicContact CB-CD2 3.88Å; H184-F217 HydrophobicContact CB-CE2 4.41Å; H184-F217 HydrophobicContact CB-CG 3.95Å; H184-F217 AromaticContact CD2-CG 3.96Å; H184-F217 AromaticContact CG-CG 3.94Å; H184-F236 AromaticContact CE1-CE2 3.52Å; H184-F236 AromaticContact CE1-CZ 3.49Å; H184-F236 VanDerWaalsContact CE1-CZ 3.49Å; H184-F236 WeakPolarHBondContact CE1-CZ 3.48Å; H184-F236 AromaticContact NE2-CZ 3.82Å
185	D	93.6	Very high	90.3	Very high	56 Å²	56	50.2 Å²	50.2	30%	0.299	26%	0.262	S	S	.	.	H	α-helix	trans	-59.7	-27.8	176.2	-82.1	-12.7	0	0	0	112.8	C181 C187	C181-D185 PolarHBondContact O-N 3.39Å; D185-C187 PolarHBondContact O-N 3.16Å
186	R	92.9	Very high	90.2	Very high	122 Å²	122	49 Å²	49	46%	0.46	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	14.1	176.6	-68.6	176	-174.7	155.2	9.1	113.5	S168 R182 E183 H184 P188	S168-R186 PolarHBondContact O-NH2 3.07Å; R182-R186 VanDerWaalsContact CG-CZ 3.5Å; R182-R186 WeakPolarHBondContact O-CG 3.18Å; R182-R186 PolarHBondContact O-N 3.37Å; E183-R186 PolarHBondContact O-N 3.19Å; H184-R186 PolarHBondContact O-N 3.33Å; H184-R186 VanDerWaalsContact O-N 3.16Å; R186-P188 WeakPolarHBondContact O-CD 3.29Å; R186-P188 VanDerWaalsContact O-N 3.16Å
187	C	95.3	Very high	90.1	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.02	26%	0.26	C	S	.	.			trans	-54.9	122	176.2	-171.4	0	0	0	0	110.3	H184 D185 Q189 N190 C213	H184-C187 WeakPolarHBondContact O-CB 3.45Å; H184-C187 PolarHBondContact O-N 2.62Å; D185-C187 PolarHBondContact O-N 3.16Å; C187-Q189 PolarHBondContact O-N 3.36Å; C187-Q189 PolarHBondContact SG-O 3.06Å; C187-N190 PolarHBondContact O-ND2 3.03Å; C187-C213 HydrophobicContact CB-CB 3.72Å; C187-C213 WeakPolarHBondContact CB-SG 3.37Å; C187-C213 WeakPolarHBondContact SG-CB 3.06Å; C187-C213 CovalentContact SG-SG 2.04Å; C187-C213 PolarHBondContact SG-SG 3.41Å
188	P	94.8	Very high	90.1	Very high	118 Å²	118	52.9 Å²	52.9	77%	0.766	27%	0.268	S	S	*	.	S	Bend	trans	-60.4	-31.8	-177.2	-24.7	33.4	0	0	0	113	R186	R186-P188 WeakPolarHBondContact O-CD 3.29Å; R186-P188 VanDerWaalsContact O-N 3.16Å
189	Q	94.6	Very high	89.7	Confident	69 Å²	69	55.2 Å²	55.2	32%	0.322	29%	0.293	S	S	.	.	S	Bend	trans	-113.9	100.1	-179.2	-68.9	173.7	-15.4	0	0	108.7	C187 H210 F245 L247	C187-Q189 PolarHBondContact O-N 3.36Å; C187-Q189 PolarHBondContact SG-O 3.06Å; Q189-H210 HydrophobicContact CB-CB 4Å; Q189-H210 PolarHBondContact O-N 3.33Å; Q189-H210 PolarHBondContact OE1-CD2 3.05Å; Q189-H210 VanDerWaalsContact OE1-CD2 3.24Å; Q189-F245 HydrophobicContact CB-CE2 4.36Å; Q189-F245 HydrophobicContact CB-CZ 4.03Å; Q189-F245 WeakPolarHBondContact O-CZ 3.31Å; Q189-L247 HydrophobicContact CG-CD1 4.39Å; Q189-L247 VanDerWaalsContact NE2-CD1 3.28Å
190	N	94.4	Very high	89.1	Confident	42 Å²	42	53.9 Å²	53.9	23%	0.225	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	165.4	176.8	70.7	55.6	0	0	0	111.2	C187 T207 I208	C187-N190 PolarHBondContact O-ND2 3.03Å; N190-T207 HydrophobicContact CB-CG2 3.7Å; N190-I208 CarbonylContact C-O 3.46Å; N190-I208 VanDerWaalsContact CA-O 3.32Å; N190-I208 WeakPolarHBondContact CA-O 3.09Å
191	I	84.7	Confident	88.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	100.3	175.7	-45.1	-179.9	0	0	0	107	Q195 N197 Y198 I200 N202 I208 F245 A271	I191-Q195 HydrophobicContact CG2-CB 4.06Å; I191-Q195 WeakPolarHBondContact CG2-O 3.34Å; I191-N197 HydrophobicContact CG1-CB 4.24Å; I191-N197 HydrophobicContact CG2-CB 4.22Å; I191-Y198 HydrophobicContact CD1-CD2 4.05Å; I191-Y198 HydrophobicContact CG1-CD2 4.01Å; I191-Y198 HydrophobicContact CG1-CE2 4.43Å; I191-I200 HydrophobicContact CD1-CD1 3.59Å; I191-I200 HydrophobicContact CD1-CG1 3.51Å; I191-N202 HydrophobicContact CB-CB 4.31Å; I191-N202 HydrophobicContact CG2-CB 3.62Å; I191-N202 PolarHBondContact O-ND2 3.42Å; I191-I208 HydrophobicContact CB-CB 4.47Å; I191-I208 PolarHBondContact N-O 3.46Å; I191-I208 PolarHBondContact O-N 3.03Å; I191-F245 HydrophobicContact CD1-CD1 4.23Å; I191-F245 HydrophobicContact CD1-CE1 4.11Å; I191-F245 HydrophobicContact CD1-CZ 4.41Å; I191-F245 HydrophobicContact CG1-CD1 4.4Å; I191-F245 HydrophobicContact CG1-CE1 3.83Å; I191-F245 HydrophobicContact CG1-CZ 4.1Å; I191-A271 HydrophobicContact CD1-CB 4.34Å
192	S	83.6	Confident	87.7	Confident	47 Å²	47	59.5 Å²	59.5	33%	0.329	31%	0.306	S	S	.	.			trans	-61.1	161.9	180	-68.4	0	0	0	0	112.2	L194 Q195 N202	S192-L194 PolarHBondContact O-N 2.96Å; S192-Q195 VanDerWaalsContact CB-OE1 3.26Å; S192-Q195 WeakPolarHBondContact O-CB 3.24Å; S192-Q195 PolarHBondContact O-N 2.92Å; S192-Q195 PolarHBondContact OG-OE1 3.24Å; S192-N202 WeakPolarHBondContact O-CB 3.3Å; S192-N202 PolarHBondContact O-ND2 3.21Å
193	P	78.2	Confident	86.8	Confident	50 Å²	50	66.8 Å²	66.8	33%	0.325	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	132.2	175.9	-28	36.4	0	0	0	111.9	Q195 R204 F205	P193-Q195 PolarHBondContact O-N 3.3Å; P193-R204 WeakPolarHBondContact CA-O 3.26Å; P193-F205 WeakPolarHBondContact CG-O 3.36Å
194	L	73.9	Confident	85.7	Confident	118 Å²	118	67.7 Å²	67.7	62%	0.618	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	3.8	-176.9	-50.9	176.5	0	0	0	115.2	S192 R201 N202	S192-L194 PolarHBondContact O-N 2.96Å; L194-R201 WeakPolarHBondContact O-CD 3.37Å; L194-R201 PolarHBondContact O-NH1 2.04Å; L194-N202 WeakPolarHBondContact CA-O 3.43Å; L194-N202 PolarHBondContact N-O 3.47Å
195	Q	77.1	Confident	84.3	Confident	70 Å²	70	73.2 Å²	73.2	33%	0.327	36%	0.359	S	S	.	.			trans	-76.2	141.6	177.9	-169.6	-179.8	6.5	0	0	111.1	I191 S192 P193 N197 R201 N202	I191-Q195 HydrophobicContact CG2-CB 4.06Å; I191-Q195 WeakPolarHBondContact CG2-O 3.34Å; S192-Q195 VanDerWaalsContact CB-OE1 3.26Å; S192-Q195 WeakPolarHBondContact O-CB 3.24Å; S192-Q195 PolarHBondContact O-N 2.92Å; S192-Q195 PolarHBondContact OG-OE1 3.24Å; P193-Q195 PolarHBondContact O-N 3.3Å; Q195-N197 HydrophobicContact CG-CB 4.49Å; Q195-R201 WeakPolarHBondContact O-CA 3.3Å; Q195-R201 WeakPolarHBondContact O-CD 3.29Å; Q195-N202 PolarHBondContact O-N 3.4Å
196	H	82.9	Confident	83.6	Confident	106 Å²	106	71.2 Å²	71.2	49%	0.491	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	120.3	164.2	-170.2	46.8	0	0	0	108.4	I200	H196-I200 WeakPolarHBondContact CA-O 3.49Å; H196-I200 VanDerWaalsContact ND1-C 3.26Å; H196-I200 PolarHBondContact ND1-O 2.96Å
197	N	86.9	Confident	83.1	Confident	52 Å²	52	67.6 Å²	67.6	28%	0.278	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	155.7	174.2	-156.6	3.9	0	0	0	109.4	I191 Q195 G199 I200	I191-N197 HydrophobicContact CG1-CB 4.24Å; I191-N197 HydrophobicContact CG2-CB 4.22Å; Q195-N197 HydrophobicContact CG-CB 4.49Å; N197-G199 PolarHBondContact O-N 3.34Å; N197-G199 VanDerWaalsContact O-N 3.08Å; N197-I200 PolarHBondContact N-O 2.99Å; N197-I200 PolarHBondContact O-N 3.36Å
198	Y	90.3	Very high	83	Confident	52 Å²	52	67.7 Å²	67.7	20%	0.204	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	38.9	177.7	-49.2	-67.3	0	0	0	113.7	I191 I200 F245 L247 L270 A271	I191-Y198 HydrophobicContact CD1-CD2 4.05Å; I191-Y198 HydrophobicContact CG1-CD2 4.01Å; I191-Y198 HydrophobicContact CG1-CE2 4.43Å; Y198-I200 PolarHBondContact O-N 3.46Å; Y198-F245 AromaticContact CD2-CE2 3.88Å; Y198-F245 HydrophobicContact CD2-CE2 3.88Å; Y198-F245 HydrophobicContact CD2-CZ 4.03Å; Y198-F245 HydrophobicContact CE2-CE2 4.01Å; Y198-F245 AromaticContact CE2-CZ 3.91Å; Y198-F245 HydrophobicContact CE2-CZ 3.91Å; Y198-L247 HydrophobicContact CD1-CD1 4.24Å; Y198-L247 HydrophobicContact CD1-CD2 3.41Å; Y198-L247 VanDerWaalsContact CD1-CD2 3.41Å; Y198-L247 HydrophobicContact CD1-CG 4.49Å; Y198-L247 HydrophobicContact CD2-CD2 4.08Å; Y198-L247 HydrophobicContact CE1-CD1 3.96Å; Y198-L247 HydrophobicContact CE1-CD2 3.95Å; Y198-L247 HydrophobicContact CG-CD2 3.49Å; Y198-L247 VanDerWaalsContact CG-CD2 3.49Å; Y198-L270 WeakPolarHBondContact O-CA 3.32Å; Y198-A271 HydrophobicContact CG-CB 4.43Å; Y198-A271 PolarHBondContact O-N 3.27Å
199	G	85.1	Confident	83	Confident	50 Å²	50	62.2 Å²	62.2	52%	0.515	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.9	-2	179.6	0	0	0	0	0	116.5	N197	N197-G199 PolarHBondContact O-N 3.34Å; N197-G199 VanDerWaalsContact O-N 3.08Å
200	I	82.9	Confident	83.1	Confident	40 Å²	40	60 Å²	60	21%	0.205	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	154.6	178.1	69.2	175	0	0	0	112	I191 H196 N197 Y198 A271 L273	I191-I200 HydrophobicContact CD1-CD1 3.59Å; I191-I200 HydrophobicContact CD1-CG1 3.51Å; H196-I200 WeakPolarHBondContact CA-O 3.49Å; H196-I200 VanDerWaalsContact ND1-C 3.26Å; H196-I200 PolarHBondContact ND1-O 2.96Å; N197-I200 PolarHBondContact N-O 2.99Å; N197-I200 PolarHBondContact O-N 3.36Å; Y198-I200 PolarHBondContact O-N 3.46Å; I200-A271 HydrophobicContact CD1-CB 3.64Å; I200-A271 HydrophobicContact CG1-CB 3.93Å; I200-L273 HydrophobicContact CD1-CD2 3.78Å; I200-L273 HydrophobicContact CD1-CG 4.11Å
201	R	83.1	Confident	83.2	Confident	121 Å²	121	58.7 Å²	58.7	46%	0.457	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.5	175	175.8	72.2	71.6	155.4	-3.3	108.4	L194 Q195 Y203	L194-R201 WeakPolarHBondContact O-CD 3.37Å; L194-R201 PolarHBondContact O-NH1 2.04Å; Q195-R201 WeakPolarHBondContact O-CA 3.3Å; Q195-R201 WeakPolarHBondContact O-CD 3.29Å; R201-Y203 HydrophobicContact CB-CE1 4.4Å; R201-Y203 HydrophobicContact CB-CE2 3.9Å; R201-Y203 HydrophobicContact CG-CD1 4.02Å; R201-Y203 HydrophobicContact CG-CD2 4.34Å; R201-Y203 HydrophobicContact CG-CE1 3.57Å; R201-Y203 HydrophobicContact CG-CE2 3.93Å; R201-Y203 HydrophobicContact CG-CG 4.39Å; R201-Y203 WeakPolarHBondContact O-CD2 3.41Å; R201-Y203 PolarHBondContact O-N 3.2Å
202	N	80.6	Confident	83.8	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.011	31%	0.314	C	S	.	.			trans	-76	103.2	173.9	-179.1	8	0	0	0	110	I191 S192 L194 Q195 R204 H206 I208	I191-N202 HydrophobicContact CB-CB 4.31Å; I191-N202 HydrophobicContact CG2-CB 3.62Å; I191-N202 PolarHBondContact O-ND2 3.42Å; S192-N202 WeakPolarHBondContact O-CB 3.3Å; S192-N202 PolarHBondContact O-ND2 3.21Å; L194-N202 WeakPolarHBondContact CA-O 3.43Å; L194-N202 PolarHBondContact N-O 3.47Å; Q195-N202 PolarHBondContact O-N 3.4Å; N202-R204 VanDerWaalsContact C-N 3.31Å; N202-R204 WeakPolarHBondContact OD1-CA 3.44Å; N202-R204 WeakPolarHBondContact OD1-CB 3.13Å; N202-R204 PolarHBondContact OD1-N 3.41Å; N202-H206 PolarHBondContact ND2-O 2.81Å; N202-I208 HydrophobicContact CB-CD1 4.01Å; N202-I208 WeakPolarHBondContact OD1-CD1 3.49Å
203	Y	75.9	Confident	84.4	Confident	193 Å²	193	61.5 Å²	61.5	76%	0.757	30%	0.3	S	S	*	.			trans	-86	-3.5	175.2	-63.7	-73.4	0	0	0	113.7	R201	R201-Y203 HydrophobicContact CB-CE1 4.4Å; R201-Y203 HydrophobicContact CB-CE2 3.9Å; R201-Y203 HydrophobicContact CG-CD1 4.02Å; R201-Y203 HydrophobicContact CG-CD2 4.34Å; R201-Y203 HydrophobicContact CG-CE1 3.57Å; R201-Y203 HydrophobicContact CG-CE2 3.93Å; R201-Y203 HydrophobicContact CG-CG 4.39Å; R201-Y203 WeakPolarHBondContact O-CD2 3.41Å; R201-Y203 PolarHBondContact O-N 3.2Å
204	R	72.6	Confident	85.3	Confident	99 Å²	99	59.3 Å²	59.3	37%	0.374	29%	0.285	S	S	.	.	S	Bend	trans	-78.9	159.7	178.4	-62.6	154.4	165.4	-75.9	1.8	109.6	P193 N202 H206	P193-R204 WeakPolarHBondContact CA-O 3.26Å; N202-R204 VanDerWaalsContact C-N 3.31Å; N202-R204 WeakPolarHBondContact OD1-CA 3.44Å; N202-R204 WeakPolarHBondContact OD1-CB 3.13Å; N202-R204 PolarHBondContact OD1-N 3.41Å; R204-H206 VanDerWaalsContact C-N 3.29Å; R204-H206 WeakPolarHBondContact CB-NE2 3.05Å; R204-H206 VanDerWaalsContact CD-NE2 3.26Å; R204-H206 WeakPolarHBondContact CD-NE2 3.45Å; R204-H206 PolarHBondContact NH1-CE1 2.88Å; R204-H206 PolarHBondContact NH1-NE2 3.4Å; R204-H206 VanDerWaalsContact NH1-NE2 3.13Å
205	F	66.9	Low	86.4	Confident	128 Å²	128	56.8 Å²	56.8	56%	0.561	28%	0.275	S	S	*	.	S	Bend	trans	-86	-5	177.5	61.7	-92.4	0	0	0	112.7	V161 P193 L240	V161-F205 HydrophobicContact CG2-CD2 4.26Å; P193-F205 WeakPolarHBondContact CG-O 3.36Å; F205-L240 HydrophobicContact CZ-CD2 4.33Å
206	H	78	Confident	87.3	Confident	13 Å²	13	58 Å²	58	6%	0.06	28%	0.276	C	S	.	.	S	Bend	trans	-111.6	153.9	175.7	45.5	-103	0	0	0	110.9	N202 R204 I242	N202-H206 PolarHBondContact ND2-O 2.81Å; R204-H206 VanDerWaalsContact C-N 3.29Å; R204-H206 WeakPolarHBondContact CB-NE2 3.05Å; R204-H206 VanDerWaalsContact CD-NE2 3.26Å; R204-H206 WeakPolarHBondContact CD-NE2 3.45Å; R204-H206 PolarHBondContact NH1-CE1 2.88Å; R204-H206 PolarHBondContact NH1-NE2 3.4Å; R204-H206 VanDerWaalsContact NH1-NE2 3.13Å; H206-I242 HydrophobicContact CB-CD1 3.86Å
207	T	84.4	Confident	88	Confident	47 Å²	47	53.3 Å²	53.3	29%	0.288	25%	0.254	S	S	.	.			trans	-67.4	140.4	175	-59.6	0	0	0	0	110.5	N190	N190-T207 HydrophobicContact CB-CG2 3.7Å
208	I	91.5	Very high	88.4	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.3	169.9	-58.3	172.3	0	0	0	106.5	N190 I191 N202 P243 F245 L273	N190-I208 CarbonylContact C-O 3.46Å; N190-I208 VanDerWaalsContact CA-O 3.32Å; N190-I208 WeakPolarHBondContact CA-O 3.09Å; I191-I208 HydrophobicContact CB-CB 4.47Å; I191-I208 PolarHBondContact N-O 3.46Å; I191-I208 PolarHBondContact O-N 3.03Å; N202-I208 HydrophobicContact CB-CD1 4.01Å; N202-I208 WeakPolarHBondContact OD1-CD1 3.49Å; I208-P243 HydrophobicContact CD1-CG 4.39Å; I208-P243 WeakPolarHBondContact CG2-O 3.47Å; I208-F245 HydrophobicContact CG2-CD1 3.65Å; I208-F245 HydrophobicContact CG2-CE1 4.34Å; I208-F245 WeakPolarHBondContact O-CE1 3.49Å; I208-L273 HydrophobicContact CD1-CD2 4.38Å; I208-L273 HydrophobicContact CG2-CD2 4.05Å
209	S	95.4	Very high	88.7	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.021	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	165.1	-177.7	-68.6	0	0	0	0	111.6	D214 C244 F245	S209-D214 WeakPolarHBondContact CB-OD1 3.47Å; S209-C244 WeakPolarHBondContact O-CA 3.42Å; S209-F245 WeakPolarHBondContact O-CD1 3.04Å; S209-F245 PolarHBondContact O-N 3.21Å; S209-F245 VanDerWaalsContact O-N 3.1Å
210	H	96.8	Very high	89.3	Confident	22 Å²	22	53.1 Å²	53.1	10%	0.102	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-63.5	144.7	173.5	-167.4	-98.5	0	0	0	111	Q189 D212 C213 D214 F245	Q189-H210 HydrophobicContact CB-CB 4Å; Q189-H210 PolarHBondContact O-N 3.33Å; Q189-H210 PolarHBondContact OE1-CD2 3.05Å; Q189-H210 VanDerWaalsContact OE1-CD2 3.24Å; H210-D212 IonicContact CE1-OD2 2.73Å; H210-D212 PolarHBondContact CE1-OD2 3.23Å; H210-D212 PolarHBondContact ND1-N 3.05Å; H210-D212 IonicContact ND1-OD2 3.75Å; H210-D212 PolarHBondContact ND1-OD2 3.04Å; H210-D212 PolarHBondContact O-N 2.86Å; H210-D212 VanDerWaalsContact O-N 3.13Å; H210-C213 WeakPolarHBondContact O-CA 3.34Å; H210-C213 WeakPolarHBondContact O-CB 3.12Å; H210-C213 PolarHBondContact O-N 3.16Å; H210-D214 PolarHBondContact O-N 3.5Å; H210-F245 CarbonylContact C-O 3.49Å; H210-F245 WeakPolarHBondContact CA-O 3.43Å; H210-F245 HydrophobicContact CB-CZ 4.43Å; H210-F245 PolarHBondContact CD2-O 3.34Å
211	C	96.6	Very high	89.9	Confident	14 Å²	14	51.2 Å²	51.2	10%	0.095	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-27.7	-176.8	-65.6	0	0	0	0	114.3	C213 D214 T215 C244 F245 V246 Q274	C211-C213 VanDerWaalsContact C-N 3.34Å; C211-D214 PolarHBondContact O-N 3.16Å; C211-T215 WeakPolarHBondContact O-CB 3.42Å; C211-T215 PolarHBondContact O-N 3.5Å; C211-T215 PolarHBondContact O-OG1 3.26Å; C211-C244 WeakPolarHBondContact CA-SG 3.3Å; C211-C244 HydrophobicContact CB-CB 3.84Å; C211-C244 WeakPolarHBondContact CB-SG 3.37Å; C211-C244 VanDerWaalsContact SG-C 3.5Å; C211-C244 WeakPolarHBondContact SG-CB 3.41Å; C211-C244 CovalentContact SG-SG 2.04Å; C211-C244 PolarHBondContact SG-SG 3.44Å; C211-F245 PolarHBondContact N-O 2.84Å; C211-F245 VanDerWaalsContact SG-C 3.51Å; C211-F245 PolarHBondContact SG-N 2.95Å; C211-F245 PolarHBondContact SG-O 2.84Å; C211-F245 VanDerWaalsContact SG-O 3.4Å; C211-V246 HydrophobicContact CB-CG1 4.1Å; C211-Q274 WeakPolarHBondContact SG-CG 3.43Å
212	D	96.7	Very high	90.4	Very high	102 Å²	102	49 Å²	49	55%	0.545	23%	0.227	S	C	.	.	H	α-helix	trans	-66.5	-37	173.4	-61.4	-23.2	0	0	0	111.9	H210 T215 R216	H210-D212 IonicContact CE1-OD2 2.73Å; H210-D212 PolarHBondContact CE1-OD2 3.23Å; H210-D212 PolarHBondContact ND1-N 3.05Å; H210-D212 IonicContact ND1-OD2 3.75Å; H210-D212 PolarHBondContact ND1-OD2 3.04Å; H210-D212 PolarHBondContact O-N 2.86Å; H210-D212 VanDerWaalsContact O-N 3.13Å; D212-T215 PolarHBondContact O-N 3.45Å; D212-R216 WeakPolarHBondContact O-CG 3.47Å; D212-R216 PolarHBondContact O-N 3.32Å
213	C	97.1	Very high	91.1	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.034	26%	0.257	C	S	.	.	H	α-helix	trans	-67	-44.2	175.7	-65.1	0	0	0	0	111	C187 H210 C211 T215 R216 F217	C187-C213 HydrophobicContact CB-CB 3.72Å; C187-C213 WeakPolarHBondContact CB-SG 3.37Å; C187-C213 WeakPolarHBondContact SG-CB 3.06Å; C187-C213 CovalentContact SG-SG 2.04Å; C187-C213 PolarHBondContact SG-SG 3.41Å; H210-C213 WeakPolarHBondContact O-CA 3.34Å; H210-C213 WeakPolarHBondContact O-CB 3.12Å; H210-C213 PolarHBondContact O-N 3.16Å; C211-C213 VanDerWaalsContact C-N 3.34Å; C213-T215 VanDerWaalsContact C-N 3.32Å; C213-T215 PolarHBondContact O-N 2.96Å; C213-R216 PolarHBondContact O-N 3.14Å; C213-F217 VanDerWaalsContact O-CB 3.27Å; C213-F217 WeakPolarHBondContact O-CB 3.27Å; C213-F217 PolarHBondContact O-N 3.21Å
214	D	96.6	Very high	91.8	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-38.4	177.3	-77	25.3	0	0	0	111.4	H184 S209 H210 C211 F217 Q218 F237 C244	H184-D214 IonicContact CD2-OD1 2.66Å; H184-D214 IonicContact CE1-OD1 3.18Å; H184-D214 IonicContact NE2-OD1 3.1Å; H184-D214 PolarHBondContact NE2-OD1 3.03Å; S209-D214 WeakPolarHBondContact CB-OD1 3.47Å; H210-D214 PolarHBondContact O-N 3.5Å; C211-D214 PolarHBondContact O-N 3.16Å; D214-F217 PolarHBondContact O-N 2.67Å; D214-Q218 WeakPolarHBondContact O-CB 3.38Å; D214-Q218 PolarHBondContact O-N 2.61Å; D214-F237 HydrophobicContact CB-CE1 4.18Å; D214-F237 HydrophobicContact CB-CZ 4.45Å; D214-F237 WeakPolarHBondContact O-CZ 3.28Å; D214-C244 HydrophobicContact CB-CB 4.16Å; D214-C244 WeakPolarHBondContact OD2-CB 3.23Å
215	T	96.1	Very high	92.3	Very high	66 Å²	66	53.5 Å²	53.5	41%	0.405	26%	0.255	S	S	.	.	H	α-helix	trans	-64.1	-47.1	175.8	-58.9	0	0	0	0	111.6	C211 D212 C213 F217 Q218 Q219	C211-T215 WeakPolarHBondContact O-CB 3.42Å; C211-T215 PolarHBondContact O-N 3.5Å; C211-T215 PolarHBondContact O-OG1 3.26Å; D212-T215 PolarHBondContact O-N 3.45Å; C213-T215 VanDerWaalsContact C-N 3.32Å; C213-T215 PolarHBondContact O-N 2.96Å; T215-F217 VanDerWaalsContact C-N 3.3Å; T215-F217 PolarHBondContact O-N 2.9Å; T215-Q218 PolarHBondContact O-N 3.37Å; T215-Q219 WeakPolarHBondContact O-CG 3.45Å; T215-Q219 PolarHBondContact O-N 2.85Å
216	R	97.3	Very high	92.8	Very high	94 Å²	94	49.5 Å²	49.5	36%	0.355	24%	0.239	S	C	.	.	H	α-helix	trans	-63.1	-39	175	-68.7	-165.6	-23.6	-83.9	-2.9	111.7	E183 D212 C213 Q219 C220	E183-R216 IonicContact OE1-CZ 2.87Å; E183-R216 IonicContact OE1-NE 3.65Å; E183-R216 PolarHBondContact OE1-NE 2.91Å; E183-R216 IonicContact OE1-NH2 3.87Å; E183-R216 PolarHBondContact OE1-NH2 3.18Å; D212-R216 WeakPolarHBondContact O-CG 3.47Å; D212-R216 PolarHBondContact O-N 3.32Å; C213-R216 PolarHBondContact O-N 3.14Å; R216-Q219 PolarHBondContact O-N 3.32Å; R216-C220 VanDerWaalsContact O-CB 3.3Å; R216-C220 WeakPolarHBondContact O-CB 3.4Å; R216-C220 PolarHBondContact O-N 2.87Å
217	F	97.2	Very high	92.7	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.035	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-48.3	177.9	177.9	-131.5	0	0	0	111.3	C180 C181 H184 C213 D214 T215 Q219 C220 L221 V232 F236 F237	C180-F217 HydrophobicContact CB-CD2 3.9Å; C180-F217 HydrophobicContact CB-CE2 3.87Å; C180-F217 WeakPolarHBondContact O-CD2 3.38Å; C181-F217 HydrophobicContact CB-CE2 4.47Å; H184-F217 HydrophobicContact CB-CB 4.13Å; H184-F217 HydrophobicContact CB-CD2 3.88Å; H184-F217 HydrophobicContact CB-CE2 4.41Å; H184-F217 HydrophobicContact CB-CG 3.95Å; H184-F217 AromaticContact CD2-CG 3.96Å; H184-F217 AromaticContact CG-CG 3.94Å; C213-F217 VanDerWaalsContact O-CB 3.27Å; C213-F217 WeakPolarHBondContact O-CB 3.27Å; C213-F217 PolarHBondContact O-N 3.21Å; D214-F217 PolarHBondContact O-N 2.67Å; T215-F217 VanDerWaalsContact C-N 3.3Å; T215-F217 PolarHBondContact O-N 2.9Å; F217-Q219 VanDerWaalsContact C-N 3.33Å; F217-Q219 PolarHBondContact O-N 2.91Å; F217-C220 WeakPolarHBondContact O-CB 2.99Å; F217-C220 PolarHBondContact O-N 2.02Å; F217-L221 HydrophobicContact CD1-CD1 4.29Å; F217-L221 HydrophobicContact CD2-CD1 4.12Å; F217-L221 HydrophobicContact CD2-CG 4.13Å; F217-L221 HydrophobicContact CE1-CD1 3.88Å; F217-L221 HydrophobicContact CE2-CD1 3.69Å; F217-L221 HydrophobicContact CE2-CD2 3.98Å; F217-L221 HydrophobicContact CE2-CG 3.83Å; F217-L221 HydrophobicContact CG-CD1 4.4Å; F217-L221 HydrophobicContact CZ-CD1 3.59Å; F217-L221 HydrophobicContact CZ-CD2 4.41Å; F217-L221 HydrophobicContact CZ-CG 4.24Å; F217-L221 WeakPolarHBondContact O-CG 3.34Å; F217-L221 PolarHBondContact O-N 2.87Å; F217-V232 HydrophobicContact CE2-CG1 4.35Å; F217-V232 HydrophobicContact CZ-CG1 3.66Å; F217-F236 HydrophobicContact CD1-CD1 4.29Å; F217-F236 HydrophobicContact CD1-CE1 4.38Å; F217-F236 HydrophobicContact CD1-CG 4.4Å; F217-F236 HydrophobicContact CE1-CB 4.1Å; F217-F236 HydrophobicContact CE1-CD1 4.07Å; F217-F236 AromaticContact CE1-CD2 3.85Å; F217-F236 HydrophobicContact CE1-CD2 3.85Å; F217-F236 HydrophobicContact CE1-CE1 4.49Å; F217-F236 HydrophobicContact CE1-CE2 4.28Å; F217-F236 AromaticContact CE1-CG 3.74Å; F217-F236 HydrophobicContact CE1-CG 3.74Å; F217-F237 AromaticContact CD1-CE2 3.76Å; F217-F237 HydrophobicContact CD1-CE2 3.76Å; F217-F237 AromaticContact CD1-CZ 3.8Å; F217-F237 HydrophobicContact CD1-CZ 3.8Å; F217-F237 HydrophobicContact CE1-CE2 4.08Å; F217-F237 HydrophobicContact CE1-CZ 4.49Å
218	Q	95.6	Very high	92.4	Very high	32 Å²	32	48 Å²	48	15%	0.15	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-47.3	174.6	178.1	164.7	8.9	0	0	111.8	D214 T215 L221 Q222 F237 F278 Y279	D214-Q218 WeakPolarHBondContact O-CB 3.38Å; D214-Q218 PolarHBondContact O-N 2.61Å; T215-Q218 PolarHBondContact O-N 3.37Å; Q218-L221 PolarHBondContact O-N 2.85Å; Q218-Q222 VanDerWaalsContact O-CG 3.31Å; Q218-Q222 WeakPolarHBondContact O-CG 3.37Å; Q218-Q222 PolarHBondContact O-N 3.28Å; Q218-Q222 VanDerWaalsContact O-N 3.07Å; Q218-F237 HydrophobicContact CB-CE1 4.46Å; Q218-F237 HydrophobicContact CB-CE2 3.9Å; Q218-F237 HydrophobicContact CB-CZ 3.74Å; Q218-F278 PolarHBondContact NE2-O 3.35Å; Q218-Y279 HydrophobicContact CG-CD2 3.97Å; Q218-Y279 HydrophobicContact CG-CE2 4.35Å
219	Q	96.4	Very high	92.3	Very high	101 Å²	101	47.7 Å²	47.7	47%	0.472	23%	0.23	S	C	.	.	H	α-helix	trans	-64.5	-41.2	177.9	-70.8	172	-3.3	0	0	112.3	T215 R216 F217 L221 Q222 N223	T215-Q219 WeakPolarHBondContact O-CG 3.45Å; T215-Q219 PolarHBondContact O-N 2.85Å; R216-Q219 PolarHBondContact O-N 3.32Å; F217-Q219 VanDerWaalsContact C-N 3.33Å; F217-Q219 PolarHBondContact O-N 2.91Å; Q219-L221 PolarHBondContact O-N 3.19Å; Q219-Q222 PolarHBondContact O-N 2.75Å; Q219-N223 VanDerWaalsContact O-CB 3.32Å; Q219-N223 WeakPolarHBondContact O-CB 3.49Å; Q219-N223 PolarHBondContact O-N 3.04Å; Q219-N223 PolarHBondContact O-ND2 2.85Å
220	C	97.8	Very high	91.7	Very high	17 Å²	17	48 Å²	48	12%	0.115	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-47.9	178.3	-176.1	0	0	0	0	111	C180 R216 F217 N223 Q224	C180-C220 WeakPolarHBondContact CA-SG 3.38Å; C180-C220 HydrophobicContact CB-CB 3.75Å; C180-C220 WeakPolarHBondContact CB-SG 3.47Å; C180-C220 WeakPolarHBondContact SG-CB 2.98Å; C180-C220 CovalentContact SG-SG 2.04Å; C180-C220 PolarHBondContact SG-SG 3.19Å; R216-C220 VanDerWaalsContact O-CB 3.3Å; R216-C220 WeakPolarHBondContact O-CB 3.4Å; R216-C220 PolarHBondContact O-N 2.87Å; F217-C220 WeakPolarHBondContact O-CB 2.99Å; F217-C220 PolarHBondContact O-N 2.02Å; C220-N223 PolarHBondContact O-N 2.83Å; C220-Q224 WeakPolarHBondContact O-CG 3.4Å; C220-Q224 PolarHBondContact O-N 3.43Å; C220-Q224 PolarHBondContact O-NE2 2.73Å; C220-Q224 VanDerWaalsContact O-NE2 3.13Å
221	L	96	Very high	91	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-62.4	-45.7	178	-67.7	172.6	0	0	0	111.8	P177 C180 F217 Q218 Q219 N223 Q224 S229 V232 Y279	P177-L221 HydrophobicContact CB-CD2 4.18Å; C180-L221 HydrophobicContact CB-CD2 3.87Å; C180-L221 HydrophobicContact CB-CG 4.23Å; F217-L221 HydrophobicContact CD1-CD1 4.29Å; F217-L221 HydrophobicContact CD2-CD1 4.12Å; F217-L221 HydrophobicContact CD2-CG 4.13Å; F217-L221 HydrophobicContact CE1-CD1 3.88Å; F217-L221 HydrophobicContact CE2-CD1 3.69Å; F217-L221 HydrophobicContact CE2-CD2 3.98Å; F217-L221 HydrophobicContact CE2-CG 3.83Å; F217-L221 HydrophobicContact CG-CD1 4.4Å; F217-L221 HydrophobicContact CZ-CD1 3.59Å; F217-L221 HydrophobicContact CZ-CD2 4.41Å; F217-L221 HydrophobicContact CZ-CG 4.24Å; F217-L221 WeakPolarHBondContact O-CG 3.34Å; F217-L221 PolarHBondContact O-N 2.87Å; Q218-L221 PolarHBondContact O-N 2.85Å; Q219-L221 PolarHBondContact O-N 3.19Å; L221-N223 VanDerWaalsContact C-N 3.26Å; L221-N223 PolarHBondContact O-N 2.98Å; L221-Q224 PolarHBondContact O-N 2.79Å; L221-S229 WeakPolarHBondContact O-CB 3.45Å; L221-V232 HydrophobicContact CD1-CB 4.43Å; L221-V232 HydrophobicContact CD1-CG1 4Å; L221-V232 HydrophobicContact CD2-CB 4.06Å; L221-V232 HydrophobicContact CD2-CG1 3.91Å; L221-Y279 HydrophobicContact CB-CE2 3.83Å; L221-Y279 HydrophobicContact CD1-CE2 4.21Å
222	Q	93.3	Very high	90.6	Very high	74 Å²	74	47.2 Å²	47.2	35%	0.346	23%	0.226	S	C	.	.	H	α-helix	trans	-60.9	-36.7	176.7	-73.3	175	-18.4	0	0	112.2	Q218 Q219 Q224 R225 Y279	Q218-Q222 VanDerWaalsContact O-CG 3.31Å; Q218-Q222 WeakPolarHBondContact O-CG 3.37Å; Q218-Q222 PolarHBondContact O-N 3.28Å; Q218-Q222 VanDerWaalsContact O-N 3.07Å; Q219-Q222 PolarHBondContact O-N 2.75Å; Q222-Q224 VanDerWaalsContact C-N 3.32Å; Q222-Q224 PolarHBondContact O-N 2.63Å; Q222-R225 PolarHBondContact O-N 2Å; Q222-Y279 HydrophobicContact CG-CE2 3.79Å
223	N	94.1	Very high	90.3	Very high	117 Å²	117	42.3 Å²	42.3	63%	0.626	20%	0.2	S	C	*	.	H	α-helix	trans	-73.2	-20.5	-180	-73.1	-24	0	0	0	113.7	Q219 C220 L221 R225	Q219-N223 VanDerWaalsContact O-CB 3.32Å; Q219-N223 WeakPolarHBondContact O-CB 3.49Å; Q219-N223 PolarHBondContact O-N 3.04Å; Q219-N223 PolarHBondContact O-ND2 2.85Å; C220-N223 PolarHBondContact O-N 2.83Å; L221-N223 VanDerWaalsContact C-N 3.26Å; L221-N223 PolarHBondContact O-N 2.98Å; N223-R225 PolarHBondContact O-N 3.24Å
224	Q	90.9	Very high	89.6	Confident	71 Å²	71	43 Å²	43	33%	0.332	20%	0.204	S	C	.	.	H	α-helix	trans	-68.2	-26.8	175.3	-57.6	-49.4	-60.5	0	0	112.5	C220 L221 Q222 D226 S229	C220-Q224 WeakPolarHBondContact O-CG 3.4Å; C220-Q224 PolarHBondContact O-N 3.43Å; C220-Q224 PolarHBondContact O-NE2 2.73Å; C220-Q224 VanDerWaalsContact O-NE2 3.13Å; L221-Q224 PolarHBondContact O-N 2.79Å; Q222-Q224 VanDerWaalsContact C-N 3.32Å; Q222-Q224 PolarHBondContact O-N 2.63Å; Q224-D226 WeakPolarHBondContact CB-OD2 3.35Å; Q224-D226 PolarHBondContact O-N 2.94Å; Q224-D226 VanDerWaalsContact O-N 3.14Å; Q224-S229 VanDerWaalsContact CB-OG 3.23Å; Q224-S229 WeakPolarHBondContact CB-OG 3.44Å; Q224-S229 VanDerWaalsContact CG-OG 3.28Å; Q224-S229 WeakPolarHBondContact CG-OG 3.25Å
225	R	83.1	Confident	88.9	Confident	201 Å²	201	43.7 Å²	43.7	76%	0.758	21%	0.21	S	C	*	.			trans	57.6	21.9	179	-58	177.5	179.6	168.4	0.5	114.6	R93 Q222 N223	R93-R225 PolarHBondContact NH2-O 3.49Å; Q222-R225 PolarHBondContact O-N 2Å; N223-R225 PolarHBondContact O-N 3.24Å
226	D	78	Confident	88.6	Confident	44 Å²	44	41.7 Å²	41.7	24%	0.235	20%	0.196	C	C	.	.	S	Bend	trans	-110.1	159	177.9	77.7	91.8	0	0	0	112.4	Q224 I228 S229 D230	Q224-D226 WeakPolarHBondContact CB-OD2 3.35Å; Q224-D226 PolarHBondContact O-N 2.94Å; Q224-D226 VanDerWaalsContact O-N 3.14Å; D226-I228 VanDerWaalsContact C-N 3.32Å; D226-I228 PolarHBondContact O-N 3.17Å; D226-I228 VanDerWaalsContact OD1-CA 3.32Å; D226-I228 WeakPolarHBondContact OD1-CA 3.49Å; D226-I228 WeakPolarHBondContact OD1-CB 3.22Å; D226-I228 PolarHBondContact OD1-N 3.1Å; D226-S229 PolarHBondContact OD1-N 2.76Å; D226-S229 VanDerWaalsContact OD2-CB 3.29Å; D226-S229 WeakPolarHBondContact OD2-CB 3.45Å; D226-S229 PolarHBondContact OD2-OG 3.09Å; D226-D230 PolarHBondContact O-N 3.17Å
227	S	76.8	Confident	88.2	Confident	19 Å²	19	37.4 Å²	37.4	13%	0.133	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-32.5	-177.3	46.5	0	0	0	0	112.8	D230 I231	S227-D230 WeakPolarHBondContact O-CB 3.29Å; S227-D230 PolarHBondContact O-N 3.25Å; S227-I231 WeakPolarHBondContact O-CG1 2.85Å; S227-I231 PolarHBondContact O-N 2.9Å
228	I	78.3	Confident	87.5	Confident	8 Å²	8	39.2 Å²	39.2	4%	0.041	19%	0.19	C	C	.	.	H	α-helix	trans	-70.8	-41	-177.2	-50.6	-55.8	0	0	0	110.8	L33 M153 F174 P177 D226 D230 I231 V232	L33-I228 HydrophobicContact CD1-CD1 4.5Å; L33-I228 HydrophobicContact CD2-CD1 3.45Å; L33-I228 VanDerWaalsContact CD2-CD1 3.45Å; M153-I228 HydrophobicContact SD-CG2 4.07Å; F174-I228 HydrophobicContact CB-CG2 4.21Å; F174-I228 HydrophobicContact CD1-CB 4.34Å; F174-I228 HydrophobicContact CD1-CG1 3.77Å; F174-I228 HydrophobicContact CD1-CG2 4.24Å; F174-I228 HydrophobicContact CD2-CG2 3.98Å; F174-I228 HydrophobicContact CE1-CD1 4.15Å; F174-I228 HydrophobicContact CE1-CG1 3.7Å; F174-I228 HydrophobicContact CE2-CG2 4.41Å; F174-I228 HydrophobicContact CG-CB 4.47Å; F174-I228 HydrophobicContact CG-CG1 4.31Å; F174-I228 HydrophobicContact CG-CG2 3.91Å; F174-I228 HydrophobicContact CZ-CD1 4.23Å; F174-I228 HydrophobicContact CZ-CG1 4.2Å; P177-I228 HydrophobicContact CG-CB 4.17Å; P177-I228 HydrophobicContact CG-CG2 3.87Å; D226-I228 VanDerWaalsContact C-N 3.32Å; D226-I228 PolarHBondContact O-N 3.17Å; D226-I228 VanDerWaalsContact OD1-CA 3.32Å; D226-I228 WeakPolarHBondContact OD1-CA 3.49Å; D226-I228 WeakPolarHBondContact OD1-CB 3.22Å; D226-I228 PolarHBondContact OD1-N 3.1Å; I228-D230 VanDerWaalsContact C-N 3.26Å; I228-D230 PolarHBondContact O-N 3.37Å; I228-I231 HydrophobicContact CD1-CD1 4.05Å; I228-I231 WeakPolarHBondContact O-CB 3.42Å; I228-I231 PolarHBondContact O-N 3.06Å; I228-I231 VanDerWaalsContact O-N 3.08Å; I228-V232 WeakPolarHBondContact O-CG2 3.38Å; I228-V232 PolarHBondContact O-N 3.01Å
229	S	87.6	Confident	86.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-38.4	171.6	-63.4	0	0	0	0	112.4	P177 L221 Q224 D226 V232 G233	P177-S229 WeakPolarHBondContact CB-OG 3.47Å; P177-S229 WeakPolarHBondContact CD-OG 3.36Å; L221-S229 WeakPolarHBondContact O-CB 3.45Å; Q224-S229 VanDerWaalsContact CB-OG 3.23Å; Q224-S229 WeakPolarHBondContact CB-OG 3.44Å; Q224-S229 VanDerWaalsContact CG-OG 3.28Å; Q224-S229 WeakPolarHBondContact CG-OG 3.25Å; D226-S229 PolarHBondContact OD1-N 2.76Å; D226-S229 VanDerWaalsContact OD2-CB 3.29Å; D226-S229 WeakPolarHBondContact OD2-CB 3.45Å; D226-S229 PolarHBondContact OD2-OG 3.09Å; S229-V232 PolarHBondContact O-N 3.38Å; S229-G233 PolarHBondContact O-N 2.94Å
230	D	83.7	Confident	85.5	Confident	8 Å²	8	37.2 Å²	37.2	4%	0.043	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-36.6	172.9	-80.2	-15.2	0	0	0	112.6	D226 S227 I228 G233 V234 Y279 A281 S282	D226-D230 PolarHBondContact O-N 3.17Å; S227-D230 WeakPolarHBondContact O-CB 3.29Å; S227-D230 PolarHBondContact O-N 3.25Å; I228-D230 VanDerWaalsContact C-N 3.26Å; I228-D230 PolarHBondContact O-N 3.37Å; D230-G233 PolarHBondContact O-N 2.76Å; D230-V234 WeakPolarHBondContact O-CB 3.27Å; D230-V234 VanDerWaalsContact O-CG2 3.28Å; D230-V234 WeakPolarHBondContact O-CG2 3.23Å; D230-V234 PolarHBondContact O-N 2.95Å; D230-Y279 HydrophobicContact CB-CE1 4.28Å; D230-Y279 VanDerWaalsContact OD1-CE1 3.26Å; D230-Y279 WeakPolarHBondContact OD1-CE1 3.36Å; D230-Y279 PolarHBondContact OD1-OH 3.07Å; D230-A281 HydrophobicContact CB-CB 3.93Å; D230-S282 VanDerWaalsContact OD2-CB 3.32Å; D230-S282 WeakPolarHBondContact OD2-CB 3.36Å; D230-S282 PolarHBondContact OD2-N 3.42Å; D230-S282 PolarHBondContact OD2-OG 3.36Å
231	I	81	Confident	84.7	Confident	12 Å²	12	40.3 Å²	40.3	6%	0.062	20%	0.198	C	C	.	.	H	α-helix	trans	-61.8	-49.8	173	-47.8	-167.1	0	0	0	110.3	L86 M153 S227 I228 G233 V234 A235	L86-I231 HydrophobicContact CD1-CB 3.9Å; L86-I231 HydrophobicContact CD1-CD1 3.66Å; L86-I231 HydrophobicContact CD1-CG1 3.36Å; L86-I231 HydrophobicContact CD1-CG2 3.73Å; L86-I231 HydrophobicContact CD2-CG1 4.05Å; L86-I231 HydrophobicContact CG-CG1 4.29Å; M153-I231 HydrophobicContact CE-CB 4.06Å; M153-I231 HydrophobicContact CE-CG2 3.57Å; S227-I231 WeakPolarHBondContact O-CG1 2.85Å; S227-I231 PolarHBondContact O-N 2.9Å; I228-I231 HydrophobicContact CD1-CD1 4.05Å; I228-I231 WeakPolarHBondContact O-CB 3.42Å; I228-I231 PolarHBondContact O-N 3.06Å; I228-I231 VanDerWaalsContact O-N 3.08Å; I231-G233 VanDerWaalsContact C-N 3.3Å; I231-G233 PolarHBondContact O-N 2.97Å; I231-V234 PolarHBondContact O-N 3.26Å; I231-A235 VanDerWaalsContact O-CB 3.29Å; I231-A235 WeakPolarHBondContact O-CB 3.1Å; I231-A235 PolarHBondContact O-N 2.86Å
232	V	89	Confident	84.1	Confident	8 Å²	8	40.8 Å²	40.8	5%	0.048	20%	0.2	C	C	.	.	H	α-helix	trans	-59	-45.7	-179.7	173.4	0	0	0	0	110.2	M153 C159 P177 F217 L221 I228 S229 A235 F236	M153-V232 HydrophobicContact CE-CB 4.41Å; M153-V232 HydrophobicContact CE-CG2 3.53Å; M153-V232 HydrophobicContact SD-CG2 3.5Å; M153-V232 WeakPolarHBondContact SD-CG2 3.36Å; C159-V232 HydrophobicContact CB-CG2 4.44Å; P177-V232 HydrophobicContact CB-CG2 4.11Å; F217-V232 HydrophobicContact CE2-CG1 4.35Å; F217-V232 HydrophobicContact CZ-CG1 3.66Å; L221-V232 HydrophobicContact CD1-CB 4.43Å; L221-V232 HydrophobicContact CD1-CG1 4Å; L221-V232 HydrophobicContact CD2-CB 4.06Å; L221-V232 HydrophobicContact CD2-CG1 3.91Å; I228-V232 WeakPolarHBondContact O-CG2 3.38Å; I228-V232 PolarHBondContact O-N 3.01Å; S229-V232 PolarHBondContact O-N 3.38Å; V232-A235 PolarHBondContact O-N 3.47Å; V232-F236 WeakPolarHBondContact O-CB 3.35Å; V232-F236 PolarHBondContact O-N 3.34Å
233	G	89.9	Confident	83.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.3	-49	178.2	0	0	0	0	0	112.6	S229 D230 I231 A235 F236 F237 Y279	S229-G233 PolarHBondContact O-N 2.94Å; D230-G233 PolarHBondContact O-N 2.76Å; I231-G233 VanDerWaalsContact C-N 3.3Å; I231-G233 PolarHBondContact O-N 2.97Å; G233-A235 PolarHBondContact O-N 2.94Å; G233-F236 PolarHBondContact O-N 2.89Å; G233-F237 WeakPolarHBondContact O-CB 3.2Å; G233-F237 VanDerWaalsContact O-CD2 3.32Å; G233-F237 WeakPolarHBondContact O-CD2 3.26Å; G233-F237 PolarHBondContact O-N 3.35Å; G233-Y279 WeakPolarHBondContact O-CB 3.28Å
234	V	83.6	Confident	83.9	Confident	19 Å²	19	32.7 Å²	32.7	12%	0.115	16%	0.16	C	C	.	.	I	π-helix	trans	-62	-43.9	177.1	170.5	0	0	0	0	111.3	D230 I231 N238 V239 Y279 A281	D230-V234 WeakPolarHBondContact O-CB 3.27Å; D230-V234 VanDerWaalsContact O-CG2 3.28Å; D230-V234 WeakPolarHBondContact O-CG2 3.23Å; D230-V234 PolarHBondContact O-N 2.95Å; I231-V234 PolarHBondContact O-N 3.26Å; V234-N238 HydrophobicContact CG1-CB 4.29Å; V234-N238 WeakPolarHBondContact O-CA 3.37Å; V234-N238 VanDerWaalsContact O-CB 3.29Å; V234-N238 WeakPolarHBondContact O-CB 3.35Å; V234-N238 PolarHBondContact O-N 2.78Å; V234-V239 HydrophobicContact CG1-CG2 4.29Å; V234-V239 PolarHBondContact O-N 2.87Å; V234-Y279 HydrophobicContact CG2-CD1 4.09Å; V234-A281 HydrophobicContact CG2-CB 3.98Å
235	A	82.1	Confident	84.2	Confident	17 Å²	17	29.3 Å²	29.3	14%	0.14	14%	0.144	C	C	.	.	I	π-helix	trans	-60.9	-47.2	179.1	0	0	0	0	0	111.7	I231 V232 G233 V239 L240	I231-A235 VanDerWaalsContact O-CB 3.29Å; I231-A235 WeakPolarHBondContact O-CB 3.1Å; I231-A235 PolarHBondContact O-N 2.86Å; V232-A235 PolarHBondContact O-N 3.47Å; G233-A235 PolarHBondContact O-N 2.94Å; A235-V239 WeakPolarHBondContact O-CB 3.29Å; A235-L240 WeakPolarHBondContact O-CB 3.16Å; A235-L240 WeakPolarHBondContact O-CG 3.33Å; A235-L240 PolarHBondContact O-N 2.97Å
236	F	88.8	Confident	84.8	Confident	25 Å²	25	21.2 Å²	21.2	11%	0.11	12%	0.117	C	C	.	.	I	π-helix	trans	-69.8	-54.5	-177.9	-174.3	-84.3	0	0	0	112.7	H184 F217 V232 G233 I242	H184-F236 AromaticContact CE1-CE2 3.52Å; H184-F236 AromaticContact CE1-CZ 3.49Å; H184-F236 VanDerWaalsContact CE1-CZ 3.49Å; H184-F236 WeakPolarHBondContact CE1-CZ 3.48Å; H184-F236 AromaticContact NE2-CZ 3.82Å; F217-F236 HydrophobicContact CD1-CD1 4.29Å; F217-F236 HydrophobicContact CD1-CE1 4.38Å; F217-F236 HydrophobicContact CD1-CG 4.4Å; F217-F236 HydrophobicContact CE1-CB 4.1Å; F217-F236 HydrophobicContact CE1-CD1 4.07Å; F217-F236 AromaticContact CE1-CD2 3.85Å; F217-F236 HydrophobicContact CE1-CD2 3.85Å; F217-F236 HydrophobicContact CE1-CE1 4.49Å; F217-F236 HydrophobicContact CE1-CE2 4.28Å; F217-F236 AromaticContact CE1-CG 3.74Å; F217-F236 HydrophobicContact CE1-CG 3.74Å; V232-F236 WeakPolarHBondContact O-CB 3.35Å; V232-F236 PolarHBondContact O-N 3.34Å; G233-F236 PolarHBondContact O-N 2.89Å; F236-I242 HydrophobicContact CD2-CD1 3.83Å; F236-I242 HydrophobicContact CE1-CB 4.28Å; F236-I242 HydrophobicContact CE2-CB 4.42Å; F236-I242 HydrophobicContact CE2-CD1 3.69Å; F236-I242 HydrophobicContact CZ-CB 4.1Å; F236-I242 HydrophobicContact CZ-CD1 4.25Å; F236-I242 HydrophobicContact CZ-CG2 4.1Å
237	F	88.6	Confident	85.6	Confident	3 Å²	3	21.1 Å²	21.1	1%	0.013	12%	0.117	C	C	.	.	I	π-helix	trans	-86.6	-34.9	-168.9	-69.9	-75.3	0	0	0	113.3	D214 F217 Q218 G233 T277 Y279	D214-F237 HydrophobicContact CB-CE1 4.18Å; D214-F237 HydrophobicContact CB-CZ 4.45Å; D214-F237 WeakPolarHBondContact O-CZ 3.28Å; F217-F237 AromaticContact CD1-CE2 3.76Å; F217-F237 HydrophobicContact CD1-CE2 3.76Å; F217-F237 AromaticContact CD1-CZ 3.8Å; F217-F237 HydrophobicContact CD1-CZ 3.8Å; F217-F237 HydrophobicContact CE1-CE2 4.08Å; F217-F237 HydrophobicContact CE1-CZ 4.49Å; Q218-F237 HydrophobicContact CB-CE1 4.46Å; Q218-F237 HydrophobicContact CB-CE2 3.9Å; Q218-F237 HydrophobicContact CB-CZ 3.74Å; G233-F237 WeakPolarHBondContact O-CB 3.2Å; G233-F237 VanDerWaalsContact O-CD2 3.32Å; G233-F237 WeakPolarHBondContact O-CD2 3.26Å; G233-F237 PolarHBondContact O-N 3.35Å; F237-T277 WeakPolarHBondContact CB-O 3.01Å; F237-T277 VanDerWaalsContact CD1-OG1 3.28Å; F237-T277 WeakPolarHBondContact CD1-OG1 3.23Å; F237-Y279 AromaticContact CD2-CD2 3.93Å; F237-Y279 HydrophobicContact CD2-CD2 3.93Å; F237-Y279 HydrophobicContact CD2-CG 4.31Å; F237-Y279 HydrophobicContact CE2-CD2 4.32Å
238	N	82.8	Confident	86.4	Confident	46 Å²	46	23.1 Å²	23.1	25%	0.246	12%	0.124	C	C	.	.	I	π-helix	trans	-102.6	-35.1	-171.7	-57.9	2.6	0	0	0	112.6	V234 F278 Y279	V234-N238 HydrophobicContact CG1-CB 4.29Å; V234-N238 WeakPolarHBondContact O-CA 3.37Å; V234-N238 VanDerWaalsContact O-CB 3.29Å; V234-N238 WeakPolarHBondContact O-CB 3.35Å; V234-N238 PolarHBondContact O-N 2.78Å; N238-F278 WeakPolarHBondContact OD1-CA 3.36Å; N238-Y279 PolarHBondContact ND2-O 3.35Å; N238-Y279 VanDerWaalsContact ND2-O 3.09Å; N238-Y279 PolarHBondContact OD1-N 3.47Å
239	V	76.4	Confident	87.1	Confident	42 Å²	42	30 Å²	30	26%	0.255	16%	0.156	S	C	.	.	I	π-helix	trans	-94.2	-56.6	-174.9	175.7	0	0	0	0	112.3	E78 A82 V234 A235 E241	E78-V239 HydrophobicContact CB-CG1 3.62Å; A82-V239 HydrophobicContact CB-CG2 4.48Å; V234-V239 HydrophobicContact CG1-CG2 4.29Å; V234-V239 PolarHBondContact O-N 2.87Å; A235-V239 WeakPolarHBondContact O-CB 3.29Å; V239-E241 PolarHBondContact O-N 3.09Å
240	L	74.8	Confident	87	Confident	49 Å²	49	34.4 Å²	34.4	26%	0.257	18%	0.177	S	C	.	.	S	Bend	trans	-74.4	-18.2	-178.5	-67	176.4	0	0	0	112.6	F205 A235 I242	F205-L240 HydrophobicContact CZ-CD2 4.33Å; A235-L240 WeakPolarHBondContact O-CB 3.16Å; A235-L240 WeakPolarHBondContact O-CG 3.33Å; A235-L240 PolarHBondContact O-N 2.97Å; L240-I242 HydrophobicContact CB-CD1 4.03Å; L240-I242 HydrophobicContact CB-CG1 3.64Å; L240-I242 HydrophobicContact CD1-CD1 4.03Å; L240-I242 PolarHBondContact O-N 3.42Å
241	E	80.5	Confident	87.2	Confident	82 Å²	82	41.5 Å²	41.5	38%	0.383	21%	0.209	S	C	.	.			trans	47.3	47.3	179.3	-56.2	-174.8	-173.2	0	0	111.1	V239 P243 R276	V239-E241 PolarHBondContact O-N 3.09Å; E241-P243 WeakPolarHBondContact O-CD 3.37Å; E241-R276 IonicContact OE1-CZ 2.92Å; E241-R276 IonicContact OE1-NH1 2.67Å; E241-R276 PolarHBondContact OE1-NH1 3.34Å; E241-R276 IonicContact OE2-CZ 2.85Å; E241-R276 IonicContact OE2-NH1 2.76Å; E241-R276 PolarHBondContact OE2-NH1 3.5Å
242	I	83	Confident	87.4	Confident	12 Å²	12	42.2 Å²	42.2	6%	0.062	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-69.8	118.1	-179.2	-55.1	-172.4	0	0	0	107.3	H206 F236 L240	H206-I242 HydrophobicContact CB-CD1 3.86Å; F236-I242 HydrophobicContact CD2-CD1 3.83Å; F236-I242 HydrophobicContact CE1-CB 4.28Å; F236-I242 HydrophobicContact CE2-CB 4.42Å; F236-I242 HydrophobicContact CE2-CD1 3.69Å; F236-I242 HydrophobicContact CZ-CB 4.1Å; F236-I242 HydrophobicContact CZ-CD1 4.25Å; F236-I242 HydrophobicContact CZ-CG2 4.1Å; L240-I242 HydrophobicContact CB-CD1 4.03Å; L240-I242 HydrophobicContact CB-CG1 3.64Å; L240-I242 HydrophobicContact CD1-CD1 4.03Å; L240-I242 PolarHBondContact O-N 3.42Å
243	P	88.8	Confident	87.2	Confident	12 Å²	12	42.9 Å²	42.9	8%	0.078	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-74.3	150.4	175.6	32	-33.7	0	0	0	109.5	I208 E241 L273	I208-P243 HydrophobicContact CD1-CG 4.39Å; I208-P243 WeakPolarHBondContact CG2-O 3.47Å; E241-P243 WeakPolarHBondContact O-CD 3.37Å; P243-L273 HydrophobicContact CB-CD2 4.36Å; P243-L273 HydrophobicContact CG-CD2 4.29Å
244	C	94.9	Very high	87.2	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.054	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-97	169	163.1	70.7	0	0	0	0	110.3	S209 C211 D214 L273 Q274	S209-C244 WeakPolarHBondContact O-CA 3.42Å; C211-C244 WeakPolarHBondContact CA-SG 3.3Å; C211-C244 HydrophobicContact CB-CB 3.84Å; C211-C244 WeakPolarHBondContact CB-SG 3.37Å; C211-C244 VanDerWaalsContact SG-C 3.5Å; C211-C244 WeakPolarHBondContact SG-CB 3.41Å; C211-C244 CovalentContact SG-SG 2.04Å; C211-C244 PolarHBondContact SG-SG 3.44Å; D214-C244 HydrophobicContact CB-CB 4.16Å; D214-C244 WeakPolarHBondContact OD2-CB 3.23Å; C244-L273 WeakPolarHBondContact O-CA 3.49Å; C244-Q274 PolarHBondContact O-N 2.92Å
245	F	95.8	Very high	87.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	154.4	172.1	68.7	-85.1	0	0	0	112.6	Q189 I191 Y198 I208 S209 H210 C211 L247 A271 R272 L273	Q189-F245 HydrophobicContact CB-CE2 4.36Å; Q189-F245 HydrophobicContact CB-CZ 4.03Å; Q189-F245 WeakPolarHBondContact O-CZ 3.31Å; I191-F245 HydrophobicContact CD1-CD1 4.23Å; I191-F245 HydrophobicContact CD1-CE1 4.11Å; I191-F245 HydrophobicContact CD1-CZ 4.41Å; I191-F245 HydrophobicContact CG1-CD1 4.4Å; I191-F245 HydrophobicContact CG1-CE1 3.83Å; I191-F245 HydrophobicContact CG1-CZ 4.1Å; Y198-F245 AromaticContact CD2-CE2 3.88Å; Y198-F245 HydrophobicContact CD2-CE2 3.88Å; Y198-F245 HydrophobicContact CD2-CZ 4.03Å; Y198-F245 HydrophobicContact CE2-CE2 4.01Å; Y198-F245 AromaticContact CE2-CZ 3.91Å; Y198-F245 HydrophobicContact CE2-CZ 3.91Å; I208-F245 HydrophobicContact CG2-CD1 3.65Å; I208-F245 HydrophobicContact CG2-CE1 4.34Å; I208-F245 WeakPolarHBondContact O-CE1 3.49Å; S209-F245 WeakPolarHBondContact O-CD1 3.04Å; S209-F245 PolarHBondContact O-N 3.21Å; S209-F245 VanDerWaalsContact O-N 3.1Å; H210-F245 CarbonylContact C-O 3.49Å; H210-F245 WeakPolarHBondContact CA-O 3.43Å; H210-F245 HydrophobicContact CB-CZ 4.43Å; H210-F245 PolarHBondContact CD2-O 3.34Å; C211-F245 PolarHBondContact N-O 2.84Å; C211-F245 VanDerWaalsContact SG-C 3.51Å; C211-F245 PolarHBondContact SG-N 2.95Å; C211-F245 PolarHBondContact SG-O 2.84Å; C211-F245 VanDerWaalsContact SG-O 3.4Å; F245-L247 HydrophobicContact CD2-CD2 4Å; F245-L247 HydrophobicContact CD2-CG 4.31Å; F245-L247 HydrophobicContact CE2-CD2 3.79Å; F245-L247 HydrophobicContact CE2-CG 4.04Å; F245-A271 HydrophobicContact CB-CB 4.03Å; F245-A271 HydrophobicContact CD2-CB 3.65Å; F245-A271 HydrophobicContact CE2-CB 4.37Å; F245-A271 HydrophobicContact CG-CB 3.99Å; F245-R272 WeakPolarHBondContact CA-O 3.32Å; F245-L273 HydrophobicContact CB-CD2 4.1Å
246	V	96.7	Very high	87.8	Confident	31 Å²	31	54.8 Å²	54.8	19%	0.188	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	150	163.3	-60.2	0	0	0	0	108.9	C211 E248 A271 R272 Q274	C211-V246 HydrophobicContact CB-CG1 4.1Å; V246-E248 HydrophobicContact CG2-CG 4.39Å; V246-A271 WeakPolarHBondContact O-CA 3.33Å; V246-R272 HydrophobicContact CG2-CB 4.19Å; V246-R272 PolarHBondContact N-O 3.17Å; V246-R272 PolarHBondContact O-N 2.92Å; V246-Q274 HydrophobicContact CG1-CG 4.09Å
247	L	95.3	Very high	87.8	Confident	42 Å²	42	57.8 Å²	57.8	22%	0.22	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	129	173.1	-66.8	178.1	0	0	0	110.3	Q189 Y198 F245 A271	Q189-L247 HydrophobicContact CG-CD1 4.39Å; Q189-L247 VanDerWaalsContact NE2-CD1 3.28Å; Y198-L247 HydrophobicContact CD1-CD1 4.24Å; Y198-L247 HydrophobicContact CD1-CD2 3.41Å; Y198-L247 VanDerWaalsContact CD1-CD2 3.41Å; Y198-L247 HydrophobicContact CD1-CG 4.49Å; Y198-L247 HydrophobicContact CD2-CD2 4.08Å; Y198-L247 HydrophobicContact CE1-CD1 3.96Å; Y198-L247 HydrophobicContact CE1-CD2 3.95Å; Y198-L247 HydrophobicContact CG-CD2 3.49Å; Y198-L247 VanDerWaalsContact CG-CD2 3.49Å; F245-L247 HydrophobicContact CD2-CD2 4Å; F245-L247 HydrophobicContact CD2-CG 4.31Å; F245-L247 HydrophobicContact CE2-CD2 3.79Å; F245-L247 HydrophobicContact CE2-CG 4.04Å; L247-A271 HydrophobicContact CD2-CB 4.27Å
248	E	93.1	Very high	87.8	Confident	61 Å²	61	68.6 Å²	68.6	29%	0.285	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.4	174.2	-66.1	-173.2	155.2	0	0	109.8	V246 Q250 S269 L270 R272	V246-E248 HydrophobicContact CG2-CG 4.39Å; E248-Q250 PolarHBondContact O-N 2.06Å; E248-S269 WeakPolarHBondContact O-CA 3.38Å; E248-L270 PolarHBondContact N-O 3.28Å; E248-L270 PolarHBondContact O-N 3.4Å; E248-R272 IonicContact OE1-CZ 3.35Å; E248-R272 IonicContact OE1-NE 2.95Å; E248-R272 PolarHBondContact OE1-NE 3.27Å; E248-R272 IonicContact OE1-NH2 3.63Å; E248-R272 PolarHBondContact OE1-NH2 2.97Å; E248-R272 WeakPolarHBondContact OE2-CD 3.34Å; E248-R272 IonicContact OE2-NE 3.26Å; E248-R272 PolarHBondContact OE2-NE 3.12Å; E248-R272 VanDerWaalsContact OE2-NE 3.09Å
249	E	92.8	Very high	88.1	Confident	154 Å²	154	74 Å²	74	72%	0.72	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.3	123.8	172.6	-68.9	-168.8	168.2	0	0	109.6	T267 V268	E249-T267 HydrophobicContact CB-CG2 3.67Å; E249-T267 HydrophobicContact CG-CG2 4.02Å; E249-V268 WeakPolarHBondContact CA-O 3.49Å
250	Q	85.8	Confident	88.2	Confident	92 Å²	92	74.3 Å²	74.3	43%	0.43	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.3	175.8	-62.9	-170.4	6.8	0	0	109.7	E248 A252 V268 L270	E248-Q250 PolarHBondContact O-N 2.06Å; Q250-A252 PolarHBondContact O-N 2.98Å; Q250-V268 PolarHBondContact N-O 3.41Å; Q250-V268 WeakPolarHBondContact O-CG2 3.29Å; Q250-V268 PolarHBondContact O-N 3.22Å; Q250-L270 HydrophobicContact CB-CD1 4.06Å; Q250-L270 HydrophobicContact CG-CD1 4.42Å
251	E	88.6	Confident	89	Confident	156 Å²	156	73.1 Å²	73.1	73%	0.729	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	119	169	-73.6	-163.3	148.1	0	0	109.6
252	A	84.1	Confident	89.5	Confident	28 Å²	28	70.7 Å²	70.7	23%	0.231	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	167.3	172.8	0	0	0	0	0	111.3	Q250 V254 Y265 G266 V268	Q250-A252 PolarHBondContact O-N 2.98Å; A252-V254 PolarHBondContact O-N 3.22Å; A252-Y265 WeakPolarHBondContact O-CA 3.27Å; A252-G266 PolarHBondContact N-O 3.19Å; A252-G266 PolarHBondContact O-N 3.13Å; A252-G266 VanDerWaalsContact O-O 3.11Å; A252-V268 HydrophobicContact CB-CG1 4.43Å; A252-V268 HydrophobicContact CB-CG2 3.31Å
253	C	85.1	Confident	90	Very high	21 Å²	21	78.1 Å²	78.1	14%	0.142	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	112.7	176.5	-167.5	0	0	0	0	111.4	A255 W256 C262 Y265	C253-A255 PolarHBondContact SG-O 2.93Å; C253-W256 HydrophobicContact CB-CD2 4.37Å; C253-W256 HydrophobicContact CB-CH2 4.07Å; C253-W256 HydrophobicContact CB-CZ2 3.69Å; C253-W256 PolarHBondContact O-NE1 3.25Å; C253-C262 WeakPolarHBondContact CA-SG 3.09Å; C253-C262 HydrophobicContact CB-CB 3.75Å; C253-C262 WeakPolarHBondContact CB-SG 3.23Å; C253-C262 WeakPolarHBondContact SG-CA 3.46Å; C253-C262 WeakPolarHBondContact SG-CB 3.41Å; C253-C262 CovalentContact SG-SG 2.02Å; C253-C262 PolarHBondContact SG-SG 3.43Å; C253-Y265 HydrophobicContact CB-CE1 4.47Å
254	V	89.2	Confident	90.2	Very high	79 Å²	79	80.8 Å²	80.8	48%	0.479	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-20.6	179.5	-62.9	0	0	0	0	112.7	A252 T264 V268	A252-V254 PolarHBondContact O-N 3.22Å; V254-T264 WeakPolarHBondContact CG2-O 3.44Å; V254-T264 PolarHBondContact N-O 2.97Å; V254-V268 HydrophobicContact CG1-CG1 3.6Å
255	A	87.9	Confident	90	Very high	33 Å²	33	87.8 Å²	87.8	27%	0.273	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.9	173.7	0	0	0	0	0	111.1	C253 R263 T264	C253-A255 PolarHBondContact SG-O 2.93Å; A255-R263 HydrophobicContact CB-CB 4.29Å; A255-R263 WeakPolarHBondContact O-CA 3.12Å; A255-R263 WeakPolarHBondContact O-CB 3.48Å; A255-R263 PolarHBondContact O-N 3.23Å; A255-T264 VanDerWaalsContact CB-OG1 3.22Å; A255-T264 WeakPolarHBondContact CB-OG1 3.46Å; A255-T264 PolarHBondContact N-O 3.17Å; A255-T264 PolarHBondContact O-N 3.46Å
256	W	90	Very high	89.7	Confident	174 Å²	174	88.8 Å²	88.8	66%	0.659	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.7	144.6	-176.7	-59.8	81.1	0	0	0	110.8	C253	C253-W256 HydrophobicContact CB-CD2 4.37Å; C253-W256 HydrophobicContact CB-CH2 4.07Å; C253-W256 HydrophobicContact CB-CZ2 3.69Å; C253-W256 PolarHBondContact O-NE1 3.25Å
257	Y	90.7	Very high	89.6	Confident	89 Å²	89	91.7 Å²	91.7	35%	0.349	45%	0.446	S	S	.	.			trans	-74.8	155.8	161.2	-66.7	-70.3	0	0	0	110.1	W259 G260 G261 C262 R263	Y257-W259 VanDerWaalsContact CB-CZ2 3.46Å; Y257-W259 AromaticContact CD1-CH2 3.42Å; Y257-W259 HydrophobicContact CD1-CH2 3.42Å; Y257-W259 VanDerWaalsContact CD1-CH2 3.42Å; Y257-W259 AromaticContact CD1-CZ2 3.42Å; Y257-W259 HydrophobicContact CD1-CZ2 3.42Å; Y257-W259 VanDerWaalsContact CD1-CZ2 3.42Å; Y257-W259 HydrophobicContact CD1-CZ3 4.24Å; Y257-W259 AromaticContact CD2-CE2 3.91Å; Y257-W259 HydrophobicContact CD2-CH2 4.41Å; Y257-W259 AromaticContact CD2-CZ2 3.56Å; Y257-W259 HydrophobicContact CD2-CZ2 3.56Å; Y257-W259 AromaticContact CE1-CH2 3.97Å; Y257-W259 HydrophobicContact CE1-CH2 3.97Å; Y257-W259 AromaticContact CE1-CZ2 3.97Å; Y257-W259 HydrophobicContact CE1-CZ2 3.97Å; Y257-W259 HydrophobicContact CE2-CZ2 4.08Å; Y257-W259 HydrophobicContact CG-CD2 4.37Å; Y257-W259 AromaticContact CG-CE2 3.58Å; Y257-W259 AromaticContact CG-CH2 3.68Å; Y257-W259 HydrophobicContact CG-CH2 3.68Å; Y257-W259 AromaticContact CG-CZ2 3.19Å; Y257-W259 HydrophobicContact CG-CZ2 3.19Å; Y257-W259 HydrophobicContact CG-CZ3 4.44Å; Y257-W259 PolarHBondContact O-N 3Å; Y257-G260 PolarHBondContact O-N 3.17Å; Y257-G261 WeakPolarHBondContact CD2-O 3.42Å; Y257-G261 PolarHBondContact N-O 2.74Å; Y257-C262 WeakPolarHBondContact CE2-O 3.18Å; Y257-R263 HydrophobicContact CD1-CB 4.22Å; Y257-R263 HydrophobicContact CD1-CG 4.41Å; Y257-R263 HydrophobicContact CD2-CB 4Å; Y257-R263 HydrophobicContact CE1-CB 3.94Å; Y257-R263 HydrophobicContact CE1-CG 3.75Å; Y257-R263 VanDerWaalsContact CE2-CA 3.45Å; Y257-R263 HydrophobicContact CE2-CB 3.72Å; Y257-R263 HydrophobicContact CE2-CG 4.16Å; Y257-R263 HydrophobicContact CG-CB 4.24Å
258	W	87.5	Confident	89.2	Confident	230 Å²	230	91.6 Å²	91.6	87%	0.871	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.4	-178.7	66.1	-90.7	0	0	0	113.7	G260	W258-G260 VanDerWaalsContact C-N 3.28Å; W258-G260 PolarHBondContact O-N 3.23Å
259	W	88.5	Confident	89.1	Confident	160 Å²	160	91.3 Å²	91.3	61%	0.606	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	2.7	173	59.5	81.7	0	0	0	114.2	Y257	Y257-W259 VanDerWaalsContact CB-CZ2 3.46Å; Y257-W259 AromaticContact CD1-CH2 3.42Å; Y257-W259 HydrophobicContact CD1-CH2 3.42Å; Y257-W259 VanDerWaalsContact CD1-CH2 3.42Å; Y257-W259 AromaticContact CD1-CZ2 3.42Å; Y257-W259 HydrophobicContact CD1-CZ2 3.42Å; Y257-W259 VanDerWaalsContact CD1-CZ2 3.42Å; Y257-W259 HydrophobicContact CD1-CZ3 4.24Å; Y257-W259 AromaticContact CD2-CE2 3.91Å; Y257-W259 HydrophobicContact CD2-CH2 4.41Å; Y257-W259 AromaticContact CD2-CZ2 3.56Å; Y257-W259 HydrophobicContact CD2-CZ2 3.56Å; Y257-W259 AromaticContact CE1-CH2 3.97Å; Y257-W259 HydrophobicContact CE1-CH2 3.97Å; Y257-W259 AromaticContact CE1-CZ2 3.97Å; Y257-W259 HydrophobicContact CE1-CZ2 3.97Å; Y257-W259 HydrophobicContact CE2-CZ2 4.08Å; Y257-W259 HydrophobicContact CG-CD2 4.37Å; Y257-W259 AromaticContact CG-CE2 3.58Å; Y257-W259 AromaticContact CG-CH2 3.68Å; Y257-W259 HydrophobicContact CG-CH2 3.68Å; Y257-W259 AromaticContact CG-CZ2 3.19Å; Y257-W259 HydrophobicContact CG-CZ2 3.19Å; Y257-W259 HydrophobicContact CG-CZ3 4.44Å; Y257-W259 PolarHBondContact O-N 3Å
260	G	79.5	Confident	89.1	Confident	47 Å²	47	86.3 Å²	86.3	49%	0.485	43%	0.43	S	S	.	.	S	Bend	trans	91.3	3.6	174.9	0	0	0	0	0	116.2	Y257 W258	Y257-G260 PolarHBondContact O-N 3.17Å; W258-G260 VanDerWaalsContact C-N 3.28Å; W258-G260 PolarHBondContact O-N 3.23Å
261	G	91.6	Very high	89.5	Confident	25 Å²	25	82.4 Å²	82.4	26%	0.258	41%	0.414	S	S	.	.			trans	-77.2	156.7	169.9	0	0	0	0	0	112.3	Y257	Y257-G261 WeakPolarHBondContact CD2-O 3.42Å; Y257-G261 PolarHBondContact N-O 2.74Å
262	C	91	Very high	89.7	Confident	30 Å²	30	80 Å²	80	20%	0.203	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.8	174.9	-167.6	0	0	0	0	112.3	C253 Y257 T264 Y265	C253-C262 WeakPolarHBondContact CA-SG 3.09Å; C253-C262 HydrophobicContact CB-CB 3.75Å; C253-C262 WeakPolarHBondContact CB-SG 3.23Å; C253-C262 WeakPolarHBondContact SG-CA 3.46Å; C253-C262 WeakPolarHBondContact SG-CB 3.41Å; C253-C262 CovalentContact SG-SG 2.02Å; C253-C262 PolarHBondContact SG-SG 3.43Å; Y257-C262 WeakPolarHBondContact CE2-O 3.18Å; C262-T264 PolarHBondContact SG-O 3.42Å; C262-T264 VanDerWaalsContact SG-O 3.34Å; C262-Y265 HydrophobicContact CB-CE1 4.36Å; C262-Y265 HydrophobicContact CB-CE2 3.73Å
263	R	92.8	Very high	90.1	Very high	169 Å²	169	82.7 Å²	82.7	64%	0.638	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	-45.7	176	-176.6	175.8	-178.9	-171.6	-0.5	112.1	A255 Y257	A255-R263 HydrophobicContact CB-CB 4.29Å; A255-R263 WeakPolarHBondContact O-CA 3.12Å; A255-R263 WeakPolarHBondContact O-CB 3.48Å; A255-R263 PolarHBondContact O-N 3.23Å; Y257-R263 HydrophobicContact CD1-CB 4.22Å; Y257-R263 HydrophobicContact CD1-CG 4.41Å; Y257-R263 HydrophobicContact CD2-CB 4Å; Y257-R263 HydrophobicContact CE1-CB 3.94Å; Y257-R263 HydrophobicContact CE1-CG 3.75Å; Y257-R263 VanDerWaalsContact CE2-CA 3.45Å; Y257-R263 HydrophobicContact CE2-CB 3.72Å; Y257-R263 HydrophobicContact CE2-CG 4.16Å; Y257-R263 HydrophobicContact CG-CB 4.24Å
264	T	93.1	Very high	90.5	Very high	67 Å²	67	84.1 Å²	84.1	41%	0.411	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	133.3	177.8	55	0	0	0	0	110.3	V254 A255 C262	V254-T264 WeakPolarHBondContact CG2-O 3.44Å; V254-T264 PolarHBondContact N-O 2.97Å; A255-T264 VanDerWaalsContact CB-OG1 3.22Å; A255-T264 WeakPolarHBondContact CB-OG1 3.46Å; A255-T264 PolarHBondContact N-O 3.17Å; A255-T264 PolarHBondContact O-N 3.46Å; C262-T264 PolarHBondContact SG-O 3.42Å; C262-T264 VanDerWaalsContact SG-O 3.34Å
265	Y	90.6	Very high	90.1	Very high	156 Å²	156	85.2 Å²	85.2	61%	0.612	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	148.6	168.7	-69.4	-92.2	0	0	0	109.6	A252 C253 C262	A252-Y265 WeakPolarHBondContact O-CA 3.27Å; C253-Y265 HydrophobicContact CB-CE1 4.47Å; C262-Y265 HydrophobicContact CB-CE1 4.36Å; C262-Y265 HydrophobicContact CB-CE2 3.73Å
266	G	90.8	Very high	89.5	Confident	20 Å²	20	88.7 Å²	88.7	21%	0.206	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	163.8	174.1	0	0	0	0	0	110.4	A252 V268	A252-G266 PolarHBondContact N-O 3.19Å; A252-G266 PolarHBondContact O-N 3.13Å; A252-G266 VanDerWaalsContact O-O 3.11Å; G266-V268 PolarHBondContact O-N 3.46Å
267	T	93.4	Very high	89.1	Confident	92 Å²	92	83.1 Å²	83.1	56%	0.564	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.6	176.6	-46	0	0	0	0	109.8	E249	E249-T267 HydrophobicContact CB-CG2 3.67Å; E249-T267 HydrophobicContact CG-CG2 4.02Å
268	V	87.8	Confident	88.9	Confident	40 Å²	40	84.1 Å²	84.1	24%	0.242	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.5	174.1	-62.7	0	0	0	0	110	E249 Q250 A252 V254 G266 L270	E249-V268 WeakPolarHBondContact CA-O 3.49Å; Q250-V268 PolarHBondContact N-O 3.41Å; Q250-V268 WeakPolarHBondContact O-CG2 3.29Å; Q250-V268 PolarHBondContact O-N 3.22Å; A252-V268 HydrophobicContact CB-CG1 4.43Å; A252-V268 HydrophobicContact CB-CG2 3.31Å; V254-V268 HydrophobicContact CG1-CG1 3.6Å; G266-V268 PolarHBondContact O-N 3.46Å; V268-L270 HydrophobicContact CG2-CD1 4.36Å; V268-L270 HydrophobicContact CG2-CD2 3.88Å; V268-L270 HydrophobicContact CG2-CG 3.93Å; V268-L270 PolarHBondContact O-N 3.33Å
269	S	90.9	Very high	88.9	Confident	56 Å²	56	73.3 Å²	73.3	39%	0.392	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	110.9	173.7	-49.7	0	0	0	0	110	E248	E248-S269 WeakPolarHBondContact O-CA 3.38Å
270	L	91.9	Very high	88.8	Confident	48 Å²	48	71.3 Å²	71.3	25%	0.251	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.2	176.7	-59.1	-178.5	0	0	0	110.2	Y198 E248 Q250 V268	Y198-L270 WeakPolarHBondContact O-CA 3.32Å; E248-L270 PolarHBondContact N-O 3.28Å; E248-L270 PolarHBondContact O-N 3.4Å; Q250-L270 HydrophobicContact CB-CD1 4.06Å; Q250-L270 HydrophobicContact CG-CD1 4.42Å; V268-L270 HydrophobicContact CG2-CD1 4.36Å; V268-L270 HydrophobicContact CG2-CD2 3.88Å; V268-L270 HydrophobicContact CG2-CG 3.93Å; V268-L270 PolarHBondContact O-N 3.33Å
271	A	93.6	Very high	88.8	Confident	11 Å²	11	69.1 Å²	69.1	9%	0.091	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	123.4	177.5	0	0	0	0	0	110.2	I191 Y198 I200 F245 V246 L247	I191-A271 HydrophobicContact CD1-CB 4.34Å; Y198-A271 HydrophobicContact CG-CB 4.43Å; Y198-A271 PolarHBondContact O-N 3.27Å; I200-A271 HydrophobicContact CD1-CB 3.64Å; I200-A271 HydrophobicContact CG1-CB 3.93Å; F245-A271 HydrophobicContact CB-CB 4.03Å; F245-A271 HydrophobicContact CD2-CB 3.65Å; F245-A271 HydrophobicContact CE2-CB 4.37Å; F245-A271 HydrophobicContact CG-CB 3.99Å; V246-A271 WeakPolarHBondContact O-CA 3.33Å; L247-A271 HydrophobicContact CD2-CB 4.27Å
272	R	94.2	Very high	87.8	Confident	106 Å²	106	70.5 Å²	70.5	40%	0.4	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.1	166.5	-176.6	169	58.9	83.8	-0.6	109.2	F245 V246 E248 Q274	F245-R272 WeakPolarHBondContact CA-O 3.32Å; V246-R272 HydrophobicContact CG2-CB 4.19Å; V246-R272 PolarHBondContact N-O 3.17Å; V246-R272 PolarHBondContact O-N 2.92Å; E248-R272 IonicContact OE1-CZ 3.35Å; E248-R272 IonicContact OE1-NE 2.95Å; E248-R272 PolarHBondContact OE1-NE 3.27Å; E248-R272 IonicContact OE1-NH2 3.63Å; E248-R272 PolarHBondContact OE1-NH2 2.97Å; E248-R272 WeakPolarHBondContact OE2-CD 3.34Å; E248-R272 IonicContact OE2-NE 3.26Å; E248-R272 PolarHBondContact OE2-NE 3.12Å; E248-R272 VanDerWaalsContact OE2-NE 3.09Å; R272-Q274 VanDerWaalsContact CZ-NE2 3.35Å
273	L	92.8	Very high	86.3	Confident	83 Å²	83	72.4 Å²	72.4	44%	0.435	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	134.8	176.6	-64.3	178.6	0	0	0	110.1	I200 I208 P243 C244 F245	I200-L273 HydrophobicContact CD1-CD2 3.78Å; I200-L273 HydrophobicContact CD1-CG 4.11Å; I208-L273 HydrophobicContact CD1-CD2 4.38Å; I208-L273 HydrophobicContact CG2-CD2 4.05Å; P243-L273 HydrophobicContact CB-CD2 4.36Å; P243-L273 HydrophobicContact CG-CD2 4.29Å; C244-L273 WeakPolarHBondContact O-CA 3.49Å; F245-L273 HydrophobicContact CB-CD2 4.1Å
274	Q	93.1	Very high	84.4	Confident	51 Å²	51	67.1 Å²	67.1	24%	0.238	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-92.3	156.2	172.9	-64.9	-59.1	-18.7	0	0	111.5	C211 C244 V246 R272	C211-Q274 WeakPolarHBondContact SG-CG 3.43Å; C244-Q274 PolarHBondContact O-N 2.92Å; V246-Q274 HydrophobicContact CG1-CG 4.09Å; R272-Q274 VanDerWaalsContact CZ-NE2 3.35Å
275	P	81.4	Confident	82.2	Confident	103 Å²	103	67.1 Å²	67.1	67%	0.669	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-55.4	154.5	166.3	-21.5	33	0	0	0	111.8	T277	P275-T277 PolarHBondContact O-N 3.47Å
276	R	74.5	Confident	79.9	Confident	105 Å²	105	70.4 Å²	70.4	40%	0.396	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-61.6	136.8	177.4	72.5	-174.4	-169.7	-163.4	15	111	E241 F278	E241-R276 IonicContact OE1-CZ 2.92Å; E241-R276 IonicContact OE1-NH1 2.67Å; E241-R276 PolarHBondContact OE1-NH1 3.34Å; E241-R276 IonicContact OE2-CZ 2.85Å; E241-R276 IonicContact OE2-NH1 2.76Å; E241-R276 PolarHBondContact OE2-NH1 3.5Å; R276-F278 VanDerWaalsContact NE-CZ 3.26Å; R276-F278 VanDerWaalsContact NH2-CZ 3.32Å
277	T	80.8	Confident	77.4	Confident	58 Å²	58	73.7 Å²	73.7	36%	0.356	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-90.2	145.8	165.6	51.6	0	0	0	0	109.1	F237 P275	F237-T277 WeakPolarHBondContact CB-O 3.01Å; F237-T277 VanDerWaalsContact CD1-OG1 3.28Å; F237-T277 WeakPolarHBondContact CD1-OG1 3.23Å; P275-T277 PolarHBondContact O-N 3.47Å
278	F	86.7	Confident	74.8	Confident	110 Å²	110	74.7 Å²	74.7	48%	0.482	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-96.4	140.4	176.5	-68.9	-85.9	0	0	0	110.5	Q218 N238 R276	Q218-F278 PolarHBondContact NE2-O 3.35Å; N238-F278 WeakPolarHBondContact OD1-CA 3.36Å; R276-F278 VanDerWaalsContact NE-CZ 3.26Å; R276-F278 VanDerWaalsContact NH2-CZ 3.32Å
279	Y	87.5	Confident	71.9	Confident	2 Å²	2	77.4 Å²	77.4	1%	0.008	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-89.9	117.1	169.8	-172.1	-86.8	0	0	0	109.9	Q218 L221 Q222 D230 G233 V234 F237 N238 A281	Q218-Y279 HydrophobicContact CG-CD2 3.97Å; Q218-Y279 HydrophobicContact CG-CE2 4.35Å; L221-Y279 HydrophobicContact CB-CE2 3.83Å; L221-Y279 HydrophobicContact CD1-CE2 4.21Å; Q222-Y279 HydrophobicContact CG-CE2 3.79Å; D230-Y279 HydrophobicContact CB-CE1 4.28Å; D230-Y279 VanDerWaalsContact OD1-CE1 3.26Å; D230-Y279 WeakPolarHBondContact OD1-CE1 3.36Å; D230-Y279 PolarHBondContact OD1-OH 3.07Å; G233-Y279 WeakPolarHBondContact O-CB 3.28Å; V234-Y279 HydrophobicContact CG2-CD1 4.09Å; F237-Y279 AromaticContact CD2-CD2 3.93Å; F237-Y279 HydrophobicContact CD2-CD2 3.93Å; F237-Y279 HydrophobicContact CD2-CG 4.31Å; F237-Y279 HydrophobicContact CE2-CD2 4.32Å; N238-Y279 PolarHBondContact ND2-O 3.35Å; N238-Y279 VanDerWaalsContact ND2-O 3.09Å; N238-Y279 PolarHBondContact OD1-N 3.47Å; Y279-A281 HydrophobicContact CD1-CB 4.01Å; Y279-A281 HydrophobicContact CE1-CB 3.83Å; Y279-A281 PolarHBondContact O-N 2.99Å
280	N	87.3	Confident	69.3	Low	118 Å²	118	80.4 Å²	80.4	63%	0.631	44%	0.439	S	S	*	.			trans	-87.3	104.9	172.2	-68.9	-22.2	0	0	0	108.5
281	A	78.9	Confident	66.3	Low	1 Å²	1	84.2 Å²	84.2	1%	0.008	47%	0.465	C	S	.	.			trans	-82.3	154.1	179.1	0	0	0	0	0	110.9	D230 V234 Y279 W283 S284	D230-A281 HydrophobicContact CB-CB 3.93Å; V234-A281 HydrophobicContact CG2-CB 3.98Å; Y279-A281 HydrophobicContact CD1-CB 4.01Å; Y279-A281 HydrophobicContact CE1-CB 3.83Å; Y279-A281 PolarHBondContact O-N 2.99Å; A281-W283 HydrophobicContact CB-CG 4.4Å; A281-W283 PolarHBondContact O-N 2.91Å; A281-W283 VanDerWaalsContact O-N 3.14Å; A281-S284 PolarHBondContact N-OG 2.65Å; A281-S284 WeakPolarHBondContact O-CB 3.31Å; A281-S284 PolarHBondContact O-N 3.46Å; A281-S284 PolarHBondContact O-OG 2.58Å; A281-S284 VanDerWaalsContact O-OG 3.06Å
282	S	70.4	Confident	63.3	Low	55 Å²	55	88.5 Å²	88.5	39%	0.385	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-55.7	-37.9	-172.5	58.9	0	0	0	0	113.4	D230 S285	D230-S282 VanDerWaalsContact OD2-CB 3.32Å; D230-S282 WeakPolarHBondContact OD2-CB 3.36Å; D230-S282 PolarHBondContact OD2-N 3.42Å; D230-S282 PolarHBondContact OD2-OG 3.36Å; S282-S285 PolarHBondContact O-OG 2.94Å
283	W	60.9	Low	60.2	Low	70 Å²	70	88.7 Å²	88.7	27%	0.265	51%	0.509	S	S	.	.	G	3₁₀ helix	trans	-70.9	-22.4	175.4	58.4	-59.4	0	0	0	115.1	A85 L86 H89 A281 S285 W286	A85-W283 HydrophobicContact CB-CH2 3.91Å; A85-W283 HydrophobicContact CB-CZ3 4.19Å; L86-W283 HydrophobicContact CB-CH2 4.41Å; L86-W283 HydrophobicContact CD2-CD2 4.3Å; L86-W283 VanDerWaalsContact CD2-CE2 3.46Å; L86-W283 HydrophobicContact CD2-CH2 3.83Å; L86-W283 HydrophobicContact CD2-CZ2 3.23Å; L86-W283 HydrophobicContact CG-CH2 3.73Å; L86-W283 HydrophobicContact CG-CZ2 3.56Å; H89-W283 HydrophobicContact CB-CD2 4.49Å; H89-W283 HydrophobicContact CB-CE3 3.37Å; H89-W283 HydrophobicContact CB-CZ3 3.68Å; H89-W283 AromaticContact CD2-CE3 3.98Å; H89-W283 AromaticContact CD2-CZ3 3.55Å; H89-W283 AromaticContact CG-CE3 3.71Å; H89-W283 AromaticContact CG-CZ3 3.75Å; A281-W283 HydrophobicContact CB-CG 4.4Å; A281-W283 PolarHBondContact O-N 2.91Å; A281-W283 VanDerWaalsContact O-N 3.14Å; W283-S285 PolarHBondContact O-N 3.12Å; W283-W286 PolarHBondContact O-N 2.92Å
284	S	51.4	Low	57.1	Low	57 Å²	57	94.1 Å²	94.1	40%	0.399	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-64.8	-24.3	176.2	-42.4	0	0	0	0	112.3	A281 W286	A281-S284 PolarHBondContact N-OG 2.65Å; A281-S284 WeakPolarHBondContact O-CB 3.31Å; A281-S284 PolarHBondContact O-N 3.46Å; A281-S284 PolarHBondContact O-OG 2.58Å; A281-S284 VanDerWaalsContact O-OG 3.06Å; S284-W286 PolarHBondContact O-N 2.96Å
285	S	46.7	Very low	54.4	Low	68 Å²	68	100 Å²	100	48%	0.476	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-72.6	-23.8	-177.1	-30.6	0	0	0	0	113.6	S282 W283	S282-S285 PolarHBondContact O-OG 2.94Å; W283-S285 PolarHBondContact O-N 3.12Å
286	W	42.2	Very low	51.9	Low	224 Å²	224	100.9 Å²	100.9	85%	0.848	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-83.1	-10.6	-177.5	-78.8	-176.6	0	0	0	114.2	W283 S284 T288	W283-W286 PolarHBondContact O-N 2.92Å; S284-W286 PolarHBondContact O-N 2.96Å; W286-T288 VanDerWaalsContact C-N 3.3Å; W286-T288 PolarHBondContact O-N 3.08Å
287	A	39.3	Very low	49.8	Very low	89 Å²	89	103.9 Å²	103.9	74%	0.736	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-85	3.5	176.9	0	0	0	0	0	113.9
288	T	38.3	Very low	47.2	Very low	114 Å²	114	105.6 Å²	105.6	70%	0.699	61%	0.609	S	S	*	*			trans	-142.1	66.6	-178.9	-30.3	0	0	0	0	112.1	W286	W286-T288 VanDerWaalsContact C-N 3.3Å; W286-T288 PolarHBondContact O-N 3.08Å
289	S	26.7	Very low	44.5	Very low	96 Å²	96	106.2 Å²	106.2	67%	0.671	62%	0.624	S	S	*	*			trans	-96.4	116.5	151.6	-64.5	0	0	0	0	107.5	T291	S289-T291 PolarHBondContact O-N 3.42Å
290	P	37.2	Very low	42	Very low	119 Å²	119	111.5 Å²	111.5	77%	0.773	66%	0.658	S	S	*	*			trans	-70.3	113.5	170.1	7.4	5	0	0	0	107.9
291	T	27.9	Very low	39.1	Very low	129 Å²	129	115.2 Å²	115.2	79%	0.791	67%	0.669	S	S	*	*			trans	-53.9	124.8	165.9	-44.7	0	0	0	0	108.5	S289 S293	S289-T291 PolarHBondContact O-N 3.42Å; T291-S293 PolarHBondContact O-N 2.94Å; T291-S293 VanDerWaalsContact O-N 3.09Å
292	P	31.5	Very low	36.7	Very low	101 Å²	101	121.2 Å²	121.2	66%	0.656	71%	0.708	S	S	*	*			trans	-66.5	115.7	176.2	25	-29.3	0	0	0	108.6	F294	P292-F294 PolarHBondContact O-N 3.47Å
293	S	27.8	Very low	34.6	Very low	109 Å²	109	129.4 Å²	129.4	76%	0.762	73%	0.73	S	S	*	*			trans	-60.6	113.5	172.2	165.1	0	0	0	0	109.1	T291 Q295	T291-S293 PolarHBondContact O-N 2.94Å; T291-S293 VanDerWaalsContact O-N 3.09Å; S293-Q295 PolarHBondContact O-N 3.38Å
294	F	29.1	Very low	33	Very low	198 Å²	198	135.4 Å²	135.4	87%	0.868	76%	0.761	S	S	*	*			trans	-68.7	114.9	163.5	-83.3	-86.7	0	0	0	108.6	P292	P292-F294 PolarHBondContact O-N 3.47Å
295	Q	35.6	Very low	31.8	Very low	173 Å²	173	140.5 Å²	140.5	81%	0.808	78%	0.776	S	S	*	*			trans	-72.4	126.3	169.3	-67.5	175.9	-12.9	0	0	109.2	S293	S293-Q295 PolarHBondContact O-N 3.38Å
296	S	29	Very low	30.9	Very low	123 Å²	123	144.9 Å²	144.9	86%	0.86	79%	0.789	S	S	*	*			trans	-112.8	116.2	160.2	-79.3	0	0	0	0	109.3
297	L	30.4	Very low	30.2	Very low	167 Å²	167	141.6 Å²	141.6	87%	0.874	78%	0.783	S	S	*	*			trans	-67.2	135.4	170.1	-88.5	91.5	0	0	0	111.6
298	A	25.6	Very low	29.7	Very low	94 Å²	94	144 Å²	144	78%	0.777	78%	0.783	S	S	*	*			trans	-165.5	163.2	144.5	0	0	0	0	0	110.4
299	P	31.6	Very low	29.1	Very low	124 Å²	124	150.5 Å²	150.5	81%	0.805	79%	0.794	S	S	*	*				-112.3	179.3	-114.6	8.2	16.8	0	0	0	115.5
300	P	33.3	Very low	29	Very low	113 Å²	113	155 Å²	155	73%	0.734	80%	0.802	S	S	*	*			trans	-108.4	165.3	-155.7	41.3	-34.9	0	0	0	117.5
301	K	26.6	Very low	28.3	Very low	196 Å²	196	161.2 Å²	161.2	85%	0.852	81%	0.81	S	S	*	*			trans	95.2	155.1	155.2	-68.7	-175.3	-175.3	172.5	0	118.4
302	P	30.3	Very low	28.2	Very low	126 Å²	126	160.1 Å²	160.1	82%	0.818	81%	0.805	S	S	*	*			cis	-131.2	168.9	13	28.3	-4.8	0	0	0	118.1
303	R	26.1	Very low	28.4	Very low	227 Å²	227	161 Å²	161	86%	0.857	81%	0.811	S	S	*	*			trans	-70	149.6	179.7	-75.2	176.6	158.8	180	-6.3	114.2
304	Q	27	Very low	28.4	Very low	196 Å²	196	164.9 Å²	164.9	92%	0.916	82%	0.817	S	S	*	*			trans	-132	127.2	147.9	-152.6	164.7	13.9	0	0	110.7
305	K	26.6	Very low	28.2	Very low	164 Å²	164	164.1 Å²	164.1	71%	0.713	82%	0.816	S	S	*	*			trans	-77.1	145.7	179.2	-64.4	171.2	174.4	174.5	0	109.1
306	Q	27.8	Very low	27.6	Very low	160 Å²	160	165.8 Å²	165.8	75%	0.748	82%	0.821	S	S	*	*				148.4	146.7	89.5	-118.1	163.1	11.3	0	0	103.5
307	H	26.4	Very low	27.4	Very low	156 Å²	156	163.8 Å²	163.8	72%	0.722	82%	0.819	S	S	*	*			cis	-172.1	142.4	49	-136.4	-77.7	0	0	0	109.9
308	L	29	Very low	27.2	Very low	140 Å²	140	161.2 Å²	161.2	73%	0.733	82%	0.815	S	S	*	*			trans	-66.9	145.9	164.9	-87.4	85.1	0	0	0	111.4
309	R	25.6	Very low	27.2	Very low	250 Å²	250	166.1 Å²	166.1	94%	0.943	82%	0.819	S	S	*	*			trans	-147.5	136.7	136.3	-80.6	-155.3	172.8	-169.5	-2.5	113.6
310	K	23.9	Very low	26.9	Very low	191 Å²	191	169 Å²	169	83%	0.83	82%	0.822	S	S	*	*			trans	-79.5	158.7	-178.9	-70.1	171.4	172.2	178.5	0	112.4
311	W	23.6	Very low	26.7	Very low	248 Å²	248	169.5 Å²	169.5	94%	0.939	83%	0.825	S	S	*	*			trans	-67.3	150.4	169.8	-150.4	-37.1	0	0	0	112.6
312	P	26.6	Very low	26.7	Very low	107 Å²	107	165.4 Å²	165.4	70%	0.695	82%	0.821	S	S	*	*			trans	-110	146.6	157.2	32	-22.5	0	0	0	114.8
313	P	35.7	Very low	26.5	Very low	120 Å²	120	169.6 Å²	169.6	78%	0.779	83%	0.826	S	S	*	*			trans	-101.2	156.7	-177.7	38.8	-32.1	0	0	0	114
314	Q	26.3	Very low	26.4	Very low	190 Å²	190	162.9 Å²	162.9	89%	0.888	82%	0.819	S	S	*	*			trans	-171.6	109.2	156.1	-117.9	174.2	-21	0	0	110.3
315	Q	24.9	Very low	26.3	Very low	181 Å²	181	161.8 Å²	161.8	85%	0.846	82%	0.819	S	S	*	*				63.5	107.7	84.3	-79.1	-149.8	18.8	0	0	118.3
316	K	24.1	Very low	26.1	Very low	208 Å²	208	159.4 Å²	159.4	90%	0.904	82%	0.819	S	S	*	*				46.7	121.7	123.5	-129	174.2	-171.9	178.4	0	120.3
317	G	23.8	Very low	26	Very low	81 Å²	81	158.8 Å²	158.8	84%	0.835	83%	0.826	S	S	*	*			trans	-171	111.2	159.3	0	0	0	0	0	112.8
318	S	26.6	Very low	25.8	Very low	113 Å²	113	156.8 Å²	156.8	79%	0.79	83%	0.825	S	S	*	*			trans	-82.5	148.6	174	151.7	0	0	0	0	111.4
319	K	25.6	Very low	25.6	Very low	197 Å²	197	156.5 Å²	156.5	86%	0.857	82%	0.823	S	S	*	*			trans	176.5	125.2	130.3	-96.4	171.8	-172.8	-172.5	0	112.3
320	H	25.9	Very low	25.5	Very low	185 Å²	185	152.5 Å²	152.5	86%	0.856	82%	0.815	S	S	*	*			trans	-66.3	157.9	156.4	-93.4	-66	0	0	0	110.5
321	P	28.2	Very low	25.4	Very low	124 Å²	124	150.3 Å²	150.3	81%	0.805	81%	0.813	S	S	*	*				-143.7	153.8	94.3	32.3	-13.1	0	0	0	115.8
322	S	26.5	Very low	25.7	Very low	109 Å²	109	144.2 Å²	144.2	76%	0.762	81%	0.805	S	S	*	*			trans	-66.2	149	169.7	42.1	0	0	0	0	114.5
323	K	25.6	Very low	25.7	Very low	215 Å²	215	147.3 Å²	147.3	94%	0.935	81%	0.813	S	S	*	*			trans	-145.2	126.8	145.4	-94.4	-173.2	-179.6	178.9	0	110.7
324	A	24	Very low	25.1	Very low	85 Å²	85	147.9 Å²	147.9	70%	0.702	81%	0.814	S	S	*	*			trans	-80.5	160.4	168.9	0	0	0	0	0	110.6
325	N	24.9	Very low	25.3	Very low	173 Å²	173	144 Å²	144	93%	0.925	81%	0.807	S	S	*	*			trans	-149.2	132.5	140.6	-98.4	-7.2	0	0	0	109.9
326	T	24	Very low	25.6	Very low	115 Å²	115	140.5 Å²	140.5	71%	0.706	80%	0.8	S	S	*	*			trans	-95	135.7	177.1	-61.7	0	0	0	0	108.8	V328	T326-V328 HydrophobicContact CG2-CG2 4.17Å
327	T	24.3	Very low	26	Very low	147 Å²	147	141.3 Å²	141.3	90%	0.902	80%	0.798	S	S	*	*			trans	-139.8	120.4	149.6	-45.4	0	0	0	0	109.2
328	V	23.9	Very low	26.2	Very low	114 Å²	114	145.2 Å²	145.2	69%	0.691	80%	0.798	S	S	*	*			trans	-80.4	146.3	172.5	167.6	0	0	0	0	108.7	T326	T326-V328 HydrophobicContact CG2-CG2 4.17Å
329	L	22.9	Very low	26.3	Very low	134 Å²	134	146.7 Å²	146.7	70%	0.702	80%	0.798	S	S	*	*				169.9	127.7	116.4	-161.9	63.1	0	0	0	113.9
330	Q	23.6	Very low	26.5	Very low	165 Å²	165	143.9 Å²	143.9	77%	0.771	80%	0.797	S	S	*	*			trans	84.1	108.9	148.9	-81.7	160.3	21.3	0	0	122.7
331	D	22.3	Very low	26.5	Very low	145 Å²	145	139 Å²	139	78%	0.775	79%	0.788	S	S	*	*			trans	-58.4	166.8	144.6	-116.6	-34.3	0	0	0	111.7
332	P	29.6	Very low	26.8	Very low	120 Å²	120	139.2 Å²	139.2	78%	0.779	79%	0.79	S	S	*	*			cis	-144.4	165.1	47	34.1	-10.9	0	0	0	119.1
333	M	26.8	Very low	26.9	Very low	173 Å²	173	140.9 Å²	140.9	85%	0.852	80%	0.795	S	S	*	*			trans	-28.9	137.8	157.7	-87	-165.5	160.8	0	0	116.4
334	V	23.3	Very low	27.1	Very low	132 Å²	132	133.8 Å²	133.8	80%	0.8	78%	0.784	S	S	*	*			trans	-150.8	125.6	133.2	170	0	0	0	0	109.4
335	S	31.2	Very low	27.4	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	79%	0.792	S	S	*	*			trans	-83.3	149.3	160.6	-160.7	0	0	0	0	109
336	P	29.7	Very low	27.6	Very low	109 Å²	109	139 Å²	139	71%	0.708	79%	0.792	S	S	*	*			trans	-132.2	134.4	135.2	18.7	0.4	0	0	0	113.2
337	R	34	Very low	27.6	Very low	225 Å²	225	137 Å²	137	85%	0.849	80%	0.795	S	S	*	*			trans	-60.9	144.4	151.7	-71	179.6	173	173.7	-2.1	109.2
338	L	26.5	Very low	28.6	Very low	162 Å²	162	136 Å²	136	85%	0.848	79%	0.791	S	S	*	*			trans	-144.5	105.9	155.6	-107.7	150.2	0	0	0	108.4
339	D	29.1	Very low	28.9	Very low	145 Å²	145	140 Å²	140	78%	0.775	80%	0.802	S	S	*	*			trans	-68.9	132.4	161.8	-73	-59.6	0	0	0	109.7
340	V	30.2	Very low	29.8	Very low	138 Å²	138	137.5 Å²	137.5	84%	0.836	81%	0.808	S	S	*	*			trans	-149.9	130.9	145.9	-175.9	0	0	0	0	109.2
341	A	26.1	Very low	30.7	Very low	82 Å²	82	133.1 Å²	133.1	68%	0.678	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-68.5	170.1	-177.4	0	0	0	0	0	114.8
342	P	34	Very low	32	Very low	129 Å²	129	128.5 Å²	128.5	84%	0.838	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-92.3	124.3	-173.6	33.7	-26.3	0	0	0	112.2
343	T	28.6	Very low	33.3	Very low	143 Å²	143	130.7 Å²	130.7	88%	0.877	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-95.3	123	167.8	-32.6	0	0	0	0	109.4
344	G	30.1	Very low	34.8	Very low	67 Å²	67	126 Å²	126	69%	0.691	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-71.7	156.4	180	0	0	0	0	0	113.7
345	L	31.1	Very low	36.6	Very low	170 Å²	170	127.4 Å²	127.4	89%	0.89	76%	0.76	S	S	*	*			trans	-146.3	113.1	162.7	-86.6	169	0	0	0	109.4
346	Q	28.2	Very low	38.3	Very low	197 Å²	197	123.6 Å²	123.6	92%	0.921	74%	0.738	S	S	*	*			trans	-86	148.3	155.1	-81	174.4	6.7	0	0	108.9
347	G	24.4	Very low	40.2	Very low	74 Å²	74	118.4 Å²	118.4	76%	0.763	70%	0.704	S	S	*	*			trans	135.1	128.8	157.3	0	0	0	0	0	115.2
348	P	44.8	Very low	42.2	Very low	126 Å²	126	113.8 Å²	113.8	82%	0.818	69%	0.687	S	S	*	*			trans	-100.7	137.4	-159.2	36.8	-26.8	0	0	0	113
349	Q	30	Very low	44.7	Very low	197 Å²	197	111.6 Å²	111.6	92%	0.921	67%	0.667	S	S	*	*			trans	-176.4	142.8	145.6	-85.3	-118.3	19.7	0	0	108
350	G	42.3	Very low	47.1	Very low	81 Å²	81	104.9 Å²	104.9	84%	0.835	63%	0.631	S	S	*	*	S	Bend	trans	-60.5	151.1	-159.9	0	0	0	0	0	116.8
351	G	42.6	Very low	49.6	Very low	74 Å²	74	98.3 Å²	98.3	76%	0.763	59%	0.592	S	S	*	*			trans	115.9	110.4	172.5	0	0	0	0	0	113.8	K353	G351-K353 PolarHBondContact O-N 2.86Å
352	L	49.9	Very low	52.5	Low	47 Å²	47	101.4 Å²	101.4	25%	0.246	59%	0.586	C	S	.	*			trans	-62.6	116.8	170.4	-106.8	146	0	0	0	109.9	P410 V413	L352-P410 HydrophobicContact CD1-CB 3.96Å; L352-P410 HydrophobicContact CD1-CG 3.91Å; L352-P410 HydrophobicContact CD2-CG 3.68Å; L352-P410 HydrophobicContact CG-CB 4.19Å; L352-P410 HydrophobicContact CG-CG 3.8Å; L352-V413 HydrophobicContact CD1-CB 3.83Å; L352-V413 HydrophobicContact CD1-CG2 3.37Å
353	K	56.7	Low	54.9	Low	166 Å²	166	95.5 Å²	95.5	72%	0.722	55%	0.548	S	S	*	.			trans	-47.6	140	173.4	-80.4	-178	178.6	176.9	0	110.4	G351 Q355 G356 A357	G351-K353 PolarHBondContact O-N 2.86Å; K353-Q355 PolarHBondContact O-N 3.35Å; K353-G356 PolarHBondContact O-N 2.96Å; K353-A357 PolarHBondContact O-N 3.5Å
354	P	58.1	Low	57.6	Low	75 Å²	75	89.1 Å²	89.1	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-52.9	-31.3	-173	-30.5	34.9	0	0	0	115.6	R358	P354-R358 WeakPolarHBondContact O-CB 3.43Å; P354-R358 PolarHBondContact O-N 3.03Å
355	Q	60.7	Low	60.5	Low	162 Å²	162	90.8 Å²	90.8	76%	0.757	49%	0.493	S	S	*	.	H	α-helix	trans	-72.4	-37	178.1	-62.2	-172.9	-3.2	0	0	112.9	K353 W359	K353-Q355 PolarHBondContact O-N 3.35Å; Q355-W359 WeakPolarHBondContact O-CB 3.29Å; Q355-W359 PolarHBondContact O-N 2.94Å
356	G	66.7	Low	63.3	Low	26 Å²	26	91.5 Å²	91.5	27%	0.268	48%	0.484	S	S	.	.	H	α-helix	trans	-67	-45.1	179.7	0	0	0	0	0	112.4	K353 W359 V360	K353-G356 PolarHBondContact O-N 2.96Å; G356-W359 WeakPolarHBondContact O-CB 3.5Å; G356-W359 PolarHBondContact O-N 2.95Å; G356-V360 WeakPolarHBondContact O-CG2 3.32Å; G356-V360 PolarHBondContact O-N 3.43Å
357	A	69.6	Low	66.3	Low	1 Å²	1	83.2 Å²	83.2	1%	0.008	45%	0.445	C	S	.	.	H	α-helix	trans	-69	-37.2	178	0	0	0	0	0	112.5	K353 W359 V360 C361 T494	K353-A357 PolarHBondContact O-N 3.5Å; A357-W359 VanDerWaalsContact C-N 3.27Å; A357-W359 PolarHBondContact O-N 3.06Å; A357-V360 PolarHBondContact O-N 3.34Å; A357-C361 PolarHBondContact O-N 2.86Å; A357-C361 PolarHBondContact O-SG 2.96Å; A357-C361 VanDerWaalsContact O-SG 3.36Å; A357-T494 HydrophobicContact CB-CG2 3.38Å
358	R	76.5	Confident	69.4	Low	128 Å²	128	79.7 Å²	79.7	48%	0.483	41%	0.409	S	S	.	.	H	α-helix	trans	-61.9	-37.7	172.7	-176.2	177.2	-76	153	-5	111.5	P354 C361 R362	P354-R358 WeakPolarHBondContact O-CB 3.43Å; P354-R358 PolarHBondContact O-N 3.03Å; R358-C361 PolarHBondContact O-N 3.29Å; R358-R362 WeakPolarHBondContact O-CG 3.43Å; R358-R362 PolarHBondContact O-N 3.38Å
359	W	79.7	Confident	71.5	Confident	115 Å²	115	75.6 Å²	75.6	44%	0.436	38%	0.38	S	S	.	.	H	α-helix	trans	-70	-39	177.2	-173.4	72.6	0	0	0	112.6	Q355 G356 A357 R362 S363 F404 H408	Q355-W359 WeakPolarHBondContact O-CB 3.29Å; Q355-W359 PolarHBondContact O-N 2.94Å; G356-W359 WeakPolarHBondContact O-CB 3.5Å; G356-W359 PolarHBondContact O-N 2.95Å; A357-W359 VanDerWaalsContact C-N 3.27Å; A357-W359 PolarHBondContact O-N 3.06Å; W359-R362 PolarHBondContact O-N 3.48Å; W359-S363 PolarHBondContact O-N 2.96Å; W359-F404 HydrophobicContact CD2-CE2 4.38Å; W359-F404 AromaticContact CD2-CZ 3.69Å; W359-F404 HydrophobicContact CD2-CZ 3.69Å; W359-F404 AromaticContact CE2-CE2 3.87Å; W359-F404 AromaticContact CE2-CZ 3.64Å; W359-F404 HydrophobicContact CE3-CE1 4.32Å; W359-F404 HydrophobicContact CE3-CE2 4.42Å; W359-F404 AromaticContact CE3-CZ 3.59Å; W359-F404 HydrophobicContact CE3-CZ 3.59Å; W359-F404 AromaticContact CH2-CE2 3.44Å; W359-F404 HydrophobicContact CH2-CE2 3.44Å; W359-F404 VanDerWaalsContact CH2-CE2 3.44Å; W359-F404 AromaticContact CH2-CZ 3.44Å; W359-F404 HydrophobicContact CH2-CZ 3.44Å; W359-F404 VanDerWaalsContact CH2-CZ 3.44Å; W359-F404 AromaticContact CZ2-CE2 3.35Å; W359-F404 HydrophobicContact CZ2-CE2 3.35Å; W359-F404 AromaticContact CZ2-CZ 3.51Å; W359-F404 HydrophobicContact CZ2-CZ 3.51Å; W359-F404 HydrophobicContact CZ3-CE1 4.29Å; W359-F404 HydrophobicContact CZ3-CE2 4.02Å; W359-F404 AromaticContact CZ3-CZ 3.51Å; W359-F404 HydrophobicContact CZ3-CZ 3.51Å; W359-H408 HydrophobicContact CE3-CB 4.39Å; W359-H408 HydrophobicContact CH2-CB 3.92Å; W359-H408 AromaticContact CH2-CD2 3.38Å; W359-H408 WeakPolarHBondContact CH2-CD2 3.17Å; W359-H408 AromaticContact CH2-CE1 3.57Å; W359-H408 AromaticContact CH2-CG 3.26Å; W359-H408 AromaticContact CH2-ND1 3.39Å; W359-H408 WeakPolarHBondContact CH2-ND1 3.28Å; W359-H408 AromaticContact CH2-NE2 3.58Å; W359-H408 HydrophobicContact CZ3-CB 3.41Å; W359-H408 VanDerWaalsContact CZ3-CB 3.41Å; W359-H408 AromaticContact CZ3-CD2 3.86Å; W359-H408 AromaticContact CZ3-CG 3.28Å; W359-H408 AromaticContact CZ3-ND1 3.51Å
360	V	78.8	Confident	74.4	Confident	4 Å²	4	72.1 Å²	72.1	2%	0.024	36%	0.364	C	S	.	.	H	α-helix	trans	-60.9	-46.4	170.4	171.7	0	0	0	0	111	G356 A357 R362 S363 F364 L405 V413	G356-V360 WeakPolarHBondContact O-CG2 3.32Å; G356-V360 PolarHBondContact O-N 3.43Å; A357-V360 PolarHBondContact O-N 3.34Å; V360-R362 VanDerWaalsContact C-N 3.33Å; V360-R362 PolarHBondContact O-N 2.91Å; V360-S363 VanDerWaalsContact O-CB 3.32Å; V360-S363 WeakPolarHBondContact O-CB 3.46Å; V360-S363 PolarHBondContact O-N 2.76Å; V360-S363 PolarHBondContact O-OG 2.87Å; V360-F364 HydrophobicContact CG1-CE2 3.9Å; V360-F364 WeakPolarHBondContact O-CD2 3.23Å; V360-L405 HydrophobicContact CG1-CD2 4.07Å; V360-V413 HydrophobicContact CG1-CG1 4.42Å
361	C	82.9	Confident	76.7	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.7	-39.9	176.8	-63.3	0	0	0	0	112.8	A357 R358 S363 F364 R365 Y487 C490 L491	A357-C361 PolarHBondContact O-N 2.86Å; A357-C361 PolarHBondContact O-SG 2.96Å; A357-C361 VanDerWaalsContact O-SG 3.36Å; R358-C361 PolarHBondContact O-N 3.29Å; C361-S363 PolarHBondContact O-N 2.67Å; C361-S363 VanDerWaalsContact O-N 3.16Å; C361-F364 PolarHBondContact O-N 3.09Å; C361-R365 PolarHBondContact O-N 3.4Å; C361-Y487 HydrophobicContact CB-CD2 4.12Å; C361-Y487 HydrophobicContact CB-CE2 4.16Å; C361-Y487 VanDerWaalsContact O-CD2 3.3Å; C361-Y487 WeakPolarHBondContact O-CD2 3.49Å; C361-C490 WeakPolarHBondContact CA-SG 3.46Å; C361-C490 HydrophobicContact CB-CB 3.79Å; C361-C490 WeakPolarHBondContact CB-SG 3.39Å; C361-C490 WeakPolarHBondContact SG-CB 3.44Å; C361-C490 PolarHBondContact SG-O 3.42Å; C361-C490 CovalentContact SG-SG 2.06Å; C361-C490 PolarHBondContact SG-SG 3.37Å; C361-L491 HydrophobicContact CB-CD2 4.01Å; C361-L491 HydrophobicContact CB-CG 4.29Å
362	R	86.4	Confident	79	Confident	147 Å²	147	73.8 Å²	73.8	56%	0.555	33%	0.328	S	S	*	.	H	α-helix	trans	-57.8	-28.9	174.5	-74.7	179.6	-168.1	-147	4.2	113.3	R358 W359 V360 F364 R365 R366 Y487	R358-R362 WeakPolarHBondContact O-CG 3.43Å; R358-R362 PolarHBondContact O-N 3.38Å; W359-R362 PolarHBondContact O-N 3.48Å; V360-R362 VanDerWaalsContact C-N 3.33Å; V360-R362 PolarHBondContact O-N 2.91Å; R362-F364 VanDerWaalsContact C-N 3.35Å; R362-R365 WeakPolarHBondContact O-CB 3.44Å; R362-R365 PolarHBondContact O-N 2.81Å; R362-R366 WeakPolarHBondContact O-CB 3.38Å; R362-R366 PolarHBondContact O-N 2.79Å; R362-Y487 HydrophobicContact CG-CE2 4.07Å
363	S	85.6	Confident	81	Confident	5 Å²	5	75.3 Å²	75.3	4%	0.035	33%	0.334	C	S	.	.	H	α-helix	trans	-66.4	-35.9	176.9	79.6	0	0	0	0	112.6	W359 V360 C361 R366 H367 F404	W359-S363 PolarHBondContact O-N 2.96Å; V360-S363 VanDerWaalsContact O-CB 3.32Å; V360-S363 WeakPolarHBondContact O-CB 3.46Å; V360-S363 PolarHBondContact O-N 2.76Å; V360-S363 PolarHBondContact O-OG 2.87Å; C361-S363 PolarHBondContact O-N 2.67Å; C361-S363 VanDerWaalsContact O-N 3.16Å; S363-R366 PolarHBondContact O-N 3.34Å; S363-H367 VanDerWaalsContact O-CB 3.31Å; S363-H367 WeakPolarHBondContact O-CB 3.4Å; S363-H367 PolarHBondContact O-CD2 3.01Å; S363-H367 PolarHBondContact O-N 3.39Å; S363-F404 WeakPolarHBondContact OG-CD1 3.28Å
364	F	85.4	Confident	82.7	Confident	9 Å²	9	70.3 Å²	70.3	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-67.1	-41.6	174.8	-64.9	-79.5	0	0	0	111.5	V360 C361 R362 R366 H367 L368 D369 L401 L405 L417 F486 C490	V360-F364 HydrophobicContact CG1-CE2 3.9Å; V360-F364 WeakPolarHBondContact O-CD2 3.23Å; C361-F364 PolarHBondContact O-N 3.09Å; R362-F364 VanDerWaalsContact C-N 3.35Å; F364-R366 VanDerWaalsContact C-N 3.34Å; F364-R366 PolarHBondContact O-N 2.92Å; F364-H367 PolarHBondContact O-N 3.14Å; F364-L368 HydrophobicContact CD1-CD1 3.83Å; F364-L368 WeakPolarHBondContact O-CA 3.29Å; F364-L368 WeakPolarHBondContact O-CB 3.4Å; F364-L368 PolarHBondContact O-N 3.31Å; F364-D369 PolarHBondContact O-N 2.9Å; F364-L401 HydrophobicContact CD1-CD1 3.74Å; F364-L401 HydrophobicContact CD1-CD2 3.7Å; F364-L401 HydrophobicContact CD1-CG 4.33Å; F364-L401 HydrophobicContact CE1-CD1 3.8Å; F364-L401 HydrophobicContact CE1-CD2 3.66Å; F364-L401 HydrophobicContact CE1-CG 4.18Å; F364-L401 HydrophobicContact CG-CD1 4.22Å; F364-L401 HydrophobicContact CZ-CD1 4.35Å; F364-L405 HydrophobicContact CE1-CD1 4.19Å; F364-L405 HydrophobicContact CE2-CD2 4.19Å; F364-L405 HydrophobicContact CZ-CD1 3.98Å; F364-L405 HydrophobicContact CZ-CD2 3.89Å; F364-L417 HydrophobicContact CD1-CD2 3.21Å; F364-L417 HydrophobicContact CD2-CD2 4.26Å; F364-L417 HydrophobicContact CE1-CB 4.37Å; F364-L417 HydrophobicContact CE1-CD2 3.02Å; F364-L417 HydrophobicContact CE1-CG 4.28Å; F364-L417 HydrophobicContact CE2-CD2 4.1Å; F364-L417 HydrophobicContact CG-CD2 3.85Å; F364-L417 HydrophobicContact CZ-CB 4.39Å; F364-L417 HydrophobicContact CZ-CD2 3.51Å; F364-F486 HydrophobicContact CB-CB 4.02Å; F364-C490 HydrophobicContact CD2-CB 4.24Å
365	R	89.1	Confident	84.2	Confident	102 Å²	102	66.8 Å²	66.8	39%	0.385	29%	0.29	S	S	.	.	I	π-helix	trans	-55.2	-50.9	171.6	-169.7	-179.3	-73.5	-168.2	-13.7	111.6	C361 R362 D369 Q370 Y487	C361-R365 PolarHBondContact O-N 3.4Å; R362-R365 WeakPolarHBondContact O-CB 3.44Å; R362-R365 PolarHBondContact O-N 2.81Å; R365-D369 WeakPolarHBondContact CA-OD2 3.32Å; R365-Q370 HydrophobicContact CG-CG 4.33Å; R365-Q370 VanDerWaalsContact O-CB 3.3Å; R365-Q370 WeakPolarHBondContact O-CB 3.46Å; R365-Q370 VanDerWaalsContact O-CG 3.26Å; R365-Q370 WeakPolarHBondContact O-CG 3.5Å; R365-Q370 PolarHBondContact O-N 3.43Å; R365-Y487 HydrophobicContact CB-CD2 3.8Å; R365-Y487 HydrophobicContact CB-CG 4.07Å; R365-Y487 VanDerWaalsContact NH2-CZ 3.31Å
366	R	90.9	Very high	85.5	Confident	185 Å²	185	59.6 Å²	59.6	70%	0.698	26%	0.26	S	S	*	.	I	π-helix	trans	-68.4	-35.8	-174.5	-173.2	179.5	-174.9	176.6	3.5	113.1	R362 S363 F364	R362-R366 WeakPolarHBondContact O-CB 3.38Å; R362-R366 PolarHBondContact O-N 2.79Å; S363-R366 PolarHBondContact O-N 3.34Å; F364-R366 VanDerWaalsContact C-N 3.34Å; F364-R366 PolarHBondContact O-N 2.92Å
367	H	90.9	Very high	86.6	Confident	23 Å²	23	61.6 Å²	61.6	11%	0.106	27%	0.268	C	S	.	.	I	π-helix	trans	-105.1	-23.3	-169.8	-62.7	-46	0	0	0	114.4	S363 F364 C397 L401	S363-H367 VanDerWaalsContact O-CB 3.31Å; S363-H367 WeakPolarHBondContact O-CB 3.4Å; S363-H367 PolarHBondContact O-CD2 3.01Å; S363-H367 PolarHBondContact O-N 3.39Å; F364-H367 PolarHBondContact O-N 3.14Å; H367-C397 WeakPolarHBondContact O-CB 3.36Å; H367-L401 HydrophobicContact CB-CB 3.85Å; H367-L401 HydrophobicContact CB-CD1 4.39Å
368	L	89.6	Confident	87.4	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-115	-63.9	179.3	-57.4	179.9	0	0	0	111.4	F364 Q370 C371 F393 T398 L401 L421 F486	F364-L368 HydrophobicContact CD1-CD1 3.83Å; F364-L368 WeakPolarHBondContact O-CA 3.29Å; F364-L368 WeakPolarHBondContact O-CB 3.4Å; F364-L368 PolarHBondContact O-N 3.31Å; L368-Q370 PolarHBondContact O-N 3.29Å; L368-Q370 VanDerWaalsContact O-N 3.14Å; L368-C371 WeakPolarHBondContact O-CB 3.37Å; L368-C371 PolarHBondContact O-N 3.35Å; L368-F393 HydrophobicContact CB-CD1 4.43Å; L368-F393 HydrophobicContact CB-CE1 3.83Å; L368-F393 HydrophobicContact CB-CZ 3.9Å; L368-F393 HydrophobicContact CD2-CD1 4.08Å; L368-F393 HydrophobicContact CD2-CD2 4.03Å; L368-F393 HydrophobicContact CD2-CE1 4.23Å; L368-F393 HydrophobicContact CD2-CE2 4.18Å; L368-F393 HydrophobicContact CD2-CG 3.97Å; L368-F393 HydrophobicContact CD2-CZ 4.29Å; L368-F393 HydrophobicContact CG-CZ 4.48Å; L368-F393 WeakPolarHBondContact O-CE1 3.49Å; L368-T398 HydrophobicContact CD2-CG2 4.37Å; L368-L401 HydrophobicContact CD1-CD2 3.66Å; L368-L401 HydrophobicContact CD2-CD2 3.92Å; L368-L401 HydrophobicContact CG-CD2 3.77Å; L368-L421 HydrophobicContact CD1-CD1 4.18Å; L368-L421 HydrophobicContact CD1-CD2 3.44Å; L368-L421 VanDerWaalsContact CD1-CD2 3.44Å; L368-L421 HydrophobicContact CD1-CG 4.31Å; L368-L421 HydrophobicContact CD2-CD2 3.89Å; L368-L421 HydrophobicContact CG-CD2 4.31Å; L368-F486 HydrophobicContact CB-CD2 4.35Å; L368-F486 HydrophobicContact CB-CG 4.42Å; L368-F486 HydrophobicContact CD1-CB 4.17Å; L368-F486 HydrophobicContact CD1-CD1 3.66Å; L368-F486 HydrophobicContact CD1-CD2 4.3Å; L368-F486 HydrophobicContact CD1-CE1 4.09Å; L368-F486 HydrophobicContact CD1-CG 3.78Å
369	D	88.6	Confident	88	Confident	40 Å²	40	64.5 Å²	64.5	21%	0.214	29%	0.287	C	S	.	.	I	π-helix	trans	-59.9	-34.5	-173.2	-57.8	-37.3	0	0	0	112.1	F364 R365 F486 Y487	F364-D369 PolarHBondContact O-N 2.9Å; R365-D369 WeakPolarHBondContact CA-OD2 3.32Å; D369-F486 WeakPolarHBondContact OD1-CB 3.5Å; D369-F486 WeakPolarHBondContact OD1-CD2 3.24Å; D369-F486 PolarHBondContact OD1-N 3.05Å; D369-Y487 WeakPolarHBondContact OD2-CB 3.29Å; D369-Y487 PolarHBondContact OD2-N 3.19Å
370	Q	90.8	Very high	88.3	Confident	124 Å²	124	64.9 Å²	64.9	58%	0.579	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	13	176.7	-64.2	174	-10.8	0	0	113.2	R365 L368 K372	R365-Q370 HydrophobicContact CG-CG 4.33Å; R365-Q370 VanDerWaalsContact O-CB 3.3Å; R365-Q370 WeakPolarHBondContact O-CB 3.46Å; R365-Q370 VanDerWaalsContact O-CG 3.26Å; R365-Q370 WeakPolarHBondContact O-CG 3.5Å; R365-Q370 PolarHBondContact O-N 3.43Å; L368-Q370 PolarHBondContact O-N 3.29Å; L368-Q370 VanDerWaalsContact O-N 3.14Å; Q370-K372 PolarHBondContact O-N 2.96Å; Q370-K372 VanDerWaalsContact O-N 3.16Å
371	C	91.5	Very high	88.9	Confident	7 Å²	7	68 Å²	68	5%	0.047	31%	0.309	C	S	.	.			trans	-69.5	111.8	178.1	-175.9	0	0	0	0	109.9	L368 H373 F393 C397	L368-C371 WeakPolarHBondContact O-CB 3.37Å; L368-C371 PolarHBondContact O-N 3.35Å; C371-H373 PolarHBondContact O-N 3.41Å; C371-H373 VanDerWaalsContact O-N 3.11Å; C371-H373 PolarHBondContact SG-O 2.77Å; C371-F393 HydrophobicContact CB-CD1 4.15Å; C371-C397 HydrophobicContact CB-CB 3.92Å; C371-C397 WeakPolarHBondContact CB-SG 3.38Å; C371-C397 WeakPolarHBondContact SG-CB 3.48Å; C371-C397 CovalentContact SG-SG 2.04Å; C371-C397 PolarHBondContact SG-SG 3.26Å
372	K	90.1	Very high	89.2	Confident	184 Å²	184	69.8 Å²	69.8	80%	0.8	32%	0.317	S	S	*	.	S	Bend	trans	-56.1	-29.7	177.4	-64.9	-170.7	176.7	-171.2	0	113.5	Q370	Q370-K372 PolarHBondContact O-N 2.96Å; Q370-K372 VanDerWaalsContact O-N 3.16Å
373	H	91.9	Very high	89.1	Confident	78 Å²	78	68 Å²	68	36%	0.361	32%	0.315	S	S	.	.	S	Bend	trans	-112.4	80.3	-177.3	-56.4	105.9	0	0	0	109.7	C371 F382 H394 F426	C371-H373 PolarHBondContact O-N 3.41Å; C371-H373 VanDerWaalsContact O-N 3.11Å; C371-H373 PolarHBondContact SG-O 2.77Å; H373-F382 AromaticContact CD2-CZ 3.83Å; H373-H394 HydrophobicContact CB-CB 3.65Å; H373-H394 VanDerWaalsContact O-CB 3.3Å; H373-H394 WeakPolarHBondContact O-CB 3.19Å; H373-H394 PolarHBondContact O-N 3.05Å; H373-F426 HydrophobicContact CB-CE2 4.33Å; H373-F426 HydrophobicContact CB-CZ 3.81Å; H373-F426 VanDerWaalsContact O-CE1 3.26Å; H373-F426 WeakPolarHBondContact O-CE1 3.32Å; H373-F426 VanDerWaalsContact O-CZ 3.23Å; H373-F426 WeakPolarHBondContact O-CZ 3.27Å
374	Q	92.1	Very high	89.1	Confident	62 Å²	62	69.6 Å²	69.6	29%	0.29	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	149.7	172.9	67.7	-177.5	-6.6	0	0	109.9	K381 L392 F393	Q374-K381 VanDerWaalsContact O-CD 3.29Å; Q374-K381 WeakPolarHBondContact O-CD 3.45Å; Q374-K381 PolarHBondContact O-NZ 3.25Å; Q374-L392 WeakPolarHBondContact CA-O 3.37Å; Q374-F393 HydrophobicContact CB-CD1 3.85Å; Q374-F393 HydrophobicContact CB-CE1 4.07Å; Q374-F393 VanDerWaalsContact OE1-CE1 3.28Å
375	I	90.3	Very high	89.3	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	116	174.3	-47.7	179.3	0	0	0	106.1	E379 K381 F382 L384 N386 P391 L392 F426 A446	I375-E379 HydrophobicContact CG2-CB 4.03Å; I375-E379 HydrophobicContact CG2-CG 4.49Å; I375-E379 VanDerWaalsContact CG2-O 3.3Å; I375-E379 WeakPolarHBondContact CG2-O 3.36Å; I375-K381 HydrophobicContact CB-CB 4.49Å; I375-K381 HydrophobicContact CG1-CB 4.15Å; I375-K381 HydrophobicContact CG2-CB 4.02Å; I375-F382 HydrophobicContact CD1-CD2 4.1Å; I375-F382 HydrophobicContact CG1-CD2 3.95Å; I375-F382 HydrophobicContact CG1-CE2 4.33Å; I375-L384 HydrophobicContact CD1-CB 4.08Å; I375-L384 HydrophobicContact CD1-CD2 3.93Å; I375-L384 HydrophobicContact CD1-CG 4.34Å; I375-N386 HydrophobicContact CB-CB 4.33Å; I375-N386 HydrophobicContact CG2-CB 3.66Å; I375-N386 PolarHBondContact O-ND2 3.03Å; I375-P391 CarbonylContact O-C 3.52Å; I375-P391 WeakPolarHBondContact O-CA 3.41Å; I375-L392 HydrophobicContact CB-CB 4.37Å; I375-L392 HydrophobicContact CD1-CD2 4.49Å; I375-L392 PolarHBondContact N-O 3.14Å; I375-L392 PolarHBondContact O-N 2.94Å; I375-F426 HydrophobicContact CD1-CD1 4.15Å; I375-F426 HydrophobicContact CD1-CE1 4.17Å; I375-F426 HydrophobicContact CD1-CG 4.39Å; I375-F426 HydrophobicContact CD1-CZ 4.44Å; I375-F426 HydrophobicContact CG1-CD1 4.26Å; I375-F426 HydrophobicContact CG1-CE1 3.84Å; I375-F426 HydrophobicContact CG1-CZ 4.15Å; I375-A446 HydrophobicContact CD1-CB 3.94Å
376	G	88.6	Confident	89.4	Confident	12 Å²	12	68.5 Å²	68.5	12%	0.124	33%	0.325	C	S	.	.			trans	-66.1	171.4	-179.6	0	0	0	0	0	113.2	Q378 E379 N386	G376-Q378 PolarHBondContact O-N 2.8Å; G376-E379 WeakPolarHBondContact CA-OE2 3.49Å; G376-E379 PolarHBondContact N-OE2 3.47Å; G376-E379 WeakPolarHBondContact O-CB 3.5Å; G376-E379 PolarHBondContact O-N 3.28Å; G376-N386 WeakPolarHBondContact O-CB 3.4Å; G376-N386 PolarHBondContact O-ND2 3.38Å
377	P	88.8	Confident	89.1	Confident	67 Å²	67	63.7 Å²	63.7	44%	0.435	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	133.1	174.4	-21.8	34.3	0	0	0	111.1	E379 A388 Q389	P377-E379 PolarHBondContact O-N 2.91Å; P377-A388 WeakPolarHBondContact CA-O 3.35Å; P377-Q389 WeakPolarHBondContact CB-O 3.44Å; P377-Q389 WeakPolarHBondContact CG-O 3.37Å
378	Q	86.3	Confident	88.6	Confident	117 Å²	117	64.5 Å²	64.5	55%	0.547	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	16.3	-176.6	-50.3	-57.2	-38	0	0	114.4	G376 N386 S387	G376-Q378 PolarHBondContact O-N 2.8Å; Q378-N386 WeakPolarHBondContact CA-O 3.29Å; Q378-N386 PolarHBondContact N-O 3.34Å; Q378-S387 PolarHBondContact NE2-O 3.04Å
379	E	89.4	Confident	88.2	Confident	74 Å²	74	72.6 Å²	72.6	35%	0.346	37%	0.368	S	S	.	.			trans	-88.3	139.8	178.4	-169	-175.4	173.8	0	0	109.9	I375 G376 P377 K381 N386	I375-E379 HydrophobicContact CG2-CB 4.03Å; I375-E379 HydrophobicContact CG2-CG 4.49Å; I375-E379 VanDerWaalsContact CG2-O 3.3Å; I375-E379 WeakPolarHBondContact CG2-O 3.36Å; G376-E379 WeakPolarHBondContact CA-OE2 3.49Å; G376-E379 PolarHBondContact N-OE2 3.47Å; G376-E379 WeakPolarHBondContact O-CB 3.5Å; G376-E379 PolarHBondContact O-N 3.28Å; P377-E379 PolarHBondContact O-N 2.91Å; E379-K381 HydrophobicContact CG-CB 4.37Å; E379-N386 PolarHBondContact O-N 2.68Å
380	I	87.3	Confident	87.9	Confident	122 Å²	122	74.2 Å²	74.2	63%	0.626	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.1	164.8	-56.8	176.2	0	0	0	107.4	L384 L385	I380-L384 WeakPolarHBondContact CA-O 3.48Å; I380-L385 HydrophobicContact CD1-CD1 4.26Å; I380-L385 HydrophobicContact CG1-CB 4.01Å; I380-L385 HydrophobicContact CG1-CD1 3.52Å; I380-L385 HydrophobicContact CG1-CG 4.31Å
381	K	89.6	Confident	87.6	Confident	70 Å²	70	69.6 Å²	69.6	30%	0.304	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	147.3	176	-165.8	-177.3	-168.4	161.7	0	109.7	Q374 I375 E379 Q383 L384	Q374-K381 VanDerWaalsContact O-CD 3.29Å; Q374-K381 WeakPolarHBondContact O-CD 3.45Å; Q374-K381 PolarHBondContact O-NZ 3.25Å; I375-K381 HydrophobicContact CB-CB 4.49Å; I375-K381 HydrophobicContact CG1-CB 4.15Å; I375-K381 HydrophobicContact CG2-CB 4.02Å; E379-K381 HydrophobicContact CG-CB 4.37Å; K381-Q383 PolarHBondContact O-N 2.95Å; K381-L384 PolarHBondContact N-O 3.21Å; K381-L384 VanDerWaalsContact N-O 3.14Å; K381-L384 PolarHBondContact O-N 3.03Å
382	F	89.5	Confident	87.6	Confident	38 Å²	38	69.7 Å²	69.7	17%	0.167	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	36.7	-172.7	-46.8	-68	0	0	0	111.4	H373 I375 L384 F426 L428 P444 R445 A446	H373-F382 AromaticContact CD2-CZ 3.83Å; I375-F382 HydrophobicContact CD1-CD2 4.1Å; I375-F382 HydrophobicContact CG1-CD2 3.95Å; I375-F382 HydrophobicContact CG1-CE2 4.33Å; F382-L384 PolarHBondContact O-N 3.33Å; F382-L384 VanDerWaalsContact O-N 3.1Å; F382-F426 AromaticContact CD2-CE2 3.87Å; F382-F426 HydrophobicContact CD2-CE2 3.87Å; F382-F426 AromaticContact CD2-CZ 3.91Å; F382-F426 HydrophobicContact CD2-CZ 3.91Å; F382-F426 HydrophobicContact CE2-CE2 4.06Å; F382-F426 AromaticContact CE2-CZ 3.75Å; F382-F426 HydrophobicContact CE2-CZ 3.75Å; F382-L428 HydrophobicContact CB-CD2 3.93Å; F382-L428 HydrophobicContact CD1-CD2 3.69Å; F382-L428 HydrophobicContact CD2-CD2 4.2Å; F382-L428 HydrophobicContact CE1-CD2 4.24Å; F382-L428 HydrophobicContact CG-CD2 3.67Å; F382-P444 WeakPolarHBondContact CB-O 3.45Å; F382-R445 CarbonylContact O-C 3.57Å; F382-R445 VanDerWaalsContact O-CA 3.29Å; F382-R445 WeakPolarHBondContact O-CA 3.28Å; F382-A446 HydrophobicContact CB-CB 3.55Å; F382-A446 HydrophobicContact CD2-CB 4.35Å; F382-A446 HydrophobicContact CG-CB 4.34Å; F382-A446 PolarHBondContact O-N 3.43Å
383	Q	85.6	Confident	87.7	Confident	109 Å²	109	61.1 Å²	61.1	51%	0.509	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	20.1	-179.6	-51.7	165.9	27.2	0	0	114.8	K381 D443 R445	K381-Q383 PolarHBondContact O-N 2.95Å; Q383-D443 PolarHBondContact NE2-O 3.49Å; Q383-R445 HydrophobicContact CB-CB 4.44Å
384	L	85.4	Confident	87.8	Confident	38 Å²	38	58.5 Å²	58.5	20%	0.199	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.2	175.1	-178.6	68	0	0	0	109.5	I375 I380 K381 F382 L392 F426 A446 K448	I375-L384 HydrophobicContact CD1-CB 4.08Å; I375-L384 HydrophobicContact CD1-CD2 3.93Å; I375-L384 HydrophobicContact CD1-CG 4.34Å; I380-L384 WeakPolarHBondContact CA-O 3.48Å; K381-L384 PolarHBondContact N-O 3.21Å; K381-L384 VanDerWaalsContact N-O 3.14Å; K381-L384 PolarHBondContact O-N 3.03Å; F382-L384 PolarHBondContact O-N 3.33Å; F382-L384 VanDerWaalsContact O-N 3.1Å; L384-L392 HydrophobicContact CD2-CD2 3.76Å; L384-F426 HydrophobicContact CD2-CB 4.37Å; L384-A446 HydrophobicContact CB-CB 3.82Å; L384-A446 HydrophobicContact CD2-CB 3.82Å; L384-A446 HydrophobicContact CG-CB 4.48Å; L384-K448 HydrophobicContact CD2-CB 4.22Å
385	L	89.6	Confident	87.9	Confident	85 Å²	85	55.8 Å²	55.8	45%	0.445	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	123.6	169.3	174.6	63	0	0	0	109.6	I380 S387	I380-L385 HydrophobicContact CD1-CD1 4.26Å; I380-L385 HydrophobicContact CG1-CB 4.01Å; I380-L385 HydrophobicContact CG1-CD1 3.52Å; I380-L385 HydrophobicContact CG1-CG 4.31Å; L385-S387 PolarHBondContact O-N 3.44Å
386	N	89.7	Confident	88.1	Confident	4 Å²	4	60 Å²	60	2%	0.021	32%	0.316	C	S	.	.			trans	-89.7	90.2	169.5	-178.4	26.8	0	0	0	111	I375 G376 Q378 E379 A388 E390 L392	I375-N386 HydrophobicContact CB-CB 4.33Å; I375-N386 HydrophobicContact CG2-CB 3.66Å; I375-N386 PolarHBondContact O-ND2 3.03Å; G376-N386 WeakPolarHBondContact O-CB 3.4Å; G376-N386 PolarHBondContact O-ND2 3.38Å; Q378-N386 WeakPolarHBondContact CA-O 3.29Å; Q378-N386 PolarHBondContact N-O 3.34Å; E379-N386 PolarHBondContact O-N 2.68Å; N386-A388 PolarHBondContact O-N 3.1Å; N386-A388 VanDerWaalsContact O-N 3.15Å; N386-A388 WeakPolarHBondContact OD1-CB 3.15Å; N386-A388 PolarHBondContact OD1-N 3.38Å; N386-E390 PolarHBondContact ND2-O 3.34Å; N386-L392 PolarHBondContact ND2-N 2.91Å
387	S	85.1	Confident	88.3	Confident	84 Å²	84	60.4 Å²	60.4	59%	0.587	32%	0.316	S	S	*	.			trans	-70.4	-2.9	177.8	-48.3	0	0	0	0	114.5	Q378 L385	Q378-S387 PolarHBondContact NE2-O 3.04Å; L385-S387 PolarHBondContact O-N 3.44Å
388	A	80.4	Confident	88.4	Confident	39 Å²	39	57.3 Å²	57.3	32%	0.322	30%	0.296	S	S	.	.	S	Bend	trans	-79.4	157.8	177.1	0	0	0	0	0	111.7	P377 N386 E390	P377-A388 WeakPolarHBondContact CA-O 3.35Å; N386-A388 PolarHBondContact O-N 3.1Å; N386-A388 VanDerWaalsContact O-N 3.15Å; N386-A388 WeakPolarHBondContact OD1-CB 3.15Å; N386-A388 PolarHBondContact OD1-N 3.38Å; A388-E390 PolarHBondContact O-N 2.82Å
389	Q	80.9	Confident	88.7	Confident	170 Å²	170	58.3 Å²	58.3	79%	0.794	30%	0.295	S	S	*	.	S	Bend	trans	-77.7	-9	171.1	-62.4	-167.6	24.5	0	0	112.9	P377	P377-Q389 WeakPolarHBondContact CB-O 3.44Å; P377-Q389 WeakPolarHBondContact CG-O 3.37Å
390	E	82	Confident	88.7	Confident	75 Å²	75	62.9 Å²	62.9	35%	0.35	31%	0.309	S	S	.	.	S	Bend	trans	-108.5	148.1	-179.9	-62.7	-59.6	165.1	0	0	111.5	N386 A388	N386-E390 PolarHBondContact ND2-O 3.34Å; A388-E390 PolarHBondContact O-N 2.82Å
391	P	85.8	Confident	88.7	Confident	26 Å²	26	57.1 Å²	57.1	17%	0.169	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-67.3	134.6	177.6	25.2	-30.3	0	0	0	112	I375 F393 F486	I375-P391 CarbonylContact O-C 3.52Å; I375-P391 WeakPolarHBondContact O-CA 3.41Å; P391-F393 HydrophobicContact CB-CE2 4.11Å; P391-F393 HydrophobicContact CB-CZ 3.96Å; P391-F393 HydrophobicContact CG-CE2 3.78Å; P391-F393 HydrophobicContact CG-CZ 3.69Å; P391-F393 WeakPolarHBondContact O-CD2 3.31Å; P391-F393 WeakPolarHBondContact O-CE2 3.31Å; P391-F486 HydrophobicContact CG-CE2 3.62Å; P391-F486 HydrophobicContact CG-CZ 3.81Å
392	L	90.3	Very high	88.6	Confident	9 Å²	9	54 Å²	54	5%	0.047	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.3	175.5	-171.4	68.8	0	0	0	110.4	Q374 I375 L384 N386 F426 K448	Q374-L392 WeakPolarHBondContact CA-O 3.37Å; I375-L392 HydrophobicContact CB-CB 4.37Å; I375-L392 HydrophobicContact CD1-CD2 4.49Å; I375-L392 PolarHBondContact N-O 3.14Å; I375-L392 PolarHBondContact O-N 2.94Å; L384-L392 HydrophobicContact CD2-CD2 3.76Å; N386-L392 PolarHBondContact ND2-N 2.91Å; L392-F426 HydrophobicContact CD2-CB 4.05Å; L392-F426 HydrophobicContact CD2-CD1 4.27Å; L392-F426 HydrophobicContact CG-CB 4.44Å; L392-F426 HydrophobicContact CG-CD1 4.04Å; L392-F426 WeakPolarHBondContact O-CE1 3.37Å; L392-K448 HydrophobicContact CD1-CG 4.44Å; L392-K448 HydrophobicContact CD2-CB 4.42Å; L392-K448 HydrophobicContact CD2-CD 4.38Å; L392-K448 HydrophobicContact CD2-CG 4.21Å
393	F	92.9	Very high	88.4	Confident	5 Å²	5	60.9 Å²	60.9	2%	0.022	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	152.7	-176.2	-63.3	-80.1	0	0	0	113.3	L368 C371 Q374 P391 T398 L421 C425 F426 F486	L368-F393 HydrophobicContact CB-CD1 4.43Å; L368-F393 HydrophobicContact CB-CE1 3.83Å; L368-F393 HydrophobicContact CB-CZ 3.9Å; L368-F393 HydrophobicContact CD2-CD1 4.08Å; L368-F393 HydrophobicContact CD2-CD2 4.03Å; L368-F393 HydrophobicContact CD2-CE1 4.23Å; L368-F393 HydrophobicContact CD2-CE2 4.18Å; L368-F393 HydrophobicContact CD2-CG 3.97Å; L368-F393 HydrophobicContact CD2-CZ 4.29Å; L368-F393 HydrophobicContact CG-CZ 4.48Å; L368-F393 WeakPolarHBondContact O-CE1 3.49Å; C371-F393 HydrophobicContact CB-CD1 4.15Å; Q374-F393 HydrophobicContact CB-CD1 3.85Å; Q374-F393 HydrophobicContact CB-CE1 4.07Å; Q374-F393 VanDerWaalsContact OE1-CE1 3.28Å; P391-F393 HydrophobicContact CB-CE2 4.11Å; P391-F393 HydrophobicContact CB-CZ 3.96Å; P391-F393 HydrophobicContact CG-CE2 3.78Å; P391-F393 HydrophobicContact CG-CZ 3.69Å; P391-F393 WeakPolarHBondContact O-CD2 3.31Å; P391-F393 WeakPolarHBondContact O-CE2 3.31Å; F393-T398 HydrophobicContact CB-CG2 3.69Å; F393-T398 HydrophobicContact CG-CG2 4.45Å; F393-L421 HydrophobicContact CD2-CD2 3.96Å; F393-L421 HydrophobicContact CE2-CD2 3.87Å; F393-C425 CarbonylContact O-C 3.47Å; F393-C425 WeakPolarHBondContact O-CA 3.44Å; F393-C425 VanDerWaalsContact O-CB 3.26Å; F393-C425 WeakPolarHBondContact O-CB 3.38Å; F393-F426 VanDerWaalsContact C-CE1 3.4Å; F393-F426 WeakPolarHBondContact O-CD1 3.43Å; F393-F426 PolarHBondContact O-N 2.8Å; F393-F486 HydrophobicContact CE2-CE1 4.5Å; F393-F486 AromaticContact CE2-CE2 3.85Å; F393-F486 HydrophobicContact CE2-CE2 3.85Å; F393-F486 AromaticContact CE2-CZ 3.72Å; F393-F486 HydrophobicContact CE2-CZ 3.72Å; F393-F486 HydrophobicContact CZ-CD2 4.11Å; F393-F486 AromaticContact CZ-CE2 3.47Å; F393-F486 HydrophobicContact CZ-CE2 3.47Å; F393-F486 VanDerWaalsContact CZ-CE2 3.47Å; F393-F486 AromaticContact CZ-CZ 3.87Å; F393-F486 HydrophobicContact CZ-CZ 3.87Å
394	H	94.9	Very high	88.4	Confident	23 Å²	23	57.3 Å²	57.3	11%	0.106	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-63.6	141.9	171.1	-172.5	-95.2	0	0	0	111.5	H373 N396 C397 T398 F426	H373-H394 HydrophobicContact CB-CB 3.65Å; H373-H394 VanDerWaalsContact O-CB 3.3Å; H373-H394 WeakPolarHBondContact O-CB 3.19Å; H373-H394 PolarHBondContact O-N 3.05Å; H394-N396 PolarHBondContact CE1-ND2 3.26Å; H394-N396 WeakPolarHBondContact ND1-CB 3.4Å; H394-N396 PolarHBondContact ND1-N 3.14Å; H394-N396 VanDerWaalsContact ND1-N 3.18Å; H394-N396 PolarHBondContact O-N 3.44Å; H394-C397 WeakPolarHBondContact O-CB 3.11Å; H394-C397 PolarHBondContact O-N 3.4Å; H394-T398 PolarHBondContact O-N 3.17Å; H394-F426 CarbonylContact C-O 3.53Å; H394-F426 WeakPolarHBondContact CA-O 3.33Å; H394-F426 HydrophobicContact CB-CE1 4.08Å; H394-F426 HydrophobicContact CB-CE2 4.18Å; H394-F426 HydrophobicContact CB-CZ 3.9Å; H394-F426 AromaticContact CD2-CE2 3.84Å; H394-F426 PolarHBondContact CD2-O 2.81Å; H394-F426 VanDerWaalsContact CD2-O 3.26Å
395	C	93.3	Very high	88	Confident	4 Å²	4	56 Å²	56	3%	0.027	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-26.1	-175.4	-65.9	0	0	0	0	114.5	T398 R399 C425 F426 K427 V449	C395-T398 PolarHBondContact O-OG1 2.83Å; C395-R399 WeakPolarHBondContact O-CB 3.34Å; C395-R399 PolarHBondContact O-N 3.4Å; C395-C425 WeakPolarHBondContact CA-SG 3.43Å; C395-C425 HydrophobicContact CB-CB 3.94Å; C395-C425 WeakPolarHBondContact CB-SG 3.36Å; C395-C425 WeakPolarHBondContact SG-CB 3.3Å; C395-C425 CovalentContact SG-SG 2.03Å; C395-C425 PolarHBondContact SG-SG 2.86Å; C395-F426 PolarHBondContact N-O 2.94Å; C395-F426 PolarHBondContact SG-O 3.38Å; C395-K427 HydrophobicContact CB-CG 4.23Å; C395-V449 WeakPolarHBondContact SG-CG2 3.15Å
396	N	94.4	Very high	87.4	Confident	90 Å²	90	56.4 Å²	56.4	48%	0.481	26%	0.262	S	S	.	.	H	α-helix	trans	-71.6	-37.3	174.9	-71	-17	0	0	0	112.6	H394 R399 R400	H394-N396 PolarHBondContact CE1-ND2 3.26Å; H394-N396 WeakPolarHBondContact ND1-CB 3.4Å; H394-N396 PolarHBondContact ND1-N 3.14Å; H394-N396 VanDerWaalsContact ND1-N 3.18Å; H394-N396 PolarHBondContact O-N 3.44Å; N396-R399 PolarHBondContact O-N 2.93Å; N396-R400 VanDerWaalsContact O-CG 3.32Å; N396-R400 WeakPolarHBondContact O-CG 3.36Å; N396-R400 PolarHBondContact O-N 3.38Å
397	C	92.2	Very high	86.7	Confident	20 Å²	20	62.1 Å²	62.1	14%	0.135	29%	0.292	C	S	.	.	H	α-helix	trans	-63.5	-50.5	177.8	-74.5	0	0	0	0	110.2	H367 C371 H394 R399 R400 L401	H367-C397 WeakPolarHBondContact O-CB 3.36Å; C371-C397 HydrophobicContact CB-CB 3.92Å; C371-C397 WeakPolarHBondContact CB-SG 3.38Å; C371-C397 WeakPolarHBondContact SG-CB 3.48Å; C371-C397 CovalentContact SG-SG 2.04Å; C371-C397 PolarHBondContact SG-SG 3.26Å; H394-C397 WeakPolarHBondContact O-CB 3.11Å; H394-C397 PolarHBondContact O-N 3.4Å; C397-R399 PolarHBondContact O-N 2.76Å; C397-R400 PolarHBondContact O-N 3.03Å; C397-L401 PolarHBondContact O-N 3.31Å; C397-L401 VanDerWaalsContact O-N 3.15Å
398	T	91.3	Very high	85.9	Confident	2 Å²	2	62.2 Å²	62.2	1%	0.012	28%	0.283	C	S	.	.	H	α-helix	trans	-66.4	-35.6	177.1	56.6	0	0	0	0	112.6	L368 F393 H394 C395 L401 T402 H453 L454	L368-T398 HydrophobicContact CD2-CG2 4.37Å; F393-T398 HydrophobicContact CB-CG2 3.69Å; F393-T398 HydrophobicContact CG-CG2 4.45Å; H394-T398 PolarHBondContact O-N 3.17Å; C395-T398 PolarHBondContact O-OG1 2.83Å; T398-L401 PolarHBondContact O-N 3.25Å; T398-T402 WeakPolarHBondContact O-CB 3.33Å; T398-T402 VanDerWaalsContact O-CG2 3.25Å; T398-T402 WeakPolarHBondContact O-CG2 3.45Å; T398-T402 PolarHBondContact O-N 3.49Å; T398-T402 PolarHBondContact O-OG1 2.97Å; T398-H453 PolarHBondContact OG1-NE2 2.94Å; T398-L454 HydrophobicContact CG2-CD1 4.35Å
399	R	92.1	Very high	85	Confident	137 Å²	137	62 Å²	62	52%	0.517	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-42.3	175.5	-174.9	179.3	-59.9	-120.3	-3.3	112.8	C395 N396 C397 T402 R403 H453	C395-R399 WeakPolarHBondContact O-CB 3.34Å; C395-R399 PolarHBondContact O-N 3.4Å; N396-R399 PolarHBondContact O-N 2.93Å; C397-R399 PolarHBondContact O-N 2.76Å; R399-T402 WeakPolarHBondContact CA-OG1 3.46Å; R399-T402 PolarHBondContact O-N 3.09Å; R399-T402 PolarHBondContact O-OG1 3.18Å; R399-R403 WeakPolarHBondContact O-CB 3.19Å; R399-R403 PolarHBondContact O-N 2.81Å; R399-H453 PolarHBondContact N-NE2 3.38Å
400	R	91.2	Very high	83.7	Confident	171 Å²	171	56.8 Å²	56.8	65%	0.645	26%	0.26	S	S	*	.	H	α-helix	trans	-62.7	-46.2	177.4	-75.2	174.8	177.3	-173.8	-1.4	111	N396 C397 R403 F404	N396-R400 VanDerWaalsContact O-CG 3.32Å; N396-R400 WeakPolarHBondContact O-CG 3.36Å; N396-R400 PolarHBondContact O-N 3.38Å; C397-R400 PolarHBondContact O-N 3.03Å; R400-R403 PolarHBondContact O-N 2.84Å; R400-F404 PolarHBondContact O-N 2.84Å
401	L	86.9	Confident	82.4	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-52.8	174.9	-180	66.7	0	0	0	112	F364 H367 L368 C397 T398 R403 F404 L405 L421	F364-L401 HydrophobicContact CD1-CD1 3.74Å; F364-L401 HydrophobicContact CD1-CD2 3.7Å; F364-L401 HydrophobicContact CD1-CG 4.33Å; F364-L401 HydrophobicContact CE1-CD1 3.8Å; F364-L401 HydrophobicContact CE1-CD2 3.66Å; F364-L401 HydrophobicContact CE1-CG 4.18Å; F364-L401 HydrophobicContact CG-CD1 4.22Å; F364-L401 HydrophobicContact CZ-CD1 4.35Å; H367-L401 HydrophobicContact CB-CB 3.85Å; H367-L401 HydrophobicContact CB-CD1 4.39Å; L368-L401 HydrophobicContact CD1-CD2 3.66Å; L368-L401 HydrophobicContact CD2-CD2 3.92Å; L368-L401 HydrophobicContact CG-CD2 3.77Å; C397-L401 PolarHBondContact O-N 3.31Å; C397-L401 VanDerWaalsContact O-N 3.15Å; T398-L401 PolarHBondContact O-N 3.25Å; L401-R403 VanDerWaalsContact C-N 3.28Å; L401-R403 PolarHBondContact O-N 2.97Å; L401-F404 WeakPolarHBondContact O-CB 3.42Å; L401-F404 PolarHBondContact O-N 2.98Å; L401-F404 VanDerWaalsContact O-N 3.08Å; L401-L405 HydrophobicContact CD1-CD1 4.11Å; L401-L405 HydrophobicContact CD1-CD2 4.45Å; L401-L405 HydrophobicContact CD1-CG 4.12Å; L401-L405 HydrophobicContact CD2-CD1 4.45Å; L401-L405 HydrophobicContact CG-CD1 3.88Å; L401-L405 HydrophobicContact CG-CG 4.27Å; L401-L405 WeakPolarHBondContact O-CG 3.36Å; L401-L405 PolarHBondContact O-N 2.86Å; L401-L421 HydrophobicContact CD2-CD1 3.78Å
402	T	86.2	Confident	80.8	Confident	3 Å²	3	62 Å²	62	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-61.3	-35.1	-178.7	54	0	0	0	0	113.1	T398 R399 R406 H453 L454 L457	T398-T402 WeakPolarHBondContact O-CB 3.33Å; T398-T402 VanDerWaalsContact O-CG2 3.25Å; T398-T402 WeakPolarHBondContact O-CG2 3.45Å; T398-T402 PolarHBondContact O-N 3.49Å; T398-T402 PolarHBondContact O-OG1 2.97Å; R399-T402 WeakPolarHBondContact CA-OG1 3.46Å; R399-T402 PolarHBondContact O-N 3.09Å; R399-T402 PolarHBondContact O-OG1 3.18Å; T402-R406 WeakPolarHBondContact O-CB 3.4Å; T402-R406 WeakPolarHBondContact O-CG 3.26Å; T402-R406 PolarHBondContact O-N 2.87Å; T402-H453 PolarHBondContact OG1-CD2 3.14Å; T402-L454 HydrophobicContact CG2-CD2 3.67Å; T402-L457 HydrophobicContact CG2-CB 4.32Å; T402-L457 HydrophobicContact CG2-CD2 3.55Å
403	R	86.6	Confident	78.8	Confident	183 Å²	183	63.5 Å²	63.5	69%	0.691	30%	0.298	S	S	*	.	H	α-helix	trans	-65.9	-42.9	174.2	-167.1	177.3	-173.5	166.5	1.7	111.3	R399 R400 L401 R406 L407	R399-R403 WeakPolarHBondContact O-CB 3.19Å; R399-R403 PolarHBondContact O-N 2.81Å; R400-R403 PolarHBondContact O-N 2.84Å; L401-R403 VanDerWaalsContact C-N 3.28Å; L401-R403 PolarHBondContact O-N 2.97Å; R403-R406 PolarHBondContact O-N 2.8Å; R403-L407 HydrophobicContact CG-CD1 4.28Å; R403-L407 WeakPolarHBondContact O-CD1 3.44Å; R403-L407 PolarHBondContact O-N 2.87Å
404	F	84.6	Confident	76.8	Confident	35 Å²	35	64 Å²	64	15%	0.154	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-52.8	175.3	-178.9	-86.5	0	0	0	111.3	W359 S363 R400 L401 R406 L407 H408	W359-F404 HydrophobicContact CD2-CE2 4.38Å; W359-F404 AromaticContact CD2-CZ 3.69Å; W359-F404 HydrophobicContact CD2-CZ 3.69Å; W359-F404 AromaticContact CE2-CE2 3.87Å; W359-F404 AromaticContact CE2-CZ 3.64Å; W359-F404 HydrophobicContact CE3-CE1 4.32Å; W359-F404 HydrophobicContact CE3-CE2 4.42Å; W359-F404 AromaticContact CE3-CZ 3.59Å; W359-F404 HydrophobicContact CE3-CZ 3.59Å; W359-F404 AromaticContact CH2-CE2 3.44Å; W359-F404 HydrophobicContact CH2-CE2 3.44Å; W359-F404 VanDerWaalsContact CH2-CE2 3.44Å; W359-F404 AromaticContact CH2-CZ 3.44Å; W359-F404 HydrophobicContact CH2-CZ 3.44Å; W359-F404 VanDerWaalsContact CH2-CZ 3.44Å; W359-F404 AromaticContact CZ2-CE2 3.35Å; W359-F404 HydrophobicContact CZ2-CE2 3.35Å; W359-F404 AromaticContact CZ2-CZ 3.51Å; W359-F404 HydrophobicContact CZ2-CZ 3.51Å; W359-F404 HydrophobicContact CZ3-CE1 4.29Å; W359-F404 HydrophobicContact CZ3-CE2 4.02Å; W359-F404 AromaticContact CZ3-CZ 3.51Å; W359-F404 HydrophobicContact CZ3-CZ 3.51Å; S363-F404 WeakPolarHBondContact OG-CD1 3.28Å; R400-F404 PolarHBondContact O-N 2.84Å; L401-F404 WeakPolarHBondContact O-CB 3.42Å; L401-F404 PolarHBondContact O-N 2.98Å; L401-F404 VanDerWaalsContact O-N 3.08Å; F404-R406 VanDerWaalsContact C-N 3.27Å; F404-R406 PolarHBondContact O-N 2.97Å; F404-L407 PolarHBondContact O-N 3.25Å; F404-H408 HydrophobicContact CD1-CB 4.49Å; F404-H408 AromaticContact CD2-CD2 3.76Å; F404-H408 HydrophobicContact CE1-CB 4.18Å; F404-H408 AromaticContact CE2-CD2 3.79Å; F404-H408 HydrophobicContact CZ-CB 4.33Å; F404-H408 WeakPolarHBondContact O-CB 3.47Å; F404-H408 PolarHBondContact O-CD2 3.32Å; F404-H408 PolarHBondContact O-N 2.95Å
405	L	78.3	Confident	75	Confident	10 Å²	10	65.7 Å²	65.7	5%	0.052	31%	0.311	C	S	.	.	H	α-helix	trans	-60.2	-36.7	-179.4	-63.2	175.1	0	0	0	112.1	V360 F364 L401 L407 H408 S409 T414 L457	V360-L405 HydrophobicContact CG1-CD2 4.07Å; F364-L405 HydrophobicContact CE1-CD1 4.19Å; F364-L405 HydrophobicContact CE2-CD2 4.19Å; F364-L405 HydrophobicContact CZ-CD1 3.98Å; F364-L405 HydrophobicContact CZ-CD2 3.89Å; L401-L405 HydrophobicContact CD1-CD1 4.11Å; L401-L405 HydrophobicContact CD1-CD2 4.45Å; L401-L405 HydrophobicContact CD1-CG 4.12Å; L401-L405 HydrophobicContact CD2-CD1 4.45Å; L401-L405 HydrophobicContact CG-CD1 3.88Å; L401-L405 HydrophobicContact CG-CG 4.27Å; L401-L405 WeakPolarHBondContact O-CG 3.36Å; L401-L405 PolarHBondContact O-N 2.86Å; L405-L407 VanDerWaalsContact C-N 3.29Å; L405-L407 PolarHBondContact O-N 2.9Å; L405-H408 PolarHBondContact O-N 3.08Å; L405-S409 WeakPolarHBondContact CA-OG 3.22Å; L405-S409 VanDerWaalsContact CD2-OG 3.24Å; L405-S409 WeakPolarHBondContact CD2-OG 3.45Å; L405-S409 WeakPolarHBondContact O-CB 3.32Å; L405-S409 PolarHBondContact O-N 3.13Å; L405-S409 PolarHBondContact O-OG 2.95Å; L405-T414 HydrophobicContact CD2-CG2 4.35Å; L405-L457 HydrophobicContact CD1-CD2 4.2Å
406	R	75.8	Confident	73.1	Confident	93 Å²	93	70.3 Å²	70.3	35%	0.351	33%	0.334	S	S	.	.	H	α-helix	trans	-63.7	-31.5	176.7	-78.1	174.6	-173.4	-170.2	5.7	114.3	T402 R403 F404 H453 R460	T402-R406 WeakPolarHBondContact O-CB 3.4Å; T402-R406 WeakPolarHBondContact O-CG 3.26Å; T402-R406 PolarHBondContact O-N 2.87Å; R403-R406 PolarHBondContact O-N 2.8Å; F404-R406 VanDerWaalsContact C-N 3.27Å; F404-R406 PolarHBondContact O-N 2.97Å; R406-H453 PolarHBondContact NH2-O 3.34Å; R406-R460 PolarHBondContact O-NH1 3.11Å
407	L	74.7	Confident	71.2	Confident	124 Å²	124	66.7 Å²	66.7	65%	0.649	31%	0.314	S	S	*	.	H	α-helix	trans	-89.3	-24.6	-177.2	-74.6	162.9	0	0	0	112.3	R403 F404 L405	R403-L407 HydrophobicContact CG-CD1 4.28Å; R403-L407 WeakPolarHBondContact O-CD1 3.44Å; R403-L407 PolarHBondContact O-N 2.87Å; F404-L407 PolarHBondContact O-N 3.25Å; L405-L407 VanDerWaalsContact C-N 3.29Å; L405-L407 PolarHBondContact O-N 2.9Å
408	H	69.8	Low	69.6	Low	87 Å²	87	67.1 Å²	67.1	40%	0.403	31%	0.313	S	S	.	.	H	α-helix	trans	-132.9	-6.6	-160.5	-69.4	-51.1	0	0	0	115.8	W359 F404 L405 P410	W359-H408 HydrophobicContact CE3-CB 4.39Å; W359-H408 HydrophobicContact CH2-CB 3.92Å; W359-H408 AromaticContact CH2-CD2 3.38Å; W359-H408 WeakPolarHBondContact CH2-CD2 3.17Å; W359-H408 AromaticContact CH2-CE1 3.57Å; W359-H408 AromaticContact CH2-CG 3.26Å; W359-H408 AromaticContact CH2-ND1 3.39Å; W359-H408 WeakPolarHBondContact CH2-ND1 3.28Å; W359-H408 AromaticContact CH2-NE2 3.58Å; W359-H408 HydrophobicContact CZ3-CB 3.41Å; W359-H408 VanDerWaalsContact CZ3-CB 3.41Å; W359-H408 AromaticContact CZ3-CD2 3.86Å; W359-H408 AromaticContact CZ3-CG 3.28Å; W359-H408 AromaticContact CZ3-ND1 3.51Å; F404-H408 HydrophobicContact CD1-CB 4.49Å; F404-H408 AromaticContact CD2-CD2 3.76Å; F404-H408 HydrophobicContact CE1-CB 4.18Å; F404-H408 AromaticContact CE2-CD2 3.79Å; F404-H408 HydrophobicContact CZ-CB 4.33Å; F404-H408 WeakPolarHBondContact O-CB 3.47Å; F404-H408 PolarHBondContact O-CD2 3.32Å; F404-H408 PolarHBondContact O-N 2.95Å; L405-H408 PolarHBondContact O-N 3.08Å; H408-P410 WeakPolarHBondContact O-CD 3.41Å
409	S	61	Low	68	Low	34 Å²	34	74.4 Å²	74.4	24%	0.238	35%	0.347	C	S	.	.			trans	-95.6	123.6	-178	-63.5	0	0	0	0	112.5	L405	L405-S409 WeakPolarHBondContact CA-OG 3.22Å; L405-S409 VanDerWaalsContact CD2-OG 3.24Å; L405-S409 WeakPolarHBondContact CD2-OG 3.45Å; L405-S409 WeakPolarHBondContact O-CB 3.32Å; L405-S409 PolarHBondContact O-N 3.13Å; L405-S409 PolarHBondContact O-OG 2.95Å
410	P	54.3	Low	66.5	Low	60 Å²	60	69 Å²	69	39%	0.39	33%	0.328	S	S	.	.			trans	-74.9	155.8	159.4	-14.2	31.5	0	0	0	111.4	L352 H408 E412 T414	L352-P410 HydrophobicContact CD1-CB 3.96Å; L352-P410 HydrophobicContact CD1-CG 3.91Å; L352-P410 HydrophobicContact CD2-CG 3.68Å; L352-P410 HydrophobicContact CG-CB 4.19Å; L352-P410 HydrophobicContact CG-CG 3.8Å; H408-P410 WeakPolarHBondContact O-CD 3.41Å; P410-E412 PolarHBondContact O-N 3.04Å; P410-T414 PolarHBondContact O-OG1 3.36Å
411	S	53.3	Low	65.5	Low	57 Å²	57	61.6 Å²	61.6	40%	0.399	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-18.7	-167	44.6	0	0	0	0	117.1
412	E	52.3	Low	64.9	Low	154 Å²	154	63 Å²	63	72%	0.72	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-30	-169.9	-65.9	-62.8	134.8	0	0	114.3	P410	P410-E412 PolarHBondContact O-N 3.04Å
413	V	49.8	Very low	64.8	Low	40 Å²	40	65.5 Å²	65.5	24%	0.242	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-5.6	-174.2	172.4	0	0	0	0	113.1	L352 V360	L352-V413 HydrophobicContact CD1-CB 3.83Å; L352-V413 HydrophobicContact CD1-CG2 3.37Å; V360-V413 HydrophobicContact CG1-CG1 4.42Å
414	T	50.8	Low	64.9	Low	15 Å²	15	58.3 Å²	58.3	9%	0.092	31%	0.307	C	S	.	.	S	Bend	trans	-93.4	-2.9	-178	18.2	0	0	0	0	114.7	L405 P410 L461	L405-T414 HydrophobicContact CD2-CG2 4.35Å; P410-T414 PolarHBondContact O-OG1 3.36Å; T414-L461 HydrophobicContact CG2-CD2 4.39Å
415	N	55.5	Low	65.3	Low	59 Å²	59	56.7 Å²	56.7	32%	0.316	30%	0.3	S	S	.	.	S	Bend	trans	-84.5	-5.1	-173.6	-79.7	-22.1	0	0	0	115.9
416	M	54.3	Low	66	Low	102 Å²	102	56.2 Å²	56.2	50%	0.502	30%	0.298	S	S	.	.	S	Bend	trans	-119.3	-0.2	-171.6	-71.6	-111.6	-159.1	0	0	115.5	W475 L493	M416-W475 HydrophobicContact CE-CB 4.25Å; M416-W475 HydrophobicContact CE-CG 4.21Å; M416-L493 HydrophobicContact CB-CD1 3.77Å; M416-L493 HydrophobicContact CB-CD2 4.48Å; M416-L493 HydrophobicContact SD-CD2 4.1Å
417	L	55.4	Low	66.9	Low	13 Å²	13	57.1 Å²	57.1	7%	0.068	30%	0.304	C	S	.	.	S	Bend	trans	-111.5	3.9	-180	-128.9	83.5	0	0	0	114.7	F364 L420 F486 L493	F364-L417 HydrophobicContact CD1-CD2 3.21Å; F364-L417 HydrophobicContact CD2-CD2 4.26Å; F364-L417 HydrophobicContact CE1-CB 4.37Å; F364-L417 HydrophobicContact CE1-CD2 3.02Å; F364-L417 HydrophobicContact CE1-CG 4.28Å; F364-L417 HydrophobicContact CE2-CD2 4.1Å; F364-L417 HydrophobicContact CG-CD2 3.85Å; F364-L417 HydrophobicContact CZ-CB 4.39Å; F364-L417 HydrophobicContact CZ-CD2 3.51Å; L417-L420 HydrophobicContact CD1-CD1 3.95Å; L417-L420 HydrophobicContact CG-CD1 3.99Å; L417-F486 HydrophobicContact CD2-CD1 3.86Å; L417-F486 HydrophobicContact CG-CD1 4.38Å; L417-L493 HydrophobicContact CD1-CD1 4.23Å
418	W	57.5	Low	67.6	Low	30 Å²	30	53.8 Å²	53.8	11%	0.114	29%	0.287	C	S	.	.	H	α-helix	trans	-71.8	-39.9	179.8	166.5	-100.9	0	0	0	112.2	L420 L421 G422 T423 L454 Q458	W418-L420 PolarHBondContact O-N 2.94Å; W418-L421 PolarHBondContact O-N 3.18Å; W418-G422 WeakPolarHBondContact CH2-O 3.42Å; W418-G422 WeakPolarHBondContact CZ3-O 3.31Å; W418-T423 HydrophobicContact CH2-CG2 3.72Å; W418-T423 HydrophobicContact CZ2-CG2 3.62Å; W418-L454 HydrophobicContact CH2-CB 4.26Å; W418-L454 HydrophobicContact CZ3-CB 4.05Å; W418-L454 WeakPolarHBondContact CZ3-O 3.35Å; W418-Q458 HydrophobicContact CD2-CB 3.8Å; W418-Q458 HydrophobicContact CD2-CG 3.73Å; W418-Q458 VanDerWaalsContact CE2-NE2 3.25Å; W418-Q458 HydrophobicContact CE3-CB 3.8Å; W418-Q458 HydrophobicContact CE3-CG 4.27Å; W418-Q458 HydrophobicContact CG-CG 4.33Å; W418-Q458 HydrophobicContact CH2-CB 3.56Å; W418-Q458 HydrophobicContact CH2-CG 4Å; W418-Q458 HydrophobicContact CZ2-CB 3.59Å; W418-Q458 HydrophobicContact CZ2-CG 3.45Å; W418-Q458 VanDerWaalsContact CZ2-CG 3.45Å; W418-Q458 VanDerWaalsContact CZ2-NE2 3.27Å; W418-Q458 HydrophobicContact CZ3-CB 3.68Å; W418-Q458 HydrophobicContact CZ3-CG 4.38Å
419	E	57.5	Low	68.2	Low	155 Å²	155	50.6 Å²	50.6	72%	0.724	28%	0.276	S	S	*	.	H	α-helix	trans	-61.5	-31.7	-179.1	-65.1	-55.3	135.7	0	0	112.2
420	L	61.7	Low	69	Low	22 Å²	22	54 Å²	54	12%	0.115	30%	0.297	C	S	.	.	H	α-helix	trans	-79.7	-23.7	-176.7	-65.5	129.3	0	0	0	114.3	L417 W418 F486	L417-L420 HydrophobicContact CD1-CD1 3.95Å; L417-L420 HydrophobicContact CG-CD1 3.99Å; W418-L420 PolarHBondContact O-N 2.94Å; L420-F486 HydrophobicContact CB-CE1 3.63Å; L420-F486 HydrophobicContact CB-CZ 4.27Å
421	L	69.3	Low	69.7	Low	17 Å²	17	53.4 Å²	53.4	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-95.4	-15.1	-175.3	-70	169.9	0	0	0	114	L368 F393 L401 W418 F486	L368-L421 HydrophobicContact CD1-CD1 4.18Å; L368-L421 HydrophobicContact CD1-CD2 3.44Å; L368-L421 VanDerWaalsContact CD1-CD2 3.44Å; L368-L421 HydrophobicContact CD1-CG 4.31Å; L368-L421 HydrophobicContact CD2-CD2 3.89Å; L368-L421 HydrophobicContact CG-CD2 4.31Å; F393-L421 HydrophobicContact CD2-CD2 3.96Å; F393-L421 HydrophobicContact CE2-CD2 3.87Å; L401-L421 HydrophobicContact CD2-CD1 3.78Å; W418-L421 PolarHBondContact O-N 3.18Å; L421-F486 HydrophobicContact CD2-CE1 3.97Å; L421-F486 HydrophobicContact CD2-CZ 4.44Å; L421-F486 HydrophobicContact CG-CE1 4.32Å
422	G	75.3	Confident	70.1	Confident	29 Å²	29	56.1 Å²	56.1	30%	0.299	30%	0.303	S	S	.	.			trans	55.2	-167.2	-177.8	0	0	0	0	0	114.1	W418	W418-G422 WeakPolarHBondContact CH2-O 3.42Å; W418-G422 WeakPolarHBondContact CZ3-O 3.31Å
423	T	82.6	Confident	70.4	Confident	56 Å²	56	56.5 Å²	56.5	34%	0.344	31%	0.31	S	S	.	.	S	Bend	trans	-102	4.6	-179.4	56.3	0	0	0	0	113.4	W418 A451 R455	W418-T423 HydrophobicContact CH2-CG2 3.72Å; W418-T423 HydrophobicContact CZ2-CG2 3.62Å; T423-A451 WeakPolarHBondContact O-CB 3.32Å; T423-A451 PolarHBondContact O-N 2.92Å; T423-R455 HydrophobicContact CG2-CG 4.35Å
424	T	88.4	Confident	70.6	Confident	32 Å²	32	57.7 Å²	57.7	20%	0.196	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.4	-170.1	59.9	0	0	0	0	112.2	K448 V449	T424-K448 WeakPolarHBondContact OG1-CE 3.2Å; T424-V449 WeakPolarHBondContact CA-O 3.45Å
425	C	93.1	Very high	70.8	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.007	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	173.3	170.2	55.6	0	0	0	0	108.6	F393 C395 V449 A451	F393-C425 CarbonylContact O-C 3.47Å; F393-C425 WeakPolarHBondContact O-CA 3.44Å; F393-C425 VanDerWaalsContact O-CB 3.26Å; F393-C425 WeakPolarHBondContact O-CB 3.38Å; C395-C425 WeakPolarHBondContact CA-SG 3.43Å; C395-C425 HydrophobicContact CB-CB 3.94Å; C395-C425 WeakPolarHBondContact CB-SG 3.36Å; C395-C425 WeakPolarHBondContact SG-CB 3.3Å; C395-C425 CovalentContact SG-SG 2.03Å; C395-C425 PolarHBondContact SG-SG 2.86Å; C425-V449 PolarHBondContact N-O 2.95Å; C425-V449 WeakPolarHBondContact O-CG2 3.35Å; C425-V449 PolarHBondContact O-N 3.18Å; C425-V449 VanDerWaalsContact O-O 3.1Å; C425-A451 HydrophobicContact CB-CB 4.46Å; C425-A451 VanDerWaalsContact SG-CB 3.59Å
426	F	94.4	Very high	70.6	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	154.8	172	77.4	-90.2	0	0	0	112.9	H373 I375 F382 L384 L392 F393 H394 C395 L428 A446 I447	H373-F426 HydrophobicContact CB-CE2 4.33Å; H373-F426 HydrophobicContact CB-CZ 3.81Å; H373-F426 VanDerWaalsContact O-CE1 3.26Å; H373-F426 WeakPolarHBondContact O-CE1 3.32Å; H373-F426 VanDerWaalsContact O-CZ 3.23Å; H373-F426 WeakPolarHBondContact O-CZ 3.27Å; I375-F426 HydrophobicContact CD1-CD1 4.15Å; I375-F426 HydrophobicContact CD1-CE1 4.17Å; I375-F426 HydrophobicContact CD1-CG 4.39Å; I375-F426 HydrophobicContact CD1-CZ 4.44Å; I375-F426 HydrophobicContact CG1-CD1 4.26Å; I375-F426 HydrophobicContact CG1-CE1 3.84Å; I375-F426 HydrophobicContact CG1-CZ 4.15Å; F382-F426 AromaticContact CD2-CE2 3.87Å; F382-F426 HydrophobicContact CD2-CE2 3.87Å; F382-F426 AromaticContact CD2-CZ 3.91Å; F382-F426 HydrophobicContact CD2-CZ 3.91Å; F382-F426 HydrophobicContact CE2-CE2 4.06Å; F382-F426 AromaticContact CE2-CZ 3.75Å; F382-F426 HydrophobicContact CE2-CZ 3.75Å; L384-F426 HydrophobicContact CD2-CB 4.37Å; L392-F426 HydrophobicContact CD2-CB 4.05Å; L392-F426 HydrophobicContact CD2-CD1 4.27Å; L392-F426 HydrophobicContact CG-CB 4.44Å; L392-F426 HydrophobicContact CG-CD1 4.04Å; L392-F426 WeakPolarHBondContact O-CE1 3.37Å; F393-F426 VanDerWaalsContact C-CE1 3.4Å; F393-F426 WeakPolarHBondContact O-CD1 3.43Å; F393-F426 PolarHBondContact O-N 2.8Å; H394-F426 CarbonylContact C-O 3.53Å; H394-F426 WeakPolarHBondContact CA-O 3.33Å; H394-F426 HydrophobicContact CB-CE1 4.08Å; H394-F426 HydrophobicContact CB-CE2 4.18Å; H394-F426 HydrophobicContact CB-CZ 3.9Å; H394-F426 AromaticContact CD2-CE2 3.84Å; H394-F426 PolarHBondContact CD2-O 2.81Å; H394-F426 VanDerWaalsContact CD2-O 3.26Å; C395-F426 PolarHBondContact N-O 2.94Å; C395-F426 PolarHBondContact SG-O 3.38Å; F426-L428 HydrophobicContact CD2-CD2 4.35Å; F426-L428 HydrophobicContact CE2-CD2 3.85Å; F426-L428 HydrophobicContact CE2-CG 4.11Å; F426-A446 HydrophobicContact CB-CB 4.13Å; F426-A446 HydrophobicContact CD2-CB 3.39Å; F426-A446 HydrophobicContact CE2-CB 3.95Å; F426-A446 HydrophobicContact CG-CB 3.94Å; F426-I447 CarbonylContact C-O 3.56Å; F426-I447 WeakPolarHBondContact CA-O 3.35Å
427	K	93.6	Very high	70.2	Confident	112 Å²	112	67.5 Å²	67.5	49%	0.487	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	142.2	167.1	-68.3	-178.2	179.1	178.1	0	109.1	C395 A446 I447 V449	C395-K427 HydrophobicContact CB-CG 4.23Å; K427-A446 CarbonylContact O-C 3.58Å; K427-A446 WeakPolarHBondContact O-CA 3.1Å; K427-I447 PolarHBondContact N-O 3.21Å; K427-I447 PolarHBondContact O-N 2.83Å; K427-V449 HydrophobicContact CD-CG2 4.43Å; K427-V449 HydrophobicContact CG-CG2 4.15Å
428	L	90.6	Very high	70	Confident	54 Å²	54	77.1 Å²	77.1	28%	0.283	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	130.6	168.3	-67.1	176.1	0	0	0	109.1	F382 F426 P444 R445 A446	F382-L428 HydrophobicContact CB-CD2 3.93Å; F382-L428 HydrophobicContact CD1-CD2 3.69Å; F382-L428 HydrophobicContact CD2-CD2 4.2Å; F382-L428 HydrophobicContact CE1-CD2 4.24Å; F382-L428 HydrophobicContact CG-CD2 3.67Å; F426-L428 HydrophobicContact CD2-CD2 4.35Å; F426-L428 HydrophobicContact CE2-CD2 3.85Å; F426-L428 HydrophobicContact CE2-CG 4.11Å; L428-P444 HydrophobicContact CB-CB 4.14Å; L428-P444 HydrophobicContact CD1-CB 4.49Å; L428-P444 HydrophobicContact CD1-CG 4.18Å; L428-P444 HydrophobicContact CD2-CB 4.14Å; L428-P444 HydrophobicContact CD2-CG 4.19Å; L428-P444 HydrophobicContact CG-CB 4.48Å; L428-R445 CarbonylContact C-O 3.33Å; L428-R445 WeakPolarHBondContact CA-O 3.36Å; L428-A446 HydrophobicContact CD2-CB 4.38Å
429	A	82.3	Confident	69.9	Low	20 Å²	20	83.8 Å²	83.8	17%	0.165	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	155.2	171.7	0	0	0	0	0	108.8	P444 R445 I447	A429-P444 CarbonylContact O-C 3.44Å; A429-P444 WeakPolarHBondContact O-CA 3.45Å; A429-R445 HydrophobicContact CB-CG 3.98Å; A429-R445 PolarHBondContact N-O 3.33Å; A429-R445 PolarHBondContact O-N 2.81Å; A429-I447 HydrophobicContact CB-CD1 3.54Å; A429-I447 HydrophobicContact CB-CG1 4.11Å
430	P	76.6	Confident	69.9	Low	107 Å²	107	79.4 Å²	79.4	70%	0.695	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-54.2	149.1	170.9	-22.3	33	0	0	0	111.2
431	P	70.1	Confident	69.7	Low	46 Å²	46	81.1 Å²	81.1	30%	0.299	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-57.8	152.5	169.4	25.4	-31.8	0	0	0	110.3
432	L	61.7	Low	69.5	Low	115 Å²	115	91.3 Å²	91.3	60%	0.602	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-67.2	149	172.5	-71	166.1	0	0	0	109.4	C434	L432-C434 PolarHBondContact O-N 3.32Å; L432-C434 PolarHBondContact O-SG 2.92Å
433	D	57.3	Low	69.2	Low	162 Å²	162	94.7 Å²	94.7	87%	0.866	51%	0.509	S	S	*	.			trans	-44.7	112.8	-176.1	-64	-49.1	0	0	0	112.2	V435	D433-V435 PolarHBondContact O-N 3.15Å
434	C	54	Low	68.9	Low	64 Å²	64	94.4 Å²	94.4	43%	0.432	51%	0.508	S	S	.	.			trans	-90.8	99.7	175.8	-66.4	0	0	0	0	107	L432 E436 C440	L432-C434 PolarHBondContact O-N 3.32Å; L432-C434 PolarHBondContact O-SG 2.92Å; C434-E436 PolarHBondContact O-N 2.86Å; C434-C440 HydrophobicContact CB-CB 3.51Å; C434-C440 VanDerWaalsContact CB-SG 3.52Å; C434-C440 WeakPolarHBondContact SG-CB 3.38Å
435	V	54.9	Low	68.8	Low	132 Å²	132	96.8 Å²	96.8	80%	0.8	51%	0.514	S	S	*	.			trans	-59.4	129.6	168.2	-178.2	0	0	0	0	107.3	D433 G437	D433-V435 PolarHBondContact O-N 3.15Å; V435-G437 PolarHBondContact O-N 3Å
436	E	51.1	Low	68.7	Low	203 Å²	203	97.1 Å²	97.1	95%	0.949	52%	0.516	S	S	*	.	S	Bend	trans	-52.6	99.5	-173.3	-76.7	174.9	139.7	0	0	112.4	C434	C434-E436 PolarHBondContact O-N 2.86Å
437	G	46.3	Very low	68.4	Low	47 Å²	47	100.3 Å²	100.3	49%	0.485	53%	0.533	S	S	.	.			trans	-160.6	129.7	174.8	0	0	0	0	0	107.9	V435	V435-G437 PolarHBondContact O-N 3Å
438	K	52.7	Low	68.3	Low	215 Å²	215	100.3 Å²	100.3	94%	0.935	53%	0.533	S	S	*	.	S	Bend	trans	-54.1	139	-169.1	-68.6	-173.9	176.2	-178.1	0	111.9
439	D	54	Low	68.3	Low	171 Å²	171	99.8 Å²	99.8	91%	0.914	53%	0.532	S	S	*	.			trans	83.5	40.1	-176.6	-67.6	-14.6	0	0	0	118.4
440	C	57.8	Low	68.7	Low	62 Å²	62	103.2 Å²	103.2	42%	0.419	56%	0.555	S	S	.	*			trans	-88.5	113	160.8	-72	0	0	0	0	111.4	C434 R442	C434-C440 HydrophobicContact CB-CB 3.51Å; C434-C440 VanDerWaalsContact CB-SG 3.52Å; C434-C440 WeakPolarHBondContact SG-CB 3.38Å; C440-R442 PolarHBondContact O-N 3.21Å
441	S	58.5	Low	69.3	Low	59 Å²	59	98.2 Å²	98.2	41%	0.413	52%	0.523	S	S	.	.			trans	-65.5	115.6	172.2	162.5	0	0	0	0	109.5	D443	S441-D443 PolarHBondContact O-N 2.98Å; S441-D443 VanDerWaalsContact O-N 3.15Å; S441-D443 WeakPolarHBondContact OG-CB 3.33Å; S441-D443 PolarHBondContact OG-N 3.27Å; S441-D443 PolarHBondContact OG-OD2 2.83Å
442	R	64.1	Low	70.1	Confident	230 Å²	230	105.4 Å²	105.4	87%	0.868	54%	0.544	S	S	*	.			trans	-73.7	7.9	175.8	-67.6	-177.2	174.1	-176.9	-2.9	113.1	C440	C440-R442 PolarHBondContact O-N 3.21Å
443	D	69.4	Low	71.3	Confident	100 Å²	100	100.8 Å²	100.8	54%	0.535	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-72.9	138.7	-174.1	-63.4	-51.1	0	0	0	110.8	Q383 S441	Q383-D443 PolarHBondContact NE2-O 3.49Å; S441-D443 PolarHBondContact O-N 2.98Å; S441-D443 VanDerWaalsContact O-N 3.15Å; S441-D443 WeakPolarHBondContact OG-CB 3.33Å; S441-D443 PolarHBondContact OG-N 3.27Å; S441-D443 PolarHBondContact OG-OD2 2.83Å
444	P	76.8	Confident	72.5	Confident	50 Å²	50	93.1 Å²	93.1	33%	0.325	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-64.4	140	178.7	27.2	-34.1	0	0	0	110.7	F382 L428 A429	F382-P444 WeakPolarHBondContact CB-O 3.45Å; L428-P444 HydrophobicContact CB-CB 4.14Å; L428-P444 HydrophobicContact CD1-CB 4.49Å; L428-P444 HydrophobicContact CD1-CG 4.18Å; L428-P444 HydrophobicContact CD2-CB 4.14Å; L428-P444 HydrophobicContact CD2-CG 4.19Å; L428-P444 HydrophobicContact CG-CB 4.48Å; A429-P444 CarbonylContact O-C 3.44Å; A429-P444 WeakPolarHBondContact O-CA 3.45Å
445	R	85.7	Confident	74	Confident	82 Å²	82	96.4 Å²	96.4	31%	0.309	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	139.8	177.3	71.8	179.6	179.8	154.7	0.6	111.4	F382 Q383 L428 A429	F382-R445 CarbonylContact O-C 3.57Å; F382-R445 VanDerWaalsContact O-CA 3.29Å; F382-R445 WeakPolarHBondContact O-CA 3.28Å; Q383-R445 HydrophobicContact CB-CB 4.44Å; L428-R445 CarbonylContact C-O 3.33Å; L428-R445 WeakPolarHBondContact CA-O 3.36Å; A429-R445 HydrophobicContact CB-CG 3.98Å; A429-R445 PolarHBondContact N-O 3.33Å; A429-R445 PolarHBondContact O-N 2.81Å
446	A	90.9	Very high	75.3	Confident	8 Å²	8	97.4 Å²	97.4	7%	0.066	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132	172.7	0	0	0	0	0	110.6	I375 F382 L384 F426 K427 L428	I375-A446 HydrophobicContact CD1-CB 3.94Å; F382-A446 HydrophobicContact CB-CB 3.55Å; F382-A446 HydrophobicContact CD2-CB 4.35Å; F382-A446 HydrophobicContact CG-CB 4.34Å; F382-A446 PolarHBondContact O-N 3.43Å; L384-A446 HydrophobicContact CB-CB 3.82Å; L384-A446 HydrophobicContact CD2-CB 3.82Å; L384-A446 HydrophobicContact CG-CB 4.48Å; F426-A446 HydrophobicContact CB-CB 4.13Å; F426-A446 HydrophobicContact CD2-CB 3.39Å; F426-A446 HydrophobicContact CE2-CB 3.95Å; F426-A446 HydrophobicContact CG-CB 3.94Å; K427-A446 CarbonylContact O-C 3.58Å; K427-A446 WeakPolarHBondContact O-CA 3.1Å; L428-A446 HydrophobicContact CD2-CB 4.38Å
447	I	88.5	Confident	76.4	Confident	68 Å²	68	88.3 Å²	88.3	35%	0.349	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.2	172.7	-55.7	176.5	0	0	0	107.8	F426 K427 A429 V449	F426-I447 CarbonylContact C-O 3.56Å; F426-I447 WeakPolarHBondContact CA-O 3.35Å; K427-I447 PolarHBondContact N-O 3.21Å; K427-I447 PolarHBondContact O-N 2.83Å; A429-I447 HydrophobicContact CB-CD1 3.54Å; A429-I447 HydrophobicContact CB-CG1 4.11Å; I447-V449 HydrophobicContact CG2-CG1 4.17Å
448	K	91	Very high	77.8	Confident	111 Å²	111	87.5 Å²	87.5	48%	0.483	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	128.9	172.8	-170.9	176	-180	179.6	0	109	L384 L392 T424	L384-K448 HydrophobicContact CD2-CB 4.22Å; L392-K448 HydrophobicContact CD1-CG 4.44Å; L392-K448 HydrophobicContact CD2-CB 4.42Å; L392-K448 HydrophobicContact CD2-CD 4.38Å; L392-K448 HydrophobicContact CD2-CG 4.21Å; T424-K448 WeakPolarHBondContact OG1-CE 3.2Å
449	V	91.1	Very high	78.9	Confident	43 Å²	43	82.2 Å²	82.2	26%	0.261	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	146.6	-177.2	-62.8	0	0	0	0	111.2	C395 T424 C425 K427 I447 A451	C395-V449 WeakPolarHBondContact SG-CG2 3.15Å; T424-V449 WeakPolarHBondContact CA-O 3.45Å; C425-V449 PolarHBondContact N-O 2.95Å; C425-V449 WeakPolarHBondContact O-CG2 3.35Å; C425-V449 PolarHBondContact O-N 3.18Å; C425-V449 VanDerWaalsContact O-O 3.1Å; K427-V449 HydrophobicContact CD-CG2 4.43Å; K427-V449 HydrophobicContact CG-CG2 4.15Å; I447-V449 HydrophobicContact CG2-CG1 4.17Å; V449-A451 PolarHBondContact O-N 2.56Å
450	S	89.6	Confident	79.7	Confident	93 Å²	93	80.2 Å²	80.2	65%	0.65	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.6	126	171.1	-64.4	0	0	0	0	111
451	A	89.9	Confident	80.1	Confident	2 Å²	2	78 Å²	78	2%	0.017	36%	0.355	C	S	.	.			trans	-100.4	99.4	-171.2	0	0	0	0	0	111.5	T423 C425 V449 H453 L454 R455	T423-A451 WeakPolarHBondContact O-CB 3.32Å; T423-A451 PolarHBondContact O-N 2.92Å; C425-A451 HydrophobicContact CB-CB 4.46Å; C425-A451 VanDerWaalsContact SG-CB 3.59Å; V449-A451 PolarHBondContact O-N 2.56Å; A451-H453 PolarHBondContact O-N 3.06Å; A451-H453 VanDerWaalsContact O-N 3.16Å; A451-L454 HydrophobicContact CB-CB 3.87Å; A451-L454 HydrophobicContact CB-CD1 3.62Å; A451-L454 HydrophobicContact CB-CG 3.8Å; A451-L454 PolarHBondContact O-N 2.94Å; A451-L454 VanDerWaalsContact O-N 3.08Å; A451-R455 PolarHBondContact O-N 2.9Å
452	R	87	Confident	80.5	Confident	196 Å²	196	82.2 Å²	82.2	74%	0.74	36%	0.361	S	S	*	.	H	α-helix	trans	-54.1	-35.2	176.8	-73.9	-170.3	-77.1	-177.8	-4.9	113.4	R456	R452-R456 WeakPolarHBondContact O-CB 3.22Å; R452-R456 WeakPolarHBondContact O-CG 3.32Å; R452-R456 PolarHBondContact O-N 3.14Å
453	H	85.7	Confident	80.6	Confident	18 Å²	18	78.1 Å²	78.1	8%	0.083	35%	0.352	C	S	.	.	H	α-helix	trans	-70.1	-34.7	179.4	58.2	-79.9	0	0	0	113.1	T398 R399 T402 R406 A451 L457	T398-H453 PolarHBondContact OG1-NE2 2.94Å; R399-H453 PolarHBondContact N-NE2 3.38Å; T402-H453 PolarHBondContact OG1-CD2 3.14Å; R406-H453 PolarHBondContact NH2-O 3.34Å; A451-H453 PolarHBondContact O-N 3.06Å; A451-H453 VanDerWaalsContact O-N 3.16Å; H453-L457 WeakPolarHBondContact O-CB 3.23Å; H453-L457 PolarHBondContact O-N 2.73Å; H453-L457 VanDerWaalsContact O-N 3.14Å
454	L	84.1	Confident	80.1	Confident	1 Å²	1	76.8 Å²	76.8	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-71.1	-47.7	173.6	-68	176.8	0	0	0	110.6	T398 T402 W418 A451 R456 L457 Q458	T398-L454 HydrophobicContact CG2-CD1 4.35Å; T402-L454 HydrophobicContact CG2-CD2 3.67Å; W418-L454 HydrophobicContact CH2-CB 4.26Å; W418-L454 HydrophobicContact CZ3-CB 4.05Å; W418-L454 WeakPolarHBondContact CZ3-O 3.35Å; A451-L454 HydrophobicContact CB-CB 3.87Å; A451-L454 HydrophobicContact CB-CD1 3.62Å; A451-L454 HydrophobicContact CB-CG 3.8Å; A451-L454 PolarHBondContact O-N 2.94Å; A451-L454 VanDerWaalsContact O-N 3.08Å; L454-R456 VanDerWaalsContact C-N 3.33Å; L454-R456 PolarHBondContact O-N 2.76Å; L454-L457 WeakPolarHBondContact O-CA 3Å; L454-L457 WeakPolarHBondContact O-CB 3.36Å; L454-L457 PolarHBondContact O-N 3.04Å; L454-Q458 PolarHBondContact O-N 2.97Å
455	R	84.1	Confident	79.1	Confident	133 Å²	133	78.1 Å²	78.1	50%	0.502	35%	0.346	S	S	.	.	H	α-helix	trans	-55.8	-44.4	175.4	-69.9	-179.9	67.2	-174.9	1.5	112.7	T423 A451 L457 Q458 Q459	T423-R455 HydrophobicContact CG2-CG 4.35Å; A451-R455 PolarHBondContact O-N 2.9Å; R455-L457 VanDerWaalsContact C-N 3.34Å; R455-L457 PolarHBondContact O-N 3.38Å; R455-Q458 WeakPolarHBondContact O-CB 3.41Å; R455-Q458 PolarHBondContact O-N 3.25Å; R455-Q459 WeakPolarHBondContact O-CG 3.44Å; R455-Q459 PolarHBondContact O-N 2.86Å
456	R	82.1	Confident	77.3	Confident	153 Å²	153	82.4 Å²	82.4	58%	0.577	37%	0.37	S	S	*	.	H	α-helix	trans	-66.7	-34.4	176.1	-75.8	-176.5	-174.4	-171.6	2.9	113	R452 L454 R460	R452-R456 WeakPolarHBondContact O-CB 3.22Å; R452-R456 WeakPolarHBondContact O-CG 3.32Å; R452-R456 PolarHBondContact O-N 3.14Å; L454-R456 VanDerWaalsContact C-N 3.33Å; L454-R456 PolarHBondContact O-N 2.76Å; R456-R460 WeakPolarHBondContact O-CB 3.34Å; R456-R460 PolarHBondContact O-N 3.4Å; R456-R460 VanDerWaalsContact O-N 3.16Å
457	L	74.3	Confident	75.2	Confident	13 Å²	13	90.8 Å²	90.8	7%	0.068	41%	0.405	C	S	.	.	H	α-helix	trans	-65.5	-46.5	174.2	-178.8	64.5	0	0	0	109.9	T402 L405 H453 L454 R455 Q459 R460 L461	T402-L457 HydrophobicContact CG2-CB 4.32Å; T402-L457 HydrophobicContact CG2-CD2 3.55Å; L405-L457 HydrophobicContact CD1-CD2 4.2Å; H453-L457 WeakPolarHBondContact O-CB 3.23Å; H453-L457 PolarHBondContact O-N 2.73Å; H453-L457 VanDerWaalsContact O-N 3.14Å; L454-L457 WeakPolarHBondContact O-CA 3Å; L454-L457 WeakPolarHBondContact O-CB 3.36Å; L454-L457 PolarHBondContact O-N 3.04Å; R455-L457 VanDerWaalsContact C-N 3.34Å; R455-L457 PolarHBondContact O-N 3.38Å; L457-Q459 PolarHBondContact O-N 3.43Å; L457-R460 PolarHBondContact O-N 3.07Å; L457-L461 HydrophobicContact CD1-CD1 4.24Å; L457-L461 HydrophobicContact CD1-CG 4.41Å; L457-L461 HydrophobicContact CG-CD1 3.97Å; L457-L461 VanDerWaalsContact O-CG 3.29Å; L457-L461 WeakPolarHBondContact O-CG 3.49Å; L457-L461 PolarHBondContact O-N 3.44Å
458	Q	75.8	Confident	72.9	Confident	29 Å²	29	90.4 Å²	90.4	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-56.8	-48.9	175.6	-173.6	-178.9	18.9	0	0	112.8	W418 L454 R455 R460 L461 R462	W418-Q458 HydrophobicContact CD2-CB 3.8Å; W418-Q458 HydrophobicContact CD2-CG 3.73Å; W418-Q458 VanDerWaalsContact CE2-NE2 3.25Å; W418-Q458 HydrophobicContact CE3-CB 3.8Å; W418-Q458 HydrophobicContact CE3-CG 4.27Å; W418-Q458 HydrophobicContact CG-CG 4.33Å; W418-Q458 HydrophobicContact CH2-CB 3.56Å; W418-Q458 HydrophobicContact CH2-CG 4Å; W418-Q458 HydrophobicContact CZ2-CB 3.59Å; W418-Q458 HydrophobicContact CZ2-CG 3.45Å; W418-Q458 VanDerWaalsContact CZ2-CG 3.45Å; W418-Q458 VanDerWaalsContact CZ2-NE2 3.27Å; W418-Q458 HydrophobicContact CZ3-CB 3.68Å; W418-Q458 HydrophobicContact CZ3-CG 4.38Å; L454-Q458 PolarHBondContact O-N 2.97Å; R455-Q458 WeakPolarHBondContact O-CB 3.41Å; R455-Q458 PolarHBondContact O-N 3.25Å; Q458-R460 VanDerWaalsContact C-N 3.34Å; Q458-R460 PolarHBondContact O-N 3.29Å; Q458-L461 PolarHBondContact O-N 2.94Å; Q458-R462 WeakPolarHBondContact O-CG 2.91Å; Q458-R462 PolarHBondContact O-N 2.88Å
459	Q	76.3	Confident	70.4	Confident	104 Å²	104	91.7 Å²	91.7	49%	0.486	44%	0.435	S	S	.	.	H	α-helix	trans	-59.8	-44.2	179.1	-74.9	172.7	-25.8	0	0	111.7	R455 L457 L461 R462 Q463	R455-Q459 WeakPolarHBondContact O-CG 3.44Å; R455-Q459 PolarHBondContact O-N 2.86Å; L457-Q459 PolarHBondContact O-N 3.43Å; Q459-L461 VanDerWaalsContact C-N 3.32Å; Q459-L461 PolarHBondContact O-N 3.16Å; Q459-R462 PolarHBondContact O-N 2.85Å; Q459-Q463 WeakPolarHBondContact O-CG 3.3Å; Q459-Q463 PolarHBondContact O-N 2.96Å; Q459-Q463 VanDerWaalsContact O-N 3.09Å
460	R	71.5	Confident	67.8	Low	130 Å²	130	96.8 Å²	96.8	49%	0.491	46%	0.46	S	S	.	.	H	α-helix	trans	-63.2	-37.8	177	-170.2	179.1	-174.3	-166.1	1.8	112.1	R406 R456 L457 Q458 Q463 L464	R406-R460 PolarHBondContact O-NH1 3.11Å; R456-R460 WeakPolarHBondContact O-CB 3.34Å; R456-R460 PolarHBondContact O-N 3.4Å; R456-R460 VanDerWaalsContact O-N 3.16Å; L457-R460 PolarHBondContact O-N 3.07Å; Q458-R460 VanDerWaalsContact C-N 3.34Å; Q458-R460 PolarHBondContact O-N 3.29Å; R460-Q463 PolarHBondContact O-N 3.3Å; R460-L464 WeakPolarHBondContact O-CG 3.37Å; R460-L464 PolarHBondContact O-N 3.23Å
461	L	64.9	Low	65.4	Low	16 Å²	16	100.6 Å²	100.6	8%	0.084	47%	0.468	C	S	.	.	H	α-helix	trans	-70.8	-42.2	178.1	-67.5	172	0	0	0	112	T414 L457 Q458 Q459 Q463 L464 Q465	T414-L461 HydrophobicContact CG2-CD2 4.39Å; L457-L461 HydrophobicContact CD1-CD1 4.24Å; L457-L461 HydrophobicContact CD1-CG 4.41Å; L457-L461 HydrophobicContact CG-CD1 3.97Å; L457-L461 VanDerWaalsContact O-CG 3.29Å; L457-L461 WeakPolarHBondContact O-CG 3.49Å; L457-L461 PolarHBondContact O-N 3.44Å; Q458-L461 PolarHBondContact O-N 2.94Å; Q459-L461 VanDerWaalsContact C-N 3.32Å; Q459-L461 PolarHBondContact O-N 3.16Å; L461-Q463 VanDerWaalsContact C-N 3.27Å; L461-Q463 PolarHBondContact O-N 3.22Å; L461-L464 HydrophobicContact CD2-CD1 4.37Å; L461-L464 PolarHBondContact O-N 3.03Å; L461-L464 VanDerWaalsContact O-N 3.12Å; L461-Q465 WeakPolarHBondContact O-CB 3.36Å; L461-Q465 PolarHBondContact O-N 3.32Å
462	R	67.1	Low	62.8	Low	146 Å²	146	109 Å²	109	55%	0.551	50%	0.499	S	S	*	.	H	α-helix	trans	-58.5	-38.9	172.7	-71.2	-173.5	-164.9	-109.4	6.3	112.3	Q458 Q459 Q465 H466	Q458-R462 WeakPolarHBondContact O-CG 2.91Å; Q458-R462 PolarHBondContact O-N 2.88Å; Q459-R462 PolarHBondContact O-N 2.85Å; R462-Q465 WeakPolarHBondContact O-CB 3.23Å; R462-Q465 PolarHBondContact O-N 3.42Å; R462-H466 PolarHBondContact O-N 2.94Å
463	Q	66.2	Low	60.1	Low	144 Å²	144	104.3 Å²	104.3	67%	0.673	49%	0.486	S	S	*	.	H	α-helix	trans	-66.2	-36.3	176.4	-73.7	176.8	-9.3	0	0	112.9	Q459 R460 L461 Q465	Q459-Q463 WeakPolarHBondContact O-CG 3.3Å; Q459-Q463 PolarHBondContact O-N 2.96Å; Q459-Q463 VanDerWaalsContact O-N 3.09Å; R460-Q463 PolarHBondContact O-N 3.3Å; L461-Q463 VanDerWaalsContact C-N 3.27Å; L461-Q463 PolarHBondContact O-N 3.22Å; Q463-Q465 VanDerWaalsContact C-N 3.32Å
464	L	59.6	Low	57.7	Low	73 Å²	73	108.5 Å²	108.5	38%	0.382	52%	0.523	S	S	.	.	H	α-helix	trans	-69.7	-33.4	174.1	-71.7	165.8	0	0	0	111.6	R460 L461 H466 K467	R460-L464 WeakPolarHBondContact O-CG 3.37Å; R460-L464 PolarHBondContact O-N 3.23Å; L461-L464 HydrophobicContact CD2-CD1 4.37Å; L461-L464 PolarHBondContact O-N 3.03Å; L461-L464 VanDerWaalsContact O-N 3.12Å; L464-H466 VanDerWaalsContact C-N 3.29Å; L464-H466 PolarHBondContact O-N 3.39Å; L464-K467 PolarHBondContact O-N 2.91Å
465	Q	55.5	Low	55.3	Low	77 Å²	77	114.6 Å²	114.6	36%	0.36	55%	0.546	S	S	.	.	H	α-helix	trans	-70.5	-21.1	-179.3	-159.8	169.9	17.5	0	0	113.9	L461 R462 Q463 R472	L461-Q465 WeakPolarHBondContact O-CB 3.36Å; L461-Q465 PolarHBondContact O-N 3.32Å; R462-Q465 WeakPolarHBondContact O-CB 3.23Å; R462-Q465 PolarHBondContact O-N 3.42Å; Q463-Q465 VanDerWaalsContact C-N 3.32Å; Q465-R472 PolarHBondContact O-NH2 2.85Å
466	H	48.6	Very low	52.7	Low	173 Å²	173	113.6 Å²	113.6	80%	0.801	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-9.4	173.8	-95.4	-78.7	0	0	0	114.2	R462 L464	R462-H466 PolarHBondContact O-N 2.94Å; L464-H466 VanDerWaalsContact C-N 3.29Å; L464-H466 PolarHBondContact O-N 3.39Å
467	K	46.8	Very low	50.3	Low	184 Å²	184	112.2 Å²	112.2	80%	0.8	57%	0.571	S	S	*	*	S	Bend	trans	-99.9	-6	-174.4	-152	174.7	-178.6	-179.6	0	114	L464	L464-K467 PolarHBondContact O-N 2.91Å
468	G	41.1	Very low	48.4	Very low	60 Å²	60	119.6 Å²	119.6	62%	0.619	61%	0.605	S	S	*	*			trans	-102.7	98.5	174.1	0	0	0	0	0	110.8
469	T	38.1	Very low	46.6	Very low	137 Å²	137	123.9 Å²	123.9	84%	0.84	64%	0.635	S	S	*	*			trans	-93.4	96.7	167.2	-28	0	0	0	0	107.1
470	D	36.5	Very low	45	Very low	150 Å²	150	125.9 Å²	125.9	80%	0.802	65%	0.649	S	S	*	*	S	Bend		169.9	143.7	129.1	-123.6	-28.6	0	0	0	110.7
471	E	38.8	Very low	43.7	Very low	173 Å²	173	131.8 Å²	131.8	81%	0.808	67%	0.671	S	S	*	*			trans	46.1	84.1	173.4	-66.4	-164.6	125.7	0	0	118.7	Q473	E471-Q473 PolarHBondContact O-N 2.85Å
472	R	34.4	Very low	43.1	Very low	178 Å²	178	133.3 Å²	133.3	67%	0.672	69%	0.69	S	S	*	*			trans	-81.1	102.6	154.6	-87.3	-171.9	-172.4	144.4	32.3	110.3	Q465 A474	Q465-R472 PolarHBondContact O-NH2 2.85Å; R472-A474 PolarHBondContact O-N 3.3Å
473	Q	31.4	Very low	42.7	Very low	99 Å²	99	133.3 Å²	133.3	46%	0.463	71%	0.71	S	S	.	*			trans	-53.2	120.8	152.3	-79.2	160.1	-15.4	0	0	108.5	E471 W475 N501	E471-Q473 PolarHBondContact O-N 2.85Å; Q473-W475 HydrophobicContact CB-CZ2 4.46Å; Q473-W475 PolarHBondContact O-N 3.05Å; Q473-W475 VanDerWaalsContact O-N 3.13Å; Q473-W475 PolarHBondContact O-NE1 3.08Å; Q473-N501 PolarHBondContact NE2-ND2 3.47Å; Q473-N501 VanDerWaalsContact NE2-ND2 3.18Å
474	A	35.4	Very low	42.8	Very low	105 Å²	105	130.1 Å²	130.1	87%	0.868	70%	0.696	S	S	*	*			trans	-65.4	107.8	171.7	0	0	0	0	0	108.3	R472	R472-A474 PolarHBondContact O-N 3.3Å
475	W	32.6	Very low	43.9	Very low	130 Å²	130	128.5 Å²	128.5	49%	0.492	69%	0.69	S	S	.	*			trans	-86.2	149.7	174.6	-65.8	96	0	0	0	110	M416 Q473 S477	M416-W475 HydrophobicContact CE-CB 4.25Å; M416-W475 HydrophobicContact CE-CG 4.21Å; Q473-W475 HydrophobicContact CB-CZ2 4.46Å; Q473-W475 PolarHBondContact O-N 3.05Å; Q473-W475 VanDerWaalsContact O-N 3.13Å; Q473-W475 PolarHBondContact O-NE1 3.08Å; W475-S477 PolarHBondContact O-N 3.1Å
476	P	29.7	Very low	45.2	Very low	112 Å²	112	125.5 Å²	125.5	73%	0.727	68%	0.676	S	S	*	*			trans	-60.5	132.1	-163	-20.3	30.9	0	0	0	113.1	E478	P476-E478 PolarHBondContact O-N 3.41Å; P476-E478 VanDerWaalsContact O-N 3.1Å
477	S	32.6	Very low	46.9	Very low	123 Å²	123	118.5 Å²	118.5	86%	0.86	64%	0.643	S	S	*	*			trans	-75.4	15.9	-176.8	-38.6	0	0	0	0	114.9	W475	W475-S477 PolarHBondContact O-N 3.1Å
478	E	34	Very low	48.6	Very low	168 Å²	168	113 Å²	113	79%	0.785	62%	0.622	S	S	*	*			trans	-109.5	118.8	-178.2	-72.7	-163	146.3	0	0	111.6	P476 L480	P476-E478 PolarHBondContact O-N 3.41Å; P476-E478 VanDerWaalsContact O-N 3.1Å; E478-L480 PolarHBondContact O-N 3.12Å; E478-L480 VanDerWaalsContact O-N 3.12Å
479	P	38.6	Very low	50.4	Low	120 Å²	120	112.7 Å²	112.7	78%	0.779	60%	0.604	S	S	*	*			trans	-63	115.7	167.7	-11.6	25.4	0	0	0	108.1	R481	P479-R481 PolarHBondContact O-N 2.89Å
480	L	42.7	Very low	52.3	Low	146 Å²	146	106.4 Å²	106.4	76%	0.764	57%	0.566	S	S	*	*			trans	-58.9	104.1	175.8	-133	80.1	0	0	0	108.8	E478 G482	E478-L480 PolarHBondContact O-N 3.12Å; E478-L480 VanDerWaalsContact O-N 3.12Å; L480-G482 PolarHBondContact O-N 3.13Å
481	R	44	Very low	54.4	Low	253 Å²	253	101 Å²	101	96%	0.955	54%	0.537	S	S	*	.			trans	-75.1	92.5	-171.3	-168.6	179.2	-68.2	-128.2	1.1	110.1	P479	P479-R481 PolarHBondContact O-N 2.89Å
482	G	50.7	Low	56.2	Low	48 Å²	48	97 Å²	97	50%	0.495	52%	0.518	S	S	.	.	S	Bend	trans	-172.9	155.3	170.2	0	0	0	0	0	112	L480 M484	L480-G482 PolarHBondContact O-N 3.13Å; G482-M484 VanDerWaalsContact C-N 3.26Å; G482-M484 PolarHBondContact O-N 3.18Å
483	P	58.8	Low	58	Low	147 Å²	147	91.2 Å²	91.2	96%	0.955	50%	0.501	S	S	*	.			trans	-75.4	76.5	-178.7	31.4	-33.7	0	0	0	110.7
484	M	69.8	Low	59.9	Low	77 Å²	77	87 Å²	87	38%	0.379	48%	0.481	S	S	.	.			trans	-92.9	136.7	176.6	-81.3	-100.9	-78	0	0	110.9	G482 N488 Q492	G482-M484 VanDerWaalsContact C-N 3.26Å; G482-M484 PolarHBondContact O-N 3.18Å; M484-N488 HydrophobicContact CE-CB 4.14Å; M484-N488 HydrophobicContact SD-CB 3.95Å; M484-Q492 HydrophobicContact CE-CG 4.15Å; M484-Q492 VanDerWaalsContact CE-NE2 3.31Å
485	S	82.1	Confident	61.6	Low	39 Å²	39	87.3 Å²	87.3	27%	0.273	47%	0.465	S	S	.	.			trans	-65.3	151.8	173.7	67.2	0	0	0	0	111.9	Y487 N488 Q489	S485-Y487 PolarHBondContact O-N 3.49Å; S485-N488 PolarHBondContact O-N 3.01Å; S485-N488 WeakPolarHBondContact OG-CB 3.32Å; S485-N488 PolarHBondContact OG-N 2.96Å; S485-N488 PolarHBondContact OG-ND2 3.09Å; S485-N488 VanDerWaalsContact OG-ND2 3.17Å; S485-Q489 PolarHBondContact O-N 3.18Å
486	F	82.6	Confident	63.2	Low	13 Å²	13	83 Å²	83	6%	0.057	46%	0.458	C	S	.	.	H	α-helix	trans	-60.1	-33.2	178	-73.2	-99.7	0	0	0	111.4	F364 L368 D369 P391 F393 L417 L420 L421 C490	F364-F486 HydrophobicContact CB-CB 4.02Å; L368-F486 HydrophobicContact CB-CD2 4.35Å; L368-F486 HydrophobicContact CB-CG 4.42Å; L368-F486 HydrophobicContact CD1-CB 4.17Å; L368-F486 HydrophobicContact CD1-CD1 3.66Å; L368-F486 HydrophobicContact CD1-CD2 4.3Å; L368-F486 HydrophobicContact CD1-CE1 4.09Å; L368-F486 HydrophobicContact CD1-CG 3.78Å; D369-F486 WeakPolarHBondContact OD1-CB 3.5Å; D369-F486 WeakPolarHBondContact OD1-CD2 3.24Å; D369-F486 PolarHBondContact OD1-N 3.05Å; P391-F486 HydrophobicContact CG-CE2 3.62Å; P391-F486 HydrophobicContact CG-CZ 3.81Å; F393-F486 HydrophobicContact CE2-CE1 4.5Å; F393-F486 AromaticContact CE2-CE2 3.85Å; F393-F486 HydrophobicContact CE2-CE2 3.85Å; F393-F486 AromaticContact CE2-CZ 3.72Å; F393-F486 HydrophobicContact CE2-CZ 3.72Å; F393-F486 HydrophobicContact CZ-CD2 4.11Å; F393-F486 AromaticContact CZ-CE2 3.47Å; F393-F486 HydrophobicContact CZ-CE2 3.47Å; F393-F486 VanDerWaalsContact CZ-CE2 3.47Å; F393-F486 AromaticContact CZ-CZ 3.87Å; F393-F486 HydrophobicContact CZ-CZ 3.87Å; L417-F486 HydrophobicContact CD2-CD1 3.86Å; L417-F486 HydrophobicContact CG-CD1 4.38Å; L420-F486 HydrophobicContact CB-CE1 3.63Å; L420-F486 HydrophobicContact CB-CZ 4.27Å; L421-F486 HydrophobicContact CD2-CE1 3.97Å; L421-F486 HydrophobicContact CD2-CZ 4.44Å; L421-F486 HydrophobicContact CG-CE1 4.32Å; F486-C490 VanDerWaalsContact O-CB 3.23Å; F486-C490 WeakPolarHBondContact O-CB 3.39Å; F486-C490 PolarHBondContact O-N 3.43Å
487	Y	84.7	Confident	64.7	Low	27 Å²	27	81.5 Å²	81.5	11%	0.106	45%	0.454	C	S	.	.	H	α-helix	trans	-60.4	-48.4	171.3	174.9	-91.9	0	0	0	113	C361 R362 R365 D369 S485 C490 L491	C361-Y487 HydrophobicContact CB-CD2 4.12Å; C361-Y487 HydrophobicContact CB-CE2 4.16Å; C361-Y487 VanDerWaalsContact O-CD2 3.3Å; C361-Y487 WeakPolarHBondContact O-CD2 3.49Å; R362-Y487 HydrophobicContact CG-CE2 4.07Å; R365-Y487 HydrophobicContact CB-CD2 3.8Å; R365-Y487 HydrophobicContact CB-CG 4.07Å; R365-Y487 VanDerWaalsContact NH2-CZ 3.31Å; D369-Y487 WeakPolarHBondContact OD2-CB 3.29Å; D369-Y487 PolarHBondContact OD2-N 3.19Å; S485-Y487 PolarHBondContact O-N 3.49Å; Y487-C490 PolarHBondContact O-N 3.27Å; Y487-L491 HydrophobicContact CD1-CD1 4.03Å; Y487-L491 HydrophobicContact CD1-CG 4.42Å; Y487-L491 HydrophobicContact CE1-CD1 3.22Å; Y487-L491 HydrophobicContact CE1-CG 3.93Å; Y487-L491 HydrophobicContact CE2-CD1 4.42Å; Y487-L491 HydrophobicContact CE2-CG 4.47Å; Y487-L491 VanDerWaalsContact CZ-CD1 3.48Å; Y487-L491 WeakPolarHBondContact O-CG 3.47Å; Y487-L491 PolarHBondContact O-N 2.73Å
488	N	82.1	Confident	66	Low	68 Å²	68	81 Å²	81	36%	0.364	43%	0.434	S	S	.	.	H	α-helix	trans	-68.7	-40.1	-178.1	-72.2	-19.1	0	0	0	111	M484 S485 L491 Q492	M484-N488 HydrophobicContact CE-CB 4.14Å; M484-N488 HydrophobicContact SD-CB 3.95Å; S485-N488 PolarHBondContact O-N 3.01Å; S485-N488 WeakPolarHBondContact OG-CB 3.32Å; S485-N488 PolarHBondContact OG-N 2.96Å; S485-N488 PolarHBondContact OG-ND2 3.09Å; S485-N488 VanDerWaalsContact OG-ND2 3.17Å; N488-L491 PolarHBondContact O-N 3.15Å; N488-Q492 PolarHBondContact O-N 3.45Å
489	Q	79.3	Confident	66.8	Low	53 Å²	53	83 Å²	83	25%	0.248	43%	0.434	C	S	.	.	H	α-helix	trans	-62.1	-43.9	174.9	-163.9	174.8	18.4	0	0	111.4	S485 L491 Q492 L493	S485-Q489 PolarHBondContact O-N 3.18Å; Q489-L491 VanDerWaalsContact C-N 3.34Å; Q489-L491 PolarHBondContact O-N 2.92Å; Q489-Q492 PolarHBondContact O-N 3.49Å; Q489-L493 HydrophobicContact CG-CD1 4.33Å; Q489-L493 WeakPolarHBondContact O-CG 3.48Å; Q489-L493 PolarHBondContact O-N 2.02Å
490	C	78.6	Confident	67	Low	6 Å²	6	82.7 Å²	82.7	4%	0.041	43%	0.432	C	S	.	.	H	α-helix	trans	-59.4	-42.7	173.2	178	0	0	0	0	112.4	C361 F364 F486 Y487 T494	C361-C490 WeakPolarHBondContact CA-SG 3.46Å; C361-C490 HydrophobicContact CB-CB 3.79Å; C361-C490 WeakPolarHBondContact CB-SG 3.39Å; C361-C490 WeakPolarHBondContact SG-CB 3.44Å; C361-C490 PolarHBondContact SG-O 3.42Å; C361-C490 CovalentContact SG-SG 2.06Å; C361-C490 PolarHBondContact SG-SG 3.37Å; F364-C490 HydrophobicContact CD2-CB 4.24Å; F486-C490 VanDerWaalsContact O-CB 3.23Å; F486-C490 WeakPolarHBondContact O-CB 3.39Å; F486-C490 PolarHBondContact O-N 3.43Å; Y487-C490 PolarHBondContact O-N 3.27Å; C490-T494 VanDerWaalsContact O-CB 3.27Å; C490-T494 WeakPolarHBondContact O-CB 3.46Å; C490-T494 PolarHBondContact O-N 3.01Å; C490-T494 PolarHBondContact O-OG1 3.29Å
491	L	80.4	Confident	67.1	Low	35 Å²	35	82.8 Å²	82.8	18%	0.183	43%	0.433	C	S	.	.	H	α-helix	trans	-64.7	-44.3	177.7	-77.8	-173.9	0	0	0	112.3	C361 Y487 N488 Q489 T494 Q495	C361-L491 HydrophobicContact CB-CD2 4.01Å; C361-L491 HydrophobicContact CB-CG 4.29Å; Y487-L491 HydrophobicContact CD1-CD1 4.03Å; Y487-L491 HydrophobicContact CD1-CG 4.42Å; Y487-L491 HydrophobicContact CE1-CD1 3.22Å; Y487-L491 HydrophobicContact CE1-CG 3.93Å; Y487-L491 HydrophobicContact CE2-CD1 4.42Å; Y487-L491 HydrophobicContact CE2-CG 4.47Å; Y487-L491 VanDerWaalsContact CZ-CD1 3.48Å; Y487-L491 WeakPolarHBondContact O-CG 3.47Å; Y487-L491 PolarHBondContact O-N 2.73Å; N488-L491 PolarHBondContact O-N 3.15Å; Q489-L491 VanDerWaalsContact C-N 3.34Å; Q489-L491 PolarHBondContact O-N 2.92Å; L491-T494 PolarHBondContact O-N 3.39Å; L491-Q495 WeakPolarHBondContact O-CB 3.25Å; L491-Q495 WeakPolarHBondContact O-CG 3.45Å; L491-Q495 PolarHBondContact O-N 3.21Å
492	Q	76.8	Confident	67	Low	89 Å²	89	73.8 Å²	73.8	42%	0.416	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-46.5	178.4	-80.5	-172.1	-22	0	0	111.7	M484 N488 Q489 T494 Q495 A496	M484-Q492 HydrophobicContact CE-CG 4.15Å; M484-Q492 VanDerWaalsContact CE-NE2 3.31Å; N488-Q492 PolarHBondContact O-N 3.45Å; Q489-Q492 PolarHBondContact O-N 3.49Å; Q492-T494 VanDerWaalsContact C-N 3.32Å; Q492-T494 PolarHBondContact O-N 3Å; Q492-Q495 PolarHBondContact O-N 3.26Å; Q492-Q495 VanDerWaalsContact O-N 3.1Å; Q492-A496 WeakPolarHBondContact O-CB 2.9Å; Q492-A496 PolarHBondContact O-N 3.3Å
493	L	70.6	Confident	66.1	Low	58 Å²	58	79 Å²	79	30%	0.304	43%	0.431	S	S	.	.	H	α-helix	trans	-62.8	-41	177.4	-69.2	168.6	0	0	0	111.7	M416 L417 Q489 Q495 A496 A497	M416-L493 HydrophobicContact CB-CD1 3.77Å; M416-L493 HydrophobicContact CB-CD2 4.48Å; M416-L493 HydrophobicContact SD-CD2 4.1Å; L417-L493 HydrophobicContact CD1-CD1 4.23Å; Q489-L493 HydrophobicContact CG-CD1 4.33Å; Q489-L493 WeakPolarHBondContact O-CG 3.48Å; Q489-L493 PolarHBondContact O-N 2.02Å; L493-Q495 VanDerWaalsContact C-N 3.27Å; L493-Q495 PolarHBondContact O-N 2.74Å; L493-A496 PolarHBondContact O-N 3.05Å; L493-A497 WeakPolarHBondContact O-CB 3.37Å; L493-A497 PolarHBondContact O-N 2.99Å
494	T	71	Confident	64.9	Low	10 Å²	10	81.5 Å²	81.5	6%	0.061	43%	0.429	C	S	.	.	H	α-helix	trans	-64.2	-31.7	174.8	-60.9	0	0	0	0	112.3	A357 C490 L491 Q492 R498	A357-T494 HydrophobicContact CB-CG2 3.38Å; C490-T494 VanDerWaalsContact O-CB 3.27Å; C490-T494 WeakPolarHBondContact O-CB 3.46Å; C490-T494 PolarHBondContact O-N 3.01Å; C490-T494 PolarHBondContact O-OG1 3.29Å; L491-T494 PolarHBondContact O-N 3.39Å; Q492-T494 VanDerWaalsContact C-N 3.32Å; Q492-T494 PolarHBondContact O-N 3Å; T494-R498 VanDerWaalsContact O-CG 3.29Å; T494-R498 WeakPolarHBondContact O-CG 3.37Å
495	Q	72.3	Confident	63	Low	111 Å²	111	85.1 Å²	85.1	52%	0.519	44%	0.443	S	S	.	.	H	α-helix	trans	-79.8	-36.8	177.2	-72.9	168.5	11.7	0	0	112.1	L491 Q492 L493 R498	L491-Q495 WeakPolarHBondContact O-CB 3.25Å; L491-Q495 WeakPolarHBondContact O-CG 3.45Å; L491-Q495 PolarHBondContact O-N 3.21Å; Q492-Q495 PolarHBondContact O-N 3.26Å; Q492-Q495 VanDerWaalsContact O-N 3.1Å; L493-Q495 VanDerWaalsContact C-N 3.27Å; L493-Q495 PolarHBondContact O-N 2.74Å; Q495-R498 WeakPolarHBondContact O-CB 3.36Å; Q495-R498 PolarHBondContact O-N 3.33Å
496	A	65.1	Low	60.7	Low	41 Å²	41	88 Å²	88	34%	0.339	46%	0.463	S	S	.	.	H	α-helix	trans	-64.1	-44.6	175.7	0	0	0	0	0	111.4	Q492 L493 R498 R499	Q492-A496 WeakPolarHBondContact O-CB 2.9Å; Q492-A496 PolarHBondContact O-N 3.3Å; L493-A496 PolarHBondContact O-N 3.05Å; A496-R498 PolarHBondContact O-N 3.47Å; A496-R499 PolarHBondContact O-N 3.09Å; A496-R499 VanDerWaalsContact O-N 3.14Å
497	A	61.9	Low	58.1	Low	79 Å²	79	99 Å²	99	65%	0.653	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-7.7	174.5	0	0	0	0	0	114.2	L493	L493-A497 WeakPolarHBondContact O-CB 3.37Å; L493-A497 PolarHBondContact O-N 2.99Å
498	R	61.2	Low	55.4	Low	114 Å²	114	102.8 Å²	102.8	43%	0.43	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-10.7	176.4	-73.8	177.4	-168.1	177.1	9.4	114.1	T494 Q495 A496 P500	T494-R498 VanDerWaalsContact O-CG 3.29Å; T494-R498 WeakPolarHBondContact O-CG 3.37Å; Q495-R498 WeakPolarHBondContact O-CB 3.36Å; Q495-R498 PolarHBondContact O-N 3.33Å; A496-R498 PolarHBondContact O-N 3.47Å; R498-P500 VanDerWaalsContact O-CD 3.28Å; R498-P500 WeakPolarHBondContact O-CD 3.46Å
499	R	49.7	Very low	53	Low	208 Å²	208	112.5 Å²	112.5	79%	0.785	58%	0.578	S	S	*	*	S	Bend	trans	-73.4	118.2	177.9	-75.8	-162.3	175.9	-172.9	0.5	108.5	A496	A496-R499 PolarHBondContact O-N 3.09Å; A496-R499 VanDerWaalsContact O-N 3.14Å
500	P	43.1	Very low	51.7	Low	115 Å²	115	115.5 Å²	115.5	75%	0.747	59%	0.594	S	S	*	*			trans	-61.5	140.3	170.3	-12.2	26.9	0	0	0	108.4	R498 G502	R498-P500 VanDerWaalsContact O-CD 3.28Å; R498-P500 WeakPolarHBondContact O-CD 3.46Å; P500-G502 PolarHBondContact O-N 3.18Å
501	N	45.3	Very low	50.3	Low	148 Å²	148	121.3 Å²	121.3	79%	0.791	62%	0.624	S	S	*	*	S	Bend	trans	-61.6	103.3	173	-146	15.6	0	0	0	108	Q473	Q473-N501 PolarHBondContact NE2-ND2 3.47Å; Q473-N501 VanDerWaalsContact NE2-ND2 3.18Å
502	G	41.7	Very low	48.6	Very low	63 Å²	63	126.1 Å²	126.1	65%	0.649	65%	0.648	S	S	*	*			trans	156.7	70.2	-175.8	0	0	0	0	0	114.9	P500	P500-G502 PolarHBondContact O-N 3.18Å
503	Q	32.3	Very low	46.9	Very low	159 Å²	159	128.2 Å²	128.2	74%	0.743	66%	0.662	S	S	*	*			trans	-178.8	87.7	136.7	-103.1	-179.1	9.4	0	0	109	K505	Q503-K505 PolarHBondContact O-N 3.3Å
504	Q	33.4	Very low	45.5	Very low	199 Å²	199	132.6 Å²	132.6	93%	0.93	68%	0.684	S	S	*	*			trans	-71	97.1	154.5	-166.9	161.9	6.9	0	0	106.1
505	K	29.2	Very low	43.7	Very low	152 Å²	152	140.8 Å²	140.8	66%	0.661	73%	0.726	S	S	*	*			trans	-92	105	163.8	-85.1	-171.5	176.4	-177.1	0	107.6	Q503 W507	Q503-K505 PolarHBondContact O-N 3.3Å; K505-W507 PolarHBondContact O-N 3.17Å
506	S	33.4	Very low	41.7	Very low	99 Å²	99	142.9 Å²	142.9	69%	0.692	74%	0.74	S	S	*	*			trans	-57.2	115.5	162	56	0	0	0	0	109.1
507	W	27.4	Very low	39.9	Very low	245 Å²	245	150.8 Å²	150.8	93%	0.928	77%	0.771	S	S	*	*			trans	-114.4	84.3	157.1	-87.4	44.4	0	0	0	106.7	K505	K505-W507 PolarHBondContact O-N 3.17Å
508	S	29.4	Very low	38.1	Very low	106 Å²	106	156.8 Å²	156.8	74%	0.741	78%	0.781	S	S	*	*			trans	-74.9	118.1	151.1	41.8	0	0	0	0	107.8
509	Q	30.9	Very low	36	Very low	273 Å²	273	160.6 Å²	160.6	100%	1.276	81%	0.813	S	S	*	*			trans	-162.1	0	138.4	-107.9	177.5	15.9	0	0	109.1

Retrieved 509 of 509 residues in 1095.1 ms (Link to these results)

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