A0A087Y4L0_POEFO Loading...

mRNA m(6)A methyltransferase

AlphaFold DB , UniProt , Accession A0A087Y4L0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 587 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.4	Very low	64.2	Low	225 Å²	225	112.4 Å²	112.4	100%	1.108	60%	0.597	S	S	*	*				0	5.5	0	-73.8	-162.5	-89.2	0	0	113.8
2	S	53	Low	65.6	Low	80 Å²	80	114.9 Å²	114.9	56%	0.559	60%	0.599	S	S	*	*	H	α-helix	trans	-79.8	-27.7	178.4	47.7	0	0	0	0	114.5	S6	S2-S6 PolarHBondContact O-N 3.21Å
3	D	55	Low	67	Low	116 Å²	116	118.9 Å²	118.9	62%	0.62	61%	0.609	S	S	*	*	H	α-helix	trans	-85.3	-28	-163.6	-57.9	-13.3	0	0	0	112.7	N7	D3-N7 WeakPolarHBondContact O-CB 3.24Å; D3-N7 PolarHBondContact O-N 3.29Å; D3-N7 PolarHBondContact O-ND2 2.8Å
4	T	63.1	Low	67.9	Low	96 Å²	96	119.7 Å²	119.7	59%	0.589	61%	0.609	S	S	*	*	H	α-helix	trans	-68.6	-39.3	175	44.3	0	0	0	0	111.7	N7 I8	T4-N7 PolarHBondContact O-N 3.39Å; T4-I8 WeakPolarHBondContact O-CD1 3.29Å; T4-I8 VanDerWaalsContact O-CG1 3.24Å; T4-I8 WeakPolarHBondContact O-CG1 3.45Å; T4-I8 PolarHBondContact O-N 3.47Å
5	W	54.4	Low	68.2	Low	162 Å²	162	117.4 Å²	117.4	61%	0.614	60%	0.598	S	S	*	*	H	α-helix	trans	-70.2	-40.9	177	-171.5	-113.9	0	0	0	112.4	N7 I8 Q9	W5-N7 VanDerWaalsContact C-N 3.33Å; W5-N7 PolarHBondContact O-N 3.31Å; W5-I8 PolarHBondContact O-N 2.9Å; W5-Q9 VanDerWaalsContact NE1-NE2 3.2Å; W5-Q9 WeakPolarHBondContact O-CG 3.11Å; W5-Q9 PolarHBondContact O-N 3.39Å
6	S	67.4	Low	68.7	Low	71 Å²	71	114.9 Å²	114.9	50%	0.497	59%	0.586	S	S	.	*	H	α-helix	trans	-61.3	-40.5	172.7	-85.7	0	0	0	0	112.3	S2 Q9 A10	S2-S6 PolarHBondContact O-N 3.21Å; S6-Q9 PolarHBondContact O-N 2.83Å; S6-A10 WeakPolarHBondContact O-CB 3.14Å; S6-A10 PolarHBondContact O-N 3.5Å
7	N	70.8	Confident	69.4	Low	115 Å²	115	111.7 Å²	111.7	62%	0.615	58%	0.577	S	S	*	*	H	α-helix	trans	-65.7	-40.6	176.7	-81.1	-21.7	0	0	0	112.5	D3 T4 W5 A10 H11	D3-N7 WeakPolarHBondContact O-CB 3.24Å; D3-N7 PolarHBondContact O-N 3.29Å; D3-N7 PolarHBondContact O-ND2 2.8Å; T4-N7 PolarHBondContact O-N 3.39Å; W5-N7 VanDerWaalsContact C-N 3.33Å; W5-N7 PolarHBondContact O-N 3.31Å; N7-A10 PolarHBondContact O-N 2.84Å; N7-H11 WeakPolarHBondContact O-CB 3.41Å; N7-H11 PolarHBondContact O-N 3.44Å
8	I	74.6	Confident	69.6	Low	103 Å²	103	111.1 Å²	111.1	53%	0.528	57%	0.574	S	S	.	*	H	α-helix	trans	-65.1	-41.4	176.6	-68.2	163.8	0	0	0	111	T4 W5 H11 K12	T4-I8 WeakPolarHBondContact O-CD1 3.29Å; T4-I8 VanDerWaalsContact O-CG1 3.24Å; T4-I8 WeakPolarHBondContact O-CG1 3.45Å; T4-I8 PolarHBondContact O-N 3.47Å; W5-I8 PolarHBondContact O-N 2.9Å; I8-H11 PolarHBondContact O-N 3.32Å; I8-K12 WeakPolarHBondContact O-CB 3.31Å; I8-K12 PolarHBondContact O-N 3.14Å
9	Q	70	Confident	70.1	Confident	106 Å²	106	114.3 Å²	114.3	50%	0.495	58%	0.578	S	S	.	*	H	α-helix	trans	-67.9	-39.9	176.4	-74	-166	-13	0	0	112.6	W5 S6 H11 K12 K13	W5-Q9 VanDerWaalsContact NE1-NE2 3.2Å; W5-Q9 WeakPolarHBondContact O-CG 3.11Å; W5-Q9 PolarHBondContact O-N 3.39Å; S6-Q9 PolarHBondContact O-N 2.83Å; Q9-H11 VanDerWaalsContact C-N 3.34Å; Q9-K12 PolarHBondContact O-N 3.04Å; Q9-K13 WeakPolarHBondContact O-CB 3.5Å; Q9-K13 PolarHBondContact O-N 3.3Å
10	A	79.1	Confident	70.3	Confident	52 Å²	52	113.6 Å²	113.6	43%	0.43	57%	0.572	S	S	.	*	H	α-helix	trans	-62.3	-42.7	175.5	0	0	0	0	0	111.5	S6 N7 K13 Q14	S6-A10 WeakPolarHBondContact O-CB 3.14Å; S6-A10 PolarHBondContact O-N 3.5Å; N7-A10 PolarHBondContact O-N 2.84Å; A10-K13 PolarHBondContact O-N 3.19Å; A10-Q14 PolarHBondContact O-N 2.88Å
11	H	72.3	Confident	70.3	Confident	110 Å²	110	116 Å²	116	51%	0.509	58%	0.575	S	S	.	*	H	α-helix	trans	-65	-42.1	177.6	-169.6	-103.1	0	0	0	112.1	N7 I8 Q9 K13 Q14 L15	N7-H11 WeakPolarHBondContact O-CB 3.41Å; N7-H11 PolarHBondContact O-N 3.44Å; I8-H11 PolarHBondContact O-N 3.32Å; Q9-H11 VanDerWaalsContact C-N 3.34Å; H11-K13 VanDerWaalsContact C-N 3.33Å; H11-K13 PolarHBondContact O-N 2.93Å; H11-Q14 PolarHBondContact O-N 3.43Å; H11-L15 PolarHBondContact O-N 3.36Å
12	K	81.1	Confident	71.1	Confident	143 Å²	143	110.6 Å²	110.6	62%	0.622	55%	0.55	S	S	*	.	H	α-helix	trans	-61.4	-42	174.5	-168.9	173.7	-179.7	177.3	0	111.7	I8 Q9 Q14 L15 D16	I8-K12 WeakPolarHBondContact O-CB 3.31Å; I8-K12 PolarHBondContact O-N 3.14Å; Q9-K12 PolarHBondContact O-N 3.04Å; K12-Q14 PolarHBondContact O-N 3.24Å; K12-L15 PolarHBondContact O-N 2.98Å; K12-D16 PolarHBondContact O-N 3.29Å
13	K	83.6	Confident	71.7	Confident	167 Å²	167	114.3 Å²	114.3	73%	0.726	56%	0.555	S	S	*	*	H	α-helix	trans	-65.5	-36.5	177.5	-164.3	176.7	-177.9	-179.6	0	112.5	Q9 A10 H11 S17	Q9-K13 WeakPolarHBondContact O-CB 3.5Å; Q9-K13 PolarHBondContact O-N 3.3Å; A10-K13 PolarHBondContact O-N 3.19Å; H11-K13 VanDerWaalsContact C-N 3.33Å; H11-K13 PolarHBondContact O-N 2.93Å; K13-S17 WeakPolarHBondContact O-CB 3.43Å; K13-S17 PolarHBondContact O-N 3.47Å
14	Q	79.6	Confident	72	Confident	130 Å²	130	116.5 Å²	116.5	61%	0.607	56%	0.555	S	S	*	*	H	α-helix	trans	-66.4	-42.8	173.5	-81.8	-175.4	-31.9	0	0	112.4	A10 H11 K12 D16 S17 L18	A10-Q14 PolarHBondContact O-N 2.88Å; H11-Q14 PolarHBondContact O-N 3.43Å; K12-Q14 PolarHBondContact O-N 3.24Å; Q14-D16 PolarHBondContact O-N 2.9Å; Q14-S17 PolarHBondContact O-N 3.08Å; Q14-L18 WeakPolarHBondContact O-CB 3.28Å; Q14-L18 PolarHBondContact O-N 3.47Å
15	L	73.3	Confident	71.8	Confident	85 Å²	85	121.5 Å²	121.5	45%	0.445	56%	0.563	S	S	.	*	H	α-helix	trans	-63.5	-39.9	177	-77.2	168.6	0	0	0	112.5	H11 K12 L18 R19	H11-L15 PolarHBondContact O-N 3.36Å; K12-L15 PolarHBondContact O-N 2.98Å; L15-L18 PolarHBondContact O-N 3.17Å; L15-R19 PolarHBondContact O-N 3.45Å
16	D	75.6	Confident	72.1	Confident	78 Å²	78	123 Å²	123	42%	0.417	57%	0.569	S	S	.	*	H	α-helix	trans	-69.1	-39.4	176.9	-71.6	-26.8	0	0	0	111.6	K12 Q14 L18 R19 E20	K12-D16 PolarHBondContact O-N 3.29Å; Q14-D16 PolarHBondContact O-N 2.9Å; D16-L18 PolarHBondContact O-N 3.46Å; D16-R19 PolarHBondContact O-N 3.48Å; D16-E20 PolarHBondContact O-N 3.25Å
17	S	80.8	Confident	71.5	Confident	60 Å²	60	128 Å²	128	42%	0.42	58%	0.581	S	S	.	*	H	α-helix	trans	-62.4	-40.4	173.1	-175	0	0	0	0	112.6	K13 Q14 E20 R21	K13-S17 WeakPolarHBondContact O-CB 3.43Å; K13-S17 PolarHBondContact O-N 3.47Å; Q14-S17 PolarHBondContact O-N 3.08Å; S17-E20 PolarHBondContact O-N 3.11Å; S17-R21 PolarHBondContact O-N 3.06Å
18	L	72.2	Confident	70.5	Confident	100 Å²	100	128.8 Å²	128.8	52%	0.524	59%	0.586	S	S	.	*	H	α-helix	trans	-64.9	-43.7	174.9	-93	159.3	0	0	0	111.9	Q14 L15 D16 E20 R21 L22	Q14-L18 WeakPolarHBondContact O-CB 3.28Å; Q14-L18 PolarHBondContact O-N 3.47Å; L15-L18 PolarHBondContact O-N 3.17Å; D16-L18 PolarHBondContact O-N 3.46Å; L18-E20 VanDerWaalsContact C-N 3.3Å; L18-E20 PolarHBondContact O-N 2.96Å; L18-R21 PolarHBondContact O-N 2.84Å; L18-L22 WeakPolarHBondContact O-CB 3.47Å; L18-L22 WeakPolarHBondContact O-CG 3.46Å; L18-L22 PolarHBondContact O-N 3.44Å
19	R	80.4	Confident	69	Low	172 Å²	172	129.6 Å²	129.6	65%	0.649	60%	0.598	S	S	*	*	H	α-helix	trans	-61.2	-38.9	173.6	-86.1	179.4	175.9	157.6	-0.8	112	L15 D16 K23	L15-R19 PolarHBondContact O-N 3.45Å; D16-R19 PolarHBondContact O-N 3.48Å; R19-K23 WeakPolarHBondContact O-CB 3.47Å; R19-K23 WeakPolarHBondContact O-CG 3.4Å; R19-K23 PolarHBondContact O-N 2.95Å
20	E	72.9	Confident	67.8	Low	100 Å²	100	128.8 Å²	128.8	47%	0.467	61%	0.609	S	S	.	*	H	α-helix	trans	-69.2	-42.9	177.8	-154.6	-169.5	149.5	0	0	111.7	D16 S17 L18 L22 K23 R24	D16-E20 PolarHBondContact O-N 3.25Å; S17-E20 PolarHBondContact O-N 3.11Å; L18-E20 VanDerWaalsContact C-N 3.3Å; L18-E20 PolarHBondContact O-N 2.96Å; E20-L22 VanDerWaalsContact C-N 3.35Å; E20-L22 PolarHBondContact O-N 2.92Å; E20-K23 PolarHBondContact O-N 3.37Å; E20-R24 WeakPolarHBondContact O-CG 3.17Å; E20-R24 PolarHBondContact O-N 2.86Å; E20-R24 IonicContact OE1-CZ 3.57Å; E20-R24 IonicContact OE1-NE 3.5Å; E20-R24 PolarHBondContact OE1-NE 3.21Å; E20-R24 IonicContact OE1-NH2 3.83Å; E20-R24 PolarHBondContact OE1-NH2 2.95Å
21	R	70.7	Confident	66.1	Low	166 Å²	166	134.8 Å²	134.8	63%	0.626	63%	0.628	S	S	*	*	H	α-helix	trans	-61	-40.9	173.8	-81.1	178.5	132.1	174.6	-2.7	112.3	S17 L18 R24 R25	S17-R21 PolarHBondContact O-N 3.06Å; L18-R21 PolarHBondContact O-N 2.84Å; R21-R24 PolarHBondContact O-N 3.44Å; R21-R25 WeakPolarHBondContact O-CG 3.23Å; R21-R25 PolarHBondContact O-N 2.94Å
22	L	64	Low	64.4	Low	111 Å²	111	138.5 Å²	138.5	58%	0.581	65%	0.651	S	S	*	*	H	α-helix	trans	-67.4	-37.3	175.4	-75.7	168.1	0	0	0	112.2	L18 E20 R26	L18-L22 WeakPolarHBondContact O-CB 3.47Å; L18-L22 WeakPolarHBondContact O-CG 3.46Å; L18-L22 PolarHBondContact O-N 3.44Å; E20-L22 VanDerWaalsContact C-N 3.35Å; E20-L22 PolarHBondContact O-N 2.92Å; L22-R26 WeakPolarHBondContact O-CB 3.24Å; L22-R26 PolarHBondContact O-N 3.35Å
23	K	65.6	Low	62	Low	157 Å²	157	137.6 Å²	137.6	68%	0.683	66%	0.663	S	S	*	*	H	α-helix	trans	-66.5	-39	173	-80.7	179.7	178.6	177.7	0	112	R19 E20 R26 K27	R19-K23 WeakPolarHBondContact O-CB 3.47Å; R19-K23 WeakPolarHBondContact O-CG 3.4Å; R19-K23 PolarHBondContact O-N 2.95Å; E20-K23 PolarHBondContact O-N 3.37Å; K23-R26 PolarHBondContact O-N 2.98Å; K23-K27 PolarHBondContact O-N 3.41Å; K23-K27 VanDerWaalsContact O-N 3.17Å
24	R	61.6	Low	59.5	Low	162 Å²	162	132.8 Å²	132.8	61%	0.611	66%	0.661	S	S	*	*	H	α-helix	trans	-64.7	-45.9	174.7	-72	-177.6	-172.6	-147.9	4.7	111.6	E20 R21 R26 K27 D28	E20-R24 WeakPolarHBondContact O-CG 3.17Å; E20-R24 PolarHBondContact O-N 2.86Å; E20-R24 IonicContact OE1-CZ 3.57Å; E20-R24 IonicContact OE1-NE 3.5Å; E20-R24 PolarHBondContact OE1-NE 3.21Å; E20-R24 IonicContact OE1-NH2 3.83Å; E20-R24 PolarHBondContact OE1-NH2 2.95Å; R21-R24 PolarHBondContact O-N 3.44Å; R24-R26 PolarHBondContact O-N 3.46Å; R24-K27 PolarHBondContact O-N 3.42Å; R24-D28 PolarHBondContact O-N 2.84Å
25	R	58.3	Low	57.2	Low	201 Å²	201	133.3 Å²	133.3	76%	0.758	67%	0.673	S	S	*	*	H	α-helix	trans	-62.2	-27.4	173.8	-71	-176.2	-172.3	-161.2	2.5	113.7	R21	R21-R25 WeakPolarHBondContact O-CG 3.23Å; R21-R25 PolarHBondContact O-N 2.94Å
26	R	60.4	Low	55.1	Low	195 Å²	195	137.6 Å²	137.6	74%	0.736	70%	0.696	S	S	*	*	H	α-helix	trans	-78.4	-19.5	173.4	-111	-176.6	-178.7	-177.3	2.1	113.8	L22 K23 R24	L22-R26 WeakPolarHBondContact O-CB 3.24Å; L22-R26 PolarHBondContact O-N 3.35Å; K23-R26 PolarHBondContact O-N 2.98Å; R24-R26 PolarHBondContact O-N 3.46Å
27	K	55.3	Low	52.8	Low	175 Å²	175	137.6 Å²	137.6	76%	0.761	71%	0.714	S	S	*	*	H	α-helix	trans	-93	-19.2	-174.3	-152.1	177.3	-179	-173.1	0	113.1	K23 R24 P29	K23-K27 PolarHBondContact O-N 3.41Å; K23-K27 VanDerWaalsContact O-N 3.17Å; R24-K27 PolarHBondContact O-N 3.42Å; K27-P29 WeakPolarHBondContact O-CD 3.36Å
28	D	50.1	Low	50.3	Low	131 Å²	131	138.2 Å²	138.2	70%	0.701	73%	0.731	S	S	*	*			trans	-111.8	73.3	174.3	-63.9	-30.7	0	0	0	112.3	R24 A30	R24-D28 PolarHBondContact O-N 2.84Å; D28-A30 PolarHBondContact O-N 3.08Å
29	P	42.9	Very low	48.1	Very low	120 Å²	120	141.6 Å²	141.6	78%	0.779	75%	0.748	S	S	*	*			trans	-82.1	7.6	170.1	33.4	-32.8	0	0	0	113.2	K27	K27-P29 WeakPolarHBondContact O-CD 3.36Å
30	A	43.9	Very low	45.6	Very low	90 Å²	90	138.4 Å²	138.4	74%	0.744	75%	0.753	S	S	*	*	S	Bend	trans	-128.6	60.2	-172.2	0	0	0	0	0	112.4	D28	D28-A30 PolarHBondContact O-N 3.08Å
31	Q	44.5	Very low	43.4	Very low	178 Å²	178	137.9 Å²	137.9	83%	0.832	77%	0.765	S	S	*	*	S	Bend	trans	-164.7	93.9	154.7	-110.7	178.6	23.4	0	0	107
32	L	36.7	Very low	41.4	Very low	187 Å²	187	139.5 Å²	139.5	98%	0.979	78%	0.78	S	S	*	*			trans	173.1	74.1	152.2	-90.6	154.1	0	0	0	107.5
33	S	30	Very low	39.6	Very low	125 Å²	125	137.4 Å²	137.4	87%	0.874	79%	0.785	S	S	*	*			trans	-142.8	124.4	157.2	175.8	0	0	0	0	107.1
34	G	30.7	Very low	37.8	Very low	66 Å²	66	135.5 Å²	135.5	68%	0.68	79%	0.791	S	S	*	*			trans	90.1	134.6	176	0	0	0	0	0	113.9
35	T	30.7	Very low	36.2	Very low	140 Å²	140	133.9 Å²	133.9	86%	0.859	80%	0.8	S	S	*	*			cis	178.3	148.6	-5.7	13.1	0	0	0	0	104.8
36	D	30.3	Very low	34.9	Very low	175 Å²	175	128.6 Å²	128.6	94%	0.936	80%	0.799	S	S	*	*			trans	-0.8	142.1	161.1	-86.8	-30.9	0	0	0	121.7
37	G	27.5	Very low	33.4	Very low	78 Å²	78	130.4 Å²	130.4	80%	0.804	81%	0.806	S	S	*	*			trans	154.3	106.2	155.3	0	0	0	0	0	113.4
38	G	26.8	Very low	32.2	Very low	74 Å²	74	127 Å²	127	76%	0.763	80%	0.804	S	S	*	*			trans	-80.1	-169.4	179.4	0	0	0	0	0	115.8
39	L	27.8	Very low	31.1	Very low	170 Å²	170	128.2 Å²	128.2	89%	0.89	81%	0.81	S	S	*	*			trans	113	102.6	165	-64.3	169.8	0	0	0	116.7
40	S	26	Very low	30.3	Very low	106 Å²	106	127.7 Å²	127.7	74%	0.741	81%	0.81	S	S	*	*				49.3	131.1	125	55.8	0	0	0	0	123.5
41	A	27.7	Very low	29.9	Very low	88 Å²	88	129.5 Å²	129.5	73%	0.727	81%	0.814	S	S	*	*				93.8	128.6	129.6	0	0	0	0	0	121.4
42	E	27.9	Very low	29	Very low	201 Å²	201	125.4 Å²	125.4	94%	0.939	81%	0.81	S	S	*	*			trans	63.8	141.2	150.7	-63.3	-176.9	170	0	0	118.9
43	G	27	Very low	28.9	Very low	66 Å²	66	122 Å²	122	68%	0.68	80%	0.799	S	S	*	*			cis	175.2	155.8	3.1	0	0	0	0	0	109.1
44	S	26.8	Very low	28.7	Very low	117 Å²	117	121.7 Å²	121.7	82%	0.818	80%	0.798	S	S	*	*			trans	41.7	132.7	144.3	-46	0	0	0	0	120.5
45	T	28.7	Very low	28.5	Very low	129 Å²	129	123 Å²	123	79%	0.791	80%	0.802	S	S	*	*				-173.5	130.5	57.8	43.1	0	0	0	0	110.7
46	A	30.8	Very low	28.4	Very low	90 Å²	90	122.4 Å²	122.4	74%	0.744	80%	0.801	S	S	*	*				61.7	134.2	106.2	0	0	0	0	0	116.9
47	R	30	Very low	28.2	Very low	232 Å²	232	119.2 Å²	119.2	88%	0.875	79%	0.792	S	S	*	*			cis	-164	145.7	39.6	-74	-179.1	164.3	173.9	-5	114.2
48	S	29.3	Very low	28.1	Very low	105 Å²	105	121.8 Å²	121.8	73%	0.734	79%	0.792	S	S	*	*			trans	45.1	141.5	132.3	-54.8	0	0	0	0	123.1
49	D	26.7	Very low	28	Very low	155 Å²	155	124 Å²	124	83%	0.829	80%	0.796	S	S	*	*			cis	-149.1	146	46	-90.1	-42.3	0	0	0	116.4
50	S	26.3	Very low	28.1	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	80%	0.797	S	S	*	*			trans	-6.9	164.2	155.9	-62.3	0	0	0	0	123.3
51	P	36.4	Very low	28	Very low	127 Å²	127	123.4 Å²	123.4	83%	0.825	80%	0.795	S	S	*	*			cis	-143.1	178.4	31.8	37.7	-14.1	0	0	0	119.6
52	A	25.7	Very low	28.1	Very low	92 Å²	92	128.5 Å²	128.5	76%	0.76	80%	0.804	S	S	*	*			trans	-63.2	-174.3	-175.6	0	0	0	0	0	117
53	P	33.3	Very low	28.1	Very low	115 Å²	115	125.2 Å²	125.2	75%	0.747	80%	0.798	S	S	*	*			cis	-134.8	166.2	-1.1	35.2	-13.4	0	0	0	117.8
54	S	25.3	Very low	28.5	Very low	120 Å²	120	131 Å²	131	84%	0.839	81%	0.807	S	S	*	*			trans	12.4	119	155.3	-28.7	0	0	0	0	122.2
55	A	28	Very low	29.1	Very low	94 Å²	94	133.6 Å²	133.6	78%	0.777	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-83.4	157.7	156.6	0	0	0	0	0	112
56	P	28.2	Very low	30	Very low	127 Å²	127	132.7 Å²	132.7	83%	0.825	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-89.5	146.5	143.5	24.2	-9.7	0	0	0	111
57	S	25.6	Very low	31.2	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-76.3	133.1	-167.3	49.5	0	0	0	0	115.6
58	T	24.8	Very low	33	Very low	133 Å²	133	124.8 Å²	124.8	82%	0.816	77%	0.769	S	S	*	*			trans	32.5	117.7	136.4	54.9	0	0	0	0	120
59	S	26.2	Very low	35.1	Very low	119 Å²	119	124.5 Å²	124.5	83%	0.832	76%	0.764	S	S	*	*			trans	-105.8	125.6	131.5	56.4	0	0	0	0	108.7	G61	S59-G61 PolarHBondContact O-N 3.29Å
60	Q	28.6	Very low	37.5	Very low	195 Å²	195	121.2 Å²	121.2	91%	0.911	74%	0.744	S	S	*	*			trans	-44.4	129.9	170	-60.7	164.1	-15.7	0	0	109.1
61	G	25.6	Very low	40.1	Very low	69 Å²	69	117 Å²	117	71%	0.711	71%	0.713	S	S	*	*				97.4	74.1	58.2	0	0	0	0	0	108.9	S59	S59-G61 PolarHBondContact O-N 3.29Å
62	E	28.4	Very low	42.3	Very low	195 Å²	195	112.5 Å²	112.5	91%	0.911	68%	0.681	S	S	*	*			trans	-103.7	114.9	153.5	-81.7	-169.7	163.9	0	0	107	E64	E62-E64 PolarHBondContact O-N 3.27Å
63	T	29.2	Very low	45.1	Very low	133 Å²	133	113 Å²	113	82%	0.816	67%	0.665	S	S	*	*			trans	-75.6	114.2	175.9	-37.7	0	0	0	0	105	Q65	T63-Q65 VanDerWaalsContact C-N 3.28Å; T63-Q65 PolarHBondContact O-N 3.29Å
64	E	33.8	Very low	47.3	Very low	187 Å²	187	112.7 Å²	112.7	87%	0.874	65%	0.65	S	S	*	*			trans	-59.8	95.9	172.2	-89.7	-172.1	144.8	0	0	108.6	E62	E62-E64 PolarHBondContact O-N 3.27Å
65	Q	40.4	Very low	50.2	Low	172 Å²	172	107 Å²	107	80%	0.804	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-75	135.2	168.3	-154.6	162.9	-4.6	0	0	106.8	T63	T63-Q65 VanDerWaalsContact C-N 3.28Å; T63-Q65 PolarHBondContact O-N 3.29Å
66	P	47.7	Very low	52.8	Low	110 Å²	110	102.7 Å²	102.7	71%	0.714	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-55.5	134.5	179.2	21.6	-31.8	0	0	0	109.5	D68	P66-D68 PolarHBondContact O-N 3.33Å
67	P	56.5	Low	55.4	Low	58 Å²	58	98.2 Å²	98.2	38%	0.377	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-60.6	140.3	-176.8	23.8	-32.2	0	0	0	110	P69 L112	P67-P69 WeakPolarHBondContact O-CD 3.45Å; P67-P69 VanDerWaalsContact O-N 3.16Å; P67-L112 HydrophobicContact CB-CD2 3.93Å; P67-L112 HydrophobicContact CB-CG 4.48Å; P67-L112 HydrophobicContact CG-CD2 4.11Å
68	D	67.4	Low	58.1	Low	98 Å²	98	95.2 Å²	95.2	52%	0.524	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-55	117.9	178.8	-176.2	-6.7	0	0	0	109.7	P66 E70 L71 E72	P66-D68 PolarHBondContact O-N 3.33Å; D68-E70 PolarHBondContact O-N 3.03Å; D68-E70 VanDerWaalsContact O-N 3.11Å; D68-E70 WeakPolarHBondContact OD1-CB 3.29Å; D68-E70 PolarHBondContact OD1-N 3.44Å; D68-E70 VanDerWaalsContact OD1-N 3.08Å; D68-L71 HydrophobicContact CB-CB 4.15Å; D68-L71 WeakPolarHBondContact O-CB 3.41Å; D68-L71 PolarHBondContact O-N 3.17Å; D68-E72 PolarHBondContact O-N 3.2Å
69	P	72.8	Confident	60.9	Low	98 Å²	98	88.9 Å²	88.9	64%	0.636	48%	0.484	S	S	*	.	H	α-helix	trans	-59.9	-23.7	-177.9	24	-34.7	0	0	0	112.7	P67 K73	P67-P69 WeakPolarHBondContact O-CD 3.45Å; P67-P69 VanDerWaalsContact O-N 3.16Å; P69-K73 PolarHBondContact O-N 3.4Å
70	E	76.9	Confident	63.6	Low	87 Å²	87	84.3 Å²	84.3	41%	0.407	45%	0.453	S	S	.	.	H	α-helix	trans	-74.4	-36.1	177.1	-167.6	58.8	-155.7	0	0	111.7	D68 K73 R74	D68-E70 PolarHBondContact O-N 3.03Å; D68-E70 VanDerWaalsContact O-N 3.11Å; D68-E70 WeakPolarHBondContact OD1-CB 3.29Å; D68-E70 PolarHBondContact OD1-N 3.44Å; D68-E70 VanDerWaalsContact OD1-N 3.08Å; E70-K73 PolarHBondContact O-N 3.46Å; E70-R74 WeakPolarHBondContact O-CG 3.45Å; E70-R74 PolarHBondContact O-N 3.49Å; E70-R74 VanDerWaalsContact O-N 3.08Å; E70-R74 IonicContact OE1-NE 2.78Å
71	L	81.3	Confident	66.1	Low	21 Å²	21	78.9 Å²	78.9	11%	0.11	43%	0.43	C	S	.	.	H	α-helix	trans	-68	-40.9	174.2	-178.5	62.2	0	0	0	111.5	D68 K73 R74 L75 V104 C108 I109 L112	D68-L71 HydrophobicContact CB-CB 4.15Å; D68-L71 WeakPolarHBondContact O-CB 3.41Å; D68-L71 PolarHBondContact O-N 3.17Å; L71-K73 VanDerWaalsContact C-N 3.32Å; L71-K73 PolarHBondContact O-N 3.48Å; L71-R74 PolarHBondContact O-N 2.81Å; L71-L75 PolarHBondContact O-N 3.22Å; L71-V104 HydrophobicContact CD1-CB 4.38Å; L71-V104 HydrophobicContact CD1-CG1 3.76Å; L71-V104 HydrophobicContact CD1-CG2 3.64Å; L71-V104 HydrophobicContact CD2-CG1 3.82Å; L71-V104 HydrophobicContact CG-CG1 4.45Å; L71-C108 HydrophobicContact CD2-CB 4Å; L71-I109 HydrophobicContact CD1-CD1 4.07Å; L71-I109 HydrophobicContact CD2-CD1 4.5Å; L71-I109 HydrophobicContact CG-CD1 4.46Å; L71-L112 HydrophobicContact CD2-CD1 3.99Å; L71-L112 HydrophobicContact CG-CD1 3.88Å
72	E	83.3	Confident	68.3	Low	33 Å²	33	81.5 Å²	81.5	15%	0.154	43%	0.427	C	S	.	.	H	α-helix	trans	-59.1	-43.9	176.1	-170.6	170.7	174.9	0	0	111.2	D68 L75 L76 L112 K115 F116	D68-E72 PolarHBondContact O-N 3.2Å; E72-L75 PolarHBondContact O-N 2.79Å; E72-L76 HydrophobicContact CG-CD1 4.37Å; E72-L76 WeakPolarHBondContact O-CB 3.49Å; E72-L76 WeakPolarHBondContact O-CG 3.3Å; E72-L76 PolarHBondContact O-N 3.36Å; E72-L112 HydrophobicContact CB-CD2 4.24Å; E72-L112 HydrophobicContact CG-CD2 4.12Å; E72-K115 IonicContact OE1-NZ 3.03Å; E72-K115 PolarHBondContact OE1-NZ 3.19Å; E72-K115 IonicContact OE2-NZ 3.22Å; E72-K115 PolarHBondContact OE2-NZ 3.1Å; E72-F116 HydrophobicContact CG-CE1 3.9Å; E72-F116 HydrophobicContact CG-CZ 3.68Å
73	K	82.8	Confident	70.5	Confident	101 Å²	101	76.7 Å²	76.7	44%	0.439	42%	0.415	S	S	.	.	H	α-helix	trans	-65.3	-41.6	177	-172.9	-178.6	177.3	-173.3	0	112.7	P69 E70 L71 L76 G77	P69-K73 PolarHBondContact O-N 3.4Å; E70-K73 PolarHBondContact O-N 3.46Å; L71-K73 VanDerWaalsContact C-N 3.32Å; L71-K73 PolarHBondContact O-N 3.48Å; K73-L76 PolarHBondContact O-N 3.47Å; K73-G77 PolarHBondContact O-N 3.36Å
74	R	81.1	Confident	72.9	Confident	110 Å²	110	72 Å²	72	42%	0.415	38%	0.384	S	S	.	.	H	α-helix	trans	-65	-42.6	177.6	-72.8	176	-169.9	-175.8	2.1	112	E70 L71 G77 Y78	E70-R74 WeakPolarHBondContact O-CG 3.45Å; E70-R74 PolarHBondContact O-N 3.49Å; E70-R74 VanDerWaalsContact O-N 3.08Å; E70-R74 IonicContact OE1-NE 2.78Å; L71-R74 PolarHBondContact O-N 2.81Å; R74-G77 PolarHBondContact O-N 3.44Å; R74-Y78 PolarHBondContact O-N 2.91Å
75	L	84.8	Confident	74.8	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-66.8	-41.1	176.9	-178.2	62.4	0	0	0	111.8	L71 E72 G77 Y78 L79 I93 L97 I109 L112 L113 F116	L71-L75 PolarHBondContact O-N 3.22Å; E72-L75 PolarHBondContact O-N 2.79Å; L75-G77 VanDerWaalsContact C-N 3.34Å; L75-Y78 PolarHBondContact O-N 3.32Å; L75-L79 HydrophobicContact CD1-CD1 4.06Å; L75-L79 HydrophobicContact CD1-CG 4.19Å; L75-L79 HydrophobicContact CG-CD1 3.98Å; L75-L79 HydrophobicContact CG-CG 4.5Å; L75-L79 WeakPolarHBondContact O-CB 3.47Å; L75-L79 WeakPolarHBondContact O-CG 3.46Å; L75-L79 PolarHBondContact O-N 3.5Å; L75-I93 HydrophobicContact CD1-CG2 3.59Å; L75-L97 HydrophobicContact CB-CD1 4.18Å; L75-L97 HydrophobicContact CD1-CD1 3.62Å; L75-L97 HydrophobicContact CG-CD1 4.48Å; L75-I109 HydrophobicContact CD1-CD1 4.41Å; L75-I109 HydrophobicContact CD2-CD1 4.29Å; L75-L112 HydrophobicContact CD2-CB 3.59Å; L75-L112 HydrophobicContact CD2-CD1 4.15Å; L75-L113 HydrophobicContact CD1-CD2 4.39Å; L75-L113 HydrophobicContact CD2-CD2 4.21Å; L75-L113 HydrophobicContact CD2-CG 4.39Å; L75-F116 HydrophobicContact CB-CE2 4.31Å; L75-F116 HydrophobicContact CD2-CD2 4.2Å; L75-F116 HydrophobicContact CD2-CE2 3.67Å; L75-F116 HydrophobicContact CG-CE2 3.84Å
76	L	84.1	Confident	76.8	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.016	35%	0.351	C	S	.	.	H	α-helix	trans	-61.1	-43.2	172.7	-74.5	169.2	0	0	0	111.6	E72 K73 Y78 L79 S80 F116 L121 L152 I156	E72-L76 HydrophobicContact CG-CD1 4.37Å; E72-L76 WeakPolarHBondContact O-CB 3.49Å; E72-L76 WeakPolarHBondContact O-CG 3.3Å; E72-L76 PolarHBondContact O-N 3.36Å; K73-L76 PolarHBondContact O-N 3.47Å; L76-Y78 PolarHBondContact O-N 2.91Å; L76-L79 PolarHBondContact O-N 3.04Å; L76-S80 VanDerWaalsContact O-CB 3.26Å; L76-S80 WeakPolarHBondContact O-CB 3.32Å; L76-S80 PolarHBondContact O-N 3.38Å; L76-S80 PolarHBondContact O-OG 3.32Å; L76-F116 HydrophobicContact CD1-CE1 4.4Å; L76-F116 HydrophobicContact CD1-CZ 4.08Å; L76-F116 HydrophobicContact CD2-CD1 4.36Å; L76-F116 HydrophobicContact CD2-CD2 4.19Å; L76-F116 HydrophobicContact CD2-CE1 3.89Å; L76-F116 HydrophobicContact CD2-CE2 3.67Å; L76-F116 HydrophobicContact CD2-CZ 3.53Å; L76-F116 HydrophobicContact CG-CE1 4.13Å; L76-F116 HydrophobicContact CG-CE2 3.84Å; L76-F116 HydrophobicContact CG-CZ 3.46Å; L76-F116 VanDerWaalsContact CG-CZ 3.46Å; L76-L121 HydrophobicContact CD2-CD1 4.32Å; L76-L152 HydrophobicContact CB-CD2 4.06Å; L76-L152 HydrophobicContact CD2-CD2 3.65Å; L76-L152 HydrophobicContact CD2-CG 3.89Å; L76-L152 HydrophobicContact CG-CD2 4.48Å; L76-L152 WeakPolarHBondContact O-CD2 3.33Å; L76-I156 HydrophobicContact CB-CD1 4.33Å; L76-I156 HydrophobicContact CB-CG1 4.06Å
77	G	81.1	Confident	78.5	Confident	34 Å²	34	61.7 Å²	61.7	35%	0.351	35%	0.347	S	S	.	.	H	α-helix	trans	-58.6	-47.1	175.2	0	0	0	0	0	112.3	K73 R74 L75 S80	K73-G77 PolarHBondContact O-N 3.36Å; R74-G77 PolarHBondContact O-N 3.44Å; L75-G77 VanDerWaalsContact C-N 3.34Å; G77-S80 PolarHBondContact O-N 2.96Å; G77-S80 PolarHBondContact O-OG 3.31Å
78	Y	83.5	Confident	79.7	Confident	44 Å²	44	59.6 Å²	59.6	17%	0.173	33%	0.334	C	S	.	.	H	α-helix	trans	-63.1	-44.6	178.2	-177.3	-96.7	0	0	0	112.9	R74 L75 L76 S80 D81 L84 I93 Q96 L97	R74-Y78 PolarHBondContact O-N 2.91Å; L75-Y78 PolarHBondContact O-N 3.32Å; L76-Y78 PolarHBondContact O-N 2.91Å; Y78-S80 VanDerWaalsContact C-N 3.26Å; Y78-S80 PolarHBondContact O-N 2.81Å; Y78-D81 WeakPolarHBondContact O-CB 3.45Å; Y78-D81 PolarHBondContact O-N 3.47Å; Y78-L84 HydrophobicContact CD1-CD1 4.29Å; Y78-L84 HydrophobicContact CE1-CD1 3.47Å; Y78-L84 VanDerWaalsContact CE1-CD1 3.47Å; Y78-L84 HydrophobicContact CE1-CD2 4.43Å; Y78-L84 HydrophobicContact CE2-CD1 4.28Å; Y78-L84 VanDerWaalsContact CZ-CD1 3.47Å; Y78-L84 WeakPolarHBondContact OH-CD1 3.48Å; Y78-I93 HydrophobicContact CD1-CG2 4.27Å; Y78-I93 HydrophobicContact CE1-CG1 4.04Å; Y78-I93 HydrophobicContact CE1-CG2 4.26Å; Y78-Q96 HydrophobicContact CE2-CB 3.92Å; Y78-Q96 HydrophobicContact CE2-CG 4.35Å; Y78-Q96 WeakPolarHBondContact OH-CG 3.4Å; Y78-Q96 PolarHBondContact OH-OE1 3.45Å; Y78-L97 HydrophobicContact CD2-CD2 4.38Å; Y78-L97 HydrophobicContact CG-CD2 4.22Å
79	L	84.1	Confident	80.6	Confident	0 Å²	0	58 Å²	58	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-70.9	-21.9	177.2	-66.8	170.9	0	0	0	112.7	L75 L76 D81 L84 L113 F116 I122 V147 H149 L152	L75-L79 HydrophobicContact CD1-CD1 4.06Å; L75-L79 HydrophobicContact CD1-CG 4.19Å; L75-L79 HydrophobicContact CG-CD1 3.98Å; L75-L79 HydrophobicContact CG-CG 4.5Å; L75-L79 WeakPolarHBondContact O-CB 3.47Å; L75-L79 WeakPolarHBondContact O-CG 3.46Å; L75-L79 PolarHBondContact O-N 3.5Å; L76-L79 PolarHBondContact O-N 3.04Å; L79-D81 VanDerWaalsContact C-N 3.26Å; L79-D81 PolarHBondContact O-N 3.3Å; L79-L84 HydrophobicContact CD2-CD2 4.16Å; L79-L113 HydrophobicContact CD1-CD2 3.99Å; L79-F116 HydrophobicContact CD1-CD2 3.97Å; L79-F116 HydrophobicContact CD1-CE2 4.31Å; L79-I122 HydrophobicContact CD1-CD1 4.35Å; L79-I122 HydrophobicContact CD1-CG2 4.2Å; L79-V147 HydrophobicContact CD2-CG2 4.43Å; L79-H149 PolarHBondContact O-CE1 2.97Å; L79-L152 HydrophobicContact CB-CD1 3.88Å
80	S	81.4	Confident	81.1	Confident	23 Å²	23	53.3 Å²	53.3	16%	0.161	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-10.8	177.4	75.8	0	0	0	0	114.2	L76 G77 Y78 L82 H149	L76-S80 VanDerWaalsContact O-CB 3.26Å; L76-S80 WeakPolarHBondContact O-CB 3.32Å; L76-S80 PolarHBondContact O-N 3.38Å; L76-S80 PolarHBondContact O-OG 3.32Å; G77-S80 PolarHBondContact O-N 2.96Å; G77-S80 PolarHBondContact O-OG 3.31Å; Y78-S80 VanDerWaalsContact C-N 3.26Å; Y78-S80 PolarHBondContact O-N 2.81Å; S80-L82 PolarHBondContact O-N 2.93Å; S80-H149 PolarHBondContact O-ND1 2.95Å
81	D	81.1	Confident	81.3	Confident	81 Å²	81	52.5 Å²	52.5	43%	0.433	29%	0.292	S	S	.	.			trans	-71.2	117.7	179.7	-167.6	-19.3	0	0	0	110.9	Y78 L79 S83 L84	Y78-D81 WeakPolarHBondContact O-CB 3.45Å; Y78-D81 PolarHBondContact O-N 3.47Å; L79-D81 VanDerWaalsContact C-N 3.26Å; L79-D81 PolarHBondContact O-N 3.3Å; D81-S83 PolarHBondContact O-N 3.48Å; D81-S83 WeakPolarHBondContact OD1-CB 3.37Å; D81-S83 PolarHBondContact OD1-N 3.49Å; D81-S83 PolarHBondContact OD1-OG 2.86Å; D81-S83 PolarHBondContact OD2-OG 2.92Å; D81-L84 WeakPolarHBondContact O-CB 3.44Å; D81-L84 PolarHBondContact O-N 2.94Å
82	L	72.9	Confident	81.3	Confident	123 Å²	123	53.1 Å²	53.1	64%	0.644	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-11.2	179.1	-67.7	169.1	0	0	0	113	S80 H149 W153	S80-L82 PolarHBondContact O-N 2.93Å; L82-H149 HydrophobicContact CD2-CB 4.33Å; L82-W153 HydrophobicContact CD1-CH2 4.18Å; L82-W153 HydrophobicContact CD1-CZ2 4.08Å; L82-W153 HydrophobicContact CG-CZ2 4.37Å
83	S	73.6	Confident	81.3	Confident	95 Å²	95	51.5 Å²	51.5	66%	0.664	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-1	176.1	71.3	0	0	0	0	113.9	D81 S85	D81-S83 PolarHBondContact O-N 3.48Å; D81-S83 WeakPolarHBondContact OD1-CB 3.37Å; D81-S83 PolarHBondContact OD1-N 3.49Å; D81-S83 PolarHBondContact OD1-OG 2.86Å; D81-S83 PolarHBondContact OD2-OG 2.92Å; S83-S85 PolarHBondContact O-N 3Å
84	L	80.6	Confident	81.3	Confident	33 Å²	33	47 Å²	47	17%	0.173	27%	0.274	C	S	.	.			trans	-65.9	123.2	-180	-169	76.6	0	0	0	111.3	Y78 L79 D81 L86	Y78-L84 HydrophobicContact CD1-CD1 4.29Å; Y78-L84 HydrophobicContact CE1-CD1 3.47Å; Y78-L84 VanDerWaalsContact CE1-CD1 3.47Å; Y78-L84 HydrophobicContact CE1-CD2 4.43Å; Y78-L84 HydrophobicContact CE2-CD1 4.28Å; Y78-L84 VanDerWaalsContact CZ-CD1 3.47Å; Y78-L84 WeakPolarHBondContact OH-CD1 3.48Å; L79-L84 HydrophobicContact CD2-CD2 4.16Å; D81-L84 WeakPolarHBondContact O-CB 3.44Å; D81-L84 PolarHBondContact O-N 2.94Å; L84-L86 HydrophobicContact CD2-CD2 3.88Å; L84-L86 HydrophobicContact CD2-CG 4.47Å; L84-L86 PolarHBondContact O-N 3.17Å
85	S	73.1	Confident	81.3	Confident	95 Å²	95	46.7 Å²	46.7	66%	0.664	28%	0.281	S	S	*	.			trans	-78.7	98.8	176.1	60.6	0	0	0	0	111.2	S83 T88	S83-S85 PolarHBondContact O-N 3Å; S85-T88 PolarHBondContact O-OG1 3.35Å
86	L	82.4	Confident	81	Confident	62 Å²	62	52.9 Å²	52.9	33%	0.325	31%	0.31	S	S	.	.	S	Bend	trans	-83.9	143.7	171.6	-63.7	173.2	0	0	0	110.8	L84 V144 V147	L84-L86 HydrophobicContact CD2-CD2 3.88Å; L84-L86 HydrophobicContact CD2-CG 4.47Å; L84-L86 PolarHBondContact O-N 3.17Å; L86-V144 HydrophobicContact CD2-CB 4.31Å; L86-V144 HydrophobicContact CD2-CG1 3.98Å; L86-V147 HydrophobicContact CD1-CB 4.28Å; L86-V147 HydrophobicContact CD1-CG2 3.88Å; L86-V147 HydrophobicContact CD2-CG2 4.26Å
87	P	82.7	Confident	80.7	Confident	97 Å²	97	53.8 Å²	53.8	63%	0.63	31%	0.314	S	S	*	.	S	Bend	cis	-79	142.6	2.4	31.1	-34	0	0	0	113.4	V143 V144	P87-V143 HydrophobicContact CB-CG1 3.79Å; P87-V144 VanDerWaalsContact CA-O 3.23Å; P87-V144 WeakPolarHBondContact CA-O 3.14Å; P87-V144 WeakPolarHBondContact CB-O 3.27Å
88	T	83.3	Confident	80.6	Confident	14 Å²	14	55.2 Å²	55.2	9%	0.086	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.5	177.2	-45	0	0	0	0	110.6	S85 A92 I93 V144	S85-T88 PolarHBondContact O-OG1 3.35Å; T88-A92 HydrophobicContact CG2-CB 4.12Å; T88-I93 HydrophobicContact CG2-CD1 4.36Å; T88-I93 HydrophobicContact CG2-CG1 3.8Å; T88-V144 PolarHBondContact N-O 3Å; T88-V144 VanDerWaalsContact N-O 3.12Å; T88-V144 PolarHBondContact O-N 3.33Å
89	D	85.3	Confident	79.7	Confident	64 Å²	64	56.8 Å²	56.8	34%	0.342	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	152.5	178.5	73.6	56.9	0	0	0	113.1	L91 A92 I93 V143	D89-L91 PolarHBondContact O-N 3.49Å; D89-L91 VanDerWaalsContact O-N 3.15Å; D89-L91 WeakPolarHBondContact OD1-CA 3.41Å; D89-L91 WeakPolarHBondContact OD1-CB 3.35Å; D89-L91 PolarHBondContact OD1-N 3.33Å; D89-A92 PolarHBondContact O-N 2.94Å; D89-A92 WeakPolarHBondContact OD1-CB 3.46Å; D89-A92 PolarHBondContact OD1-N 3.49Å; D89-I93 WeakPolarHBondContact O-CG1 3.47Å; D89-I93 PolarHBondContact O-N 3.47Å; D89-V143 HydrophobicContact CB-CG2 4.24Å
90	S	83.1	Confident	78.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-58.5	-23.5	179.6	50.5	0	0	0	0	114.3	T94 H106 T141 T142	S90-T94 WeakPolarHBondContact O-CB 3.41Å; S90-T94 PolarHBondContact O-N 2.69Å; S90-T94 PolarHBondContact O-OG1 3.24Å; S90-H106 PolarHBondContact OG-NE2 2.93Å; S90-H106 VanDerWaalsContact OG-NE2 3.09Å; S90-T141 WeakPolarHBondContact OG-CA 3.4Å; S90-T142 VanDerWaalsContact CB-O 3.27Å; S90-T142 WeakPolarHBondContact CB-O 3.41Å; S90-T142 PolarHBondContact N-O 2.94Å; S90-T142 PolarHBondContact OG-N 3.29Å; S90-T142 PolarHBondContact OG-O 3.49Å; S90-T142 VanDerWaalsContact OG-O 3.06Å
91	L	81.4	Confident	76.7	Confident	69 Å²	69	69.8 Å²	69.8	36%	0.361	41%	0.409	S	S	.	.	H	α-helix	trans	-83.1	-38.6	-177.7	-151.3	136.2	0	0	0	110.7	D89 T94 N95 T141	D89-L91 PolarHBondContact O-N 3.49Å; D89-L91 VanDerWaalsContact O-N 3.15Å; D89-L91 WeakPolarHBondContact OD1-CA 3.41Å; D89-L91 WeakPolarHBondContact OD1-CB 3.35Å; D89-L91 PolarHBondContact OD1-N 3.33Å; L91-T94 PolarHBondContact O-N 2.93Å; L91-N95 VanDerWaalsContact O-CG 3.26Å; L91-N95 PolarHBondContact O-N 2.82Å; L91-N95 PolarHBondContact O-ND2 2.98Å; L91-T141 HydrophobicContact CB-CG2 4.14Å; L91-T141 HydrophobicContact CD1-CG2 3.97Å
92	A	81.1	Confident	75.7	Confident	34 Å²	34	67.7 Å²	67.7	28%	0.281	41%	0.406	S	S	.	.	H	α-helix	trans	-62.9	-43.8	169.2	0	0	0	0	0	111.2	T88 D89 T94 N95 Q96	T88-A92 HydrophobicContact CG2-CB 4.12Å; D89-A92 PolarHBondContact O-N 2.94Å; D89-A92 WeakPolarHBondContact OD1-CB 3.46Å; D89-A92 PolarHBondContact OD1-N 3.49Å; A92-T94 VanDerWaalsContact C-N 3.33Å; A92-T94 PolarHBondContact O-N 2.96Å; A92-N95 PolarHBondContact O-N 2.88Å; A92-Q96 WeakPolarHBondContact O-CB 3.47Å; A92-Q96 WeakPolarHBondContact O-CG 3.44Å; A92-Q96 PolarHBondContact O-N 3.42Å
93	I	83.2	Confident	75.3	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	42%	0.417	C	S	.	.	H	α-helix	trans	-60.8	-43.4	173.9	-63.6	168.1	0	0	0	110.6	L75 Y78 T88 D89 N95 Q96 L97 I109 L113 V144	L75-I93 HydrophobicContact CD1-CG2 3.59Å; Y78-I93 HydrophobicContact CD1-CG2 4.27Å; Y78-I93 HydrophobicContact CE1-CG1 4.04Å; Y78-I93 HydrophobicContact CE1-CG2 4.26Å; T88-I93 HydrophobicContact CG2-CD1 4.36Å; T88-I93 HydrophobicContact CG2-CG1 3.8Å; D89-I93 WeakPolarHBondContact O-CG1 3.47Å; D89-I93 PolarHBondContact O-N 3.47Å; I93-N95 PolarHBondContact O-N 3.24Å; I93-Q96 PolarHBondContact O-N 3.35Å; I93-L97 HydrophobicContact CG2-CD1 3.78Å; I93-L97 HydrophobicContact CG2-CG 4.41Å; I93-L97 WeakPolarHBondContact O-CB 3.35Å; I93-L97 WeakPolarHBondContact O-CG 3.48Å; I93-L97 PolarHBondContact O-N 2.99Å; I93-I109 HydrophobicContact CB-CG2 4.49Å; I93-I109 HydrophobicContact CG2-CG2 4.02Å; I93-L113 HydrophobicContact CD1-CD1 4.17Å; I93-L113 HydrophobicContact CD1-CD2 4.45Å; I93-V144 HydrophobicContact CD1-CG2 3.84Å
94	T	82.9	Confident	75.4	Confident	7 Å²	7	65 Å²	65	4%	0.043	39%	0.391	C	S	.	.	H	α-helix	trans	-62.3	-44	177.6	-58	0	0	0	0	111.4	S90 L91 A92 Q96 L97 N98 H106	S90-T94 WeakPolarHBondContact O-CB 3.41Å; S90-T94 PolarHBondContact O-N 2.69Å; S90-T94 PolarHBondContact O-OG1 3.24Å; L91-T94 PolarHBondContact O-N 2.93Å; A92-T94 VanDerWaalsContact C-N 3.33Å; A92-T94 PolarHBondContact O-N 2.96Å; T94-Q96 VanDerWaalsContact C-N 3.34Å; T94-Q96 PolarHBondContact O-N 3.1Å; T94-L97 PolarHBondContact O-N 3.06Å; T94-N98 WeakPolarHBondContact O-CB 3.32Å; T94-N98 PolarHBondContact O-N 3.38Å; T94-N98 PolarHBondContact O-ND2 3.36Å; T94-H106 HydrophobicContact CG2-CB 4.46Å
95	N	81.2	Confident	75.3	Confident	103 Å²	103	67.6 Å²	67.6	55%	0.551	41%	0.408	S	S	*	.	H	α-helix	trans	-65.8	-35.5	178.1	-70.8	-23.8	0	0	0	112.7	L91 A92 I93	L91-N95 VanDerWaalsContact O-CG 3.26Å; L91-N95 PolarHBondContact O-N 2.82Å; L91-N95 PolarHBondContact O-ND2 2.98Å; A92-N95 PolarHBondContact O-N 2.88Å; I93-N95 PolarHBondContact O-N 3.24Å
96	Q	79.1	Confident	75.6	Confident	129 Å²	129	64.6 Å²	64.6	60%	0.603	38%	0.384	S	S	*	.	H	α-helix	trans	-71.1	-36.6	176.7	-71.9	-104.6	-12.6	0	0	112.5	Y78 A92 I93 T94	Y78-Q96 HydrophobicContact CE2-CB 3.92Å; Y78-Q96 HydrophobicContact CE2-CG 4.35Å; Y78-Q96 WeakPolarHBondContact OH-CG 3.4Å; Y78-Q96 PolarHBondContact OH-OE1 3.45Å; A92-Q96 WeakPolarHBondContact O-CB 3.47Å; A92-Q96 WeakPolarHBondContact O-CG 3.44Å; A92-Q96 PolarHBondContact O-N 3.42Å; I93-Q96 PolarHBondContact O-N 3.35Å; T94-Q96 VanDerWaalsContact C-N 3.34Å; T94-Q96 PolarHBondContact O-N 3.1Å
97	L	77.4	Confident	75.3	Confident	22 Å²	22	63.7 Å²	63.7	12%	0.115	39%	0.39	C	S	.	.	H	α-helix	trans	-83.5	-14.4	-179.9	-70	176.4	0	0	0	113.7	L75 Y78 I93 T94 S99 I109	L75-L97 HydrophobicContact CB-CD1 4.18Å; L75-L97 HydrophobicContact CD1-CD1 3.62Å; L75-L97 HydrophobicContact CG-CD1 4.48Å; Y78-L97 HydrophobicContact CD2-CD2 4.38Å; Y78-L97 HydrophobicContact CG-CD2 4.22Å; I93-L97 HydrophobicContact CG2-CD1 3.78Å; I93-L97 HydrophobicContact CG2-CG 4.41Å; I93-L97 WeakPolarHBondContact O-CB 3.35Å; I93-L97 WeakPolarHBondContact O-CG 3.48Å; I93-L97 PolarHBondContact O-N 2.99Å; T94-L97 PolarHBondContact O-N 3.06Å; L97-S99 PolarHBondContact O-N 3.1Å; L97-I109 HydrophobicContact CD1-CD1 3.75Å
98	N	79.9	Confident	75.3	Confident	65 Å²	65	62 Å²	62	35%	0.348	38%	0.379	S	S	.	.			trans	-71.5	91.5	172.2	-85.8	-27.3	0	0	0	110.6	T94 V104	T94-N98 WeakPolarHBondContact O-CB 3.32Å; T94-N98 PolarHBondContact O-N 3.38Å; T94-N98 PolarHBondContact O-ND2 3.36Å; N98-V104 WeakPolarHBondContact OD1-CB 3.38Å; N98-V104 PolarHBondContact OD1-N 3.06Å; N98-V104 PolarHBondContact OD1-O 3.43Å
99	S	63.9	Low	75.2	Confident	77 Å²	77	61.3 Å²	61.3	54%	0.538	38%	0.375	S	S	.	.			trans	-95	165.7	171.5	-64.3	0	0	0	0	111.4	L97 E101 G102	L97-S99 PolarHBondContact O-N 3.1Å; S99-E101 PolarHBondContact O-N 3.42Å; S99-G102 PolarHBondContact O-N 3.41Å
100	A	51.3	Low	75.1	Confident	113 Å²	113	60.1 Å²	60.1	93%	0.934	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-7.2	-176.9	0	0	0	0	0	116
101	E	52	Low	75.1	Confident	183 Å²	183	63 Å²	63	86%	0.855	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.7	9.7	-176.7	-70.5	-174.5	159.4	0	0	114.8	S99	S99-E101 PolarHBondContact O-N 3.42Å
102	G	59.5	Low	75.3	Confident	36 Å²	36	59.9 Å²	59.9	37%	0.371	37%	0.371	S	S	.	.			trans	-178.7	128.2	170.6	0	0	0	0	0	114.5	S99 V104	S99-G102 PolarHBondContact O-N 3.41Å; G102-V104 PolarHBondContact O-N 3.01Å
103	T	64.1	Low	75.5	Confident	141 Å²	141	58.2 Å²	58.2	87%	0.865	36%	0.358	S	S	*	.			trans	-79.7	111.7	175.3	50.6	0	0	0	0	110.3
104	V	75.4	Confident	75.5	Confident	22 Å²	22	61.2 Å²	61.2	13%	0.133	37%	0.374	C	S	.	.			trans	-92.2	129	174.6	-176.9	0	0	0	0	109.1	L71 N98 G102 I109	L71-V104 HydrophobicContact CD1-CB 4.38Å; L71-V104 HydrophobicContact CD1-CG1 3.76Å; L71-V104 HydrophobicContact CD1-CG2 3.64Å; L71-V104 HydrophobicContact CD2-CG1 3.82Å; L71-V104 HydrophobicContact CG-CG1 4.45Å; N98-V104 WeakPolarHBondContact OD1-CB 3.38Å; N98-V104 PolarHBondContact OD1-N 3.06Å; N98-V104 PolarHBondContact OD1-O 3.43Å; G102-V104 PolarHBondContact O-N 3.01Å; V104-I109 HydrophobicContact CG1-CD1 3.82Å; V104-I109 HydrophobicContact CG1-CG1 3.64Å
105	T	80.1	Confident	75.6	Confident	86 Å²	86	64.3 Å²	64.3	53%	0.528	39%	0.387	S	S	.	.			trans	-82.2	143.2	175.6	60.4	0	0	0	0	110.7	G107 C108 I109	T105-G107 PolarHBondContact O-N 3.47Å; T105-C108 PolarHBondContact O-N 2.75Å; T105-C108 VanDerWaalsContact O-N 3.1Å; T105-C108 PolarHBondContact OG1-SG 3.13Å; T105-I109 PolarHBondContact O-N 3.22Å
106	H	79.1	Confident	76	Confident	32 Å²	32	59.4 Å²	59.4	15%	0.148	36%	0.36	C	S	.	.	H	α-helix	trans	-55.6	-36.8	177.9	174.9	-101.1	0	0	0	112.4	S90 T94 C108 I109 Q110	S90-H106 PolarHBondContact OG-NE2 2.93Å; S90-H106 VanDerWaalsContact OG-NE2 3.09Å; T94-H106 HydrophobicContact CG2-CB 4.46Å; H106-C108 PolarHBondContact O-N 3.31Å; H106-I109 PolarHBondContact O-N 3.13Å; H106-Q110 PolarHBondContact O-N 3.42Å
107	G	76.4	Confident	76.4	Confident	44 Å²	44	55.1 Å²	55.1	45%	0.454	34%	0.344	S	S	.	.	H	α-helix	trans	-62.9	-35.5	176.9	0	0	0	0	0	114.3	T105 Q110 S111	T105-G107 PolarHBondContact O-N 3.47Å; G107-Q110 PolarHBondContact O-N 3.49Å; G107-S111 PolarHBondContact O-N 3.33Å
108	C	80.9	Confident	76.7	Confident	60 Å²	60	58.1 Å²	58.1	41%	0.405	37%	0.373	S	S	.	.	H	α-helix	trans	-68.8	-42.4	176.8	-72.3	0	0	0	0	112	L71 T105 H106 Q110 S111 L112	L71-C108 HydrophobicContact CD2-CB 4Å; T105-C108 PolarHBondContact O-N 2.75Å; T105-C108 VanDerWaalsContact O-N 3.1Å; T105-C108 PolarHBondContact OG1-SG 3.13Å; H106-C108 PolarHBondContact O-N 3.31Å; C108-Q110 VanDerWaalsContact C-N 3.33Å; C108-S111 PolarHBondContact O-N 3.04Å; C108-L112 WeakPolarHBondContact O-CG 3.41Å; C108-L112 PolarHBondContact O-N 3.49Å
109	I	83.1	Confident	77	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-63.6	-41.9	174.8	-65.8	-60.4	0	0	0	110.4	L71 L75 I93 L97 V104 T105 H106 S111 L112 L113	L71-I109 HydrophobicContact CD1-CD1 4.07Å; L71-I109 HydrophobicContact CD2-CD1 4.5Å; L71-I109 HydrophobicContact CG-CD1 4.46Å; L75-I109 HydrophobicContact CD1-CD1 4.41Å; L75-I109 HydrophobicContact CD2-CD1 4.29Å; I93-I109 HydrophobicContact CB-CG2 4.49Å; I93-I109 HydrophobicContact CG2-CG2 4.02Å; L97-I109 HydrophobicContact CD1-CD1 3.75Å; V104-I109 HydrophobicContact CG1-CD1 3.82Å; V104-I109 HydrophobicContact CG1-CG1 3.64Å; T105-I109 PolarHBondContact O-N 3.22Å; H106-I109 PolarHBondContact O-N 3.13Å; I109-S111 PolarHBondContact O-N 3.02Å; I109-L112 PolarHBondContact O-N 3.32Å; I109-L113 HydrophobicContact CG2-CD1 3.79Å; I109-L113 HydrophobicContact CG2-CG 4.14Å; I109-L113 WeakPolarHBondContact O-CB 3.34Å; I109-L113 VanDerWaalsContact O-CG 3.27Å; I109-L113 WeakPolarHBondContact O-CG 3.5Å; I109-L113 PolarHBondContact O-N 3.47Å
110	Q	83.3	Confident	77.9	Confident	39 Å²	39	61.5 Å²	61.5	18%	0.182	38%	0.378	C	S	.	.	H	α-helix	trans	-60.5	-46.6	177.4	-170.7	166.5	17.8	0	0	111.9	H106 G107 C108 L112 L113 L114 P140 T142	H106-Q110 PolarHBondContact O-N 3.42Å; G107-Q110 PolarHBondContact O-N 3.49Å; C108-Q110 VanDerWaalsContact C-N 3.33Å; Q110-L112 VanDerWaalsContact C-N 3.34Å; Q110-L112 PolarHBondContact O-N 2.86Å; Q110-L113 PolarHBondContact O-N 2.87Å; Q110-L114 VanDerWaalsContact O-CG 3.28Å; Q110-L114 WeakPolarHBondContact O-CG 3.48Å; Q110-L114 PolarHBondContact O-N 3.44Å; Q110-P140 PolarHBondContact NE2-O 2.87Å; Q110-T142 PolarHBondContact NE2-OG1 3.37Å
111	S	82.6	Confident	79.5	Confident	62 Å²	62	56.5 Å²	56.5	43%	0.434	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-42.2	176.7	-175.7	0	0	0	0	112.3	G107 C108 I109 L114 K115	G107-S111 PolarHBondContact O-N 3.33Å; C108-S111 PolarHBondContact O-N 3.04Å; I109-S111 PolarHBondContact O-N 3.02Å; S111-L114 PolarHBondContact O-N 2.88Å; S111-K115 WeakPolarHBondContact O-CB 3.42Å; S111-K115 PolarHBondContact O-N 3.48Å
112	L	84.9	Confident	81.3	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-39.4	177.2	-73.3	173.5	0	0	0	113.3	P67 L71 E72 L75 C108 I109 Q110 L114 K115 F116	P67-L112 HydrophobicContact CB-CD2 3.93Å; P67-L112 HydrophobicContact CB-CG 4.48Å; P67-L112 HydrophobicContact CG-CD2 4.11Å; L71-L112 HydrophobicContact CD2-CD1 3.99Å; L71-L112 HydrophobicContact CG-CD1 3.88Å; E72-L112 HydrophobicContact CB-CD2 4.24Å; E72-L112 HydrophobicContact CG-CD2 4.12Å; L75-L112 HydrophobicContact CD2-CB 3.59Å; L75-L112 HydrophobicContact CD2-CD1 4.15Å; C108-L112 WeakPolarHBondContact O-CG 3.41Å; C108-L112 PolarHBondContact O-N 3.49Å; I109-L112 PolarHBondContact O-N 3.32Å; Q110-L112 VanDerWaalsContact C-N 3.34Å; Q110-L112 PolarHBondContact O-N 2.86Å; L112-L114 VanDerWaalsContact C-N 3.3Å; L112-L114 PolarHBondContact O-N 3.32Å; L112-K115 HydrophobicContact CD2-CD 4.25Å; L112-K115 WeakPolarHBondContact O-CB 3.47Å; L112-K115 PolarHBondContact O-N 3.37Å; L112-F116 VanDerWaalsContact O-CG 3.31Å; L112-F116 WeakPolarHBondContact O-CG 3.48Å; L112-F116 PolarHBondContact O-N 3.04Å
113	L	85.8	Confident	82.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-37.9	175	-70.3	173.7	0	0	0	111.4	L75 L79 I93 I109 Q110 F116 S117 I122 V144	L75-L113 HydrophobicContact CD1-CD2 4.39Å; L75-L113 HydrophobicContact CD2-CD2 4.21Å; L75-L113 HydrophobicContact CD2-CG 4.39Å; L79-L113 HydrophobicContact CD1-CD2 3.99Å; I93-L113 HydrophobicContact CD1-CD1 4.17Å; I93-L113 HydrophobicContact CD1-CD2 4.45Å; I109-L113 HydrophobicContact CG2-CD1 3.79Å; I109-L113 HydrophobicContact CG2-CG 4.14Å; I109-L113 WeakPolarHBondContact O-CB 3.34Å; I109-L113 VanDerWaalsContact O-CG 3.27Å; I109-L113 WeakPolarHBondContact O-CG 3.5Å; I109-L113 PolarHBondContact O-N 3.47Å; Q110-L113 PolarHBondContact O-N 2.87Å; L113-F116 PolarHBondContact O-N 3.36Å; L113-S117 WeakPolarHBondContact O-CB 3.41Å; L113-S117 PolarHBondContact O-N 3.33Å; L113-I122 HydrophobicContact CB-CD1 4.24Å; L113-I122 HydrophobicContact CD2-CD1 3.54Å; L113-V144 HydrophobicContact CD1-CG2 4.22Å; L113-V144 HydrophobicContact CD2-CG2 3.81Å
114	L	83.1	Confident	83.7	Confident	63 Å²	63	46.9 Å²	46.9	33%	0.33	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-39.6	173.3	-64.3	177.7	0	0	0	111.9	Q110 S111 L112 S117 A118 V124	Q110-L114 VanDerWaalsContact O-CG 3.28Å; Q110-L114 WeakPolarHBondContact O-CG 3.48Å; Q110-L114 PolarHBondContact O-N 3.44Å; S111-L114 PolarHBondContact O-N 2.88Å; L112-L114 VanDerWaalsContact C-N 3.3Å; L112-L114 PolarHBondContact O-N 3.32Å; L114-S117 PolarHBondContact O-N 2.7Å; L114-A118 WeakPolarHBondContact O-CB 3.17Å; L114-A118 PolarHBondContact O-N 2.87Å; L114-V124 HydrophobicContact CD2-CG2 4.34Å
115	K	85.9	Confident	84.1	Confident	72 Å²	72	54.9 Å²	54.9	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-59.8	-45.5	173.4	-174.2	-170.3	-178.4	-165.4	0	111.5	E72 S111 L112 A118 Q119	E72-K115 IonicContact OE1-NZ 3.03Å; E72-K115 PolarHBondContact OE1-NZ 3.19Å; E72-K115 IonicContact OE2-NZ 3.22Å; E72-K115 PolarHBondContact OE2-NZ 3.1Å; S111-K115 WeakPolarHBondContact O-CB 3.42Å; S111-K115 PolarHBondContact O-N 3.48Å; L112-K115 HydrophobicContact CD2-CD 4.25Å; L112-K115 WeakPolarHBondContact O-CB 3.47Å; L112-K115 PolarHBondContact O-N 3.37Å; K115-A118 PolarHBondContact O-N 3.31Å; K115-Q119 VanDerWaalsContact O-CG 3.31Å; K115-Q119 WeakPolarHBondContact O-CG 3.43Å; K115-Q119 PolarHBondContact O-N 3.15Å
116	F	88.6	Confident	84	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-70	-34.7	178.9	-65.3	-18.3	0	0	0	112.7	E72 L75 L76 L79 L112 L113 Q119 E120 L121 I122	E72-F116 HydrophobicContact CG-CE1 3.9Å; E72-F116 HydrophobicContact CG-CZ 3.68Å; L75-F116 HydrophobicContact CB-CE2 4.31Å; L75-F116 HydrophobicContact CD2-CD2 4.2Å; L75-F116 HydrophobicContact CD2-CE2 3.67Å; L75-F116 HydrophobicContact CG-CE2 3.84Å; L76-F116 HydrophobicContact CD1-CE1 4.4Å; L76-F116 HydrophobicContact CD1-CZ 4.08Å; L76-F116 HydrophobicContact CD2-CD1 4.36Å; L76-F116 HydrophobicContact CD2-CD2 4.19Å; L76-F116 HydrophobicContact CD2-CE1 3.89Å; L76-F116 HydrophobicContact CD2-CE2 3.67Å; L76-F116 HydrophobicContact CD2-CZ 3.53Å; L76-F116 HydrophobicContact CG-CE1 4.13Å; L76-F116 HydrophobicContact CG-CE2 3.84Å; L76-F116 HydrophobicContact CG-CZ 3.46Å; L76-F116 VanDerWaalsContact CG-CZ 3.46Å; L79-F116 HydrophobicContact CD1-CD2 3.97Å; L79-F116 HydrophobicContact CD1-CE2 4.31Å; L112-F116 VanDerWaalsContact O-CG 3.31Å; L112-F116 WeakPolarHBondContact O-CG 3.48Å; L112-F116 PolarHBondContact O-N 3.04Å; L113-F116 PolarHBondContact O-N 3.36Å; F116-Q119 CarbonylContact O-C 3.52Å; F116-Q119 PolarHBondContact O-N 2.66Å; F116-E120 PolarHBondContact O-N 3.04Å; F116-L121 HydrophobicContact CB-CB 4.26Å; F116-L121 HydrophobicContact CB-CD1 4.33Å; F116-L121 HydrophobicContact CD1-CD1 3.98Å; F116-L121 HydrophobicContact CG-CD1 4.29Å; F116-L121 WeakPolarHBondContact O-CB 3.48Å; F116-L121 PolarHBondContact O-N 3.05Å; F116-I122 HydrophobicContact CB-CD1 3.85Å; F116-I122 HydrophobicContact CB-CG1 3.8Å
117	S	86.5	Confident	83.2	Confident	38 Å²	38	58.3 Å²	58.3	27%	0.266	32%	0.317	S	S	.	.	H	α-helix	trans	-65.7	-42.2	171.8	-177.4	0	0	0	0	112.1	L113 L114 Q119 E120 I122 V124	L113-S117 WeakPolarHBondContact O-CB 3.41Å; L113-S117 PolarHBondContact O-N 3.33Å; L114-S117 PolarHBondContact O-N 2.7Å; S117-Q119 PolarHBondContact O-N 3.44Å; S117-E120 WeakPolarHBondContact O-CA 3.41Å; S117-E120 PolarHBondContact O-N 3.3Å; S117-I122 VanDerWaalsContact CA-O 3.31Å; S117-I122 WeakPolarHBondContact CA-O 3.4Å; S117-I122 PolarHBondContact OG-O 2.94Å; S117-V124 WeakPolarHBondContact OG-CG2 3.39Å
118	A	84.7	Confident	81.8	Confident	86 Å²	86	62.7 Å²	62.7	71%	0.711	34%	0.335	S	S	*	.	H	α-helix	trans	-64.5	-24.6	174.4	0	0	0	0	0	113.2	L114 K115 E120	L114-A118 WeakPolarHBondContact O-CB 3.17Å; L114-A118 PolarHBondContact O-N 2.87Å; K115-A118 PolarHBondContact O-N 3.31Å; A118-E120 VanDerWaalsContact C-N 3.29Å
119	Q	85.4	Confident	80	Confident	79 Å²	79	65.4 Å²	65.4	37%	0.369	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	6	172.4	-69.2	175.6	-0.4	0	0	113.1	K115 F116 S117 L121	K115-Q119 VanDerWaalsContact O-CG 3.31Å; K115-Q119 WeakPolarHBondContact O-CG 3.43Å; K115-Q119 PolarHBondContact O-N 3.15Å; F116-Q119 CarbonylContact O-C 3.52Å; F116-Q119 PolarHBondContact O-N 2.66Å; S117-Q119 PolarHBondContact O-N 3.44Å; Q119-L121 HydrophobicContact CB-CD1 4.15Å; Q119-L121 HydrophobicContact CB-CG 3.9Å; Q119-L121 PolarHBondContact O-N 3.4Å
120	E	83.1	Confident	77.8	Confident	134 Å²	134	73 Å²	73	63%	0.626	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	28.9	-177.2	-52.7	179.8	171.2	0	0	114.1	F116 S117 A118 K151	F116-E120 PolarHBondContact O-N 3.04Å; S117-E120 WeakPolarHBondContact O-CA 3.41Å; S117-E120 PolarHBondContact O-N 3.3Å; A118-E120 VanDerWaalsContact C-N 3.29Å; E120-K151 WeakPolarHBondContact O-CD 3.47Å; E120-K151 PolarHBondContact O-NZ 3.44Å; E120-K151 IonicContact OE2-NZ 3.51Å; E120-K151 PolarHBondContact OE2-NZ 2.88Å
121	L	85.8	Confident	75.5	Confident	7 Å²	7	76.7 Å²	76.7	4%	0.037	42%	0.424	C	S	.	.	S	Bend	trans	-84.9	-30.4	175.9	-57.6	178.7	0	0	0	111.8	L76 F116 Q119 D148 K151 M155	L76-L121 HydrophobicContact CD2-CD1 4.32Å; F116-L121 HydrophobicContact CB-CB 4.26Å; F116-L121 HydrophobicContact CB-CD1 4.33Å; F116-L121 HydrophobicContact CD1-CD1 3.98Å; F116-L121 HydrophobicContact CG-CD1 4.29Å; F116-L121 WeakPolarHBondContact O-CB 3.48Å; F116-L121 PolarHBondContact O-N 3.05Å; Q119-L121 HydrophobicContact CB-CD1 4.15Å; Q119-L121 HydrophobicContact CB-CG 3.9Å; Q119-L121 PolarHBondContact O-N 3.4Å; L121-D148 PolarHBondContact O-N 3.03Å; L121-K151 HydrophobicContact CD2-CB 3.57Å; L121-M155 HydrophobicContact CD1-CE 4.46Å; L121-M155 HydrophobicContact CD1-CG 4Å; L121-M155 HydrophobicContact CD2-CG 3.92Å
122	I	88.5	Confident	73.3	Confident	8 Å²	8	79.1 Å²	79.1	4%	0.041	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.8	-179.7	63.7	174.2	0	0	0	110.8	L79 L113 F116 S117 V124 V144 A146 V147 L152	L79-I122 HydrophobicContact CD1-CD1 4.35Å; L79-I122 HydrophobicContact CD1-CG2 4.2Å; L113-I122 HydrophobicContact CB-CD1 4.24Å; L113-I122 HydrophobicContact CD2-CD1 3.54Å; F116-I122 HydrophobicContact CB-CD1 3.85Å; F116-I122 HydrophobicContact CB-CG1 3.8Å; S117-I122 VanDerWaalsContact CA-O 3.31Å; S117-I122 WeakPolarHBondContact CA-O 3.4Å; S117-I122 PolarHBondContact OG-O 2.94Å; I122-V124 HydrophobicContact CD1-CG1 3.71Å; I122-V124 HydrophobicContact CG1-CG1 3.97Å; I122-V144 HydrophobicContact CB-CG1 4.31Å; I122-V144 HydrophobicContact CD1-CG1 4.49Å; I122-V144 HydrophobicContact CD1-CG2 4.32Å; I122-A146 CarbonylContact C-O 3.59Å; I122-A146 WeakPolarHBondContact CA-O 3.35Å; I122-V147 HydrophobicContact CG2-CB 4.32Å; I122-V147 HydrophobicContact CG2-CG1 4.11Å; I122-V147 HydrophobicContact CG2-CG2 3.9Å; I122-L152 HydrophobicContact CG2-CD1 4.12Å
123	E	86.3	Confident	71.1	Confident	124 Å²	124	84.4 Å²	84.4	58%	0.579	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.6	170.3	-165	178.5	177.4	0	0	109.4	V145 A146	E123-V145 PolarHBondContact O-N 3.26Å; E123-A146 HydrophobicContact CB-CB 3.95Å; E123-A146 PolarHBondContact N-O 3Å; E123-A146 PolarHBondContact O-N 3.44Å
124	V	88.3	Confident	68.7	Low	27 Å²	27	89.5 Å²	89.5	16%	0.164	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.6	-178.7	-58.3	0	0	0	0	111.5	L114 S117 I122 T142 V143 V144	L114-V124 HydrophobicContact CD2-CG2 4.34Å; S117-V124 WeakPolarHBondContact OG-CG2 3.39Å; I122-V124 HydrophobicContact CD1-CG1 3.71Å; I122-V124 HydrophobicContact CG1-CG1 3.97Å; V124-T142 HydrophobicContact CB-CG2 3.57Å; V124-T142 HydrophobicContact CG1-CG2 3.97Å; V124-T142 HydrophobicContact CG2-CG2 4.02Å; V124-V143 CarbonylContact C-O 3.52Å; V124-V143 VanDerWaalsContact CA-O 3.28Å; V124-V143 WeakPolarHBondContact CA-O 3.26Å; V124-V144 HydrophobicContact CG1-CG2 4.3Å
125	R	84.5	Confident	66.8	Low	190 Å²	190	93.6 Å²	93.6	72%	0.717	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103	115.8	171.2	-168.8	176.7	-178.5	113.7	-1.1	108.8	V143 V145	R125-V143 PolarHBondContact N-O 3.3Å; R125-V143 PolarHBondContact O-N 3.3Å; R125-V145 HydrophobicContact CB-CG2 3.75Å
126	Q	78.1	Confident	64.6	Low	113 Å²	113	95.3 Å²	95.3	53%	0.528	56%	0.559	S	S	.	*			trans	-87.7	140.7	169.3	-66.4	-174.9	9	0	0	109.9	T128	Q126-T128 PolarHBondContact O-N 3.43Å
127	P	61.8	Low	62.5	Low	77 Å²	77	101.7 Å²	101.7	50%	0.5	60%	0.603	S	S	.	*			trans	-66.6	121	171.1	24.2	-29.2	0	0	0	109.9	S129 T141	P127-S129 PolarHBondContact O-N 2.92Å; P127-T141 VanDerWaalsContact CD-O 3.3Å; P127-T141 WeakPolarHBondContact CD-O 3.32Å
128	T	46.1	Very low	60.7	Low	135 Å²	135	104.2 Å²	104.2	83%	0.828	62%	0.621	S	S	*	*			trans	-67.6	114	175.2	46.8	0	0	0	0	110	Q126 I130	Q126-T128 PolarHBondContact O-N 3.43Å; T128-I130 PolarHBondContact O-N 3.38Å
129	S	44.5	Very low	59.4	Low	118 Å²	118	103.3 Å²	103.3	83%	0.825	61%	0.607	S	S	*	*			trans	-77.7	77.7	177.1	59.7	0	0	0	0	111.9	P127	P127-S129 PolarHBondContact O-N 2.92Å
130	I	36.2	Very low	58.4	Low	158 Å²	158	103.6 Å²	103.6	81%	0.81	62%	0.616	S	S	*	*			trans	-147	92	157	-53.7	-180	0	0	0	110	T128	T128-I130 PolarHBondContact O-N 3.38Å
131	S	33.9	Very low	58	Low	117 Å²	117	99.5 Å²	99.5	82%	0.818	60%	0.6	S	S	*	*				174.8	128.4	121.6	45.3	0	0	0	0	110
132	S	36.9	Very low	57.8	Low	114 Å²	114	99.1 Å²	99.1	80%	0.797	60%	0.599	S	S	*	*			trans	-62.8	123.5	-177.9	47.6	0	0	0	0	113.1
133	S	38.7	Very low	57.6	Low	113 Å²	113	100.8 Å²	100.8	79%	0.79	61%	0.609	S	S	*	*			trans	156.4	94.9	130.5	51.2	0	0	0	0	111.2
134	S	35.2	Very low	57.6	Low	107 Å²	107	94.9 Å²	94.9	75%	0.748	58%	0.581	S	S	*	*			trans	-178.8	121.7	144.7	32.9	0	0	0	0	109.4	T136	S134-T136 PolarHBondContact O-N 3.09Å
135	T	43.4	Very low	57.5	Low	149 Å²	149	96.7 Å²	96.7	91%	0.914	59%	0.592	S	S	*	*			trans	-66.9	88.9	169.3	40.7	0	0	0	0	110
136	T	39	Very low	57.4	Low	108 Å²	108	89.4 Å²	89.4	66%	0.663	57%	0.573	S	S	*	*			trans	-144	117.9	159.6	47.6	0	0	0	0	109	S134 S138	S134-T136 PolarHBondContact O-N 3.09Å; T136-S138 PolarHBondContact O-N 3.43Å
137	S	44.8	Very low	57.8	Low	133 Å²	133	85 Å²	85	93%	0.93	55%	0.554	S	S	*	*			trans	-78.5	69.9	-172	55.2	0	0	0	0	113.1
138	S	49.9	Very low	58.9	Low	91 Å²	91	84 Å²	84	64%	0.636	54%	0.544	S	S	*	.			trans	-112.3	129.4	172.8	39.2	0	0	0	0	110.9	T136	T136-S138 PolarHBondContact O-N 3.43Å
139	P	57.8	Low	60.6	Low	67 Å²	67	79.7 Å²	79.7	44%	0.435	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-64.6	152	-178.9	26.2	-33	0	0	0	111.7	T141	P139-T141 PolarHBondContact O-N 3.48Å
140	P	62.9	Low	62.4	Low	85 Å²	85	79.3 Å²	79.3	55%	0.552	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-63.9	116.6	-178.5	26	-33.6	0	0	0	110.9	Q110	Q110-P140 PolarHBondContact NE2-O 2.87Å
141	T	75.9	Confident	64.6	Low	48 Å²	48	75.5 Å²	75.5	29%	0.294	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-91.8	120.4	-178.7	52.9	0	0	0	0	111.5	S90 L91 P127 P139	S90-T141 WeakPolarHBondContact OG-CA 3.4Å; L91-T141 HydrophobicContact CB-CG2 4.14Å; L91-T141 HydrophobicContact CD1-CG2 3.97Å; P127-T141 VanDerWaalsContact CD-O 3.3Å; P127-T141 WeakPolarHBondContact CD-O 3.32Å; P139-T141 PolarHBondContact O-N 3.48Å
142	T	81.4	Confident	66.9	Low	0 Å²	0	69.9 Å²	69.9	0%	0	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-73.8	137.6	167.2	-57.3	0	0	0	0	109.7	S90 Q110 V124	S90-T142 VanDerWaalsContact CB-O 3.27Å; S90-T142 WeakPolarHBondContact CB-O 3.41Å; S90-T142 PolarHBondContact N-O 2.94Å; S90-T142 PolarHBondContact OG-N 3.29Å; S90-T142 PolarHBondContact OG-O 3.49Å; S90-T142 VanDerWaalsContact OG-O 3.06Å; Q110-T142 PolarHBondContact NE2-OG1 3.37Å; V124-T142 HydrophobicContact CB-CG2 3.57Å; V124-T142 HydrophobicContact CG1-CG2 3.97Å; V124-T142 HydrophobicContact CG2-CG2 4.02Å
143	V	84.4	Confident	68.7	Low	43 Å²	43	71 Å²	71	26%	0.261	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.9	176.8	-178.6	0	0	0	0	109.6	P87 D89 V124 R125	P87-V143 HydrophobicContact CB-CG1 3.79Å; D89-V143 HydrophobicContact CB-CG2 4.24Å; V124-V143 CarbonylContact C-O 3.52Å; V124-V143 VanDerWaalsContact CA-O 3.28Å; V124-V143 WeakPolarHBondContact CA-O 3.26Å; R125-V143 PolarHBondContact N-O 3.3Å; R125-V143 PolarHBondContact O-N 3.3Å
144	V	85.4	Confident	70.6	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122	173.4	-174.5	0	0	0	0	108.3	L86 P87 T88 I93 L113 I122 V124 V147	L86-V144 HydrophobicContact CD2-CB 4.31Å; L86-V144 HydrophobicContact CD2-CG1 3.98Å; P87-V144 VanDerWaalsContact CA-O 3.23Å; P87-V144 WeakPolarHBondContact CA-O 3.14Å; P87-V144 WeakPolarHBondContact CB-O 3.27Å; T88-V144 PolarHBondContact N-O 3Å; T88-V144 VanDerWaalsContact N-O 3.12Å; T88-V144 PolarHBondContact O-N 3.33Å; I93-V144 HydrophobicContact CD1-CG2 3.84Å; L113-V144 HydrophobicContact CD1-CG2 4.22Å; L113-V144 HydrophobicContact CD2-CG2 3.81Å; I122-V144 HydrophobicContact CB-CG1 4.31Å; I122-V144 HydrophobicContact CD1-CG1 4.49Å; I122-V144 HydrophobicContact CD1-CG2 4.32Å; V124-V144 HydrophobicContact CG1-CG2 4.3Å; V144-V147 HydrophobicContact CG1-CG2 3.88Å
145	V	85.7	Confident	72.5	Confident	65 Å²	65	66.4 Å²	66.4	39%	0.394	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-38.4	-174.1	-176.9	0	0	0	0	111.4	E123 R125	E123-V145 PolarHBondContact O-N 3.26Å; R125-V145 HydrophobicContact CB-CG2 3.75Å
146	A	83.5	Confident	74	Confident	37 Å²	37	61.7 Å²	61.7	31%	0.306	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	153.4	179.2	0	0	0	0	0	110.9	I122 E123	I122-A146 CarbonylContact C-O 3.59Å; I122-A146 WeakPolarHBondContact CA-O 3.35Å; E123-A146 HydrophobicContact CB-CB 3.95Å; E123-A146 PolarHBondContact N-O 3Å; E123-A146 PolarHBondContact O-N 3.44Å
147	V	86.9	Confident	74.9	Confident	20 Å²	20	59 Å²	59	12%	0.121	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	128.2	177.9	177.1	0	0	0	0	109.3	L79 L86 I122 V144 H149 L152	L79-V147 HydrophobicContact CD2-CG2 4.43Å; L86-V147 HydrophobicContact CD1-CB 4.28Å; L86-V147 HydrophobicContact CD1-CG2 3.88Å; L86-V147 HydrophobicContact CD2-CG2 4.26Å; I122-V147 HydrophobicContact CG2-CB 4.32Å; I122-V147 HydrophobicContact CG2-CG1 4.11Å; I122-V147 HydrophobicContact CG2-CG2 3.9Å; V144-V147 HydrophobicContact CG1-CG2 3.88Å; V147-H149 PolarHBondContact O-CD2 3.45Å; V147-H149 PolarHBondContact O-N 2.93Å; V147-L152 HydrophobicContact CG1-CD1 3.51Å
148	D	83.9	Confident	75.4	Confident	56 Å²	56	57 Å²	57	30%	0.299	35%	0.346	S	S	.	.			trans	-89.1	89.3	173	-174	-26.5	0	0	0	109.7	L121 T150 K151 L152	L121-D148 PolarHBondContact O-N 3.03Å; D148-T150 PolarHBondContact O-N 3.34Å; D148-T150 WeakPolarHBondContact OD1-CB 3.47Å; D148-T150 PolarHBondContact OD1-N 3.37Å; D148-T150 VanDerWaalsContact OD1-N 3.11Å; D148-K151 HydrophobicContact CB-CB 4.37Å; D148-K151 HydrophobicContact CB-CD 4.31Å; D148-K151 HydrophobicContact CB-CG 4.44Å; D148-K151 PolarHBondContact O-N 3.21Å; D148-K151 PolarHBondContact OD1-N 2.91Å; D148-K151 VanDerWaalsContact OD1-N 3.11Å; D148-K151 WeakPolarHBondContact OD2-CD 3.34Å; D148-K151 WeakPolarHBondContact OD2-CE 3.4Å; D148-K151 WeakPolarHBondContact OD2-CG 3.27Å; D148-K151 IonicContact OD2-NZ 3.35Å; D148-L152 WeakPolarHBondContact O-CB 3.28Å; D148-L152 PolarHBondContact O-N 2.88Å
149	H	82.8	Confident	75.2	Confident	44 Å²	44	56.5 Å²	56.5	20%	0.204	34%	0.339	C	S	.	.	H	α-helix	trans	-60.2	-26.2	-177.6	-66.2	-84.4	0	0	0	113.4	L79 S80 L82 V147 W153	L79-H149 PolarHBondContact O-CE1 2.97Å; S80-H149 PolarHBondContact O-ND1 2.95Å; L82-H149 HydrophobicContact CD2-CB 4.33Å; V147-H149 PolarHBondContact O-CD2 3.45Å; V147-H149 PolarHBondContact O-N 2.93Å; H149-W153 WeakPolarHBondContact O-CB 3.39Å; H149-W153 VanDerWaalsContact O-CG 3.26Å; H149-W153 PolarHBondContact O-N 3.28Å
150	T	81.6	Confident	74.4	Confident	110 Å²	110	57.4 Å²	57.4	68%	0.675	35%	0.348	S	S	*	.	H	α-helix	trans	-70	-47.7	179.3	-49.9	0	0	0	0	110.7	D148 A154	D148-T150 PolarHBondContact O-N 3.34Å; D148-T150 WeakPolarHBondContact OD1-CB 3.47Å; D148-T150 PolarHBondContact OD1-N 3.37Å; D148-T150 VanDerWaalsContact OD1-N 3.11Å; T150-A154 PolarHBondContact O-N 3.03Å
151	K	82.3	Confident	73	Confident	78 Å²	78	56.2 Å²	56.2	34%	0.339	35%	0.351	S	S	.	.	H	α-helix	trans	-68.8	-36.2	176.3	-65.2	-180	-172.1	176.8	0	111.7	E120 L121 D148 A154 M155	E120-K151 WeakPolarHBondContact O-CD 3.47Å; E120-K151 PolarHBondContact O-NZ 3.44Å; E120-K151 IonicContact OE2-NZ 3.51Å; E120-K151 PolarHBondContact OE2-NZ 2.88Å; L121-K151 HydrophobicContact CD2-CB 3.57Å; D148-K151 HydrophobicContact CB-CB 4.37Å; D148-K151 HydrophobicContact CB-CD 4.31Å; D148-K151 HydrophobicContact CB-CG 4.44Å; D148-K151 PolarHBondContact O-N 3.21Å; D148-K151 PolarHBondContact OD1-N 2.91Å; D148-K151 VanDerWaalsContact OD1-N 3.11Å; D148-K151 WeakPolarHBondContact OD2-CD 3.34Å; D148-K151 WeakPolarHBondContact OD2-CE 3.4Å; D148-K151 WeakPolarHBondContact OD2-CG 3.27Å; D148-K151 IonicContact OD2-NZ 3.35Å; K151-A154 WeakPolarHBondContact O-CB 3.39Å; K151-A154 PolarHBondContact O-N 3.31Å; K151-M155 PolarHBondContact O-N 3.44Å; K151-M155 VanDerWaalsContact O-N 3.13Å
152	L	81.8	Confident	70.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-68.5	-40.8	-178.1	-141.8	150.7	0	0	0	111.8	L76 L79 I122 V147 D148 A154 M155 I156	L76-L152 HydrophobicContact CB-CD2 4.06Å; L76-L152 HydrophobicContact CD2-CD2 3.65Å; L76-L152 HydrophobicContact CD2-CG 3.89Å; L76-L152 HydrophobicContact CG-CD2 4.48Å; L76-L152 WeakPolarHBondContact O-CD2 3.33Å; L79-L152 HydrophobicContact CB-CD1 3.88Å; I122-L152 HydrophobicContact CG2-CD1 4.12Å; V147-L152 HydrophobicContact CG1-CD1 3.51Å; D148-L152 WeakPolarHBondContact O-CB 3.28Å; D148-L152 PolarHBondContact O-N 2.88Å; L152-A154 PolarHBondContact O-N 3.28Å; L152-M155 PolarHBondContact O-N 3.05Å; L152-I156 HydrophobicContact CD2-CD1 3.9Å; L152-I156 HydrophobicContact CD2-CG1 4.48Å; L152-I156 WeakPolarHBondContact O-CG1 3.31Å; L152-I156 PolarHBondContact O-N 2.98Å; L152-I156 VanDerWaalsContact O-N 3.1Å
153	W	76.2	Confident	68.5	Low	138 Å²	138	67.1 Å²	67.1	52%	0.523	41%	0.414	S	S	.	.	H	α-helix	trans	-64.4	-36.4	171.7	-72	-15.6	0	0	0	113.2	L82 H149 M155 I156 G157	L82-W153 HydrophobicContact CD1-CH2 4.18Å; L82-W153 HydrophobicContact CD1-CZ2 4.08Å; L82-W153 HydrophobicContact CG-CZ2 4.37Å; H149-W153 WeakPolarHBondContact O-CB 3.39Å; H149-W153 VanDerWaalsContact O-CG 3.26Å; H149-W153 PolarHBondContact O-N 3.28Å; W153-M155 VanDerWaalsContact C-N 3.29Å; W153-M155 PolarHBondContact O-N 3.36Å; W153-I156 PolarHBondContact O-N 3.29Å; W153-G157 PolarHBondContact O-N 3.39Å
154	A	77.6	Confident	65.9	Low	63 Å²	63	77 Å²	77	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-63.7	-34.6	174.9	0	0	0	0	0	112.6	T150 K151 L152 S158	T150-A154 PolarHBondContact O-N 3.03Å; K151-A154 WeakPolarHBondContact O-CB 3.39Å; K151-A154 PolarHBondContact O-N 3.31Å; L152-A154 PolarHBondContact O-N 3.28Å; A154-S158 PolarHBondContact O-N 3.18Å; A154-S158 PolarHBondContact O-OG 3.34Å
155	M	75.2	Confident	63.1	Low	60 Å²	60	81.9 Å²	81.9	30%	0.296	49%	0.486	S	S	.	.	H	α-helix	trans	-70.7	-42.5	175	-73.4	-68	-74.4	0	0	112.3	L121 K151 L152 W153 G157 S158 V159	L121-M155 HydrophobicContact CD1-CE 4.46Å; L121-M155 HydrophobicContact CD1-CG 4Å; L121-M155 HydrophobicContact CD2-CG 3.92Å; K151-M155 PolarHBondContact O-N 3.44Å; K151-M155 VanDerWaalsContact O-N 3.13Å; L152-M155 PolarHBondContact O-N 3.05Å; W153-M155 VanDerWaalsContact C-N 3.29Å; W153-M155 PolarHBondContact O-N 3.36Å; M155-G157 VanDerWaalsContact C-N 3.28Å; M155-G157 PolarHBondContact O-N 3Å; M155-S158 PolarHBondContact O-N 2.68Å; M155-S158 VanDerWaalsContact O-N 3.13Å; M155-V159 WeakPolarHBondContact O-CG2 3.49Å; M155-V159 PolarHBondContact O-N 2.8Å
156	I	75.1	Confident	60.3	Low	49 Å²	49	82.1 Å²	82.1	25%	0.251	50%	0.503	S	S	.	.	H	α-helix	trans	-61.9	-37.4	176.3	-67.1	167	0	0	0	111.4	L76 L152 W153 S158 V159 S160	L76-I156 HydrophobicContact CB-CD1 4.33Å; L76-I156 HydrophobicContact CB-CG1 4.06Å; L152-I156 HydrophobicContact CD2-CD1 3.9Å; L152-I156 HydrophobicContact CD2-CG1 4.48Å; L152-I156 WeakPolarHBondContact O-CG1 3.31Å; L152-I156 PolarHBondContact O-N 2.98Å; L152-I156 VanDerWaalsContact O-N 3.1Å; W153-I156 PolarHBondContact O-N 3.29Å; I156-S158 VanDerWaalsContact C-N 3.33Å; I156-S158 PolarHBondContact O-N 3.48Å; I156-V159 PolarHBondContact O-N 3Å; I156-S160 PolarHBondContact O-N 3.18Å; I156-S160 PolarHBondContact O-OG 3.22Å; I156-S160 VanDerWaalsContact O-OG 3.1Å
157	G	57.7	Low	57.6	Low	51 Å²	51	86.8 Å²	86.8	53%	0.526	53%	0.527	S	S	.	.	H	α-helix	trans	-64.9	-31.9	175	0	0	0	0	0	113.9	W153 M155	W153-G157 PolarHBondContact O-N 3.39Å; M155-G157 VanDerWaalsContact C-N 3.28Å; M155-G157 PolarHBondContact O-N 3Å
158	S	54.7	Low	54.7	Low	92 Å²	92	93.8 Å²	93.8	64%	0.643	56%	0.556	S	S	*	*	H	α-helix	trans	-77.5	-32	178.5	-64.9	0	0	0	0	113.2	A154 M155 I156 S160	A154-S158 PolarHBondContact O-N 3.18Å; A154-S158 PolarHBondContact O-OG 3.34Å; M155-S158 PolarHBondContact O-N 2.68Å; M155-S158 VanDerWaalsContact O-N 3.13Å; I156-S158 VanDerWaalsContact C-N 3.33Å; I156-S158 PolarHBondContact O-N 3.48Å; S158-S160 VanDerWaalsContact C-N 3.34Å
159	V	47.4	Very low	52	Low	80 Å²	80	102.8 Å²	102.8	49%	0.485	59%	0.586	S	S	.	*	H	α-helix	trans	-74.8	-25.4	179.1	179.8	0	0	0	0	112	M155 I156 G161	M155-V159 WeakPolarHBondContact O-CG2 3.49Å; M155-V159 PolarHBondContact O-N 2.8Å; I156-V159 PolarHBondContact O-N 3Å; V159-G161 VanDerWaalsContact C-N 3.32Å; V159-G161 PolarHBondContact O-N 3.21Å
160	S	39.4	Very low	49.2	Very low	87 Å²	87	110.5 Å²	110.5	61%	0.608	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-3	179.3	-54.5	0	0	0	0	114.1	I156 S158	I156-S160 PolarHBondContact O-N 3.18Å; I156-S160 PolarHBondContact O-OG 3.22Å; I156-S160 VanDerWaalsContact O-OG 3.1Å; S158-S160 VanDerWaalsContact C-N 3.34Å
161	G	35.1	Very low	46.6	Very low	60 Å²	60	109.5 Å²	109.5	62%	0.619	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	2	-172.8	0	0	0	0	0	116.9	V159 Q163	V159-G161 VanDerWaalsContact C-N 3.32Å; V159-G161 PolarHBondContact O-N 3.21Å; G161-Q163 PolarHBondContact O-N 3.36Å
162	A	29.3	Very low	43.9	Very low	92 Å²	92	115.4 Å²	115.4	76%	0.76	65%	0.65	S	S	*	*			trans	-90.7	46.6	-172.5	0	0	0	0	0	114.7
163	Q	32.8	Very low	41.1	Very low	185 Å²	185	122 Å²	122	86%	0.864	69%	0.685	S	S	*	*			trans	-147.3	83.9	160	-80.8	-162.5	-13.5	0	0	111.5	G161	G161-Q163 PolarHBondContact O-N 3.36Å
164	R	28.6	Very low	38.7	Very low	251 Å²	251	124.2 Å²	124.2	95%	0.947	70%	0.701	S	S	*	*	S	Bend		173.7	140.4	126	-95.5	173.9	178	-175	0.2	110.7
165	A	28.4	Very low	36.2	Very low	101 Å²	101	126.4 Å²	126.4	84%	0.835	71%	0.709	S	S	*	*			trans	-46.4	143	179.1	0	0	0	0	0	112.7
166	G	26.7	Very low	33.8	Very low	71 Å²	71	131.9 Å²	131.9	73%	0.732	74%	0.738	S	S	*	*			cis	107.1	80.1	34.7	0	0	0	0	0	109
167	V	27.3	Very low	31.3	Very low	135 Å²	135	133 Å²	133	82%	0.818	76%	0.762	S	S	*	*			trans	-143.9	117.7	161.1	-177.5	0	0	0	0	110.1
168	K	25.6	Very low	29.7	Very low	166 Å²	166	133.7 Å²	133.7	72%	0.722	77%	0.769	S	S	*	*			trans	-74.8	142.3	167.1	-70.3	169.6	176.9	165.8	0	109.8
169	R	26.2	Very low	28.3	Very low	246 Å²	246	139.5 Å²	139.5	93%	0.928	78%	0.783	S	S	*	*			trans	-138.7	139.6	138.8	-72.6	-167.5	-167.8	162	7	111.1
170	K	24.1	Very low	27.2	Very low	205 Å²	205	141 Å²	141	89%	0.891	80%	0.797	S	S	*	*			trans	-113	135.1	176.9	-171.5	-171	179.1	-162.5	0	106.6
171	A	27.5	Very low	26.6	Very low	90 Å²	90	142.7 Å²	142.7	74%	0.744	81%	0.806	S	S	*	*			trans	8	135.6	159.4	0	0	0	0	0	120.8
172	E	24.4	Very low	26.1	Very low	202 Å²	202	149.4 Å²	149.4	94%	0.944	82%	0.818	S	S	*	*				-148.1	157.3	126.8	-116.6	171.8	-169.8	0	0	111.8
173	D	24.7	Very low	26	Very low	137 Å²	137	153.4 Å²	153.4	73%	0.733	83%	0.826	S	S	*	*			trans	-93.6	146.3	-155.5	-177.7	21.7	0	0	0	112.4
174	Q	25.2	Very low	25.7	Very low	185 Å²	185	153.6 Å²	153.6	86%	0.864	83%	0.827	S	S	*	*			trans	-168.9	102.3	151.5	-110.6	165.5	69.2	0	0	112.2
175	T	24.3	Very low	25.6	Very low	109 Å²	109	147.4 Å²	147.4	67%	0.669	82%	0.822	S	S	*	*			trans	2.9	135.5	142.5	55.9	0	0	0	0	118.7
176	L	24.5	Very low	25.5	Very low	175 Å²	175	148.3 Å²	148.3	92%	0.916	82%	0.822	S	S	*	*				-177.9	128.4	122.9	-95.2	164	0	0	0	112.3
177	G	24.4	Very low	25.5	Very low	73 Å²	73	149.7 Å²	149.7	75%	0.753	83%	0.827	S	S	*	*			trans	70.3	102.3	135.6	0	0	0	0	0	119.4
178	G	23.3	Very low	25.6	Very low	66 Å²	66	148.7 Å²	148.7	68%	0.68	83%	0.826	S	S	*	*			trans	-70.2	148	159.7	0	0	0	0	0	112
179	F	24.9	Very low	25.9	Very low	214 Å²	214	146 Å²	146	94%	0.939	83%	0.826	S	S	*	*			trans	-158.9	134	149.9	-94.6	-71.9	0	0	0	109.9
180	S	24.5	Very low	26.2	Very low	110 Å²	110	140.4 Å²	140.4	77%	0.769	82%	0.821	S	S	*	*			trans	-62	145.5	178.1	-44.8	0	0	0	0	113	K182	S180-K182 PolarHBondContact O-N 3.34Å
181	P	27.4	Very low	26.3	Very low	124 Å²	124	139.7 Å²	139.7	81%	0.805	82%	0.82	S	S	*	*			trans	-83.7	110.6	166.9	28.8	-23.8	0	0	0	110
182	K	24.2	Very low	26.4	Very low	200 Å²	200	140.1 Å²	140.1	87%	0.87	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-69.3	124.3	159.4	-83.5	-178.4	174.1	179.9	0	108.2	S180 Q184	S180-K182 PolarHBondContact O-N 3.34Å; K182-Q184 PolarHBondContact O-N 2.87Å
183	L	26.6	Very low	26.5	Very low	176 Å²	176	136 Å²	136	92%	0.921	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-61.4	121.8	163.7	-82.3	93.7	0	0	0	108.9
184	Q	27.3	Very low	26.6	Very low	190 Å²	190	135 Å²	135	89%	0.888	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-100.1	132.9	163	-89.2	180	-14	0	0	109.1	K182	K182-Q184 PolarHBondContact O-N 2.87Å
185	S	26.6	Very low	26.7	Very low	121 Å²	121	131.9 Å²	131.9	85%	0.846	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-62.1	133.3	178.1	42.6	0	0	0	0	112.2
186	S	25.8	Very low	26.8	Very low	120 Å²	120	132 Å²	132	84%	0.839	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-78.5	117.1	169.3	51.2	0	0	0	0	110.2
187	A	27.8	Very low	27	Very low	100 Å²	100	131.9 Å²	131.9	83%	0.826	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-88.8	131.4	166.6	0	0	0	0	0	110.2
188	S	28.8	Very low	27.3	Very low	113 Å²	113	134.5 Å²	134.5	79%	0.79	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.4	154.2	173.7	-58.5	0	0	0	0	112.2
189	P	31.6	Very low	27.8	Very low	111 Å²	111	137.3 Å²	137.3	72%	0.721	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-88.6	156.6	-173	35.1	-33.7	0	0	0	113.1
190	P	32.2	Very low	27.9	Very low	128 Å²	128	131.5 Å²	131.5	83%	0.831	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-91.6	145.3	164.1	34.2	-28.1	0	0	0	112.1
191	H	26.8	Very low	28.1	Very low	189 Å²	189	131.7 Å²	131.7	88%	0.875	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-81.1	167.2	174.9	-81.7	-87.7	0	0	0	113.4
192	A	28.4	Very low	28.1	Very low	100 Å²	100	130.9 Å²	130.9	83%	0.826	82%	0.821	S	S	*	*			trans	95.9	132.9	171.3	0	0	0	0	0	114
193	S	27.9	Very low	28.3	Very low	115 Å²	115	128.8 Å²	128.8	80%	0.804	82%	0.819	S	S	*	*			cis	-160.7	155.3	17	42.6	0	0	0	0	110.2
194	S	26.6	Very low	28.4	Very low	117 Å²	117	128.3 Å²	128.3	82%	0.818	81%	0.812	S	S	*	*			trans	-80.3	128.6	177.3	52.1	0	0	0	0	112.5
195	S	27.3	Very low	28.4	Very low	119 Å²	119	126.1 Å²	126.1	83%	0.832	81%	0.806	S	S	*	*			trans	-156	125.3	153	21.5	0	0	0	0	111.6
196	S	26.3	Very low	28.4	Very low	112 Å²	112	125 Å²	125	78%	0.783	80%	0.803	S	S	*	*			trans	-74.1	136.7	179.8	48.4	0	0	0	0	113.4
197	I	28.7	Very low	28.4	Very low	171 Å²	171	122.6 Å²	122.6	88%	0.877	80%	0.798	S	S	*	*			trans	-148.5	135.6	146.6	-53.6	-176.6	0	0	0	110.2
198	T	30.7	Very low	28.4	Very low	129 Å²	129	123.1 Å²	123.1	79%	0.791	80%	0.795	S	S	*	*			trans	-68.8	171.3	178.7	42.3	0	0	0	0	115.7
199	P	33.8	Very low	28.4	Very low	124 Å²	124	123.3 Å²	123.3	81%	0.805	80%	0.797	S	S	*	*			trans	-100.4	153.7	-167.8	37.9	-30.5	0	0	0	114.5
200	A	26.3	Very low	28.2	Very low	92 Å²	92	122.6 Å²	122.6	76%	0.76	80%	0.801	S	S	*	*			trans	-155.3	107.7	159.9	0	0	0	0	0	107.7
201	S	28.4	Very low	28	Very low	115 Å²	115	121.7 Å²	121.7	80%	0.804	80%	0.804	S	S	*	*				66	113	86.4	-74.9	0	0	0	0	116.1
202	S	27.8	Very low	28.1	Very low	106 Å²	106	116 Å²	116	74%	0.741	80%	0.797	S	S	*	*			trans	88.3	127.3	134.6	-54.3	0	0	0	0	121.2
203	L	28.3	Very low	28.1	Very low	157 Å²	157	117.4 Å²	117.4	82%	0.822	80%	0.8	S	S	*	*			trans	136.7	94.9	137.7	-71.8	165.9	0	0	0	110.6
204	Q	28.6	Very low	28.1	Very low	166 Å²	166	115.6 Å²	115.6	78%	0.776	80%	0.799	S	S	*	*				57.7	116.2	89.5	-94	-173.4	-27.3	0	0	117
205	L	28.1	Very low	28.4	Very low	144 Å²	144	114.9 Å²	114.9	75%	0.754	80%	0.801	S	S	*	*			trans	78.8	109.6	134.4	-74.1	158.8	0	0	0	121.5
206	A	26.9	Very low	28.7	Very low	96 Å²	96	117.6 Å²	117.6	79%	0.793	80%	0.8	S	S	*	*				85.2	134.3	113.1	0	0	0	0	0	121.9
207	G	25.5	Very low	29.1	Very low	70 Å²	70	122.2 Å²	122.2	72%	0.722	81%	0.806	S	S	*	*			trans	105.8	140.2	151.8	0	0	0	0	0	114.9
208	S	28.6	Very low	29.5	Very low	111 Å²	111	123.9 Å²	123.9	78%	0.776	81%	0.807	S	S	*	*			cis	-177.6	145.7	-7.4	-89.2	0	0	0	0	107
209	S	27.2	Very low	29.6	Very low	117 Å²	117	121.4 Å²	121.4	82%	0.818	81%	0.807	S	S	*	*			trans	65.2	133.1	144	57.6	0	0	0	0	124.1
210	A	29	Very low	30.2	Very low	97 Å²	97	127.9 Å²	127.9	80%	0.802	82%	0.815	S	S	*	*			trans	131.2	101	136.1	0	0	0	0	0	112.1
211	A	27.5	Very low	30.7	Very low	109 Å²	109	128.5 Å²	128.5	90%	0.901	81%	0.814	S	S	*	*				93.2	122.6	80.7	0	0	0	0	0	113.2
212	G	27.5	Very low	31.7	Very low	70 Å²	70	128.6 Å²	128.6	72%	0.722	82%	0.815	S	S	*	*			trans	160.8	97.9	166.3	0	0	0	0	0	115.3
213	S	29.6	Very low	32.7	Very low	129 Å²	129	133.2 Å²	133.2	90%	0.902	82%	0.821	S	S	*	*			trans	21.3	137.1	145.5	58	0	0	0	0	119.9
214	G	27.9	Very low	33.8	Very low	76 Å²	76	130.6 Å²	130.6	78%	0.784	82%	0.816	S	S	*	*			cis	152.4	139.4	14.5	0	0	0	0	0	107.5
215	A	33	Very low	34.9	Very low	103 Å²	103	131 Å²	131	85%	0.851	82%	0.818	S	S	*	*			trans	-176.9	110.1	154.7	0	0	0	0	0	109.6
216	E	32.6	Very low	35.9	Very low	176 Å²	176	127.9 Å²	127.9	82%	0.822	81%	0.809	S	S	*	*			trans	-69.4	134.3	165.6	-68.4	-176.7	111.2	0	0	110.7
217	K	35.3	Very low	37.7	Very low	209 Å²	209	126.9 Å²	126.9	91%	0.909	80%	0.795	S	S	*	*			trans	-144.5	108.7	138.5	-107.5	-178.8	-176.1	178.1	0	109.2	G219	K217-G219 PolarHBondContact O-N 3.34Å
218	K	37.7	Very low	39.8	Very low	206 Å²	206	129.7 Å²	129.7	90%	0.896	79%	0.79	S	S	*	*			trans	-60.9	121.4	169.3	-85.5	173.1	173.8	165.6	0	110
219	G	31.6	Very low	42.1	Very low	76 Å²	76	127.8 Å²	127.8	78%	0.784	77%	0.773	S	S	*	*			trans	-142.7	98.3	161.2	0	0	0	0	0	108.1	K217	K217-G219 PolarHBondContact O-N 3.34Å
220	R	46.9	Very low	44.6	Very low	261 Å²	261	126.2 Å²	126.2	99%	0.985	76%	0.756	S	S	*	*			trans	-85.1	110.3	-176.9	-155.4	178.7	178.9	-179.6	-1.7	108.1
221	S	37.3	Very low	46.9	Very low	105 Å²	105	128 Å²	128	73%	0.734	75%	0.749	S	S	*	*			trans	-156.2	108	156.2	-178.8	0	0	0	0	109.9	K223	S221-K223 PolarHBondContact O-N 3.46Å
222	S	48.7	Very low	49.6	Very low	117 Å²	117	127.6 Å²	127.6	82%	0.818	73%	0.729	S	S	*	*			trans	-63.4	103.1	170.4	50.6	0	0	0	0	110.9
223	K	49.1	Very low	52.1	Low	202 Å²	202	128.1 Å²	128.1	88%	0.878	71%	0.714	S	S	*	*			trans	-170	73	163.3	-118	-179.8	-178.2	-179.7	0	110.3	S221	S221-K223 PolarHBondContact O-N 3.46Å
224	S	51.4	Low	54.6	Low	102 Å²	102	128.2 Å²	128.2	71%	0.713	70%	0.7	S	S	*	*			trans	-145	40.7	176.2	86	0	0	0	0	114.9
225	Q	50.4	Low	57.2	Low	175 Å²	175	127.6 Å²	127.6	82%	0.818	68%	0.684	S	S	*	*	S	Bend	trans	-122.8	-6.6	169.7	-89	-174.3	-18.7	0	0	114.9	V229	Q225-V229 VanDerWaalsContact O-CG2 3.29Å; Q225-V229 WeakPolarHBondContact O-CG2 3.37Å
226	S	49.8	Very low	59.5	Low	79 Å²	79	127.6 Å²	127.6	55%	0.552	67%	0.669	S	S	*	*	H	α-helix	trans	-85.9	-38	174.2	108.4	0	0	0	0	112.7	H228 V229 D230	S226-H228 PolarHBondContact O-N 2.89Å; S226-V229 PolarHBondContact O-N 3.25Å; S226-D230 VanDerWaalsContact C-OD2 3.27Å; S226-D230 WeakPolarHBondContact CB-OD2 3.37Å; S226-D230 VanDerWaalsContact O-CB 3.24Å; S226-D230 WeakPolarHBondContact O-CB 3.48Å; S226-D230 PolarHBondContact O-N 2.81Å; S226-D230 PolarHBondContact OG-OD2 2.87Å
227	S	64.5	Low	61.6	Low	74 Å²	74	125.7 Å²	125.7	52%	0.517	66%	0.663	S	S	.	*	H	α-helix	trans	-67.2	-33.9	-170.4	61.8	0	0	0	0	115.2	M231	S227-M231 WeakPolarHBondContact O-CB 3.35Å; S227-M231 WeakPolarHBondContact O-CG 3.49Å; S227-M231 PolarHBondContact O-N 3.48Å; S227-M231 VanDerWaalsContact O-N 3.14Å
228	H	71.1	Confident	63.8	Low	130 Å²	130	122.6 Å²	122.6	60%	0.602	66%	0.657	S	S	*	*	H	α-helix	trans	-72.8	-42.3	177.8	-174.8	-79.1	0	0	0	111.3	S226 M231 E232	S226-H228 PolarHBondContact O-N 2.89Å; H228-M231 PolarHBondContact O-N 2.87Å; H228-E232 IonicContact CE1-OE2 3.43Å; H228-E232 IonicContact ND1-OE2 2.67Å; H228-E232 PolarHBondContact ND1-OE2 3.06Å; H228-E232 VanDerWaalsContact O-CB 3.28Å; H228-E232 WeakPolarHBondContact O-CB 3.35Å; H228-E232 PolarHBondContact O-N 3.01Å
229	V	76.9	Confident	66	Low	71 Å²	71	118.4 Å²	118.4	43%	0.43	64%	0.64	S	S	.	*	H	α-helix	trans	-71.7	-37.3	-178.9	-168.9	0	0	0	0	110	Q225 S226 E232 I233	Q225-V229 VanDerWaalsContact O-CG2 3.29Å; Q225-V229 WeakPolarHBondContact O-CG2 3.37Å; S226-V229 PolarHBondContact O-N 3.25Å; V229-E232 PolarHBondContact O-N 3.17Å; V229-I233 HydrophobicContact CG1-CD1 3.85Å; V229-I233 HydrophobicContact CG1-CG1 4.36Å; V229-I233 VanDerWaalsContact O-CB 3.31Å; V229-I233 WeakPolarHBondContact O-CB 3.43Å; V229-I233 WeakPolarHBondContact O-CD1 3.33Å; V229-I233 WeakPolarHBondContact O-CG1 3.49Å; V229-I233 PolarHBondContact O-N 3.06Å
230	D	77.8	Confident	68.3	Low	84 Å²	84	117.9 Å²	117.9	45%	0.449	62%	0.618	S	S	.	*	H	α-helix	trans	-64.9	-41.2	174.9	-66.5	-33.3	0	0	0	111.2	S226 I233 E234	S226-D230 VanDerWaalsContact C-OD2 3.27Å; S226-D230 WeakPolarHBondContact CB-OD2 3.37Å; S226-D230 VanDerWaalsContact O-CB 3.24Å; S226-D230 WeakPolarHBondContact O-CB 3.48Å; S226-D230 PolarHBondContact O-N 2.81Å; S226-D230 PolarHBondContact OG-OD2 2.87Å; D230-I233 PolarHBondContact O-N 3.33Å; D230-E234 WeakPolarHBondContact O-CB 3.31Å; D230-E234 WeakPolarHBondContact O-CG 3.45Å; D230-E234 PolarHBondContact O-N 3.17Å
231	M	78	Confident	70.2	Confident	134 Å²	134	108.5 Å²	108.5	66%	0.66	59%	0.592	S	S	*	*	H	α-helix	trans	-67.4	-35.9	173.8	-74.3	178.5	70	0	0	112.9	S227 H228 S235	S227-M231 WeakPolarHBondContact O-CB 3.35Å; S227-M231 WeakPolarHBondContact O-CG 3.49Å; S227-M231 PolarHBondContact O-N 3.48Å; S227-M231 VanDerWaalsContact O-N 3.14Å; H228-M231 PolarHBondContact O-N 2.87Å; M231-S235 VanDerWaalsContact O-CB 3.29Å; M231-S235 WeakPolarHBondContact O-CB 3.33Å; M231-S235 PolarHBondContact O-N 2.94Å
232	E	83.6	Confident	72.5	Confident	101 Å²	101	108.6 Å²	108.6	47%	0.472	59%	0.588	S	S	.	*	H	α-helix	trans	-71.6	-38.5	176.9	-166.8	169.2	-164.9	0	0	111.3	H228 V229 S235 L236	H228-E232 IonicContact CE1-OE2 3.43Å; H228-E232 IonicContact ND1-OE2 2.67Å; H228-E232 PolarHBondContact ND1-OE2 3.06Å; H228-E232 VanDerWaalsContact O-CB 3.28Å; H228-E232 WeakPolarHBondContact O-CB 3.35Å; H228-E232 PolarHBondContact O-N 3.01Å; V229-E232 PolarHBondContact O-N 3.17Å; E232-S235 WeakPolarHBondContact O-CB 3.22Å; E232-S235 PolarHBondContact O-N 3.04Å; E232-L236 HydrophobicContact CG-CD1 4.5Å; E232-L236 WeakPolarHBondContact O-CB 3.44Å; E232-L236 VanDerWaalsContact O-CG 3.24Å; E232-L236 WeakPolarHBondContact O-CG 3.47Å; E232-L236 PolarHBondContact O-N 3.04Å
233	I	81.3	Confident	74.3	Confident	80 Å²	80	110.8 Å²	110.8	41%	0.41	58%	0.583	S	S	.	*	H	α-helix	trans	-65.9	-45.1	172.4	-70.5	165.8	0	0	0	110.7	V229 D230 S235 L236 L237	V229-I233 HydrophobicContact CG1-CD1 3.85Å; V229-I233 HydrophobicContact CG1-CG1 4.36Å; V229-I233 VanDerWaalsContact O-CB 3.31Å; V229-I233 WeakPolarHBondContact O-CB 3.43Å; V229-I233 WeakPolarHBondContact O-CD1 3.33Å; V229-I233 WeakPolarHBondContact O-CG1 3.49Å; V229-I233 PolarHBondContact O-N 3.06Å; D230-I233 PolarHBondContact O-N 3.33Å; I233-S235 VanDerWaalsContact C-N 3.31Å; I233-S235 PolarHBondContact O-N 3.28Å; I233-L236 PolarHBondContact O-N 3.11Å; I233-L237 HydrophobicContact CG2-CD1 3.68Å; I233-L237 HydrophobicContact CG2-CG 4.23Å; I233-L237 WeakPolarHBondContact O-CB 3.3Å; I233-L237 VanDerWaalsContact O-CG 3.23Å; I233-L237 WeakPolarHBondContact O-CG 3.46Å; I233-L237 PolarHBondContact O-N 3.46Å
234	E	80.9	Confident	76.1	Confident	131 Å²	131	106.1 Å²	106.1	61%	0.612	56%	0.564	S	S	*	*	H	α-helix	trans	-62.6	-37.9	174.8	-79.5	-173.2	167.6	0	0	112.1	D230 L237 N238	D230-E234 WeakPolarHBondContact O-CB 3.31Å; D230-E234 WeakPolarHBondContact O-CG 3.45Å; D230-E234 PolarHBondContact O-N 3.17Å; E234-L237 PolarHBondContact O-N 3.37Å; E234-N238 WeakPolarHBondContact O-CB 3.4Å; E234-N238 PolarHBondContact O-N 3.27Å
235	S	83.8	Confident	77.7	Confident	63 Å²	63	106.3 Å²	106.3	44%	0.441	55%	0.554	S	S	.	*	H	α-helix	trans	-63.7	-43	173.4	179.7	0	0	0	0	112.2	M231 E232 I233 N238 Q239	M231-S235 VanDerWaalsContact O-CB 3.29Å; M231-S235 WeakPolarHBondContact O-CB 3.33Å; M231-S235 PolarHBondContact O-N 2.94Å; E232-S235 WeakPolarHBondContact O-CB 3.22Å; E232-S235 PolarHBondContact O-N 3.04Å; I233-S235 VanDerWaalsContact C-N 3.31Å; I233-S235 PolarHBondContact O-N 3.28Å; S235-N238 PolarHBondContact O-N 3.25Å; S235-Q239 VanDerWaalsContact O-CG 3.3Å; S235-Q239 WeakPolarHBondContact O-CG 3.43Å; S235-Q239 PolarHBondContact O-N 3.11Å; S235-Q239 PolarHBondContact O-NE2 2.93Å
236	L	81.1	Confident	79.5	Confident	104 Å²	104	104.5 Å²	104.5	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-70.2	-33.4	177.3	-72.3	168.1	0	0	0	112.7	E232 I233 Q239	E232-L236 HydrophobicContact CG-CD1 4.5Å; E232-L236 WeakPolarHBondContact O-CB 3.44Å; E232-L236 VanDerWaalsContact O-CG 3.24Å; E232-L236 WeakPolarHBondContact O-CG 3.47Å; E232-L236 PolarHBondContact O-N 3.04Å; I233-L236 PolarHBondContact O-N 3.11Å; L236-Q239 PolarHBondContact O-N 3.35Å
237	L	77.2	Confident	81.4	Confident	135 Å²	135	103.7 Å²	103.7	71%	0.707	54%	0.54	S	S	*	.	H	α-helix	trans	-74.6	-29.4	175.8	-71.6	170.8	0	0	0	112.6	I233 E234	I233-L237 HydrophobicContact CG2-CD1 3.68Å; I233-L237 HydrophobicContact CG2-CG 4.23Å; I233-L237 WeakPolarHBondContact O-CB 3.3Å; I233-L237 VanDerWaalsContact O-CG 3.23Å; I233-L237 WeakPolarHBondContact O-CG 3.46Å; I233-L237 PolarHBondContact O-N 3.46Å; E234-L237 PolarHBondContact O-N 3.37Å
238	N	81.4	Confident	82.5	Confident	144 Å²	144	105.4 Å²	105.4	77%	0.77	54%	0.538	S	S	*	.	H	α-helix	trans	-85.8	-8.3	173.8	-78.7	-7.6	0	0	0	113.5	E234 S235 Q240	E234-N238 WeakPolarHBondContact O-CB 3.4Å; E234-N238 PolarHBondContact O-N 3.27Å; S235-N238 PolarHBondContact O-N 3.25Å; N238-Q240 PolarHBondContact O-N 3.21Å
239	Q	82.9	Confident	83.5	Confident	118 Å²	118	106 Å²	106	55%	0.551	54%	0.539	S	S	*	.	S	Bend	trans	-71.7	121.4	173.7	-87.4	170.7	51.6	0	0	109.9	S235 L236 S241	S235-Q239 VanDerWaalsContact O-CG 3.3Å; S235-Q239 WeakPolarHBondContact O-CG 3.43Å; S235-Q239 PolarHBondContact O-N 3.11Å; S235-Q239 PolarHBondContact O-NE2 2.93Å; L236-Q239 PolarHBondContact O-N 3.35Å; Q239-S241 PolarHBondContact O-N 3.21Å
240	Q	80.3	Confident	84.3	Confident	66 Å²	66	107.7 Å²	107.7	31%	0.308	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-63.5	125.7	179.1	-147.5	174.2	23.2	0	0	109.6	N238 E244 Q245	N238-Q240 PolarHBondContact O-N 3.21Å; Q240-E244 HydrophobicContact CG-CB 3.9Å; Q240-E244 HydrophobicContact CG-CG 3.7Å; Q240-E244 WeakPolarHBondContact CG-OE1 3.47Å; Q240-E244 WeakPolarHBondContact CG-OE2 3.14Å; Q240-E244 VanDerWaalsContact NE2-CD 3.35Å; Q240-E244 PolarHBondContact NE2-OE1 3.4Å; Q240-Q245 HydrophobicContact CB-CG 3.96Å; Q240-Q245 HydrophobicContact CG-CG 4.23Å; Q240-Q245 PolarHBondContact O-NE2 3.22Å
241	S	87.1	Confident	84.8	Confident	64 Å²	64	106.8 Å²	106.8	45%	0.448	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-58.4	148.9	179.1	177.3	0	0	0	0	110.6	Q239 K243 E244 Q245	Q239-S241 PolarHBondContact O-N 3.21Å; S241-K243 PolarHBondContact O-N 2.94Å; S241-K243 VanDerWaalsContact O-N 3.17Å; S241-K243 PolarHBondContact OG-N 2.93Å; S241-E244 WeakPolarHBondContact O-CA 3.5Å; S241-E244 WeakPolarHBondContact O-CB 3.31Å; S241-E244 PolarHBondContact O-N 3.47Å; S241-Q245 PolarHBondContact O-N 3Å
242	T	85.4	Confident	85.5	Confident	106 Å²	106	105.4 Å²	105.4	65%	0.65	54%	0.535	S	S	*	.	H	α-helix	trans	-53.5	-36.5	173.8	49.8	0	0	0	0	112.3	Q246	T242-Q246 WeakPolarHBondContact O-CB 3.21Å; T242-Q246 WeakPolarHBondContact O-CG 3.34Å; T242-Q246 PolarHBondContact O-N 3.19Å
243	K	87.4	Confident	85.9	Confident	164 Å²	164	105.8 Å²	105.8	71%	0.713	54%	0.537	S	S	*	.	H	α-helix	trans	-65.7	-40.1	174.6	-175	178.5	179.6	-179.2	0	112.2	S241 Q246 S247	S241-K243 PolarHBondContact O-N 2.94Å; S241-K243 VanDerWaalsContact O-N 3.17Å; S241-K243 PolarHBondContact OG-N 2.93Å; K243-Q246 PolarHBondContact O-N 3.49Å; K243-S247 PolarHBondContact O-N 3.39Å
244	E	85.6	Confident	86.4	Confident	103 Å²	103	105.8 Å²	105.8	48%	0.481	54%	0.537	S	S	.	.	H	α-helix	trans	-73.7	-38	-179.5	-169.5	-170.2	159.3	0	0	111.4	Q240 S241 S247 K248	Q240-E244 HydrophobicContact CG-CB 3.9Å; Q240-E244 HydrophobicContact CG-CG 3.7Å; Q240-E244 WeakPolarHBondContact CG-OE1 3.47Å; Q240-E244 WeakPolarHBondContact CG-OE2 3.14Å; Q240-E244 VanDerWaalsContact NE2-CD 3.35Å; Q240-E244 PolarHBondContact NE2-OE1 3.4Å; S241-E244 WeakPolarHBondContact O-CA 3.5Å; S241-E244 WeakPolarHBondContact O-CB 3.31Å; S241-E244 PolarHBondContact O-N 3.47Å; E244-S247 PolarHBondContact O-N 3.49Å; E244-K248 WeakPolarHBondContact O-CB 3.34Å; E244-K248 PolarHBondContact O-N 2.89Å
245	Q	85.4	Confident	86.7	Confident	106 Å²	106	104.3 Å²	104.3	50%	0.495	53%	0.533	S	S	.	.	H	α-helix	trans	-61.6	-43.1	170.4	-69.5	179.8	3.3	0	0	111.9	Q240 S241 K248 K249	Q240-Q245 HydrophobicContact CB-CG 3.96Å; Q240-Q245 HydrophobicContact CG-CG 4.23Å; Q240-Q245 PolarHBondContact O-NE2 3.22Å; S241-Q245 PolarHBondContact O-N 3Å; Q245-K248 PolarHBondContact O-N 2.96Å; Q245-K249 WeakPolarHBondContact O-CB 3.47Å; Q245-K249 PolarHBondContact O-N 3.12Å
246	Q	87.8	Confident	87	Confident	137 Å²	137	108 Å²	108	64%	0.64	54%	0.543	S	S	*	.	H	α-helix	trans	-63.3	-42.9	174.6	-78.9	178.2	-15.7	0	0	111.9	T242 K243 K248 K249 M250	T242-Q246 WeakPolarHBondContact O-CB 3.21Å; T242-Q246 WeakPolarHBondContact O-CG 3.34Å; T242-Q246 PolarHBondContact O-N 3.19Å; K243-Q246 PolarHBondContact O-N 3.49Å; Q246-K248 VanDerWaalsContact C-N 3.34Å; Q246-K248 PolarHBondContact O-N 2.85Å; Q246-K249 PolarHBondContact O-N 2.81Å; Q246-M250 WeakPolarHBondContact O-CB 3.35Å; Q246-M250 PolarHBondContact O-N 3.29Å
247	S	89.1	Confident	87.3	Confident	63 Å²	63	108.9 Å²	108.9	44%	0.441	55%	0.548	S	S	.	.	H	α-helix	trans	-60.9	-44.2	175.4	-170.6	0	0	0	0	111.4	K243 E244 M250 S251	K243-S247 PolarHBondContact O-N 3.39Å; E244-S247 PolarHBondContact O-N 3.49Å; S247-M250 PolarHBondContact O-N 3.49Å; S247-S251 WeakPolarHBondContact O-CB 3.32Å; S247-S251 PolarHBondContact O-N 2.89Å; S247-S251 PolarHBondContact O-OG 3.32Å
248	K	89.6	Confident	87.7	Confident	109 Å²	109	108.9 Å²	108.9	47%	0.474	55%	0.548	S	S	.	.	H	α-helix	trans	-65.1	-41	178	-172.2	176.1	179.9	-179.5	0	111.8	E244 Q245 Q246 S251 Q252	E244-K248 WeakPolarHBondContact O-CB 3.34Å; E244-K248 PolarHBondContact O-N 2.89Å; Q245-K248 PolarHBondContact O-N 2.96Å; Q246-K248 VanDerWaalsContact C-N 3.34Å; Q246-K248 PolarHBondContact O-N 2.85Å; K248-S251 PolarHBondContact O-N 3.28Å; K248-Q252 WeakPolarHBondContact O-CB 3.49Å; K248-Q252 WeakPolarHBondContact O-CG 3.23Å; K248-Q252 PolarHBondContact O-N 3.29Å
249	K	92.1	Very high	87.8	Confident	143 Å²	143	107.9 Å²	107.9	62%	0.622	54%	0.543	S	S	*	.	H	α-helix	trans	-62.8	-44.6	175.2	-171.2	179.7	179.8	-176.1	0	111.3	Q245 Q246 Q252 E253	Q245-K249 WeakPolarHBondContact O-CB 3.47Å; Q245-K249 PolarHBondContact O-N 3.12Å; Q246-K249 PolarHBondContact O-N 2.81Å; K249-Q252 WeakPolarHBondContact O-CB 3.39Å; K249-Q252 PolarHBondContact O-N 3.02Å; K249-E253 WeakPolarHBondContact O-CB 3.24Å; K249-E253 PolarHBondContact O-N 2.84Å
250	M	92.1	Very high	87.8	Confident	107 Å²	107	105 Å²	105	53%	0.527	54%	0.539	S	S	.	.	H	α-helix	trans	-62.4	-43.5	175	-171.7	-177.7	83.7	0	0	111.3	Q246 S247 Q252 E253 I254	Q246-M250 WeakPolarHBondContact O-CB 3.35Å; Q246-M250 PolarHBondContact O-N 3.29Å; S247-M250 PolarHBondContact O-N 3.49Å; M250-Q252 VanDerWaalsContact C-N 3.33Å; M250-Q252 PolarHBondContact O-N 2.8Å; M250-E253 PolarHBondContact O-N 3.47Å; M250-I254 HydrophobicContact CE-CD1 4.23Å; M250-I254 HydrophobicContact CG-CD1 3.95Å; M250-I254 WeakPolarHBondContact O-CB 3.49Å; M250-I254 WeakPolarHBondContact O-CG1 3.38Å; M250-I254 PolarHBondContact O-N 2.84Å
251	S	89.9	Confident	87.9	Confident	64 Å²	64	104.7 Å²	104.7	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-63.1	-37.6	175.2	-62.6	0	0	0	0	112.7	S247 K248 L255	S247-S251 WeakPolarHBondContact O-CB 3.32Å; S247-S251 PolarHBondContact O-N 2.89Å; S247-S251 PolarHBondContact O-OG 3.32Å; K248-S251 PolarHBondContact O-N 3.28Å; S251-L255 WeakPolarHBondContact O-CB 3.45Å; S251-L255 PolarHBondContact O-N 2.99Å
252	Q	90.9	Very high	87.8	Confident	105 Å²	105	105 Å²	105	49%	0.491	54%	0.544	S	S	.	.	H	α-helix	trans	-65.6	-45.9	174.2	-78	174.4	-20.1	0	0	111.4	K248 K249 M250 I254 L255 E256	K248-Q252 WeakPolarHBondContact O-CB 3.49Å; K248-Q252 WeakPolarHBondContact O-CG 3.23Å; K248-Q252 PolarHBondContact O-N 3.29Å; K249-Q252 WeakPolarHBondContact O-CB 3.39Å; K249-Q252 PolarHBondContact O-N 3.02Å; M250-Q252 VanDerWaalsContact C-N 3.33Å; M250-Q252 PolarHBondContact O-N 2.8Å; Q252-I254 PolarHBondContact O-N 3.39Å; Q252-L255 PolarHBondContact O-N 3.47Å; Q252-E256 WeakPolarHBondContact O-CB 3.24Å; Q252-E256 WeakPolarHBondContact O-CG 3.28Å; Q252-E256 PolarHBondContact O-N 3.48Å
253	E	93.4	Very high	87.7	Confident	109 Å²	109	103.9 Å²	103.9	51%	0.509	55%	0.545	S	S	.	.	H	α-helix	trans	-63.1	-41.8	177.6	-173	174.2	-177.1	0	0	111.6	K249 M250 L255 E256 L257	K249-E253 WeakPolarHBondContact O-CB 3.24Å; K249-E253 PolarHBondContact O-N 2.84Å; M250-E253 PolarHBondContact O-N 3.47Å; E253-L255 PolarHBondContact O-N 3.3Å; E253-E256 PolarHBondContact O-N 3.35Å; E253-L257 HydrophobicContact CG-CD1 4.39Å; E253-L257 WeakPolarHBondContact O-CB 3.47Å; E253-L257 VanDerWaalsContact O-CG 3.28Å; E253-L257 WeakPolarHBondContact O-CG 3.32Å; E253-L257 PolarHBondContact O-N 3.41Å
254	I	90.3	Very high	87.4	Confident	80 Å²	80	103.7 Å²	103.7	41%	0.41	54%	0.544	S	S	.	.	H	α-helix	trans	-61.6	-44.6	173.2	-69.3	165.2	0	0	0	110.6	M250 Q252 E256 L257 L258	M250-I254 HydrophobicContact CE-CD1 4.23Å; M250-I254 HydrophobicContact CG-CD1 3.95Å; M250-I254 WeakPolarHBondContact O-CB 3.49Å; M250-I254 WeakPolarHBondContact O-CG1 3.38Å; M250-I254 PolarHBondContact O-N 2.84Å; Q252-I254 PolarHBondContact O-N 3.39Å; I254-E256 VanDerWaalsContact C-N 3.34Å; I254-E256 PolarHBondContact O-N 3.05Å; I254-L257 PolarHBondContact O-N 3.33Å; I254-L258 HydrophobicContact CG2-CD1 3.75Å; I254-L258 HydrophobicContact CG2-CG 4.21Å; I254-L258 WeakPolarHBondContact O-CB 3.41Å; I254-L258 VanDerWaalsContact O-CG 3.24Å; I254-L258 WeakPolarHBondContact O-CG 3.28Å; I254-L258 PolarHBondContact O-N 3.43Å
255	L	89	Confident	87.1	Confident	101 Å²	101	103.4 Å²	103.4	53%	0.529	54%	0.543	S	S	.	.	H	α-helix	trans	-64.7	-38.8	178.2	-175.6	64.6	0	0	0	111.8	S251 Q252 E253 L258 N259	S251-L255 WeakPolarHBondContact O-CB 3.45Å; S251-L255 PolarHBondContact O-N 2.99Å; Q252-L255 PolarHBondContact O-N 3.47Å; E253-L255 PolarHBondContact O-N 3.3Å; L255-L258 PolarHBondContact O-N 3.36Å; L255-N259 WeakPolarHBondContact CD1-ND2 3.43Å; L255-N259 WeakPolarHBondContact O-CB 3.34Å; L255-N259 VanDerWaalsContact O-CG 3.26Å; L255-N259 PolarHBondContact O-N 3Å; L255-N259 PolarHBondContact O-ND2 3.02Å
256	E	89.8	Confident	87.1	Confident	140 Å²	140	103 Å²	103	65%	0.654	54%	0.541	S	S	*	.	H	α-helix	trans	-62.7	-44.5	173.5	-77.8	177.1	-174.2	0	0	111.2	Q252 E253 I254 N259 A260	Q252-E256 WeakPolarHBondContact O-CB 3.24Å; Q252-E256 WeakPolarHBondContact O-CG 3.28Å; Q252-E256 PolarHBondContact O-N 3.48Å; E253-E256 PolarHBondContact O-N 3.35Å; I254-E256 VanDerWaalsContact C-N 3.34Å; I254-E256 PolarHBondContact O-N 3.05Å; E256-N259 PolarHBondContact O-N 3.47Å; E256-A260 VanDerWaalsContact O-CB 3.32Å; E256-A260 WeakPolarHBondContact O-CB 3.5Å; E256-A260 PolarHBondContact O-N 3Å
257	L	86.8	Confident	86.8	Confident	123 Å²	123	99.9 Å²	99.9	64%	0.644	53%	0.534	S	S	*	.	H	α-helix	trans	-67.5	-37.2	177.5	-71.2	171.7	0	0	0	112.9	E253 I254 N259 A260	E253-L257 HydrophobicContact CG-CD1 4.39Å; E253-L257 WeakPolarHBondContact O-CB 3.47Å; E253-L257 VanDerWaalsContact O-CG 3.28Å; E253-L257 WeakPolarHBondContact O-CG 3.32Å; E253-L257 PolarHBondContact O-N 3.41Å; I254-L257 PolarHBondContact O-N 3.33Å; L257-N259 VanDerWaalsContact C-N 3.33Å; L257-A260 PolarHBondContact O-N 2.89Å
258	L	85	Confident	86.5	Confident	134 Å²	134	98.6 Å²	98.6	70%	0.702	52%	0.522	S	S	*	.	H	α-helix	trans	-69.6	-31.3	176.3	-73.2	172.5	0	0	0	112.4	I254 L255	I254-L258 HydrophobicContact CG2-CD1 3.75Å; I254-L258 HydrophobicContact CG2-CG 4.21Å; I254-L258 WeakPolarHBondContact O-CB 3.41Å; I254-L258 VanDerWaalsContact O-CG 3.24Å; I254-L258 WeakPolarHBondContact O-CG 3.28Å; I254-L258 PolarHBondContact O-N 3.43Å; L255-L258 PolarHBondContact O-N 3.36Å
259	N	83.8	Confident	86	Confident	123 Å²	123	97 Å²	97	66%	0.658	52%	0.521	S	S	*	.	H	α-helix	trans	-90.5	-11.2	177.6	-68.8	-36.4	0	0	0	113.2	L255 E256 L257 S261	L255-N259 WeakPolarHBondContact CD1-ND2 3.43Å; L255-N259 WeakPolarHBondContact O-CB 3.34Å; L255-N259 VanDerWaalsContact O-CG 3.26Å; L255-N259 PolarHBondContact O-N 3Å; L255-N259 PolarHBondContact O-ND2 3.02Å; E256-N259 PolarHBondContact O-N 3.47Å; L257-N259 VanDerWaalsContact C-N 3.33Å; N259-S261 PolarHBondContact O-N 3.23Å
260	A	83.8	Confident	85.4	Confident	58 Å²	58	96.6 Å²	96.6	48%	0.479	52%	0.522	S	S	.	.	S	Bend	trans	-70.1	127.3	177.3	0	0	0	0	0	109.9	E256 L257	E256-A260 VanDerWaalsContact O-CB 3.32Å; E256-A260 WeakPolarHBondContact O-CB 3.5Å; E256-A260 PolarHBondContact O-N 3Å; L257-A260 PolarHBondContact O-N 2.89Å
261	S	82.4	Confident	84.8	Confident	60 Å²	60	97.9 Å²	97.9	42%	0.42	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-66.6	138.4	174.7	54.9	0	0	0	0	110.8	N259 Q266	N259-S261 PolarHBondContact O-N 3.23Å; S261-Q266 PolarHBondContact O-NE2 3.44Å; S261-Q266 VanDerWaalsContact OG-CG 3.28Å; S261-Q266 WeakPolarHBondContact OG-CG 3.35Å; S261-Q266 PolarHBondContact OG-NE2 3.45Å
262	T	83.8	Confident	84.1	Confident	71 Å²	71	97.8 Å²	97.8	44%	0.436	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-68.1	153.1	178	64.7	0	0	0	0	110.6	K264 E265 Q266	T262-K264 PolarHBondContact O-N 2.8Å; T262-K264 VanDerWaalsContact O-N 3.11Å; T262-E265 PolarHBondContact N-OE2 3.36Å; T262-E265 WeakPolarHBondContact O-CB 3.25Å; T262-E265 PolarHBondContact O-N 2.99Å; T262-E265 VanDerWaalsContact OG1-CG 3.25Å; T262-E265 WeakPolarHBondContact OG1-CG 3.28Å; T262-E265 PolarHBondContact OG1-N 2.96Å; T262-E265 PolarHBondContact OG1-OE2 3.27Å; T262-Q266 PolarHBondContact O-N 3.11Å
263	A	83.1	Confident	83.2	Confident	81 Å²	81	101.7 Å²	101.7	67%	0.669	53%	0.526	S	S	*	.	H	α-helix	trans	-56	-31.7	176.1	0	0	0	0	0	112.6	S267	A263-S267 WeakPolarHBondContact O-CB 3.46Å; A263-S267 PolarHBondContact O-N 3.01Å
264	K	81.3	Confident	81.9	Confident	161 Å²	161	100 Å²	100	70%	0.7	53%	0.526	S	S	*	.	H	α-helix	trans	-64.7	-48.3	173.8	-176.3	-178.5	177.6	-176.7	0	111.6	T262 S267 I268	T262-K264 PolarHBondContact O-N 2.8Å; T262-K264 VanDerWaalsContact O-N 3.11Å; K264-S267 PolarHBondContact O-N 3.25Å; K264-I268 HydrophobicContact CG-CD1 4.13Å; K264-I268 VanDerWaalsContact O-CG1 3.31Å; K264-I268 WeakPolarHBondContact O-CG1 3.3Å; K264-I268 PolarHBondContact O-N 3.35Å
265	E	81	Confident	80.1	Confident	96 Å²	96	108.2 Å²	108.2	45%	0.449	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-43.6	177.8	-73	159.1	170.6	0	0	111.3	T262 S267 I268 V269	T262-E265 PolarHBondContact N-OE2 3.36Å; T262-E265 WeakPolarHBondContact O-CB 3.25Å; T262-E265 PolarHBondContact O-N 2.99Å; T262-E265 VanDerWaalsContact OG1-CG 3.25Å; T262-E265 WeakPolarHBondContact OG1-CG 3.28Å; T262-E265 PolarHBondContact OG1-N 2.96Å; T262-E265 PolarHBondContact OG1-OE2 3.27Å; E265-S267 VanDerWaalsContact C-N 3.34Å; E265-S267 PolarHBondContact O-N 2.98Å; E265-I268 PolarHBondContact O-N 2.69Å; E265-V269 VanDerWaalsContact O-CG2 3.3Å; E265-V269 WeakPolarHBondContact O-CG2 3.5Å; E265-V269 PolarHBondContact O-N 2.93Å
266	Q	83.4	Confident	78.3	Confident	99 Å²	99	107 Å²	107	46%	0.463	57%	0.565	S	S	.	*	H	α-helix	trans	-59.6	-44.7	175.7	-67	178.1	5.5	0	0	111.7	S261 T262 I268 V269 E270	S261-Q266 PolarHBondContact O-NE2 3.44Å; S261-Q266 VanDerWaalsContact OG-CG 3.28Å; S261-Q266 WeakPolarHBondContact OG-CG 3.35Å; S261-Q266 PolarHBondContact OG-NE2 3.45Å; T262-Q266 PolarHBondContact O-N 3.11Å; Q266-I268 VanDerWaalsContact C-N 3.34Å; Q266-I268 PolarHBondContact O-N 2.98Å; Q266-V269 PolarHBondContact O-N 3.44Å; Q266-E270 WeakPolarHBondContact O-CG 3.49Å; Q266-E270 PolarHBondContact O-N 2.74Å
267	S	82.8	Confident	76.2	Confident	71 Å²	71	110.8 Å²	110.8	50%	0.497	57%	0.573	S	S	.	*	H	α-helix	trans	-62.3	-39.2	176.7	-178.9	0	0	0	0	112.6	A263 K264 E265 E270 K271	A263-S267 WeakPolarHBondContact O-CB 3.46Å; A263-S267 PolarHBondContact O-N 3.01Å; K264-S267 PolarHBondContact O-N 3.25Å; E265-S267 VanDerWaalsContact C-N 3.34Å; E265-S267 PolarHBondContact O-N 2.98Å; S267-E270 PolarHBondContact O-N 3.21Å; S267-K271 WeakPolarHBondContact O-CB 3.25Å; S267-K271 PolarHBondContact O-N 2.9Å
268	I	81.7	Confident	74.4	Confident	36 Å²	36	108 Å²	108	19%	0.185	57%	0.568	C	S	.	*	H	α-helix	trans	-65.2	-48.1	175.3	-67.8	166.3	0	0	0	110.2	K264 E265 Q266 E270 K271 F272 N502 L505	K264-I268 HydrophobicContact CG-CD1 4.13Å; K264-I268 VanDerWaalsContact O-CG1 3.31Å; K264-I268 WeakPolarHBondContact O-CG1 3.3Å; K264-I268 PolarHBondContact O-N 3.35Å; E265-I268 PolarHBondContact O-N 2.69Å; Q266-I268 VanDerWaalsContact C-N 3.34Å; Q266-I268 PolarHBondContact O-N 2.98Å; I268-E270 VanDerWaalsContact C-N 3.28Å; I268-E270 PolarHBondContact O-N 3.01Å; I268-K271 WeakPolarHBondContact O-CB 3.5Å; I268-K271 PolarHBondContact O-N 3.44Å; I268-K271 VanDerWaalsContact O-N 3.09Å; I268-F272 HydrophobicContact CG2-CD2 3.84Å; I268-F272 HydrophobicContact CG2-CE2 3.98Å; I268-F272 VanDerWaalsContact O-CD2 3.3Å; I268-F272 WeakPolarHBondContact O-CD2 3.31Å; I268-F272 PolarHBondContact O-N 3.34Å; I268-F272 VanDerWaalsContact O-N 3.08Å; I268-N502 HydrophobicContact CG2-CB 4.08Å; I268-L505 HydrophobicContact CG2-CD1 3.95Å; I268-L505 HydrophobicContact CG2-CD2 4.05Å; I268-L505 HydrophobicContact CG2-CG 4.47Å
269	V	79.2	Confident	73	Confident	76 Å²	76	109.1 Å²	109.1	46%	0.461	57%	0.569	S	S	.	*	H	α-helix	trans	-56.7	-43.5	177.2	170.9	0	0	0	0	110.9	E265 Q266 F272 R273 L505	E265-V269 VanDerWaalsContact O-CG2 3.3Å; E265-V269 WeakPolarHBondContact O-CG2 3.5Å; E265-V269 PolarHBondContact O-N 2.93Å; Q266-V269 PolarHBondContact O-N 3.44Å; V269-F272 PolarHBondContact O-N 3.29Å; V269-R273 PolarHBondContact O-N 3.49Å; V269-L505 HydrophobicContact CB-CD2 4.42Å; V269-L505 HydrophobicContact CG2-CD2 3.45Å; V269-L505 VanDerWaalsContact CG2-CD2 3.45Å
270	E	79.7	Confident	72.1	Confident	134 Å²	134	109 Å²	109	63%	0.626	57%	0.573	S	S	*	*	H	α-helix	trans	-64.7	-38.6	176.4	-75.4	-176.1	166.2	0	0	112.9	Q266 S267 I268 F272 R273	Q266-E270 WeakPolarHBondContact O-CG 3.49Å; Q266-E270 PolarHBondContact O-N 2.74Å; S267-E270 PolarHBondContact O-N 3.21Å; I268-E270 VanDerWaalsContact C-N 3.28Å; I268-E270 PolarHBondContact O-N 3.01Å; E270-F272 VanDerWaalsContact C-N 3.33Å; E270-F272 PolarHBondContact O-N 2.91Å; E270-R273 VanDerWaalsContact O-CB 3.26Å; E270-R273 WeakPolarHBondContact O-CB 3.42Å; E270-R273 PolarHBondContact O-N 3.43Å
271	K	80.7	Confident	71.5	Confident	133 Å²	133	112.3 Å²	112.3	58%	0.578	58%	0.578	S	S	*	*	H	α-helix	trans	-63.4	-39	177.8	-172.3	179.4	-178.8	179.3	0	112.3	S267 I268 R273	S267-K271 WeakPolarHBondContact O-CB 3.25Å; S267-K271 PolarHBondContact O-N 2.9Å; I268-K271 WeakPolarHBondContact O-CB 3.5Å; I268-K271 PolarHBondContact O-N 3.44Å; I268-K271 VanDerWaalsContact O-N 3.09Å; K271-R273 VanDerWaalsContact C-N 3.34Å
272	F	75.2	Confident	71.3	Confident	63 Å²	63	114.9 Å²	114.9	28%	0.276	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90	0.8	178.3	-70.5	-74.7	0	0	0	113.6	I268 V269 E270 S274 N502 L505 R530 P533	I268-F272 HydrophobicContact CG2-CD2 3.84Å; I268-F272 HydrophobicContact CG2-CE2 3.98Å; I268-F272 VanDerWaalsContact O-CD2 3.3Å; I268-F272 WeakPolarHBondContact O-CD2 3.31Å; I268-F272 PolarHBondContact O-N 3.34Å; I268-F272 VanDerWaalsContact O-N 3.08Å; V269-F272 PolarHBondContact O-N 3.29Å; E270-F272 VanDerWaalsContact C-N 3.33Å; E270-F272 PolarHBondContact O-N 2.91Å; F272-S274 PolarHBondContact O-N 2.73Å; F272-N502 WeakPolarHBondContact CE2-ND2 3.48Å; F272-L505 HydrophobicContact CD2-CD1 4.03Å; F272-R530 HydrophobicContact CB-CG 4.37Å; F272-R530 HydrophobicContact CD1-CG 3.95Å; F272-R530 HydrophobicContact CG-CG 4.27Å; F272-P533 HydrophobicContact CE1-CB 4.08Å; F272-P533 HydrophobicContact CZ-CB 3.77Å; F272-P533 HydrophobicContact CZ-CG 3.83Å
273	R	71.1	Confident	71.4	Confident	186 Å²	186	114.3 Å²	114.3	70%	0.702	58%	0.575	S	S	*	*	S	Bend	trans	-68.1	125.4	171.3	-159.5	175.5	-164.1	145	5.8	108.7	V269 E270 K271 R275	V269-R273 PolarHBondContact O-N 3.49Å; E270-R273 VanDerWaalsContact O-CB 3.26Å; E270-R273 WeakPolarHBondContact O-CB 3.42Å; E270-R273 PolarHBondContact O-N 3.43Å; K271-R273 VanDerWaalsContact C-N 3.34Å; R273-R275 PolarHBondContact O-N 2.88Å
274	S	65.3	Low	71.4	Confident	73 Å²	73	111 Å²	111	51%	0.51	55%	0.547	S	S	.	.			trans	-51.3	114.1	-178.6	-48.5	0	0	0	0	111.1	F272 G276 R277	F272-S274 PolarHBondContact O-N 2.73Å; S274-G276 PolarHBondContact O-N 3.3Å; S274-G276 VanDerWaalsContact O-N 3.12Å; S274-R277 PolarHBondContact O-N 2.93Å
275	R	54.3	Low	71.6	Confident	253 Å²	253	109.9 Å²	109.9	96%	0.955	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	114.4	177.6	-73	-175.9	170.1	-169.9	-3.5	108.3	R273	R273-R275 PolarHBondContact O-N 2.88Å
276	G	50.7	Low	71.7	Confident	77 Å²	77	107.8 Å²	107.8	79%	0.794	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.3	12.6	179.7	0	0	0	0	0	116.4	S274	S274-G276 PolarHBondContact O-N 3.3Å; S274-G276 VanDerWaalsContact O-N 3.12Å
277	R	45.3	Very low	71.6	Confident	218 Å²	218	104 Å²	104	82%	0.823	53%	0.526	S	S	*	.			trans	47.4	93.5	-164.7	-75.9	-171.3	-161.2	-153.8	4.1	108.2	S274 Q279	S274-R277 PolarHBondContact O-N 2.93Å; R277-Q279 PolarHBondContact O-N 3.36Å
278	A	49.5	Very low	71.8	Confident	65 Å²	65	100.8 Å²	100.8	54%	0.537	50%	0.504	S	S	.	.			trans	-50.9	104.8	153.1	0	0	0	0	0	105.3	V280	A278-V280 PolarHBondContact O-N 3.01Å
279	Q	54.3	Low	71.9	Confident	157 Å²	157	104.1 Å²	104.1	73%	0.734	52%	0.517	S	S	*	.			trans	-66.8	98.9	176.8	-81.3	-179.5	1.4	0	0	102.7	R277 Q281	R277-Q279 PolarHBondContact O-N 3.36Å; Q279-Q281 VanDerWaalsContact C-N 3.28Å; Q279-Q281 PolarHBondContact O-N 3.43Å
280	V	65	Low	72.1	Confident	122 Å²	122	105.2 Å²	105.2	74%	0.739	52%	0.517	S	S	*	.			trans	-56.2	106	167.3	175.1	0	0	0	0	104.3	A278 E282	A278-V280 PolarHBondContact O-N 3.01Å; V280-E282 HydrophobicContact CG1-CG 4.46Å; V280-E282 PolarHBondContact O-N 2.95Å
281	Q	70.9	Confident	72.3	Confident	126 Å²	126	102.2 Å²	102.2	59%	0.589	50%	0.503	S	S	*	.			trans	-81.8	102.9	178.9	-72.4	-169.6	-19.9	0	0	106.6	Q279 L305	Q279-Q281 VanDerWaalsContact C-N 3.28Å; Q279-Q281 PolarHBondContact O-N 3.43Å; Q281-L305 HydrophobicContact CB-CD1 3.57Å; Q281-L305 HydrophobicContact CB-CG 3.88Å
282	E	79.8	Confident	72.5	Confident	115 Å²	115	96.6 Å²	96.6	54%	0.537	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-74.1	139.8	178.1	-63	178.5	173.7	0	0	109.7	V280 K304 L305	V280-E282 HydrophobicContact CG1-CG 4.46Å; V280-E282 PolarHBondContact O-N 2.95Å; E282-K304 HydrophobicContact CB-CD 4.42Å; E282-K304 HydrophobicContact CB-CG 4.44Å; E282-K304 CarbonylContact O-C 3.51Å; E282-K304 WeakPolarHBondContact O-CA 3.28Å; E282-K304 VanDerWaalsContact O-CB 3.28Å; E282-K304 WeakPolarHBondContact O-CB 3.5Å; E282-K304 IonicContact OE2-NZ 3.85Å; E282-L305 PolarHBondContact O-N 3.43Å
283	F	84.1	Confident	73	Confident	59 Å²	59	98.9 Å²	98.9	26%	0.259	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	143.9	167	-67.7	-77.1	0	0	0	110.2	L305 F307 Q471	F283-L305 HydrophobicContact CD1-CB 3.76Å; F283-L305 HydrophobicContact CD1-CD1 4.41Å; F283-L305 HydrophobicContact CE1-CB 4.09Å; F283-L305 HydrophobicContact CE1-CD1 4.08Å; F283-L305 HydrophobicContact CZ-CD1 4.4Å; F283-F307 HydrophobicContact CB-CE2 4.48Å; F283-F307 HydrophobicContact CD1-CE1 4.03Å; F283-F307 AromaticContact CD1-CE2 3.57Å; F283-F307 HydrophobicContact CD1-CE2 3.57Å; F283-F307 AromaticContact CD1-CZ 3.24Å; F283-F307 HydrophobicContact CD1-CZ 3.24Å; F283-F307 AromaticContact CE1-CE1 3.66Å; F283-F307 HydrophobicContact CE1-CE1 3.66Å; F283-F307 HydrophobicContact CE1-CE2 4.08Å; F283-F307 AromaticContact CE1-CZ 3.26Å; F283-F307 HydrophobicContact CE1-CZ 3.26Å; F283-F307 HydrophobicContact CG-CE2 4.22Å; F283-F307 HydrophobicContact CG-CZ 4.04Å; F283-F307 HydrophobicContact CZ-CE1 4.49Å; F283-F307 HydrophobicContact CZ-CZ 4.07Å; F283-Q471 HydrophobicContact CD2-CG 3.55Å; F283-Q471 HydrophobicContact CE2-CG 3.69Å; F283-Q471 HydrophobicContact CG-CG 4.33Å
284	C	85.1	Confident	73.6	Confident	10 Å²	10	99.2 Å²	99.2	7%	0.068	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	135.2	174.4	-172.9	0	0	0	0	110.4	H286 G287 C292 K304 L305 H306	C284-H286 PolarHBondContact O-N 2.82Å; C284-H286 VanDerWaalsContact O-N 3.15Å; C284-G287 PolarHBondContact O-N 3.49Å; C284-C292 VanDerWaalsContact SG-SG 3.63Å; C284-K304 HydrophobicContact CB-CB 3.88Å; C284-K304 HydrophobicContact CB-CD 4.46Å; C284-L305 WeakPolarHBondContact CB-O 3.49Å; C284-L305 PolarHBondContact N-O 2.79Å; C284-H306 VanDerWaalsContact CB-CD2 3.48Å; C284-H306 WeakPolarHBondContact CB-CD2 3.33Å; C284-H306 WeakPolarHBondContact CB-NE2 3.4Å; C284-H306 PolarHBondContact SG-NE2 3.44Å
285	D	83.9	Confident	74.3	Confident	138 Å²	138	98.6 Å²	98.6	74%	0.738	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.4	-23.4	179.6	-58.2	-64.5	0	0	0	112.5	G287 K304	D285-G287 VanDerWaalsContact C-N 3.34Å; D285-K304 IonicContact OD2-NZ 3.61Å; D285-K304 PolarHBondContact OD2-NZ 2.97Å
286	H	82.9	Confident	75	Confident	52 Å²	52	89.2 Å²	89.2	24%	0.241	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-4.1	176	-57.3	-69.5	0	0	0	113.7	C284 T288 E291 C292 S295 D297	C284-H286 PolarHBondContact O-N 2.82Å; C284-H286 VanDerWaalsContact O-N 3.15Å; H286-T288 VanDerWaalsContact C-N 3.27Å; H286-T288 PolarHBondContact O-N 2.87Å; H286-E291 HydrophobicContact CB-CB 4.12Å; H286-E291 VanDerWaalsContact O-OE2 3.05Å; H286-C292 HydrophobicContact CB-CB 3.95Å; H286-S295 WeakPolarHBondContact CE1-CB 3.26Å; H286-S295 PolarHBondContact CE1-OG 3.41Å; H286-S295 VanDerWaalsContact CE1-OG 3.3Å; H286-S295 PolarHBondContact ND1-OG 3.22Å; H286-D297 IonicContact CE1-OD2 2.77Å; H286-D297 IonicContact NE2-OD2 2.75Å
287	G	82.3	Confident	75.5	Confident	20 Å²	20	91.6 Å²	91.6	21%	0.206	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	71.5	-71.7	178.8	0	0	0	0	0	113.4	C284 D285 H306 F307	C284-G287 PolarHBondContact O-N 3.49Å; D285-G287 VanDerWaalsContact C-N 3.34Å; G287-H306 CarbonylContact O-C 3.52Å; G287-H306 WeakPolarHBondContact O-CA 3.39Å; G287-F307 WeakPolarHBondContact O-CD2 3.49Å; G287-F307 PolarHBondContact O-N 3.33Å
288	T	85.9	Confident	76	Confident	3 Å²	3	85.4 Å²	85.4	2%	0.018	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	155.9	-179	89.2	0	0	0	0	113	H286 E290 E291 C292 F307 R309 Y339	H286-T288 VanDerWaalsContact C-N 3.27Å; H286-T288 PolarHBondContact O-N 2.87Å; T288-E290 VanDerWaalsContact C-N 3.31Å; T288-E290 WeakPolarHBondContact CB-OE2 3.49Å; T288-E290 PolarHBondContact O-N 3.24Å; T288-E290 PolarHBondContact OG1-OE2 3.09Å; T288-E291 PolarHBondContact O-N 3.42Å; T288-E291 PolarHBondContact OG1-N 2.94Å; T288-C292 PolarHBondContact O-N 2.91Å; T288-F307 VanDerWaalsContact CA-O 3.32Å; T288-F307 WeakPolarHBondContact CA-O 3.44Å; T288-F307 VanDerWaalsContact CB-O 3.29Å; T288-F307 WeakPolarHBondContact CB-O 3.22Å; T288-R309 HydrophobicContact CG2-CG 4.34Å; T288-Y339 HydrophobicContact CG2-CE1 3.99Å
289	K	84.4	Confident	76.5	Confident	107 Å²	107	88.8 Å²	88.8	47%	0.465	48%	0.475	S	S	.	.	H	α-helix	trans	-65.5	-35.6	-179.7	-170.3	168.1	-178.2	174.9	0	112	E291 C292 V293 H306 D342	K289-E291 VanDerWaalsContact C-N 3.33Å; K289-E291 PolarHBondContact O-N 3.02Å; K289-C292 PolarHBondContact O-N 2.82Å; K289-V293 HydrophobicContact CG-CG2 4.47Å; K289-V293 WeakPolarHBondContact O-CB 3.19Å; K289-V293 VanDerWaalsContact O-CG2 3.25Å; K289-V293 WeakPolarHBondContact O-CG2 3.28Å; K289-V293 PolarHBondContact O-N 2.97Å; K289-H306 HydrophobicContact CB-CB 4.17Å; K289-D342 WeakPolarHBondContact CD-OD2 3.38Å; K289-D342 IonicContact NZ-OD2 3.46Å
290	E	82.9	Confident	77.2	Confident	98 Å²	98	88.1 Å²	88.1	46%	0.458	47%	0.472	S	S	.	.	H	α-helix	trans	-66.3	-36.9	178.2	-54.7	73.2	-154.3	0	0	111.8	T288 R294	T288-E290 VanDerWaalsContact C-N 3.31Å; T288-E290 WeakPolarHBondContact CB-OE2 3.49Å; T288-E290 PolarHBondContact O-N 3.24Å; T288-E290 PolarHBondContact OG1-OE2 3.09Å; E290-R294 VanDerWaalsContact O-CB 3.27Å; E290-R294 WeakPolarHBondContact O-CB 3.18Å; E290-R294 PolarHBondContact O-N 3.01Å
291	E	84.9	Confident	77.7	Confident	72 Å²	72	87.3 Å²	87.3	34%	0.336	47%	0.47	S	S	.	.	H	α-helix	trans	-72	-43.3	175.7	-71.9	-179.9	-168.6	0	0	110.8	H286 T288 K289 V293 R294 S295 R309	H286-E291 HydrophobicContact CB-CB 4.12Å; H286-E291 VanDerWaalsContact O-OE2 3.05Å; T288-E291 PolarHBondContact O-N 3.42Å; T288-E291 PolarHBondContact OG1-N 2.94Å; K289-E291 VanDerWaalsContact C-N 3.33Å; K289-E291 PolarHBondContact O-N 3.02Å; E291-V293 PolarHBondContact O-N 2.85Å; E291-R294 PolarHBondContact O-N 2.75Å; E291-S295 PolarHBondContact O-N 3.05Å; E291-S295 PolarHBondContact O-OG 3.13Å; E291-R309 IonicContact OE1-CZ 3.74Å; E291-R309 IonicContact OE1-NH1 2.68Å; E291-R309 IonicContact OE1-NH2 2.68Å; E291-R309 PolarHBondContact OE1-NH2 2.85Å
292	C	85.6	Confident	78.2	Confident	15 Å²	15	83.4 Å²	83.4	10%	0.101	46%	0.456	C	S	.	.	H	α-helix	trans	-59	-45.4	176	-173.9	0	0	0	0	112.6	C284 H286 T288 K289 R294 S295 G296 C302 H306	C284-C292 VanDerWaalsContact SG-SG 3.63Å; H286-C292 HydrophobicContact CB-CB 3.95Å; T288-C292 PolarHBondContact O-N 2.91Å; K289-C292 PolarHBondContact O-N 2.82Å; C292-R294 VanDerWaalsContact C-N 3.31Å; C292-R294 PolarHBondContact O-N 3.17Å; C292-S295 PolarHBondContact O-N 3.2Å; C292-G296 PolarHBondContact O-N 3.43Å; C292-C302 WeakPolarHBondContact SG-CB 3.5Å; C292-H306 VanDerWaalsContact CB-NE2 3.34Å; C292-H306 WeakPolarHBondContact CB-NE2 3.44Å; C292-H306 PolarHBondContact SG-NE2 2.86Å; C292-H306 VanDerWaalsContact SG-NE2 3.44Å
293	V	84.3	Confident	78.2	Confident	110 Å²	110	84.9 Å²	84.9	67%	0.667	47%	0.473	S	S	*	.	H	α-helix	trans	-66.2	-36.2	178.6	171.5	0	0	0	0	111.2	K289 E291 G296	K289-V293 HydrophobicContact CG-CG2 4.47Å; K289-V293 WeakPolarHBondContact O-CB 3.19Å; K289-V293 VanDerWaalsContact O-CG2 3.25Å; K289-V293 WeakPolarHBondContact O-CG2 3.28Å; K289-V293 PolarHBondContact O-N 2.97Å; E291-V293 PolarHBondContact O-N 2.85Å; V293-G296 PolarHBondContact O-N 3.39Å
294	R	83.6	Confident	78.2	Confident	194 Å²	194	85 Å²	85	73%	0.732	47%	0.473	S	S	*	.	H	α-helix	trans	-70.9	-34.6	179.9	-168.6	-174.5	-45.2	-173.5	5.7	112.9	E290 E291 C292 G296	E290-R294 VanDerWaalsContact O-CB 3.27Å; E290-R294 WeakPolarHBondContact O-CB 3.18Å; E290-R294 PolarHBondContact O-N 3.01Å; E291-R294 PolarHBondContact O-N 2.75Å; C292-R294 VanDerWaalsContact C-N 3.31Å; C292-R294 PolarHBondContact O-N 3.17Å; R294-G296 VanDerWaalsContact C-N 3.32Å
295	S	79.8	Confident	78.2	Confident	60 Å²	60	86 Å²	86	42%	0.42	48%	0.477	S	S	.	.	H	α-helix	trans	-70.9	-26.6	176.6	-72.9	0	0	0	0	112.9	H286 E291 C292 D297	H286-S295 WeakPolarHBondContact CE1-CB 3.26Å; H286-S295 PolarHBondContact CE1-OG 3.41Å; H286-S295 VanDerWaalsContact CE1-OG 3.3Å; H286-S295 PolarHBondContact ND1-OG 3.22Å; E291-S295 PolarHBondContact O-N 3.05Å; E291-S295 PolarHBondContact O-OG 3.13Å; C292-S295 PolarHBondContact O-N 3.2Å; S295-D297 VanDerWaalsContact C-N 3.3Å; S295-D297 PolarHBondContact O-N 3.35Å
296	G	68.7	Low	78.4	Confident	55 Å²	55	79.9 Å²	79.9	57%	0.567	45%	0.445	S	S	*	.			trans	68.2	20.7	165.5	0	0	0	0	0	115.9	C292 V293 R294 T298	C292-G296 PolarHBondContact O-N 3.43Å; V293-G296 PolarHBondContact O-N 3.39Å; R294-G296 VanDerWaalsContact C-N 3.32Å; G296-T298 VanDerWaalsContact C-N 3.26Å; G296-T298 PolarHBondContact O-N 3.23Å
297	D	61.8	Low	78.6	Confident	128 Å²	128	77.8 Å²	77.8	68%	0.684	44%	0.435	S	S	*	.			trans	-72.8	-9.3	-171.1	-82.7	-39.2	0	0	0	114.9	H286 S295	H286-D297 IonicContact CE1-OD2 2.77Å; H286-D297 IonicContact NE2-OD2 2.75Å; S295-D297 VanDerWaalsContact C-N 3.3Å; S295-D297 PolarHBondContact O-N 3.35Å
298	T	56.5	Low	78.9	Confident	88 Å²	88	81 Å²	81	54%	0.54	44%	0.441	S	S	.	.			trans	-141.8	139.9	174.2	52.9	0	0	0	0	113.8	G296 Q300	G296-T298 VanDerWaalsContact C-N 3.26Å; G296-T298 PolarHBondContact O-N 3.23Å; T298-Q300 PolarHBondContact O-N 3.28Å; T298-Q300 VanDerWaalsContact O-N 3.14Å; T298-Q300 PolarHBondContact OG1-O 3.44Å
299	P	60.6	Low	79	Confident	135 Å²	135	84.7 Å²	84.7	88%	0.877	45%	0.454	S	S	*	.	S	Bend	trans	-71.2	-0.9	174	28.4	-33.7	0	0	0	113.9
300	Q	68.3	Low	79.1	Confident	143 Å²	143	81.6 Å²	81.6	67%	0.668	44%	0.442	S	S	*	.	S	Bend	trans	-114.5	149.7	177.5	-66.8	-65.6	-19.3	0	0	109.9	T298 C302	T298-Q300 PolarHBondContact O-N 3.28Å; T298-Q300 VanDerWaalsContact O-N 3.14Å; T298-Q300 PolarHBondContact OG1-O 3.44Å; Q300-C302 PolarHBondContact O-N 3.3Å
301	P	75.4	Confident	79.2	Confident	106 Å²	106	80.4 Å²	80.4	69%	0.688	44%	0.438	S	S	*	.			trans	-59.9	130.7	174.6	25.8	-32.9	0	0	0	109.8	T303	P301-T303 PolarHBondContact O-N 3.3Å
302	C	80.8	Confident	79.2	Confident	44 Å²	44	79.8 Å²	79.8	30%	0.297	44%	0.437	S	S	.	.			trans	-61.3	127.3	-178.1	-177.4	0	0	0	0	110.6	C292 Q300 H306	C292-C302 WeakPolarHBondContact SG-CB 3.5Å; Q300-C302 PolarHBondContact O-N 3.3Å; C302-H306 PolarHBondContact SG-CE1 3.23Å
303	T	79.7	Confident	79.3	Confident	146 Å²	146	89.6 Å²	89.6	90%	0.896	48%	0.478	S	S	*	.			trans	-90.7	-1	-178.5	58	0	0	0	0	113.3	P301	P301-T303 PolarHBondContact O-N 3.3Å
304	K	84.1	Confident	79.3	Confident	62 Å²	62	87.3 Å²	87.3	27%	0.27	46%	0.46	S	S	.	.	S	Bend	trans	-76	159.5	176.5	-65.2	-172.7	176.1	-169.5	0	110.8	E282 C284 D285 H306	E282-K304 HydrophobicContact CB-CD 4.42Å; E282-K304 HydrophobicContact CB-CG 4.44Å; E282-K304 CarbonylContact O-C 3.51Å; E282-K304 WeakPolarHBondContact O-CA 3.28Å; E282-K304 VanDerWaalsContact O-CB 3.28Å; E282-K304 WeakPolarHBondContact O-CB 3.5Å; E282-K304 IonicContact OE2-NZ 3.85Å; C284-K304 HydrophobicContact CB-CB 3.88Å; C284-K304 HydrophobicContact CB-CD 4.46Å; D285-K304 IonicContact OD2-NZ 3.61Å; D285-K304 PolarHBondContact OD2-NZ 2.97Å; K304-H306 PolarHBondContact O-CE1 2.75Å; K304-H306 PolarHBondContact O-ND1 3.27Å
305	L	85.6	Confident	79.6	Confident	30 Å²	30	79 Å²	79	16%	0.157	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	131.8	174.6	-70.8	174.3	0	0	0	110.4	Q281 E282 F283 C284 I341	Q281-L305 HydrophobicContact CB-CD1 3.57Å; Q281-L305 HydrophobicContact CB-CG 3.88Å; E282-L305 PolarHBondContact O-N 3.43Å; F283-L305 HydrophobicContact CD1-CB 3.76Å; F283-L305 HydrophobicContact CD1-CD1 4.41Å; F283-L305 HydrophobicContact CE1-CB 4.09Å; F283-L305 HydrophobicContact CE1-CD1 4.08Å; F283-L305 HydrophobicContact CZ-CD1 4.4Å; C284-L305 WeakPolarHBondContact CB-O 3.49Å; C284-L305 PolarHBondContact N-O 2.79Å; L305-I341 HydrophobicContact CD2-CG2 4Å
306	H	87.6	Confident	80	Confident	10 Å²	10	79.5 Å²	79.5	5%	0.046	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	157.1	174.6	-62.1	81.3	0	0	0	110.1	C284 G287 K289 C292 C302 K304 D342	C284-H306 VanDerWaalsContact CB-CD2 3.48Å; C284-H306 WeakPolarHBondContact CB-CD2 3.33Å; C284-H306 WeakPolarHBondContact CB-NE2 3.4Å; C284-H306 PolarHBondContact SG-NE2 3.44Å; G287-H306 CarbonylContact O-C 3.52Å; G287-H306 WeakPolarHBondContact O-CA 3.39Å; K289-H306 HydrophobicContact CB-CB 4.17Å; C292-H306 VanDerWaalsContact CB-NE2 3.34Å; C292-H306 WeakPolarHBondContact CB-NE2 3.44Å; C292-H306 PolarHBondContact SG-NE2 2.86Å; C292-H306 VanDerWaalsContact SG-NE2 3.44Å; C302-H306 PolarHBondContact SG-CE1 3.23Å; K304-H306 PolarHBondContact O-CE1 2.75Å; K304-H306 PolarHBondContact O-ND1 3.27Å; H306-D342 HydrophobicContact CB-CB 4.28Å; H306-D342 WeakPolarHBondContact O-CB 3.44Å; H306-D342 PolarHBondContact O-N 3.3Å
307	F	88.2	Confident	81	Confident	8 Å²	8	82.9 Å²	82.9	4%	0.035	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	137.7	172.2	-60.3	-77	0	0	0	110.4	F283 G287 T288 Y339 E340 I341 Q469 L470	F283-F307 HydrophobicContact CB-CE2 4.48Å; F283-F307 HydrophobicContact CD1-CE1 4.03Å; F283-F307 AromaticContact CD1-CE2 3.57Å; F283-F307 HydrophobicContact CD1-CE2 3.57Å; F283-F307 AromaticContact CD1-CZ 3.24Å; F283-F307 HydrophobicContact CD1-CZ 3.24Å; F283-F307 AromaticContact CE1-CE1 3.66Å; F283-F307 HydrophobicContact CE1-CE1 3.66Å; F283-F307 HydrophobicContact CE1-CE2 4.08Å; F283-F307 AromaticContact CE1-CZ 3.26Å; F283-F307 HydrophobicContact CE1-CZ 3.26Å; F283-F307 HydrophobicContact CG-CE2 4.22Å; F283-F307 HydrophobicContact CG-CZ 4.04Å; F283-F307 HydrophobicContact CZ-CE1 4.49Å; F283-F307 HydrophobicContact CZ-CZ 4.07Å; G287-F307 WeakPolarHBondContact O-CD2 3.49Å; G287-F307 PolarHBondContact O-N 3.33Å; T288-F307 VanDerWaalsContact CA-O 3.32Å; T288-F307 WeakPolarHBondContact CA-O 3.44Å; T288-F307 VanDerWaalsContact CB-O 3.29Å; T288-F307 WeakPolarHBondContact CB-O 3.22Å; F307-Y339 HydrophobicContact CB-CD1 3.69Å; F307-Y339 HydrophobicContact CB-CG 4.24Å; F307-E340 CarbonylContact C-O 3.59Å; F307-E340 VanDerWaalsContact CA-O 3.31Å; F307-E340 WeakPolarHBondContact CA-O 3.27Å; F307-I341 HydrophobicContact CE1-CG1 4.37Å; F307-Q469 HydrophobicContact CE1-CG 4.03Å; F307-Q469 WeakPolarHBondContact CE1-O 3.29Å; F307-Q469 WeakPolarHBondContact CZ-O 3.32Å; F307-L470 HydrophobicContact CB-CD2 4.34Å; F307-L470 HydrophobicContact CD1-CD2 3.97Å; F307-L470 HydrophobicContact CD2-CD2 3.53Å; F307-L470 HydrophobicContact CE1-CD2 4.11Å; F307-L470 HydrophobicContact CE2-CD2 3.68Å; F307-L470 HydrophobicContact CG-CD2 3.67Å; F307-L470 HydrophobicContact CZ-CD2 3.97Å
308	R	87.7	Confident	82.3	Confident	87 Å²	87	81.6 Å²	81.6	33%	0.328	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.4	170.6	-167.3	-175.4	-52.2	129.5	-5.6	108.8	Y339 E340 D342	R308-Y339 CarbonylContact O-C 3.53Å; R308-Y339 VanDerWaalsContact O-CA 3.25Å; R308-Y339 WeakPolarHBondContact O-CA 3.35Å; R308-E340 HydrophobicContact CB-CG 3.84Å; R308-E340 WeakPolarHBondContact CD-OE1 3.32Å; R308-E340 IonicContact CZ-OE1 3.65Å; R308-E340 PolarHBondContact N-O 3.23Å; R308-E340 IonicContact NE-OE1 3.89Å; R308-E340 IonicContact NH1-OE1 2.69Å; R308-E340 PolarHBondContact NH1-OE1 2.9Å; R308-E340 PolarHBondContact O-N 2.83Å; R308-D342 HydrophobicContact CB-CB 4.43Å; R308-D342 IonicContact CZ-OD1 2.68Å; R308-D342 IonicContact NE-OD1 3.94Å; R308-D342 PolarHBondContact NE-OD1 2.83Å; R308-D342 IonicContact NH2-OD1 3.67Å; R308-D342 PolarHBondContact NH2-OD1 2.86Å
309	R	89.4	Confident	83.7	Confident	80 Å²	80	81.2 Å²	81.2	30%	0.302	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	131.6	178.2	-70.6	175.7	177.6	127.7	4.2	110.6	T288 E291 I311 V337 H338 Y339	T288-R309 HydrophobicContact CG2-CG 4.34Å; E291-R309 IonicContact OE1-CZ 3.74Å; E291-R309 IonicContact OE1-NH1 2.68Å; E291-R309 IonicContact OE1-NH2 2.68Å; E291-R309 PolarHBondContact OE1-NH2 2.85Å; R309-I311 HydrophobicContact CB-CD1 4.05Å; R309-I311 HydrophobicContact CB-CG1 4.09Å; R309-V337 HydrophobicContact CB-CG1 4.15Å; R309-V337 HydrophobicContact CG-CG1 3.92Å; R309-H338 CarbonylContact C-O 3.51Å; R309-H338 WeakPolarHBondContact CA-O 3.41Å; R309-Y339 HydrophobicContact CG-CD1 3.89Å; R309-Y339 HydrophobicContact CG-CE1 3.41Å; R309-Y339 VanDerWaalsContact CG-CE1 3.41Å
310	I	85.6	Confident	84.9	Confident	42 Å²	42	76.1 Å²	76.1	22%	0.215	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	104.4	170.4	-54.1	172.1	0	0	0	107.5	H338 E340	I310-H338 HydrophobicContact CB-CB 4.19Å; I310-H338 HydrophobicContact CD1-CB 4.23Å; I310-H338 PolarHBondContact N-O 2.67Å; I310-E340 HydrophobicContact CD1-CB 4.24Å; I310-E340 HydrophobicContact CG1-CB 4.43Å; I310-E340 HydrophobicContact CG1-CG 4.25Å
311	I	85.2	Confident	85.8	Confident	73 Å²	73	72.1 Å²	72.1	37%	0.374	38%	0.381	S	S	.	.			trans	-111.2	105.2	-179.9	-53.8	-59.4	0	0	0	109.3	R309 T315 E317 V337	R309-I311 HydrophobicContact CB-CD1 4.05Å; R309-I311 HydrophobicContact CB-CG1 4.09Å; I311-T315 HydrophobicContact CD1-CG2 4.08Å; I311-E317 HydrophobicContact CD1-CG 3.88Å; I311-V337 HydrophobicContact CD1-CG1 3.94Å; I311-V337 HydrophobicContact CD1-CG2 4.01Å
312	N	84.8	Confident	86.2	Confident	60 Å²	60	67.4 Å²	67.4	32%	0.321	35%	0.35	S	S	.	.			trans	-94.4	168.6	176.3	-69.6	-34	0	0	0	111.3	H314 T315	N312-H314 WeakPolarHBondContact CB-CE1 3.45Å; N312-H314 WeakPolarHBondContact CB-ND1 3.34Å; N312-H314 PolarHBondContact O-N 3.36Å; N312-H314 VanDerWaalsContact O-N 3.09Å; N312-T315 PolarHBondContact N-OG1 3.44Å; N312-T315 VanDerWaalsContact N-OG1 3.09Å; N312-T315 WeakPolarHBondContact O-CB 3.35Å; N312-T315 PolarHBondContact O-N 2.97Å; N312-T315 PolarHBondContact O-OG1 3.45Å
313	K	87.1	Confident	86.2	Confident	220 Å²	220	68.4 Å²	68.4	96%	0.957	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-28.2	-179.5	-68.1	-177	-179.4	177.2	0	114.1
314	H	85.5	Confident	86	Confident	63 Å²	63	67.7 Å²	67.7	29%	0.292	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-4.5	179.4	59.3	-80	0	0	0	113.5	N312 M331 D332 T333 C334 K335	N312-H314 WeakPolarHBondContact CB-CE1 3.45Å; N312-H314 WeakPolarHBondContact CB-ND1 3.34Å; N312-H314 PolarHBondContact O-N 3.36Å; N312-H314 VanDerWaalsContact O-N 3.09Å; H314-M331 PolarHBondContact NE2-O 3.22Å; H314-D332 PolarHBondContact CE1-O 3.37Å; H314-D332 VanDerWaalsContact NE2-C 3.3Å; H314-D332 PolarHBondContact NE2-O 3.46Å; H314-T333 PolarHBondContact NE2-N 2.94Å; H314-C334 PolarHBondContact CD2-O 3.36Å; H314-C334 PolarHBondContact NE2-N 3.4Å; H314-C334 PolarHBondContact NE2-O 3.31Å; H314-K335 WeakPolarHBondContact O-CA 3.4Å
315	T	89.6	Confident	86	Confident	19 Å²	19	64.8 Å²	64.8	12%	0.117	33%	0.33	C	S	.	.			trans	-79.1	132.1	179	-55.1	0	0	0	0	110.1	I311 N312 V337	I311-T315 HydrophobicContact CD1-CG2 4.08Å; N312-T315 PolarHBondContact N-OG1 3.44Å; N312-T315 VanDerWaalsContact N-OG1 3.09Å; N312-T315 WeakPolarHBondContact O-CB 3.35Å; N312-T315 PolarHBondContact O-N 2.97Å; N312-T315 PolarHBondContact O-OG1 3.45Å; T315-V337 HydrophobicContact CG2-CG2 4.13Å
316	D	88.6	Confident	85.7	Confident	71 Å²	71	66.8 Å²	66.8	38%	0.38	34%	0.341	S	S	.	.			trans	-115.5	108	176.2	-177.2	-12.1	0	0	0	109	S318 L319 K335	D316-S318 VanDerWaalsContact CG-OG 3.25Å; D316-S318 PolarHBondContact O-N 3.28Å; D316-S318 VanDerWaalsContact OD1-CB 3.3Å; D316-S318 WeakPolarHBondContact OD1-CB 3.38Å; D316-S318 PolarHBondContact OD1-N 2.92Å; D316-S318 PolarHBondContact OD1-OG 3.09Å; D316-S318 PolarHBondContact OD2-OG 3.5Å; D316-L319 HydrophobicContact CB-CD1 3.89Å; D316-L319 HydrophobicContact CB-CG 3.97Å; D316-L319 PolarHBondContact O-N 2.97Å; D316-L319 VanDerWaalsContact O-N 3.16Å; D316-K335 PolarHBondContact N-O 3.47Å
317	E	89.2	Confident	85.2	Confident	125 Å²	125	68.9 Å²	68.9	58%	0.584	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24.2	-178.9	-67.8	-178.9	-141.1	0	0	113	I311 L319 G320 V337	I311-E317 HydrophobicContact CD1-CG 3.88Å; E317-L319 PolarHBondContact O-N 2.87Å; E317-G320 PolarHBondContact O-N 3.46Å; E317-V337 HydrophobicContact CG-CG2 4.33Å
318	S	88.8	Confident	84.8	Confident	102 Å²	102	69.4 Å²	69.4	71%	0.713	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-70.9	-20.6	179.5	74.2	0	0	0	0	113.4	D316 G320	D316-S318 VanDerWaalsContact CG-OG 3.25Å; D316-S318 PolarHBondContact O-N 3.28Å; D316-S318 VanDerWaalsContact OD1-CB 3.3Å; D316-S318 WeakPolarHBondContact OD1-CB 3.38Å; D316-S318 PolarHBondContact OD1-N 2.92Å; D316-S318 PolarHBondContact OD1-OG 3.09Å; D316-S318 PolarHBondContact OD2-OG 3.5Å; S318-G320 VanDerWaalsContact C-N 3.3Å
319	L	85.3	Confident	84.5	Confident	79 Å²	79	74.2 Å²	74.2	41%	0.414	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-80.7	-11.6	178.3	-60.6	-179.5	0	0	0	113	D316 E317 K335 Y336	D316-L319 HydrophobicContact CB-CD1 3.89Å; D316-L319 HydrophobicContact CB-CG 3.97Å; D316-L319 PolarHBondContact O-N 2.97Å; D316-L319 VanDerWaalsContact O-N 3.16Å; E317-L319 PolarHBondContact O-N 2.87Å; L319-K335 HydrophobicContact CD1-CB 3.89Å; L319-Y336 HydrophobicContact CB-CD1 3.73Å; L319-Y336 HydrophobicContact CB-CE1 3.76Å
320	G	86.6	Confident	84.2	Confident	29 Å²	29	76.4 Å²	76.4	30%	0.299	40%	0.396	S	S	.	.			trans	78.6	-161.5	179.8	0	0	0	0	0	114.6	E317 S318 V337	E317-G320 PolarHBondContact O-N 3.46Å; S318-G320 VanDerWaalsContact C-N 3.3Å; G320-V337 PolarHBondContact O-N 3.08Å
321	D	86.8	Confident	83.9	Confident	59 Å²	59	78.1 Å²	78.1	32%	0.316	40%	0.404	S	S	.	.	B	Isolated β-bridge	trans	-74.3	140	-173.3	-57.6	-29.1	0	0	0	112.2	S323 L325 Y339 R472	D321-S323 PolarHBondContact O-N 3.09Å; D321-L325 HydrophobicContact CB-CD2 4.43Å; D321-Y339 HydrophobicContact CB-CE2 4.37Å; D321-Y339 VanDerWaalsContact OD1-CE2 3.31Å; D321-Y339 WeakPolarHBondContact OD1-CE2 3.23Å; D321-Y339 PolarHBondContact OD1-OH 2.81Å; D321-R472 IonicContact OD2-NH1 3.9Å; D321-R472 PolarHBondContact OD2-NH1 3.48Å
322	C	84.4	Confident	83.7	Confident	6 Å²	6	81.2 Å²	81.2	4%	0.041	42%	0.421	C	S	.	.			trans	-61.9	129.8	171.2	-176.7	0	0	0	0	109.5	F324 L325 Y336 V337 H338	C322-F324 PolarHBondContact O-N 2.98Å; C322-F324 VanDerWaalsContact O-N 3.15Å; C322-F324 PolarHBondContact SG-N 3.23Å; C322-L325 HydrophobicContact CB-CD2 4.44Å; C322-L325 WeakPolarHBondContact O-CD2 3.3Å; C322-L325 VanDerWaalsContact O-CG 3.28Å; C322-L325 WeakPolarHBondContact O-CG 3.26Å; C322-L325 PolarHBondContact O-N 3.46Å; C322-Y336 VanDerWaalsContact CA-CB 3.44Å; C322-V337 WeakPolarHBondContact CB-O 3.43Å; C322-V337 PolarHBondContact N-O 3.42Å; C322-H338 VanDerWaalsContact CB-NE2 3.27Å; C322-H338 WeakPolarHBondContact CB-NE2 3.4Å; C322-H338 PolarHBondContact SG-NE2 2.85Å
323	S	79.8	Confident	83.8	Confident	65 Å²	65	83.1 Å²	83.1	46%	0.455	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.9	176.7	-70.1	0	0	0	0	113.2	D321	D321-S323 PolarHBondContact O-N 3.09Å
324	F	75.3	Confident	83.8	Confident	131 Å²	131	73.4 Å²	73.4	58%	0.575	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-14.5	-178.2	-61.4	-76	0	0	0	113.5	C322 N326 T327 C328	C322-F324 PolarHBondContact O-N 2.98Å; C322-F324 VanDerWaalsContact O-N 3.15Å; C322-F324 PolarHBondContact SG-N 3.23Å; F324-N326 PolarHBondContact O-N 3.35Å; F324-T327 WeakPolarHBondContact O-CA 3.28Å; F324-T327 WeakPolarHBondContact O-CB 3.49Å; F324-T327 PolarHBondContact O-N 2.86Å; F324-T327 PolarHBondContact O-OG1 3Å; F324-C328 HydrophobicContact CB-CB 4.09Å
325	L	85	Confident	84	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.005	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	43.1	-124.9	-179.6	-62.7	-178.1	0	0	0	112.4	D321 C322 T327 C328 H338 Y339 N468 Q469 L470	D321-L325 HydrophobicContact CB-CD2 4.43Å; C322-L325 HydrophobicContact CB-CD2 4.44Å; C322-L325 WeakPolarHBondContact O-CD2 3.3Å; C322-L325 VanDerWaalsContact O-CG 3.28Å; C322-L325 WeakPolarHBondContact O-CG 3.26Å; C322-L325 PolarHBondContact O-N 3.46Å; L325-T327 PolarHBondContact O-N 2.91Å; L325-T327 VanDerWaalsContact O-N 3.11Å; L325-C328 VanDerWaalsContact O-CB 3.27Å; L325-C328 WeakPolarHBondContact O-CB 3.46Å; L325-C328 PolarHBondContact O-N 3.37Å; L325-C328 VanDerWaalsContact O-N 3.08Å; L325-H338 PolarHBondContact O-CD2 2.86Å; L325-Y339 HydrophobicContact CD2-CD2 3.81Å; L325-Y339 HydrophobicContact CD2-CE2 4.17Å; L325-N468 HydrophobicContact CD1-CB 4.01Å; L325-N468 WeakPolarHBondContact CD1-ND2 3.11Å; L325-Q469 HydrophobicContact CB-CB 4.41Å; L325-Q469 HydrophobicContact CD1-CB 3.98Å; L325-L470 HydrophobicContact CD1-CB 4.4Å; L325-L470 HydrophobicContact CD1-CD1 3.99Å; L325-L470 HydrophobicContact CD1-CG 3.74Å
326	N	79.8	Confident	83.9	Confident	73 Å²	73	80.9 Å²	80.9	39%	0.39	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-59.6	-16.6	177.1	60.7	-30.6	0	0	0	114.9	F324	F324-N326 PolarHBondContact O-N 3.35Å
327	T	77.1	Confident	83.9	Confident	53 Å²	53	77.7 Å²	77.7	33%	0.325	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-94	9.5	176.6	68.4	0	0	0	0	113.5	F324 L325 F329	F324-T327 WeakPolarHBondContact O-CA 3.28Å; F324-T327 WeakPolarHBondContact O-CB 3.49Å; F324-T327 PolarHBondContact O-N 2.86Å; F324-T327 PolarHBondContact O-OG1 3Å; L325-T327 PolarHBondContact O-N 2.91Å; L325-T327 VanDerWaalsContact O-N 3.11Å; T327-F329 PolarHBondContact O-N 2.87Å
328	C	80.1	Confident	83.9	Confident	20 Å²	20	71.8 Å²	71.8	14%	0.135	38%	0.378	C	S	.	.			trans	-70.9	118	178.9	-170	0	0	0	0	112	F324 L325 H330	F324-C328 HydrophobicContact CB-CB 4.09Å; L325-C328 VanDerWaalsContact O-CB 3.27Å; L325-C328 WeakPolarHBondContact O-CB 3.46Å; L325-C328 PolarHBondContact O-N 3.37Å; L325-C328 VanDerWaalsContact O-N 3.08Å; C328-H330 PolarHBondContact O-N 2.8Å
329	F	79.9	Confident	83.9	Confident	187 Å²	187	67.8 Å²	67.8	82%	0.82	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-12.4	176.3	-67.4	-78.8	0	0	0	114.7	T327	T327-F329 PolarHBondContact O-N 2.87Å
330	H	83.1	Confident	83.9	Confident	127 Å²	127	67.8 Å²	67.8	59%	0.588	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	39.5	-172.6	-65.3	-42.5	0	0	0	111.9	C328 D332 T333 C334	C328-H330 PolarHBondContact O-N 2.8Å; H330-D332 PolarHBondContact O-N 3.39Å; H330-D332 VanDerWaalsContact O-N 3.1Å; H330-T333 CarbonylContact O-C 3.55Å; H330-T333 PolarHBondContact O-N 3.09Å; H330-T333 PolarHBondContact O-OG1 3.3Å; H330-C334 WeakPolarHBondContact O-CA 3.49Å; H330-C334 WeakPolarHBondContact O-CB 3.35Å; H330-C334 PolarHBondContact O-N 2.93Å
331	M	79.4	Confident	83.9	Confident	77 Å²	77	69.7 Å²	69.7	38%	0.379	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-37.6	-175.3	-158.7	137.6	64.3	0	0	112.9	H314 T333	H314-M331 PolarHBondContact NE2-O 3.22Å; M331-T333 VanDerWaalsContact C-N 3.28Å; M331-T333 PolarHBondContact O-N 3.47Å
332	D	82.2	Confident	83.5	Confident	139 Å²	139	68.6 Å²	68.6	74%	0.743	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.2	179.7	-56.9	-31.6	0	0	0	114.9	H314 H330	H314-D332 PolarHBondContact CE1-O 3.37Å; H314-D332 VanDerWaalsContact NE2-C 3.3Å; H314-D332 PolarHBondContact NE2-O 3.46Å; H330-D332 PolarHBondContact O-N 3.39Å; H330-D332 VanDerWaalsContact O-N 3.1Å
333	T	86.6	Confident	82.6	Confident	100 Å²	100	70.2 Å²	70.2	61%	0.613	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.2	-3.3	179.8	57.9	0	0	0	0	113.6	H314 H330 M331	H314-T333 PolarHBondContact NE2-N 2.94Å; H330-T333 CarbonylContact O-C 3.55Å; H330-T333 PolarHBondContact O-N 3.09Å; H330-T333 PolarHBondContact O-OG1 3.3Å; M331-T333 VanDerWaalsContact C-N 3.28Å; M331-T333 PolarHBondContact O-N 3.47Å
334	C	86.1	Confident	81.5	Confident	16 Å²	16	71.4 Å²	71.4	11%	0.108	36%	0.36	C	S	.	.			trans	-77	124.4	-176.5	179.5	0	0	0	0	111.3	H314 H330 Y336 H338	H314-C334 PolarHBondContact CD2-O 3.36Å; H314-C334 PolarHBondContact NE2-N 3.4Å; H314-C334 PolarHBondContact NE2-O 3.31Å; H330-C334 WeakPolarHBondContact O-CA 3.49Å; H330-C334 WeakPolarHBondContact O-CB 3.35Å; H330-C334 PolarHBondContact O-N 2.93Å; C334-Y336 VanDerWaalsContact C-N 3.28Å; C334-Y336 PolarHBondContact O-N 3.43Å; C334-H338 PolarHBondContact SG-CE1 3.22Å
335	K	89.9	Confident	80.2	Confident	130 Å²	130	70.2 Å²	70.2	57%	0.565	37%	0.365	S	S	*	.			trans	-77.1	-9.1	-176.4	-59.3	-174.9	178.4	-177.7	0	114.3	H314 D316 L319	H314-K335 WeakPolarHBondContact O-CA 3.4Å; D316-K335 PolarHBondContact N-O 3.47Å; L319-K335 HydrophobicContact CD1-CB 3.89Å
336	Y	88.7	Confident	78.3	Confident	108 Å²	108	78.6 Å²	78.6	42%	0.424	40%	0.404	S	S	.	.	S	Bend	trans	-92.5	160.7	-176.9	-60.3	-86	0	0	0	111.9	L319 C322 C334 H338	L319-Y336 HydrophobicContact CB-CD1 3.73Å; L319-Y336 HydrophobicContact CB-CE1 3.76Å; C322-Y336 VanDerWaalsContact CA-CB 3.44Å; C334-Y336 VanDerWaalsContact C-N 3.28Å; C334-Y336 PolarHBondContact O-N 3.43Å; Y336-H338 PolarHBondContact O-CE1 3.3Å; Y336-H338 PolarHBondContact O-ND1 2.78Å
337	V	88.7	Confident	76.7	Confident	5 Å²	5	77.3 Å²	77.3	3%	0.03	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-73.8	135.9	-178.1	-179	0	0	0	0	111.3	R309 I311 T315 E317 G320 C322 Y339	R309-V337 HydrophobicContact CB-CG1 4.15Å; R309-V337 HydrophobicContact CG-CG1 3.92Å; I311-V337 HydrophobicContact CD1-CG1 3.94Å; I311-V337 HydrophobicContact CD1-CG2 4.01Å; T315-V337 HydrophobicContact CG2-CG2 4.13Å; E317-V337 HydrophobicContact CG-CG2 4.33Å; G320-V337 PolarHBondContact O-N 3.08Å; C322-V337 WeakPolarHBondContact CB-O 3.43Å; C322-V337 PolarHBondContact N-O 3.42Å; V337-Y339 HydrophobicContact CG1-CE2 4.07Å
338	H	88.6	Confident	75	Confident	1 Å²	1	81 Å²	81	1%	0.005	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	168.6	172	-58.5	96	0	0	0	110.8	R309 I310 C322 L325 C334 Y336	R309-H338 CarbonylContact C-O 3.51Å; R309-H338 WeakPolarHBondContact CA-O 3.41Å; I310-H338 HydrophobicContact CB-CB 4.19Å; I310-H338 HydrophobicContact CD1-CB 4.23Å; I310-H338 PolarHBondContact N-O 2.67Å; C322-H338 VanDerWaalsContact CB-NE2 3.27Å; C322-H338 WeakPolarHBondContact CB-NE2 3.4Å; C322-H338 PolarHBondContact SG-NE2 2.85Å; L325-H338 PolarHBondContact O-CD2 2.86Å; C334-H338 PolarHBondContact SG-CE1 3.22Å; Y336-H338 PolarHBondContact O-CE1 3.3Å; Y336-H338 PolarHBondContact O-ND1 2.78Å
339	Y	88.2	Confident	72.9	Confident	17 Å²	17	85.4 Å²	85.4	7%	0.067	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.7	-175.6	-63.7	-91.6	0	0	0	112.1	T288 F307 R308 R309 D321 L325 V337 Q469 L470	T288-Y339 HydrophobicContact CG2-CE1 3.99Å; F307-Y339 HydrophobicContact CB-CD1 3.69Å; F307-Y339 HydrophobicContact CB-CG 4.24Å; R308-Y339 CarbonylContact O-C 3.53Å; R308-Y339 VanDerWaalsContact O-CA 3.25Å; R308-Y339 WeakPolarHBondContact O-CA 3.35Å; R309-Y339 HydrophobicContact CG-CD1 3.89Å; R309-Y339 HydrophobicContact CG-CE1 3.41Å; R309-Y339 VanDerWaalsContact CG-CE1 3.41Å; D321-Y339 HydrophobicContact CB-CE2 4.37Å; D321-Y339 VanDerWaalsContact OD1-CE2 3.31Å; D321-Y339 WeakPolarHBondContact OD1-CE2 3.23Å; D321-Y339 PolarHBondContact OD1-OH 2.81Å; L325-Y339 HydrophobicContact CD2-CD2 3.81Å; L325-Y339 HydrophobicContact CD2-CE2 4.17Å; V337-Y339 HydrophobicContact CG1-CE2 4.07Å; Y339-Q469 PolarHBondContact O-NE2 2.87Å; Y339-Q469 PolarHBondContact O-OE1 3.16Å; Y339-L470 HydrophobicContact CD1-CD2 4.37Å; Y339-L470 HydrophobicContact CD2-CD1 4.05Å; Y339-L470 HydrophobicContact CD2-CD2 4.08Å; Y339-L470 HydrophobicContact CD2-CG 4.36Å; Y339-L470 HydrophobicContact CE2-CD1 3.83Å; Y339-L470 HydrophobicContact CE2-CD2 4.48Å; Y339-L470 HydrophobicContact CG-CD2 4.04Å
340	E	86.2	Confident	71	Confident	79 Å²	79	81.5 Å²	81.5	37%	0.369	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	159.9	166.3	62.8	-175.3	-173.8	0	0	109.7	F307 R308 I310	F307-E340 CarbonylContact C-O 3.59Å; F307-E340 VanDerWaalsContact CA-O 3.31Å; F307-E340 WeakPolarHBondContact CA-O 3.27Å; R308-E340 HydrophobicContact CB-CG 3.84Å; R308-E340 WeakPolarHBondContact CD-OE1 3.32Å; R308-E340 IonicContact CZ-OE1 3.65Å; R308-E340 PolarHBondContact N-O 3.23Å; R308-E340 IonicContact NE-OE1 3.89Å; R308-E340 IonicContact NH1-OE1 2.69Å; R308-E340 PolarHBondContact NH1-OE1 2.9Å; R308-E340 PolarHBondContact O-N 2.83Å; I310-E340 HydrophobicContact CD1-CB 4.24Å; I310-E340 HydrophobicContact CG1-CB 4.43Å; I310-E340 HydrophobicContact CG1-CG 4.25Å
341	I	85.7	Confident	68.9	Low	69 Å²	69	82.3 Å²	82.3	35%	0.354	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	125.9	178.8	-60.5	175.1	0	0	0	108.7	L305 F307 S343	L305-I341 HydrophobicContact CD2-CG2 4Å; F307-I341 HydrophobicContact CE1-CG1 4.37Å; I341-S343 PolarHBondContact O-N 3.43Å
342	D	78.8	Confident	66.8	Low	37 Å²	37	86.8 Å²	86.8	20%	0.198	48%	0.475	C	S	.	.			trans	-73.6	73.1	173.9	-171.3	33.5	0	0	0	109.5	K289 H306 R308	K289-D342 WeakPolarHBondContact CD-OD2 3.38Å; K289-D342 IonicContact NZ-OD2 3.46Å; H306-D342 HydrophobicContact CB-CB 4.28Å; H306-D342 WeakPolarHBondContact O-CB 3.44Å; H306-D342 PolarHBondContact O-N 3.3Å; R308-D342 HydrophobicContact CB-CB 4.43Å; R308-D342 IonicContact CZ-OD1 2.68Å; R308-D342 IonicContact NE-OD1 3.94Å; R308-D342 PolarHBondContact NE-OD1 2.83Å; R308-D342 IonicContact NH2-OD1 3.67Å; R308-D342 PolarHBondContact NH2-OD1 2.86Å
343	S	64.7	Low	64.4	Low	39 Å²	39	83.3 Å²	83.3	27%	0.273	47%	0.471	S	S	.	.			trans	-81.6	135.8	174.6	-51.7	0	0	0	0	109.3	I341	I341-S343 PolarHBondContact O-N 3.43Å
344	P	56.9	Low	62	Low	91 Å²	91	85.2 Å²	85.2	59%	0.591	49%	0.485	S	S	*	.			trans	-62.5	142.6	170.4	24.7	-30.2	0	0	0	109.7	E346 A347	P344-E346 PolarHBondContact O-N 3.36Å; P344-A347 PolarHBondContact O-N 3.02Å
345	P	47.8	Very low	59.4	Low	106 Å²	106	93.4 Å²	93.4	69%	0.688	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-8.1	-170.1	20.7	-31.9	0	0	0	115.5	A347	P345-A347 VanDerWaalsContact C-N 3.32Å
346	E	46.6	Very low	56.7	Low	176 Å²	176	92.7 Å²	92.7	82%	0.822	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-18.6	174.6	-63.5	-175.6	175.1	0	0	113.3	P344	P344-E346 PolarHBondContact O-N 3.36Å
347	A	46.4	Very low	53.8	Low	46 Å²	46	90.7 Å²	90.7	38%	0.38	55%	0.545	S	S	.	.	S	Bend	trans	-85.7	-19.9	179.4	0	0	0	0	0	114	P344 P345 S349 S350	P344-A347 PolarHBondContact O-N 3.02Å; P345-A347 VanDerWaalsContact C-N 3.32Å; A347-S349 VanDerWaalsContact C-N 3.29Å; A347-S349 PolarHBondContact O-N 3.14Å; A347-S350 PolarHBondContact O-N 3.39Å
348	E	40.2	Very low	50.8	Low	130 Å²	130	97.2 Å²	97.2	61%	0.607	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-72.5	-19.6	-174.7	-68.9	-172.2	166.4	0	0	113.5	S350	E348-S350 VanDerWaalsContact C-N 3.28Å; E348-S350 PolarHBondContact O-N 2.78Å
349	S	36	Very low	48.2	Very low	113 Å²	113	102.8 Å²	102.8	79%	0.79	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-78.7	-7.1	177.6	-65.4	0	0	0	0	114.2	A347	A347-S349 VanDerWaalsContact C-N 3.29Å; A347-S349 PolarHBondContact O-N 3.14Å
350	S	40.1	Very low	45.9	Very low	106 Å²	106	110.9 Å²	110.9	74%	0.741	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-104.4	0.3	-175.5	-57.2	0	0	0	0	114.6	A347 E348	A347-S350 PolarHBondContact O-N 3.39Å; E348-S350 VanDerWaalsContact C-N 3.28Å; E348-S350 PolarHBondContact O-N 2.78Å
351	L	39.3	Very low	43.2	Very low	144 Å²	144	115 Å²	115	75%	0.754	68%	0.683	S	S	*	*	S	Bend	trans	-112	15.4	-172.3	-80.1	165.6	0	0	0	115
352	M	36.4	Very low	40.5	Very low	171 Å²	171	114.7 Å²	114.7	84%	0.842	70%	0.696	S	S	*	*	S	Bend	trans	-118.4	102.8	173.2	-70	-93.6	83.2	0	0	110.7
353	G	31.6	Very low	38.3	Very low	65 Å²	65	120.9 Å²	120.9	67%	0.67	73%	0.729	S	S	*	*			trans	30.2	136	158.5	0	0	0	0	0	121.6	Q355	G353-Q355 PolarHBondContact O-N 3.47Å; G353-Q355 VanDerWaalsContact O-N 3.11Å
354	P	34.8	Very low	36.9	Very low	140 Å²	140	128.1 Å²	128.1	91%	0.909	76%	0.758	S	S	*	*			trans	-71	111.7	173.6	29.2	-30.2	0	0	0	110.7
355	Q	31.8	Very low	35.7	Very low	188 Å²	188	128.4 Å²	128.4	88%	0.879	77%	0.768	S	S	*	*			trans	-89.9	138.4	156.3	-70.6	-137.7	1.6	0	0	110.3	G353	G353-Q355 PolarHBondContact O-N 3.47Å; G353-Q355 VanDerWaalsContact O-N 3.11Å
356	S	33.5	Very low	35	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	78%	0.777	S	S	*	*			trans	-39.5	137.5	178.6	49.5	0	0	0	0	117.4
357	G	27.1	Very low	34.8	Very low	65 Å²	65	131.2 Å²	131.2	67%	0.67	78%	0.777	S	S	*	*			trans	130.1	78.8	141	0	0	0	0	0	118.9
358	T	26.1	Very low	34.4	Very low	142 Å²	142	133.6 Å²	133.6	87%	0.871	80%	0.796	S	S	*	*			trans	52.1	161.7	140.6	51.9	0	0	0	0	122.5
359	P	34.5	Very low	34.2	Very low	119 Å²	119	134 Å²	134	77%	0.773	80%	0.803	S	S	*	*			cis	-124.6	174.8	-9.2	32.2	-11.5	0	0	0	114.6
360	E	38.6	Very low	34.6	Very low	186 Å²	186	133.4 Å²	133.4	87%	0.869	80%	0.799	S	S	*	*			trans	-48.1	142	177.9	-57.3	176.2	142.8	0	0	116
361	I	29.8	Very low	34.7	Very low	167 Å²	167	135.3 Å²	135.3	86%	0.856	80%	0.8	S	S	*	*			trans	-124.3	104.8	148.8	-65.4	176.4	0	0	0	106.7
362	G	30.6	Very low	34.9	Very low	61 Å²	61	133.5 Å²	133.5	63%	0.629	80%	0.795	S	S	*	*			trans	-68.2	141.5	175	0	0	0	0	0	111.9
363	L	32.7	Very low	35.8	Very low	168 Å²	168	128.5 Å²	128.5	88%	0.88	79%	0.788	S	S	*	*			trans	-126.9	102.7	154.1	-81.6	166.9	0	0	0	107	A365	L363-A365 PolarHBondContact O-N 2.91Å
364	H	33.9	Very low	37.3	Very low	190 Å²	190	133.9 Å²	133.9	88%	0.88	79%	0.792	S	S	*	*			trans	-56.7	124.8	163.9	-76.6	-90.5	0	0	0	109.1
365	A	32.8	Very low	39.5	Very low	97 Å²	97	132.3 Å²	132.3	80%	0.802	78%	0.776	S	S	*	*			trans	-124.4	116.9	154.3	0	0	0	0	0	106	L363	L363-A365 PolarHBondContact O-N 2.91Å
366	E	32.8	Very low	42.3	Very low	188 Å²	188	127.1 Å²	127.1	88%	0.879	75%	0.75	S	S	*	*			trans	-66	150.3	-174.4	-63.1	-168.9	143.1	0	0	112.9
367	D	41.1	Very low	45.2	Very low	154 Å²	154	125.1 Å²	125.1	82%	0.824	74%	0.735	S	S	*	*			trans	-5.7	106	171.4	-76.1	-41.6	0	0	0	119.1
368	A	37.7	Very low	48.5	Very low	95 Å²	95	123.5 Å²	123.5	79%	0.785	71%	0.713	S	S	*	*	S	Bend	trans	-156.6	119.6	135.8	0	0	0	0	0	110.1
369	D	36.1	Very low	51.9	Low	139 Å²	139	117 Å²	117	74%	0.743	67%	0.673	S	S	*	*			trans	62.4	83	174.4	-66.4	-16.9	0	0	0	118.8	N371	D369-N371 PolarHBondContact O-N 2.94Å
370	S	44.6	Very low	54.9	Low	101 Å²	101	114 Å²	114	71%	0.706	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	15.6	-172.1	-27.9	0	0	0	0	118.1
371	N	42.4	Very low	57.8	Low	145 Å²	145	105.1 Å²	105.1	78%	0.775	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.4	2	179.2	-96.1	-15.4	0	0	0	115.8	D369 G373	D369-N371 PolarHBondContact O-N 2.94Å; N371-G373 PolarHBondContact O-N 2.87Å; N371-G373 VanDerWaalsContact O-N 3.16Å
372	V	44.7	Very low	61.1	Low	107 Å²	107	99.3 Å²	99.3	65%	0.648	58%	0.578	S	S	*	*	S	Bend	trans	-85.8	88.4	174.1	-176.6	0	0	0	0	109
373	G	53.9	Low	64.2	Low	66 Å²	66	96.8 Å²	96.8	68%	0.68	55%	0.551	S	S	*	*	S	Bend	trans	135.8	-0.1	166.8	0	0	0	0	0	117.8	N371 L375	N371-G373 PolarHBondContact O-N 2.87Å; N371-G373 VanDerWaalsContact O-N 3.16Å; G373-L375 PolarHBondContact O-N 3.4Å
374	K	62.8	Low	67.3	Low	177 Å²	177	91.3 Å²	91.3	77%	0.77	52%	0.522	S	S	*	.			trans	-82.8	94.5	170	-77.6	-178.7	179.9	173.6	0	109.4	F376	K374-F376 PolarHBondContact O-N 2.77Å
375	L	82.3	Confident	70.3	Confident	107 Å²	107	82.6 Å²	82.6	56%	0.56	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-64.1	127.6	167.7	-62.6	176.7	0	0	0	108.5	G373 P549 N550	G373-L375 PolarHBondContact O-N 3.4Å; L375-P549 HydrophobicContact CB-CB 3.94Å; L375-P549 HydrophobicContact CD1-CB 4.22Å; L375-P549 HydrophobicContact CD1-CG 4.5Å; L375-N550 VanDerWaalsContact CD2-ND2 3.26Å; L375-N550 WeakPolarHBondContact CD2-ND2 3.49Å
376	F	90.3	Very high	73.3	Confident	79 Å²	79	82.5 Å²	82.5	35%	0.346	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-72.4	135.4	171.1	-157.1	-95.5	0	0	0	108.4	K374 Q379 P549 N550 L564 D565	K374-F376 PolarHBondContact O-N 2.77Å; F376-Q379 HydrophobicContact CE1-CG 4.41Å; F376-Q379 VanDerWaalsContact CE1-NE2 3.29Å; F376-P549 CarbonylContact O-C 3.55Å; F376-P549 VanDerWaalsContact O-CA 3.25Å; F376-P549 WeakPolarHBondContact O-CA 3.41Å; F376-P549 WeakPolarHBondContact O-CB 3.48Å; F376-N550 PolarHBondContact N-OD1 2.95Å; F376-N550 PolarHBondContact O-N 3.34Å; F376-L564 HydrophobicContact CE1-CB 3.85Å; F376-L564 HydrophobicContact CZ-CB 4.12Å; F376-D565 HydrophobicContact CE1-CB 4.27Å; F376-D565 HydrophobicContact CZ-CB 4.21Å
377	P	94.4	Very high	76.3	Confident	74 Å²	74	76.3 Å²	76.3	48%	0.481	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-60.9	158.7	-179.9	-18.3	29.5	0	0	0	111.8	L564	P377-L564 HydrophobicContact CB-CD1 3.64Å; P377-L564 HydrophobicContact CG-CD1 4.1Å
378	S	95.5	Very high	78.9	Confident	31 Å²	31	69.4 Å²	69.4	22%	0.217	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-67.2	148.4	-178.5	60.7	0	0	0	0	112.2	V547 Q548	S378-V547 VanDerWaalsContact OG-CG1 3.27Å; S378-V547 WeakPolarHBondContact OG-CG1 3.4Å; S378-Q548 WeakPolarHBondContact CA-O 3.19Å; S378-Q548 WeakPolarHBondContact CB-O 3.35Å
379	Q	98.2	Very high	81.7	Confident	5 Å²	5	67.2 Å²	67.2	2%	0.023	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	150.8	-177.2	-69.7	176.2	97.3	0	0	109.8	F376 W551 I552 T553 H562 L563 L564	F376-Q379 HydrophobicContact CE1-CG 4.41Å; F376-Q379 VanDerWaalsContact CE1-NE2 3.29Å; Q379-W551 PolarHBondContact N-O 3.18Å; Q379-W551 VanDerWaalsContact N-O 3.17Å; Q379-I552 HydrophobicContact CB-CG1 3.88Å; Q379-I552 CarbonylContact O-C 3.57Å; Q379-I552 WeakPolarHBondContact O-CA 3.49Å; Q379-T553 PolarHBondContact O-N 3.45Å; Q379-H562 CarbonylContact C-O 3.58Å; Q379-H562 WeakPolarHBondContact CA-O 3.27Å; Q379-H562 WeakPolarHBondContact CB-O 3.29Å; Q379-L563 HydrophobicContact CB-CD2 4.49Å; Q379-L564 HydrophobicContact CG-CB 4.1Å; Q379-L564 HydrophobicContact CG-CD1 4.33Å; Q379-L564 HydrophobicContact CG-CG 4.18Å
380	W	98.6	Very high	84.5	Confident	57 Å²	57	60.7 Å²	60.7	22%	0.216	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	158.1	179.7	60.8	90.5	0	0	0	113.8	V547 T553 L558 D559 H562	W380-V547 HydrophobicContact CB-CG2 4.47Å; W380-V547 HydrophobicContact CD2-CG1 4.49Å; W380-V547 HydrophobicContact CE3-CG1 3.55Å; W380-V547 HydrophobicContact CE3-CG2 4.34Å; W380-V547 HydrophobicContact CZ3-CG1 3.84Å; W380-T553 CarbonylContact C-O 3.36Å; W380-T553 WeakPolarHBondContact CA-O 3.24Å; W380-T553 WeakPolarHBondContact CB-O 3.44Å; W380-L558 HydrophobicContact CB-CD1 4.04Å; W380-L558 HydrophobicContact CB-CD2 4.49Å; W380-D559 PolarHBondContact NE1-O 3Å; W380-H562 HydrophobicContact CD2-CB 3.57Å; W380-H562 HydrophobicContact CE3-CB 3.9Å; W380-H562 AromaticContact CE3-CD2 3.98Å; W380-H562 HydrophobicContact CG-CB 4.19Å; W380-H562 HydrophobicContact CH2-CB 3.7Å; W380-H562 AromaticContact CH2-CD2 3.52Å; W380-H562 AromaticContact CH2-CG 3.52Å; W380-H562 HydrophobicContact CZ2-CB 3.36Å; W380-H562 AromaticContact CZ2-CG 3.67Å; W380-H562 HydrophobicContact CZ3-CB 3.95Å; W380-H562 AromaticContact CZ3-CD2 3.42Å; W380-H562 VanDerWaalsContact CZ3-CD2 3.42Å; W380-H562 WeakPolarHBondContact CZ3-CD2 3.48Å; W380-H562 AromaticContact CZ3-CG 3.81Å; W380-H562 PolarHBondContact N-O 3.48Å; W380-H562 PolarHBondContact O-N 2.94Å
381	I	98.5	Very high	86.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	118	173.1	-48.4	-177.7	0	0	0	108.7	C383 L393 T553 L554 G555 I561 L563 F572 I581	I381-C383 HydrophobicContact CG2-CB 4.1Å; I381-C383 PolarHBondContact O-N 2.94Å; I381-L393 HydrophobicContact CD1-CD2 3.73Å; I381-T553 PolarHBondContact N-O 3.05Å; I381-L554 HydrophobicContact CB-CD2 3.66Å; I381-L554 HydrophobicContact CD1-CD2 3.95Å; I381-L554 HydrophobicContact CG1-CD2 3.85Å; I381-G555 PolarHBondContact O-N 3.11Å; I381-I561 HydrophobicContact CG1-CG2 4.29Å; I381-I561 HydrophobicContact CG2-CD1 4.09Å; I381-I561 HydrophobicContact CG2-CG1 3.98Å; I381-I561 HydrophobicContact CG2-CG2 4.35Å; I381-L563 HydrophobicContact CD1-CD1 4.15Å; I381-L563 HydrophobicContact CD1-CD2 4.06Å; I381-L563 HydrophobicContact CG1-CD1 4.42Å; I381-L563 HydrophobicContact CG1-CD2 3.92Å; I381-L563 HydrophobicContact CG1-CG 4.33Å; I381-F572 HydrophobicContact CD1-CD2 4.44Å; I381-F572 HydrophobicContact CD1-CE2 4.47Å; I381-I581 HydrophobicContact CG2-CD1 3.6Å
382	C	98.4	Very high	89.5	Confident	44 Å²	44	52.7 Å²	52.7	30%	0.297	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	109.7	166.7	-172.2	0	0	0	0	109.8	G555 L558 G560	C382-G555 VanDerWaalsContact CA-O 3.29Å; C382-G555 WeakPolarHBondContact CA-O 3.33Å; C382-L558 HydrophobicContact CB-CB 4.12Å; C382-L558 VanDerWaalsContact CB-O 3.27Å; C382-L558 WeakPolarHBondContact CB-O 3.29Å; C382-L558 PolarHBondContact SG-O 3.31Å; C382-G560 WeakPolarHBondContact CB-O 3.32Å; C382-G560 PolarHBondContact N-O 3.43Å
383	C	97.3	Very high	92.1	Very high	8 Å²	8	47.6 Å²	47.6	5%	0.054	26%	0.257	C	S	.	.			trans	-156.1	158.1	-175.5	63.7	0	0	0	0	113.1	I381 I385 L388 G555 N556 I581	I381-C383 HydrophobicContact CG2-CB 4.1Å; I381-C383 PolarHBondContact O-N 2.94Å; C383-I385 PolarHBondContact O-N 3.03Å; C383-L388 HydrophobicContact CB-CB 4.45Å; C383-G555 PolarHBondContact N-O 3.15Å; C383-G555 CarbonylContact O-C 3.52Å; C383-N556 PolarHBondContact O-N 2.81Å; C383-I581 HydrophobicContact CB-CD1 3.78Å; C383-I581 HydrophobicContact CB-CG2 4.49Å
384	D	96.9	Very high	94.1	Very high	53 Å²	53	45.2 Å²	45.2	28%	0.283	23%	0.233	S	C	.	.			trans	-78.2	114	157.9	-168.9	-35	0	0	0	108.9	R386 Y387 L388	D384-R386 PolarHBondContact O-N 3.44Å; D384-R386 VanDerWaalsContact O-N 3.15Å; D384-R386 VanDerWaalsContact OD1-CB 3.3Å; D384-R386 WeakPolarHBondContact OD1-CB 3.46Å; D384-R386 WeakPolarHBondContact OD1-CG 3.42Å; D384-R386 IonicContact OD1-CZ 3.87Å; D384-R386 PolarHBondContact OD1-N 2.78Å; D384-R386 IonicContact OD1-NE 3.51Å; D384-R386 PolarHBondContact OD1-NE 2.92Å; D384-R386 IonicContact OD1-NH2 3.84Å; D384-R386 IonicContact OD2-CZ 3.42Å; D384-R386 IonicContact OD2-NE 3.95Å; D384-R386 PolarHBondContact OD2-NE 3.33Å; D384-R386 IonicContact OD2-NH2 2.68Å; D384-R386 PolarHBondContact OD2-NH2 3.24Å; D384-Y387 HydrophobicContact CB-CD2 3.61Å; D384-Y387 HydrophobicContact CB-CE2 4.04Å; D384-Y387 HydrophobicContact CB-CG 4.36Å; D384-Y387 PolarHBondContact O-N 2.62Å; D384-Y387 WeakPolarHBondContact OD2-CE2 3.46Å; D384-L388 PolarHBondContact O-N 3.45Å
385	I	97.2	Very high	95.7	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.041	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.3	-174.6	-59.9	-172	0	0	0	111.8	C383 Y387 M390 L424 L540 F541 L554	C383-I385 PolarHBondContact O-N 3.03Å; I385-Y387 PolarHBondContact O-N 2.89Å; I385-M390 HydrophobicContact CG2-CE 3.31Å; I385-L424 HydrophobicContact CG2-CD2 4.14Å; I385-L540 HydrophobicContact CD1-CB 4.19Å; I385-F541 HydrophobicContact CB-CE1 4.16Å; I385-F541 HydrophobicContact CB-CZ 4.25Å; I385-F541 HydrophobicContact CD1-CB 4.36Å; I385-F541 HydrophobicContact CD1-CD1 3.61Å; I385-F541 HydrophobicContact CD1-CD2 4.02Å; I385-F541 HydrophobicContact CD1-CE1 3.79Å; I385-F541 HydrophobicContact CD1-CE2 4.17Å; I385-F541 HydrophobicContact CD1-CG 3.73Å; I385-F541 HydrophobicContact CD1-CZ 4.06Å; I385-F541 HydrophobicContact CG1-CD1 4.49Å; I385-F541 HydrophobicContact CG1-CE1 4.34Å; I385-F541 HydrophobicContact CG2-CE1 4.49Å; I385-F541 HydrophobicContact CG2-CE2 4.49Å; I385-F541 HydrophobicContact CG2-CZ 4.09Å; I385-L554 HydrophobicContact CD1-CB 4.15Å; I385-L554 HydrophobicContact CG1-CB 4.39Å
386	R	95.8	Very high	96.4	Very high	94 Å²	94	36 Å²	36	36%	0.355	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.1	176.5	-59.3	174.1	-66.1	-176.9	-3.4	113	D384 L416 E420	D384-R386 PolarHBondContact O-N 3.44Å; D384-R386 VanDerWaalsContact O-N 3.15Å; D384-R386 VanDerWaalsContact OD1-CB 3.3Å; D384-R386 WeakPolarHBondContact OD1-CB 3.46Å; D384-R386 WeakPolarHBondContact OD1-CG 3.42Å; D384-R386 IonicContact OD1-CZ 3.87Å; D384-R386 PolarHBondContact OD1-N 2.78Å; D384-R386 IonicContact OD1-NE 3.51Å; D384-R386 PolarHBondContact OD1-NE 2.92Å; D384-R386 IonicContact OD1-NH2 3.84Å; D384-R386 IonicContact OD2-CZ 3.42Å; D384-R386 IonicContact OD2-NE 3.95Å; D384-R386 PolarHBondContact OD2-NE 3.33Å; D384-R386 IonicContact OD2-NH2 2.68Å; D384-R386 PolarHBondContact OD2-NH2 3.24Å; R386-L416 HydrophobicContact CG-CD2 4Å; R386-L416 HydrophobicContact CG-CG 4.46Å; R386-E420 WeakPolarHBondContact CD-OE1 3.28Å; R386-E420 IonicContact CZ-OE1 3.22Å; R386-E420 IonicContact NE-OE1 3.34Å; R386-E420 IonicContact NH1-OE1 3.95Å; R386-E420 PolarHBondContact NH1-OE1 3Å
387	Y	95.5	Very high	96.7	Very high	59 Å²	59	33.9 Å²	33.9	23%	0.231	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-18.7	-170.3	-53.1	-33.9	0	0	0	113.6	D384 I385 D389 K583	D384-Y387 HydrophobicContact CB-CD2 3.61Å; D384-Y387 HydrophobicContact CB-CE2 4.04Å; D384-Y387 HydrophobicContact CB-CG 4.36Å; D384-Y387 PolarHBondContact O-N 2.62Å; D384-Y387 WeakPolarHBondContact OD2-CE2 3.46Å; I385-Y387 PolarHBondContact O-N 2.89Å; Y387-D389 PolarHBondContact O-N 3.26Å; Y387-K583 HydrophobicContact CD1-CB 4.11Å; Y387-K583 HydrophobicContact CD1-CG 3.87Å; Y387-K583 HydrophobicContact CD2-CB 4.19Å; Y387-K583 HydrophobicContact CE1-CB 4.18Å; Y387-K583 HydrophobicContact CE1-CD 3.92Å; Y387-K583 HydrophobicContact CE1-CG 3.72Å; Y387-K583 HydrophobicContact CE2-CB 4.27Å; Y387-K583 HydrophobicContact CG-CB 4.14Å; Y387-K583 HydrophobicContact CG-CG 4.4Å
388	L	96.4	Very high	96.9	Very high	8 Å²	8	30.4 Å²	30.4	4%	0.042	16%	0.16	C	C	.	.	S	Bend	trans	-65	129.5	175.6	-179.8	68.7	0	0	0	110.5	C383 D384 M390 I392 L393 L554 Y576 I581	C383-L388 HydrophobicContact CB-CB 4.45Å; D384-L388 PolarHBondContact O-N 3.45Å; L388-M390 PolarHBondContact O-N 3.36Å; L388-I392 HydrophobicContact CD1-CD1 4.3Å; L388-L393 HydrophobicContact CD2-CD1 4.15Å; L388-L554 HydrophobicContact CD2-CD1 3.6Å; L388-L554 HydrophobicContact CD2-CD2 3.93Å; L388-L554 HydrophobicContact CD2-CG 4.41Å; L388-Y576 HydrophobicContact CD1-CE2 3.95Å; L388-I581 HydrophobicContact CB-CG2 4.29Å; L388-I581 HydrophobicContact CD1-CD1 3.93Å; L388-I581 HydrophobicContact CD1-CG1 4.26Å; L388-I581 HydrophobicContact CD1-CG2 4.14Å
389	D	95.9	Very high	97.1	Very high	49 Å²	49	28.9 Å²	28.9	26%	0.262	15%	0.15	S	C	.	.			trans	-74.4	93.4	169.4	-170.7	-15.7	0	0	0	109.6	Y387 S391 I392 R575 Y576	Y387-D389 PolarHBondContact O-N 3.26Å; D389-S391 PolarHBondContact O-N 3.35Å; D389-S391 VanDerWaalsContact O-N 3.13Å; D389-S391 WeakPolarHBondContact OD1-CB 3.35Å; D389-S391 PolarHBondContact OD1-N 2.86Å; D389-S391 PolarHBondContact OD1-OG 2.79Å; D389-I392 WeakPolarHBondContact O-CG1 3.34Å; D389-I392 PolarHBondContact O-N 3Å; D389-R575 HydrophobicContact CB-CG 4.33Å; D389-R575 IonicContact OD2-CZ 3.31Å; D389-R575 IonicContact OD2-NE 3.91Å; D389-R575 PolarHBondContact OD2-NE 3.14Å; D389-R575 IonicContact OD2-NH2 3Å; D389-Y576 WeakPolarHBondContact CB-OH 3.41Å; D389-Y576 PolarHBondContact N-OH 2.92Å
390	M	95.3	Very high	97.1	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-63.2	-16.4	-176.7	-70.8	-175.9	177.3	0	0	113.8	I385 L388 I392 L393 L429 L540	I385-M390 HydrophobicContact CG2-CE 3.31Å; L388-M390 PolarHBondContact O-N 3.36Å; M390-I392 PolarHBondContact O-N 3.39Å; M390-L393 WeakPolarHBondContact O-CB 3.49Å; M390-L393 PolarHBondContact O-N 3.4Å; M390-L429 HydrophobicContact CB-CD2 3.85Å; M390-L429 HydrophobicContact CB-CG 4.32Å; M390-L429 HydrophobicContact CG-CD2 4.35Å; M390-L429 HydrophobicContact SD-CD1 3.8Å; M390-L429 HydrophobicContact SD-CD2 4.36Å; M390-L429 HydrophobicContact SD-CG 4.1Å; M390-L540 HydrophobicContact CE-CD1 4.38Å; M390-L540 HydrophobicContact CE-CD2 4.22Å
391	S	95.5	Very high	97.1	Very high	70 Å²	70	26.4 Å²	26.4	49%	0.49	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-64.2	-27	-178.3	70.2	0	0	0	0	113.1	D389 L393 G394	D389-S391 PolarHBondContact O-N 3.35Å; D389-S391 VanDerWaalsContact O-N 3.13Å; D389-S391 WeakPolarHBondContact OD1-CB 3.35Å; D389-S391 PolarHBondContact OD1-N 2.86Å; D389-S391 PolarHBondContact OD1-OG 2.79Å; S391-L393 PolarHBondContact O-N 3.49Å; S391-G394 PolarHBondContact O-N 3.06Å
392	I	97.1	Very high	97.1	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.041	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-68.4	-20.2	-179.8	74.1	-173.2	0	0	0	113	L388 D389 M390 G394 R571 F572 R575 Y576	L388-I392 HydrophobicContact CD1-CD1 4.3Å; D389-I392 WeakPolarHBondContact O-CG1 3.34Å; D389-I392 PolarHBondContact O-N 3Å; M390-I392 PolarHBondContact O-N 3.39Å; I392-G394 VanDerWaalsContact C-N 3.29Å; I392-G394 PolarHBondContact O-N 3.34Å; I392-R571 HydrophobicContact CB-CB 3.99Å; I392-R571 HydrophobicContact CG2-CB 4.49Å; I392-R571 PolarHBondContact O-NE 3.46Å; I392-R571 PolarHBondContact O-NH2 3Å; I392-F572 HydrophobicContact CD1-CB 4.34Å; I392-F572 HydrophobicContact CD1-CD2 3.68Å; I392-F572 HydrophobicContact CD1-CE2 4.45Å; I392-F572 HydrophobicContact CD1-CG 4.44Å; I392-R575 HydrophobicContact CG2-CB 3.79Å; I392-R575 HydrophobicContact CG2-CG 3.86Å; I392-Y576 HydrophobicContact CD1-CD2 4.14Å; I392-Y576 HydrophobicContact CD1-CE2 3.81Å
393	L	97.5	Very high	97.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-80.2	-15.5	-172.9	-56.5	176.3	0	0	0	112.1	I381 L388 M390 S391 F396 L429 I538 L554 V568	I381-L393 HydrophobicContact CD1-CD2 3.73Å; L388-L393 HydrophobicContact CD2-CD1 4.15Å; M390-L393 WeakPolarHBondContact O-CB 3.49Å; M390-L393 PolarHBondContact O-N 3.4Å; S391-L393 PolarHBondContact O-N 3.49Å; L393-F396 HydrophobicContact CB-CE2 3.74Å; L393-F396 HydrophobicContact CB-CZ 3.84Å; L393-F396 WeakPolarHBondContact O-CZ 3.14Å; L393-L429 HydrophobicContact CD1-CD2 4.25Å; L393-I538 HydrophobicContact CD1-CD1 3.66Å; L393-L554 HydrophobicContact CD1-CD1 3.8Å; L393-L554 HydrophobicContact CD1-CD2 4.41Å; L393-V568 HydrophobicContact CD2-CG1 4.07Å
394	G	96.4	Very high	97	Very high	16 Å²	16	27.5 Å²	27.5	17%	0.165	15%	0.145	C	C	.	.			trans	79.9	-153.2	-175.6	0	0	0	0	0	112.4	S391 I392	S391-G394 PolarHBondContact O-N 3.06Å; I392-G394 VanDerWaalsContact C-N 3.29Å; I392-G394 PolarHBondContact O-N 3.34Å
395	K	97.4	Very high	97	Very high	86 Å²	86	25.4 Å²	25.4	37%	0.374	13%	0.134	S	C	.	.			trans	-108.8	142.9	-176.3	-56.4	-64.2	-178.3	165.6	0	111.8	A428 L429 D431 R536	K395-A428 WeakPolarHBondContact CD-O 3.37Å; K395-A428 WeakPolarHBondContact CE-O 3.5Å; K395-A428 PolarHBondContact NZ-O 3.45Å; K395-L429 WeakPolarHBondContact CA-O 3.31Å; K395-D431 WeakPolarHBondContact CD-OD2 3.24Å; K395-D431 WeakPolarHBondContact CE-OD1 3.27Å; K395-D431 WeakPolarHBondContact CE-OD2 3.41Å; K395-D431 IonicContact NZ-OD1 3.5Å; K395-D431 PolarHBondContact NZ-OD1 2.87Å; K395-D431 IonicContact NZ-OD2 3.47Å; K395-D431 PolarHBondContact NZ-OD2 3.33Å; K395-R536 PolarHBondContact O-NH2 3.04Å
396	F	97.5	Very high	96.9	Very high	6 Å²	6	27.3 Å²	27.3	3%	0.026	14%	0.144	C	C	.	.			trans	-121.2	148.7	-179.2	-59.7	-84.9	0	0	0	110.5	L393 L429 Q430 R536 K537 I538 I552	L393-F396 HydrophobicContact CB-CE2 3.74Å; L393-F396 HydrophobicContact CB-CZ 3.84Å; L393-F396 WeakPolarHBondContact O-CZ 3.14Å; F396-L429 HydrophobicContact CD2-CB 4.29Å; F396-L429 HydrophobicContact CD2-CD2 4.12Å; F396-L429 HydrophobicContact CE2-CD2 3.93Å; F396-L429 PolarHBondContact N-O 3.47Å; F396-Q430 VanDerWaalsContact O-CG 3.27Å; F396-Q430 WeakPolarHBondContact O-CG 3.38Å; F396-Q430 PolarHBondContact O-OE1 3.19Å; F396-Q430 VanDerWaalsContact O-OE1 3.11Å; F396-R536 HydrophobicContact CD1-CB 4.02Å; F396-R536 HydrophobicContact CE1-CB 4.4Å; F396-K537 VanDerWaalsContact CD1-C 3.44Å; F396-K537 WeakPolarHBondContact CD1-O 3.43Å; F396-I538 HydrophobicContact CB-CG2 3.94Å; F396-I538 HydrophobicContact CD1-CB 3.74Å; F396-I538 HydrophobicContact CD1-CG2 4.04Å; F396-I538 HydrophobicContact CD2-CB 3.97Å; F396-I538 HydrophobicContact CD2-CD1 4.34Å; F396-I538 HydrophobicContact CD2-CG2 3.63Å; F396-I538 HydrophobicContact CE1-CB 3.84Å; F396-I538 HydrophobicContact CE2-CB 4.08Å; F396-I538 HydrophobicContact CE2-CD1 3.82Å; F396-I538 HydrophobicContact CE2-CG2 4.15Å; F396-I538 HydrophobicContact CG-CB 3.8Å; F396-I538 HydrophobicContact CG-CG2 3.56Å; F396-I538 HydrophobicContact CZ-CB 4.01Å; F396-I538 HydrophobicContact CZ-CD1 3.99Å; F396-I538 HydrophobicContact CZ-CG1 4.41Å; F396-I552 HydrophobicContact CE1-CB 4.38Å; F396-I552 HydrophobicContact CE1-CD1 3.92Å; F396-I552 HydrophobicContact CE1-CG1 4.33Å; F396-I552 HydrophobicContact CZ-CD1 3.89Å
397	S	96.6	Very high	96.7	Very high	34 Å²	34	24.3 Å²	24.3	24%	0.238	13%	0.134	C	C	.	.	S	Bend	trans	-83.4	-24.4	174.2	-55.2	0	0	0	0	112.3	Q430 G433 F434 T535 R536	S397-Q430 VanDerWaalsContact C-OE1 3.32Å; S397-Q430 PolarHBondContact O-OE1 2.89Å; S397-G433 WeakPolarHBondContact O-CA 3.21Å; S397-F434 PolarHBondContact O-N 3.36Å; S397-F434 VanDerWaalsContact O-N 3.09Å; S397-T535 WeakPolarHBondContact OG-CB 3.03Å; S397-R536 PolarHBondContact N-O 3.19Å
398	V	98.3	Very high	96.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	130.9	177.4	-176	0	0	0	0	109.9	F434 F436 I528 K537 I538 W551	V398-F434 WeakPolarHBondContact CA-O 3.37Å; V398-F436 HydrophobicContact CG1-CD2 3.61Å; V398-F436 HydrophobicContact CG1-CE2 3.73Å; V398-I528 HydrophobicContact CB-CG2 4.13Å; V398-I528 HydrophobicContact CG1-CD1 4.34Å; V398-I528 HydrophobicContact CG1-CG2 3.78Å; V398-I528 HydrophobicContact CG2-CG2 3.99Å; V398-K537 HydrophobicContact CB-CB 4.44Å; V398-K537 HydrophobicContact CB-CD 4.45Å; V398-K537 HydrophobicContact CB-CG 4.1Å; V398-K537 WeakPolarHBondContact O-CA 3.45Å; V398-I538 PolarHBondContact O-N 3.43Å; V398-W551 HydrophobicContact CG1-CH2 4.43Å
399	V	98.7	Very high	95.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.7	167.6	-178.9	0	0	0	0	108.1	L429 Q430 F434 L435 F436 I538 L540	V399-L429 HydrophobicContact CG1-CD1 4.42Å; V399-L429 HydrophobicContact CG2-CB 4.15Å; V399-L429 HydrophobicContact CG2-CD1 4.46Å; V399-Q430 HydrophobicContact CG2-CB 4.4Å; V399-F434 PolarHBondContact N-O 3.48Å; V399-L435 HydrophobicContact CB-CD1 3.8Å; V399-L435 HydrophobicContact CG1-CD1 3.61Å; V399-L435 CarbonylContact O-C 3.59Å; V399-L435 VanDerWaalsContact O-CA 3.29Å; V399-L435 WeakPolarHBondContact O-CA 3.33Å; V399-F436 PolarHBondContact O-N 3.1Å; V399-I538 CarbonylContact C-O 3.55Å; V399-I538 WeakPolarHBondContact CA-O 3.37Å; V399-I538 HydrophobicContact CB-CG2 4.15Å; V399-I538 HydrophobicContact CG1-CG2 4.13Å; V399-I538 HydrophobicContact CG2-CG2 3.73Å; V399-L540 HydrophobicContact CG1-CD1 4.26Å; V399-L540 HydrophobicContact CG1-CG 4.48Å
400	M	98.8	Very high	95.4	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.025	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.7	169.8	-174.3	168.4	69.2	0	0	110	F436 I524 Y525 I528 I538 E539 L540 W551	M400-F436 CarbonylContact C-O 3.59Å; M400-F436 VanDerWaalsContact CA-O 3.3Å; M400-F436 WeakPolarHBondContact CA-O 3.48Å; M400-F436 HydrophobicContact CB-CB 4.19Å; M400-F436 HydrophobicContact CG-CB 3.9Å; M400-I524 HydrophobicContact CE-CG2 4.37Å; M400-I524 HydrophobicContact SD-CG1 4.11Å; M400-I524 HydrophobicContact SD-CG2 4.01Å; M400-Y525 HydrophobicContact CE-CD1 4.22Å; M400-Y525 HydrophobicContact CE-CE1 3.45Å; M400-Y525 VanDerWaalsContact CE-CE1 3.45Å; M400-I528 HydrophobicContact SD-CD1 3.98Å; M400-I538 PolarHBondContact N-O 2.93Å; M400-E539 VanDerWaalsContact CE-CD 3.45Å; M400-E539 HydrophobicContact CE-CG 3.93Å; M400-E539 WeakPolarHBondContact CE-OE2 3.43Å; M400-E539 CarbonylContact O-C 3.58Å; M400-E539 WeakPolarHBondContact O-CA 3.4Å; M400-L540 PolarHBondContact O-N 3.26Å; M400-W551 HydrophobicContact CB-CH2 3.94Å; M400-W551 HydrophobicContact CB-CZ3 3.79Å; M400-W551 HydrophobicContact CE-CH2 4.14Å; M400-W551 HydrophobicContact CE-CZ3 4.26Å; M400-W551 HydrophobicContact SD-CH2 4.5Å
401	A	98.6	Very high	95.1	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.033	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	133.3	177.5	0	0	0	0	0	112.1	P403 F436 L437 W438 L540	A401-P403 VanDerWaalsContact C-CD 3.45Å; A401-P403 WeakPolarHBondContact O-CD 3.34Å; A401-F436 PolarHBondContact N-O 3.32Å; A401-L437 HydrophobicContact CB-CD1 3.93Å; A401-W438 PolarHBondContact O-N 2.94Å; A401-L540 HydrophobicContact CB-CB 3.98Å; A401-L540 HydrophobicContact CB-CD1 4.42Å
402	D	98.1	Very high	94.6	Very high	42 Å²	42	44 Å²	44	23%	0.225	23%	0.233	C	C	.	.			trans	-117.8	72.7	167.1	-174.4	31.2	0	0	0	110.1	W438 K520 L540 F541	D402-W438 HydrophobicContact CB-CB 4.25Å; D402-W438 HydrophobicContact CB-CG 4.31Å; D402-W438 WeakPolarHBondContact OD1-CB 3.45Å; D402-K520 VanDerWaalsContact OD1-CE 3.32Å; D402-K520 WeakPolarHBondContact OD1-CE 3.26Å; D402-K520 IonicContact OD1-NZ 3.01Å; D402-K520 PolarHBondContact OD1-NZ 3.41Å; D402-K520 WeakPolarHBondContact OD2-CE 3.34Å; D402-K520 IonicContact OD2-NZ 2.75Å; D402-K520 PolarHBondContact OD2-NZ 2.79Å; D402-L540 PolarHBondContact N-O 3.47Å; D402-F541 WeakPolarHBondContact O-CB 3.41Å
403	P	97.5	Very high	94.2	Very high	5 Å²	5	48.9 Å²	48.9	3%	0.032	25%	0.251	C	S	.	.			trans	-75	151	-170.2	31.7	-36.4	0	0	0	112.5	A401 W405 M421 L437 F541	A401-P403 VanDerWaalsContact C-CD 3.45Å; A401-P403 WeakPolarHBondContact O-CD 3.34Å; P403-W405 HydrophobicContact CG-CD2 3.89Å; P403-W405 HydrophobicContact CG-CG 4.33Å; P403-W405 HydrophobicContact CG-CH2 4.16Å; P403-W405 HydrophobicContact CG-CZ2 3.43Å; P403-W405 VanDerWaalsContact CG-CZ2 3.43Å; P403-W405 PolarHBondContact O-N 3.48Å; P403-M421 HydrophobicContact CB-CE 3.31Å; P403-M421 HydrophobicContact CB-SD 3.81Å; P403-M421 HydrophobicContact CG-CE 3.56Å; P403-L437 HydrophobicContact CG-CD1 4.09Å; P403-F541 HydrophobicContact CB-CD2 3.76Å; P403-F541 HydrophobicContact CB-CE2 3.63Å; P403-F541 HydrophobicContact CB-CG 4.38Å; P403-F541 HydrophobicContact CB-CZ 4.13Å
404	P	96.6	Very high	93.9	Very high	28 Å²	28	52 Å²	52	18%	0.182	28%	0.284	C	S	.	.			trans	-80.3	73.6	176.8	35.8	-36.9	0	0	0	110.1	Y413 T415 L416 F541	P404-Y413 HydrophobicContact CB-CD2 4.43Å; P404-Y413 HydrophobicContact CB-CE2 4.41Å; P404-T415 CarbonylContact O-C 3.58Å; P404-T415 WeakPolarHBondContact O-CA 3.28Å; P404-T415 WeakPolarHBondContact O-CB 3.22Å; P404-L416 HydrophobicContact CG-CD1 3.77Å; P404-L416 PolarHBondContact O-N 2.75Å; P404-F541 VanDerWaalsContact CD-CD1 3.45Å; P404-F541 HydrophobicContact CG-CD1 4.26Å; P404-F541 HydrophobicContact CG-CE1 4.37Å
405	W	96.9	Very high	93.8	Very high	10 Å²	10	53.7 Å²	53.7	4%	0.038	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-54.4	137	-179.5	-62.5	110.1	0	0	0	112.6	P403 I407 T415 M421 L437 W438 V439 A443 L446	P403-W405 HydrophobicContact CG-CD2 3.89Å; P403-W405 HydrophobicContact CG-CG 4.33Å; P403-W405 HydrophobicContact CG-CH2 4.16Å; P403-W405 HydrophobicContact CG-CZ2 3.43Å; P403-W405 VanDerWaalsContact CG-CZ2 3.43Å; P403-W405 PolarHBondContact O-N 3.48Å; W405-I407 HydrophobicContact CB-CG2 3.9Å; W405-I407 PolarHBondContact O-N 3.14Å; W405-I407 VanDerWaalsContact O-N 3.1Å; W405-T415 WeakPolarHBondContact O-CG2 3.48Å; W405-M421 HydrophobicContact CE3-CE 4Å; W405-M421 HydrophobicContact CE3-CG 3.85Å; W405-M421 HydrophobicContact CE3-SD 4.42Å; W405-M421 HydrophobicContact CH2-CE 3.56Å; W405-M421 HydrophobicContact CZ2-CE 4.14Å; W405-M421 HydrophobicContact CZ3-CB 3.92Å; W405-M421 HydrophobicContact CZ3-CE 3.49Å; W405-M421 VanDerWaalsContact CZ3-CE 3.49Å; W405-M421 HydrophobicContact CZ3-CG 3.7Å; W405-M421 HydrophobicContact CZ3-SD 4.31Å; W405-L437 HydrophobicContact CH2-CD2 4.35Å; W405-L437 HydrophobicContact CZ2-CD1 3.92Å; W405-L437 HydrophobicContact CZ2-CD2 4.06Å; W405-L437 HydrophobicContact CZ2-CG 4.1Å; W405-W438 PolarHBondContact NE1-O 3.4Å; W405-V439 HydrophobicContact CZ2-CG1 4.19Å; W405-A443 HydrophobicContact CB-CB 3.91Å; W405-A443 HydrophobicContact CD2-CB 3.52Å; W405-A443 HydrophobicContact CE3-CB 4.14Å; W405-A443 HydrophobicContact CG-CB 3.41Å; W405-A443 VanDerWaalsContact CG-CB 3.41Å; W405-L446 HydrophobicContact CE3-CD2 3.78Å; W405-L446 HydrophobicContact CE3-CG 4.42Å; W405-L446 HydrophobicContact CZ3-CD2 3.72Å; W405-L446 HydrophobicContact CZ3-CG 3.94Å
406	D	94.5	Very high	93.8	Very high	47 Å²	47	50.4 Å²	50.4	25%	0.251	28%	0.277	S	S	.	.			trans	-72.9	98.5	161	-173	-1.2	0	0	0	110.1	H408 L416 R442	D406-H408 VanDerWaalsContact C-N 3.29Å; D406-H408 IonicContact OD1-CD2 3.86Å; D406-H408 PolarHBondContact OD1-N 2.67Å; D406-L416 WeakPolarHBondContact CB-O 3.06Å; D406-L416 PolarHBondContact N-O 2.86Å; D406-R442 WeakPolarHBondContact O-CD 3.35Å
407	I	90.8	Very high	93.8	Very high	31 Å²	31	53.2 Å²	53.2	16%	0.159	30%	0.295	C	S	.	.			trans	-90.5	10.5	179.4	63.9	174.9	0	0	0	113.2	W405 M409 L411 T440 R442	W405-I407 HydrophobicContact CB-CG2 3.9Å; W405-I407 PolarHBondContact O-N 3.14Å; W405-I407 VanDerWaalsContact O-N 3.1Å; I407-M409 VanDerWaalsContact C-N 3.3Å; I407-M409 HydrophobicContact CD1-CB 4.21Å; I407-M409 HydrophobicContact CD1-CG 4.22Å; I407-M409 HydrophobicContact CD1-SD 3.77Å; I407-M409 HydrophobicContact CG1-CB 3.98Å; I407-M409 HydrophobicContact CG1-CG 4.07Å; I407-M409 HydrophobicContact CG1-SD 4.25Å; I407-M409 PolarHBondContact O-N 3.36Å; I407-L411 HydrophobicContact CD1-CD1 4.02Å; I407-L411 HydrophobicContact CD1-CD2 4.17Å; I407-L411 HydrophobicContact CD1-CG 4.45Å; I407-L411 HydrophobicContact CG1-CD1 3.87Å; I407-L411 HydrophobicContact CG1-CG 4.49Å; I407-T440 HydrophobicContact CG2-CG2 4.31Å; I407-R442 HydrophobicContact CB-CG 4.36Å
408	H	90	Very high	93.8	Very high	124 Å²	124	53 Å²	53	57%	0.574	29%	0.291	S	S	*	.	S	Bend	trans	57.9	40.6	-174.9	-57.1	179.4	0	0	0	112.9	D406	D406-H408 VanDerWaalsContact C-N 3.29Å; D406-H408 IonicContact OD1-CD2 3.86Å; D406-H408 PolarHBondContact OD1-N 2.67Å
409	M	86.4	Confident	93.7	Very high	94 Å²	94	57.2 Å²	57.2	46%	0.463	31%	0.314	S	S	.	.	S	Bend	trans	-133.5	153.9	173.9	-61.1	179	68.2	0	0	109.3	I407 L411 H481	I407-M409 VanDerWaalsContact C-N 3.3Å; I407-M409 HydrophobicContact CD1-CB 4.21Å; I407-M409 HydrophobicContact CD1-CG 4.22Å; I407-M409 HydrophobicContact CD1-SD 3.77Å; I407-M409 HydrophobicContact CG1-CB 3.98Å; I407-M409 HydrophobicContact CG1-CG 4.07Å; I407-M409 HydrophobicContact CG1-SD 4.25Å; I407-M409 PolarHBondContact O-N 3.36Å; M409-L411 PolarHBondContact O-N 3.5Å; M409-H481 PolarHBondContact SD-CE1 3.09Å
410	E	85.3	Confident	93.6	Very high	205 Å²	205	59.8 Å²	59.8	96%	0.958	33%	0.326	S	S	*	.			trans	-68.6	117.5	170.2	-70.4	-178.9	-178.2	0	0	109.6
411	L	87.8	Confident	93.6	Very high	49 Å²	49	59.6 Å²	59.6	26%	0.257	33%	0.325	S	S	.	.			trans	-117.9	145.6	179.6	-68.8	173	0	0	0	110	I407 M409 Y413 T415	I407-L411 HydrophobicContact CD1-CD1 4.02Å; I407-L411 HydrophobicContact CD1-CD2 4.17Å; I407-L411 HydrophobicContact CD1-CG 4.45Å; I407-L411 HydrophobicContact CG1-CD1 3.87Å; I407-L411 HydrophobicContact CG1-CG 4.49Å; M409-L411 PolarHBondContact O-N 3.5Å; L411-Y413 HydrophobicContact CB-CD1 4.44Å; L411-Y413 HydrophobicContact CB-CD2 4.37Å; L411-Y413 HydrophobicContact CB-CE1 4.21Å; L411-Y413 HydrophobicContact CB-CE2 4.15Å; L411-Y413 HydrophobicContact CD1-CE2 3.7Å; L411-Y413 HydrophobicContact CD2-CE1 4.25Å; L411-Y413 HydrophobicContact CG-CE2 4.42Å; L411-Y413 PolarHBondContact O-N 3.48Å; L411-T415 HydrophobicContact CD1-CG2 3.81Å
412	P	86.7	Confident	93.5	Very high	131 Å²	131	62.2 Å²	62.2	85%	0.851	33%	0.334	S	S	*	.	S	Bend	trans	-76.9	15.6	-179.8	32.5	-35	0	0	0	113.3
413	Y	87.3	Confident	93.4	Very high	109 Å²	109	67.9 Å²	67.9	43%	0.427	36%	0.357	S	S	.	.	S	Bend	trans	-144.7	157.7	-178.3	51.3	-97.6	0	0	0	110.6	P404 L411 T415	P404-Y413 HydrophobicContact CB-CD2 4.43Å; P404-Y413 HydrophobicContact CB-CE2 4.41Å; L411-Y413 HydrophobicContact CB-CD1 4.44Å; L411-Y413 HydrophobicContact CB-CD2 4.37Å; L411-Y413 HydrophobicContact CB-CE1 4.21Å; L411-Y413 HydrophobicContact CB-CE2 4.15Å; L411-Y413 HydrophobicContact CD1-CE2 3.7Å; L411-Y413 HydrophobicContact CD2-CE1 4.25Å; L411-Y413 HydrophobicContact CG-CE2 4.42Å; L411-Y413 PolarHBondContact O-N 3.48Å; Y413-T415 HydrophobicContact CE2-CG2 4.46Å
414	G	90.9	Very high	93.4	Very high	66 Å²	66	68.1 Å²	68.1	68%	0.68	36%	0.357	S	S	*	.			trans	-69.7	139.9	177	0	0	0	0	0	112.1
415	T	95.6	Very high	93.3	Very high	52 Å²	52	70 Å²	70	32%	0.319	37%	0.372	S	S	.	.			trans	-108.6	162.9	177.8	55.2	0	0	0	0	111.5	P404 W405 L411 Y413	P404-T415 CarbonylContact O-C 3.58Å; P404-T415 WeakPolarHBondContact O-CA 3.28Å; P404-T415 WeakPolarHBondContact O-CB 3.22Å; W405-T415 WeakPolarHBondContact O-CG2 3.48Å; L411-T415 HydrophobicContact CD1-CG2 3.81Å; Y413-T415 HydrophobicContact CE2-CG2 4.46Å
416	L	96.6	Very high	93.3	Very high	17 Å²	17	69.7 Å²	69.7	9%	0.089	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-96.4	138.5	164.9	-92.5	67.2	0	0	0	109.1	R386 P404 D406 E420 M421 L424 F541	R386-L416 HydrophobicContact CG-CD2 4Å; R386-L416 HydrophobicContact CG-CG 4.46Å; P404-L416 HydrophobicContact CG-CD1 3.77Å; P404-L416 PolarHBondContact O-N 2.75Å; D406-L416 WeakPolarHBondContact CB-O 3.06Å; D406-L416 PolarHBondContact N-O 2.86Å; L416-E420 HydrophobicContact CB-CB 4.32Å; L416-E420 HydrophobicContact CD2-CB 4.34Å; L416-E420 HydrophobicContact CG-CB 4.24Å; L416-M421 HydrophobicContact CB-CG 3.96Å; L416-M421 HydrophobicContact CB-SD 3.76Å; L416-M421 HydrophobicContact CD2-SD 3.66Å; L416-M421 HydrophobicContact CG-SD 4.36Å; L416-L424 HydrophobicContact CD2-CD2 4.46Å; L416-F541 HydrophobicContact CD1-CE1 4.29Å; L416-F541 HydrophobicContact CD2-CE1 4.03Å; L416-F541 HydrophobicContact CD2-CZ 3.96Å
417	T	97.2	Very high	93.4	Very high	65 Å²	65	70 Å²	70	40%	0.399	38%	0.375	S	S	.	.			trans	-66.7	156.4	172.2	60.8	0	0	0	0	111.1	D419 E420 M421	T417-D419 PolarHBondContact O-N 3.38Å; T417-D419 VanDerWaalsContact O-N 3.16Å; T417-E420 PolarHBondContact N-OE2 3.06Å; T417-E420 PolarHBondContact O-N 3.09Å; T417-E420 WeakPolarHBondContact OG1-CB 3.33Å; T417-E420 VanDerWaalsContact OG1-CD 3.29Å; T417-E420 WeakPolarHBondContact OG1-CG 3.46Å; T417-E420 PolarHBondContact OG1-N 2.87Å; T417-E420 PolarHBondContact OG1-OE2 3.11Å; T417-M421 PolarHBondContact O-N 3.27Å
418	D	97.1	Very high	93.7	Very high	28 Å²	28	70.2 Å²	70.2	15%	0.15	38%	0.381	C	S	.	.	H	α-helix	trans	-52.7	-39.4	177.5	-66.8	6.2	0	0	0	112	M421 R422 R442 L446	D418-M421 WeakPolarHBondContact O-CB 3.48Å; D418-M421 PolarHBondContact O-N 3.12Å; D418-R422 WeakPolarHBondContact O-CG 3.48Å; D418-R422 PolarHBondContact O-N 3.07Å; D418-R442 IonicContact OD2-CZ 3.03Å; D418-R442 IonicContact OD2-NH2 2.69Å; D418-R442 PolarHBondContact OD2-NH2 2.74Å; D418-L446 HydrophobicContact CB-CD1 4.29Å; D418-L446 HydrophobicContact CB-CD2 4.06Å; D418-L446 VanDerWaalsContact OD1-CD2 3.28Å; D418-L446 WeakPolarHBondContact OD1-CD2 3.47Å
419	D	96.9	Very high	94.1	Very high	90 Å²	90	64.3 Å²	64.3	48%	0.481	35%	0.354	S	S	.	.	H	α-helix	trans	-72.4	-35	179.3	-74.1	-13.8	0	0	0	113.5	T417 M421 R422 K423	T417-D419 PolarHBondContact O-N 3.38Å; T417-D419 VanDerWaalsContact O-N 3.16Å; D419-M421 VanDerWaalsContact C-N 3.33Å; D419-R422 IonicContact OD1-NH1 3.81Å; D419-R422 PolarHBondContact OD1-NH1 3.14Å; D419-K423 WeakPolarHBondContact O-CB 3.27Å; D419-K423 WeakPolarHBondContact O-CD 3.5Å; D419-K423 WeakPolarHBondContact O-CG 3.49Å; D419-K423 PolarHBondContact O-N 3.08Å; D419-K423 VanDerWaalsContact O-N 3.12Å
420	E	97.1	Very high	94.6	Very high	54 Å²	54	59.8 Å²	59.8	25%	0.252	33%	0.332	S	S	.	.	H	α-helix	trans	-65.8	-40.2	172.8	-73.8	168.5	132.7	0	0	110.8	R386 L416 T417 K423 L424	R386-E420 WeakPolarHBondContact CD-OE1 3.28Å; R386-E420 IonicContact CZ-OE1 3.22Å; R386-E420 IonicContact NE-OE1 3.34Å; R386-E420 IonicContact NH1-OE1 3.95Å; R386-E420 PolarHBondContact NH1-OE1 3Å; L416-E420 HydrophobicContact CB-CB 4.32Å; L416-E420 HydrophobicContact CD2-CB 4.34Å; L416-E420 HydrophobicContact CG-CB 4.24Å; T417-E420 PolarHBondContact N-OE2 3.06Å; T417-E420 PolarHBondContact O-N 3.09Å; T417-E420 WeakPolarHBondContact OG1-CB 3.33Å; T417-E420 VanDerWaalsContact OG1-CD 3.29Å; T417-E420 WeakPolarHBondContact OG1-CG 3.46Å; T417-E420 PolarHBondContact OG1-N 2.87Å; T417-E420 PolarHBondContact OG1-OE2 3.11Å; E420-K423 PolarHBondContact O-N 3.44Å; E420-L424 PolarHBondContact O-N 3.03Å
421	M	97.8	Very high	95	Very high	1 Å²	1	54 Å²	54	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-59.9	-51.5	174	-72.6	-55.6	-58.7	0	0	111.3	P403 W405 L416 T417 D418 D419 K423 L424 W454	P403-M421 HydrophobicContact CB-CE 3.31Å; P403-M421 HydrophobicContact CB-SD 3.81Å; P403-M421 HydrophobicContact CG-CE 3.56Å; W405-M421 HydrophobicContact CE3-CE 4Å; W405-M421 HydrophobicContact CE3-CG 3.85Å; W405-M421 HydrophobicContact CE3-SD 4.42Å; W405-M421 HydrophobicContact CH2-CE 3.56Å; W405-M421 HydrophobicContact CZ2-CE 4.14Å; W405-M421 HydrophobicContact CZ3-CB 3.92Å; W405-M421 HydrophobicContact CZ3-CE 3.49Å; W405-M421 VanDerWaalsContact CZ3-CE 3.49Å; W405-M421 HydrophobicContact CZ3-CG 3.7Å; W405-M421 HydrophobicContact CZ3-SD 4.31Å; L416-M421 HydrophobicContact CB-CG 3.96Å; L416-M421 HydrophobicContact CB-SD 3.76Å; L416-M421 HydrophobicContact CD2-SD 3.66Å; L416-M421 HydrophobicContact CG-SD 4.36Å; T417-M421 PolarHBondContact O-N 3.27Å; D418-M421 WeakPolarHBondContact O-CB 3.48Å; D418-M421 PolarHBondContact O-N 3.12Å; D419-M421 VanDerWaalsContact C-N 3.33Å; M421-K423 PolarHBondContact O-N 3.34Å; M421-L424 HydrophobicContact CE-CD1 3.81Å; M421-L424 WeakPolarHBondContact O-CB 3.11Å; M421-L424 WeakPolarHBondContact O-CG 3.39Å; M421-L424 PolarHBondContact O-N 2.88Å; M421-L424 HydrophobicContact SD-CD1 3.98Å; M421-W454 HydrophobicContact CE-CH2 4.42Å; M421-W454 WeakPolarHBondContact O-CZ2 3.42Å
422	R	96.4	Very high	95.4	Very high	58 Å²	58	55.8 Å²	55.8	22%	0.219	32%	0.318	C	S	.	.	H	α-helix	trans	-57.3	-34.8	178	-71.8	-178.5	-171.8	98	10.4	113.3	D418 D419 L424 E449 Q453	D418-R422 WeakPolarHBondContact O-CG 3.48Å; D418-R422 PolarHBondContact O-N 3.07Å; D419-R422 IonicContact OD1-NH1 3.81Å; D419-R422 PolarHBondContact OD1-NH1 3.14Å; R422-L424 VanDerWaalsContact C-N 3.34Å; R422-E449 IonicContact CZ-OE1 2.67Å; R422-E449 IonicContact CZ-OE2 3.36Å; R422-E449 IonicContact NE-OE1 3.63Å; R422-E449 PolarHBondContact NE-OE1 3.19Å; R422-E449 IonicContact NE-OE2 3.56Å; R422-E449 IonicContact NH2-OE1 3.48Å; R422-E449 PolarHBondContact NH2-OE1 2.89Å; R422-E449 VanDerWaalsContact NH2-OE1 3.17Å; R422-E449 IonicContact NH2-OE2 3.71Å; R422-E449 PolarHBondContact NH2-OE2 3.22Å; R422-Q453 VanDerWaalsContact CG-OE1 3.26Å
423	K	96.6	Very high	95.9	Very high	161 Å²	161	49.6 Å²	49.6	70%	0.7	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-5.3	-177.1	-72.5	170	-172.4	168.9	0	114.6	D419 E420 M421 S425	D419-K423 WeakPolarHBondContact O-CB 3.27Å; D419-K423 WeakPolarHBondContact O-CD 3.5Å; D419-K423 WeakPolarHBondContact O-CG 3.49Å; D419-K423 PolarHBondContact O-N 3.08Å; D419-K423 VanDerWaalsContact O-N 3.12Å; E420-K423 PolarHBondContact O-N 3.44Å; M421-K423 PolarHBondContact O-N 3.34Å; K423-S425 PolarHBondContact O-N 3.03Å
424	L	96.6	Very high	96.5	Very high	10 Å²	10	45 Å²	45	5%	0.052	26%	0.259	C	S	.	.			trans	-58	134.8	176.1	-66.5	179.2	0	0	0	110.8	I385 L416 E420 M421 R422 I426 W454 F541	I385-L424 HydrophobicContact CG2-CD2 4.14Å; L416-L424 HydrophobicContact CD2-CD2 4.46Å; E420-L424 PolarHBondContact O-N 3.03Å; M421-L424 HydrophobicContact CE-CD1 3.81Å; M421-L424 WeakPolarHBondContact O-CB 3.11Å; M421-L424 WeakPolarHBondContact O-CG 3.39Å; M421-L424 PolarHBondContact O-N 2.88Å; M421-L424 HydrophobicContact SD-CD1 3.98Å; R422-L424 VanDerWaalsContact C-N 3.34Å; L424-I426 HydrophobicContact CB-CD1 4.13Å; L424-I426 HydrophobicContact CB-CG1 3.94Å; L424-I426 PolarHBondContact O-N 3.42Å; L424-W454 HydrophobicContact CB-CZ2 4.22Å; L424-W454 HydrophobicContact CD1-CZ2 4.38Å; L424-F541 HydrophobicContact CD1-CE2 4.08Å; L424-F541 HydrophobicContact CD1-CZ 3.92Å
425	S	94.7	Very high	96.9	Very high	69 Å²	69	41.9 Å²	41.9	48%	0.483	23%	0.227	S	C	.	.			trans	-79.4	39.6	-175.9	-65.3	0	0	0	0	113.5	K423 P427 A428	K423-S425 PolarHBondContact O-N 3.03Å; S425-P427 VanDerWaalsContact C-N 3.33Å; S425-A428 WeakPolarHBondContact O-CB 3.38Å; S425-A428 PolarHBondContact O-N 3.43Å; S425-A428 VanDerWaalsContact O-N 3.14Å
426	I	97.2	Very high	97	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-55.6	-39	177.1	-50.1	-57.6	0	0	0	112.9	L424 A428 L429 W454 Y456 L540	L424-I426 HydrophobicContact CB-CD1 4.13Å; L424-I426 HydrophobicContact CB-CG1 3.94Å; L424-I426 PolarHBondContact O-N 3.42Å; I426-A428 PolarHBondContact O-N 2.92Å; I426-A428 VanDerWaalsContact O-N 3.08Å; I426-L429 HydrophobicContact CD1-CD1 4.35Å; I426-L429 WeakPolarHBondContact O-CB 3.48Å; I426-L429 PolarHBondContact O-N 3.28Å; I426-W454 HydrophobicContact CB-CB 4.3Å; I426-W454 HydrophobicContact CB-CD2 3.8Å; I426-W454 HydrophobicContact CB-CE3 4.19Å; I426-W454 HydrophobicContact CB-CG 3.86Å; I426-W454 HydrophobicContact CG1-CD2 3.69Å; I426-W454 HydrophobicContact CG1-CE3 3.97Å; I426-W454 HydrophobicContact CG1-CG 4.22Å; I426-W454 HydrophobicContact CG1-CH2 4.04Å; I426-W454 HydrophobicContact CG1-CZ2 3.76Å; I426-W454 HydrophobicContact CG1-CZ3 4.14Å; I426-W454 HydrophobicContact CG2-CB 4.43Å; I426-W454 HydrophobicContact CG2-CD2 4.2Å; I426-W454 HydrophobicContact CG2-CE3 4.14Å; I426-W454 HydrophobicContact CG2-CG 4.36Å; I426-Y456 HydrophobicContact CG2-CE2 4.05Å; I426-L540 HydrophobicContact CD1-CD1 3.16Å
427	P	96.9	Very high	97.1	Very high	53 Å²	53	39 Å²	39	34%	0.344	21%	0.209	S	C	.	.	H	α-helix	trans	-58.3	-25	178.5	-28.2	37.4	0	0	0	114.5	S425 L429 W454 K495	S425-P427 VanDerWaalsContact C-N 3.33Å; P427-L429 VanDerWaalsContact C-N 3.35Å; P427-W454 HydrophobicContact CG-CB 4.14Å; P427-W454 HydrophobicContact CG-CG 4.48Å; P427-K495 PolarHBondContact O-NZ 3.22Å
428	A	96.4	Very high	97.2	Very high	36 Å²	36	36.1 Å²	36.1	30%	0.298	19%	0.191	S	C	.	.	H	α-helix	trans	-72.6	-28.4	179.4	0	0	0	0	0	112.7	K395 S425 I426 Q430	K395-A428 WeakPolarHBondContact CD-O 3.37Å; K395-A428 WeakPolarHBondContact CE-O 3.5Å; K395-A428 PolarHBondContact NZ-O 3.45Å; S425-A428 WeakPolarHBondContact O-CB 3.38Å; S425-A428 PolarHBondContact O-N 3.43Å; S425-A428 VanDerWaalsContact O-N 3.14Å; I426-A428 PolarHBondContact O-N 2.92Å; I426-A428 VanDerWaalsContact O-N 3.08Å; A428-Q430 VanDerWaalsContact C-N 3.35Å; A428-Q430 PolarHBondContact O-N 2.7Å
429	L	97.6	Very high	97.2	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-75.2	-19.5	-172.5	-66.4	174.6	0	0	0	114.1	M390 L393 K395 F396 V399 I426 P427 I538 L540	M390-L429 HydrophobicContact CB-CD2 3.85Å; M390-L429 HydrophobicContact CB-CG 4.32Å; M390-L429 HydrophobicContact CG-CD2 4.35Å; M390-L429 HydrophobicContact SD-CD1 3.8Å; M390-L429 HydrophobicContact SD-CD2 4.36Å; M390-L429 HydrophobicContact SD-CG 4.1Å; L393-L429 HydrophobicContact CD1-CD2 4.25Å; K395-L429 WeakPolarHBondContact CA-O 3.31Å; F396-L429 HydrophobicContact CD2-CB 4.29Å; F396-L429 HydrophobicContact CD2-CD2 4.12Å; F396-L429 HydrophobicContact CE2-CD2 3.93Å; F396-L429 PolarHBondContact N-O 3.47Å; V399-L429 HydrophobicContact CG1-CD1 4.42Å; V399-L429 HydrophobicContact CG2-CB 4.15Å; V399-L429 HydrophobicContact CG2-CD1 4.46Å; I426-L429 HydrophobicContact CD1-CD1 4.35Å; I426-L429 WeakPolarHBondContact O-CB 3.48Å; I426-L429 PolarHBondContact O-N 3.28Å; P427-L429 VanDerWaalsContact C-N 3.35Å; L429-I538 HydrophobicContact CD1-CD1 4.25Å; L429-I538 HydrophobicContact CD1-CG2 4.31Å; L429-I538 HydrophobicContact CD2-CD1 3.88Å; L429-L540 HydrophobicContact CD1-CD1 4.31Å; L429-L540 HydrophobicContact CD1-CD2 4.43Å
430	Q	96.9	Very high	97.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.179	C	C	.	.			trans	-152.1	134.7	-169.8	-169.6	164.9	-71.6	0	0	112.4	F396 S397 V399 A428 D432 G433 F434 Y456 K495	F396-Q430 VanDerWaalsContact O-CG 3.27Å; F396-Q430 WeakPolarHBondContact O-CG 3.38Å; F396-Q430 PolarHBondContact O-OE1 3.19Å; F396-Q430 VanDerWaalsContact O-OE1 3.11Å; S397-Q430 VanDerWaalsContact C-OE1 3.32Å; S397-Q430 PolarHBondContact O-OE1 2.89Å; V399-Q430 HydrophobicContact CG2-CB 4.4Å; A428-Q430 VanDerWaalsContact C-N 3.35Å; A428-Q430 PolarHBondContact O-N 2.7Å; Q430-D432 WeakPolarHBondContact CG-O 3.08Å; Q430-G433 VanDerWaalsContact NE2-CA 3.28Å; Q430-G433 PolarHBondContact NE2-O 3Å; Q430-F434 PolarHBondContact NE2-O 3.05Å; Q430-F434 PolarHBondContact OE1-O 3.14Å; Q430-Y456 VanDerWaalsContact NE2-CE1 3.34Å; Q430-Y456 PolarHBondContact NE2-OH 2.83Å; Q430-K495 WeakPolarHBondContact O-CE 3.39Å; Q430-K495 PolarHBondContact O-NZ 3.05Å
431	D	95.3	Very high	96.8	Very high	82 Å²	82	33 Å²	33	44%	0.439	19%	0.189	S	C	.	.	S	Bend	trans	-99.3	-51.6	171.9	-58.2	-34.3	0	0	0	109.7	K395 K495	K395-D431 WeakPolarHBondContact CD-OD2 3.24Å; K395-D431 WeakPolarHBondContact CE-OD1 3.27Å; K395-D431 WeakPolarHBondContact CE-OD2 3.41Å; K395-D431 IonicContact NZ-OD1 3.5Å; K395-D431 PolarHBondContact NZ-OD1 2.87Å; K395-D431 IonicContact NZ-OD2 3.47Å; K395-D431 PolarHBondContact NZ-OD2 3.33Å; D431-K495 WeakPolarHBondContact O-CG 3.38Å
432	D	96.4	Very high	96.6	Very high	88 Å²	88	37.1 Å²	37.1	47%	0.471	20%	0.204	S	C	.	.	S	Bend	trans	-127.8	132.3	175.8	-54.2	-78.5	0	0	0	110.6	Q430 K495 G496 S497	Q430-D432 WeakPolarHBondContact CG-O 3.08Å; D432-K495 CarbonylContact C-O 3.58Å; D432-K495 VanDerWaalsContact CA-O 3.28Å; D432-K495 WeakPolarHBondContact CA-O 3.26Å; D432-G496 VanDerWaalsContact OD1-CA 3.25Å; D432-G496 WeakPolarHBondContact OD1-CA 3.48Å; D432-S497 PolarHBondContact OD1-N 3.16Å
433	G	97.2	Very high	96.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151.1	-155.1	175.3	0	0	0	0	0	115.3	S397 Q430 V494 K495	S397-G433 WeakPolarHBondContact O-CA 3.21Å; Q430-G433 VanDerWaalsContact NE2-CA 3.28Å; Q430-G433 PolarHBondContact NE2-O 3Å; G433-V494 WeakPolarHBondContact O-CA 3.35Å; G433-K495 PolarHBondContact N-O 3.01Å; G433-K495 PolarHBondContact O-N 3.34Å
434	F	98.5	Very high	96.6	Very high	13 Å²	13	28 Å²	28	6%	0.057	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.5	-176.9	-66.9	-83.8	0	0	0	114.2	S397 V398 V399 Q430 F436 V459 V492 G493 V494 T498 F501 L531	S397-F434 PolarHBondContact O-N 3.36Å; S397-F434 VanDerWaalsContact O-N 3.09Å; V398-F434 WeakPolarHBondContact CA-O 3.37Å; V399-F434 PolarHBondContact N-O 3.48Å; Q430-F434 PolarHBondContact NE2-O 3.05Å; Q430-F434 PolarHBondContact OE1-O 3.14Å; F434-F436 HydrophobicContact CB-CE2 3.92Å; F434-V459 HydrophobicContact CE1-CG2 4.32Å; F434-V492 HydrophobicContact CD1-CG1 4.08Å; F434-G493 CarbonylContact C-O 3.6Å; F434-G493 VanDerWaalsContact CA-O 3.23Å; F434-G493 WeakPolarHBondContact CA-O 3.37Å; F434-V494 HydrophobicContact CD1-CB 4.17Å; F434-V494 HydrophobicContact CD1-CG2 4.26Å; F434-V494 HydrophobicContact CE1-CB 3.95Å; F434-V494 HydrophobicContact CE1-CG2 3.82Å; F434-V494 HydrophobicContact CZ-CG2 4.18Å; F434-T498 HydrophobicContact CZ-CG2 4.06Å; F434-F501 AromaticContact CD2-CD1 3.79Å; F434-F501 HydrophobicContact CD2-CD1 3.79Å; F434-F501 HydrophobicContact CD2-CD2 4.47Å; F434-F501 AromaticContact CD2-CE1 3.73Å; F434-F501 HydrophobicContact CD2-CE1 3.73Å; F434-F501 HydrophobicContact CD2-CE2 4.43Å; F434-F501 HydrophobicContact CD2-CG 4.17Å; F434-F501 HydrophobicContact CD2-CZ 4.08Å; F434-F501 HydrophobicContact CE2-CB 4Å; F434-F501 AromaticContact CE2-CD1 3.64Å; F434-F501 HydrophobicContact CE2-CD1 3.64Å; F434-F501 AromaticContact CE2-CD2 3.79Å; F434-F501 HydrophobicContact CE2-CD2 3.79Å; F434-F501 AromaticContact CE2-CE1 3.96Å; F434-F501 HydrophobicContact CE2-CE1 3.96Å; F434-F501 HydrophobicContact CE2-CE2 4.11Å; F434-F501 AromaticContact CE2-CG 3.54Å; F434-F501 HydrophobicContact CE2-CG 3.54Å; F434-F501 HydrophobicContact CE2-CZ 4.19Å; F434-L531 HydrophobicContact CD2-CD2 4.08Å; F434-L531 HydrophobicContact CE2-CD2 4.41Å; F434-L531 HydrophobicContact CG-CD2 4.33Å
435	L	98.7	Very high	96.7	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	127.6	170.2	170.7	65.6	0	0	0	109.7	V399 L437 L451 W454 Y456 V492 G493	V399-L435 HydrophobicContact CB-CD1 3.8Å; V399-L435 HydrophobicContact CG1-CD1 3.61Å; V399-L435 CarbonylContact O-C 3.59Å; V399-L435 VanDerWaalsContact O-CA 3.29Å; V399-L435 WeakPolarHBondContact O-CA 3.33Å; L435-L437 HydrophobicContact CG-CB 4.44Å; L435-L451 HydrophobicContact CD2-CG 4.41Å; L435-W454 HydrophobicContact CD2-CE3 3.77Å; L435-W454 HydrophobicContact CD2-CZ3 4.03Å; L435-Y456 HydrophobicContact CB-CD1 3.63Å; L435-Y456 HydrophobicContact CB-CE1 3.39Å; L435-Y456 HydrophobicContact CB-CE2 4.41Å; L435-Y456 HydrophobicContact CB-CG 4.24Å; L435-Y456 HydrophobicContact CD2-CD1 4.44Å; L435-Y456 HydrophobicContact CD2-CD2 4.02Å; L435-Y456 HydrophobicContact CD2-CE1 4.47Å; L435-Y456 HydrophobicContact CD2-CE2 4.06Å; L435-Y456 HydrophobicContact CD2-CG 4.23Å; L435-V492 CarbonylContact O-C 3.5Å; L435-V492 WeakPolarHBondContact O-CA 3.31Å; L435-G493 PolarHBondContact N-O 3.46Å; L435-G493 PolarHBondContact O-N 2.63Å
436	F	98.9	Very high	96.8	Very high	8 Å²	8	30.6 Å²	30.6	4%	0.035	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	112.4	171.9	-69.6	-99.8	0	0	0	109	V398 V399 M400 A401 F434 I462 L491 V492 I524 I528 L531	V398-F436 HydrophobicContact CG1-CD2 3.61Å; V398-F436 HydrophobicContact CG1-CE2 3.73Å; V399-F436 PolarHBondContact O-N 3.1Å; M400-F436 CarbonylContact C-O 3.59Å; M400-F436 VanDerWaalsContact CA-O 3.3Å; M400-F436 WeakPolarHBondContact CA-O 3.48Å; M400-F436 HydrophobicContact CB-CB 4.19Å; M400-F436 HydrophobicContact CG-CB 3.9Å; A401-F436 PolarHBondContact N-O 3.32Å; F434-F436 HydrophobicContact CB-CE2 3.92Å; F436-I462 HydrophobicContact CD1-CD1 4.11Å; F436-I462 HydrophobicContact CE1-CD1 3.73Å; F436-L491 WeakPolarHBondContact CA-O 3.39Å; F436-V492 HydrophobicContact CD1-CG2 3.99Å; F436-V492 HydrophobicContact CE1-CG1 4.24Å; F436-V492 HydrophobicContact CE1-CG2 3.84Å; F436-V492 HydrophobicContact CZ-CG1 4.2Å; F436-I524 HydrophobicContact CD1-CD1 4.15Å; F436-I524 HydrophobicContact CE1-CD1 4.35Å; F436-I528 HydrophobicContact CD1-CD1 4.17Å; F436-I528 HydrophobicContact CD1-CG1 4.4Å; F436-I528 HydrophobicContact CD2-CD1 3.8Å; F436-I528 HydrophobicContact CD2-CG1 4.13Å; F436-I528 HydrophobicContact CE1-CD1 4.32Å; F436-I528 HydrophobicContact CE1-CG1 4.04Å; F436-I528 HydrophobicContact CE2-CD1 3.98Å; F436-I528 HydrophobicContact CE2-CG1 3.77Å; F436-I528 HydrophobicContact CG-CD1 3.91Å; F436-I528 HydrophobicContact CG-CG1 4.44Å; F436-I528 HydrophobicContact CZ-CD1 4.24Å; F436-I528 HydrophobicContact CZ-CG1 3.72Å; F436-L531 HydrophobicContact CE2-CD2 4.24Å; F436-L531 HydrophobicContact CZ-CD2 3.86Å
437	L	98.8	Very high	96.9	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	108.7	-174.2	-176.4	65.4	0	0	0	111	A401 P403 W405 L435 V439 W454 C490 L491	A401-L437 HydrophobicContact CB-CD1 3.93Å; P403-L437 HydrophobicContact CG-CD1 4.09Å; W405-L437 HydrophobicContact CH2-CD2 4.35Å; W405-L437 HydrophobicContact CZ2-CD1 3.92Å; W405-L437 HydrophobicContact CZ2-CD2 4.06Å; W405-L437 HydrophobicContact CZ2-CG 4.1Å; L435-L437 HydrophobicContact CG-CB 4.44Å; L437-V439 HydrophobicContact CD2-CG1 4.4Å; L437-V439 HydrophobicContact CG-CG1 4.2Å; L437-W454 HydrophobicContact CD1-CZ3 4.36Å; L437-W454 HydrophobicContact CD2-CZ3 4.08Å; L437-C490 CarbonylContact O-C 3.6Å; L437-C490 WeakPolarHBondContact O-CA 3.3Å; L437-L491 HydrophobicContact CB-CB 4.45Å; L437-L491 PolarHBondContact N-O 3.27Å; L437-L491 PolarHBondContact O-N 2.86Å
438	W	98.6	Very high	96.9	Very high	5 Å²	5	32 Å²	32	2%	0.019	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	133	174.8	-68.1	96.8	0	0	0	111	A401 D402 W405 W464 E488 H489 C490 K520 P521 I524	A401-W438 PolarHBondContact O-N 2.94Å; D402-W438 HydrophobicContact CB-CB 4.25Å; D402-W438 HydrophobicContact CB-CG 4.31Å; D402-W438 WeakPolarHBondContact OD1-CB 3.45Å; W405-W438 PolarHBondContact NE1-O 3.4Å; W438-W464 HydrophobicContact CH2-CB 4.12Å; W438-W464 HydrophobicContact CZ3-CB 4.12Å; W438-W464 HydrophobicContact CZ3-CE3 4.43Å; W438-E488 HydrophobicContact CE3-CB 4.33Å; W438-E488 HydrophobicContact CZ3-CB 4.13Å; W438-H489 WeakPolarHBondContact CA-O 3.28Å; W438-C490 HydrophobicContact CD2-CB 3.82Å; W438-C490 HydrophobicContact CE3-CB 3.74Å; W438-C490 HydrophobicContact CG-CB 4.43Å; W438-C490 HydrophobicContact CH2-CB 4.22Å; W438-C490 HydrophobicContact CZ2-CB 4.29Å; W438-C490 HydrophobicContact CZ3-CB 3.95Å; W438-K520 HydrophobicContact CD2-CD 3.61Å; W438-K520 HydrophobicContact CD2-CG 4.04Å; W438-K520 HydrophobicContact CE3-CD 3.67Å; W438-K520 HydrophobicContact CG-CD 4.17Å; W438-K520 VanDerWaalsContact CG-CE 3.45Å; W438-K520 HydrophobicContact CG-CG 4.35Å; W438-K520 HydrophobicContact CH2-CD 4.08Å; W438-K520 HydrophobicContact CZ2-CB 3.95Å; W438-K520 HydrophobicContact CZ2-CD 4.01Å; W438-K520 HydrophobicContact CZ2-CG 4.11Å; W438-K520 HydrophobicContact CZ3-CD 3.91Å; W438-P521 HydrophobicContact CH2-CG 4.09Å; W438-P521 HydrophobicContact CZ2-CG 4.49Å; W438-I524 HydrophobicContact CZ2-CG1 4.48Å
439	V	98	Very high	97	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.024	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	148.5	-175.3	-70.2	0	0	0	0	111	W405 L437 A443 M444 H489 L491	W405-V439 HydrophobicContact CZ2-CG1 4.19Å; L437-V439 HydrophobicContact CD2-CG1 4.4Å; L437-V439 HydrophobicContact CG-CG1 4.2Å; V439-A443 VanDerWaalsContact CG1-O 3.31Å; V439-A443 WeakPolarHBondContact CG1-O 3.34Å; V439-M444 HydrophobicContact CB-SD 3.96Å; V439-M444 HydrophobicContact CG2-CE 4.25Å; V439-M444 HydrophobicContact CG2-SD 3.37Å; V439-M444 WeakPolarHBondContact CG2-SD 3.23Å; V439-H489 HydrophobicContact CG2-CB 3.82Å; V439-H489 PolarHBondContact N-O 3.48Å; V439-L491 HydrophobicContact CG1-CD1 3.98Å; V439-L491 HydrophobicContact CG1-CG 4.19Å; V439-L491 HydrophobicContact CG2-CD1 4.23Å; V439-L491 HydrophobicContact CG2-CD2 4.08Å; V439-L491 HydrophobicContact CG2-CG 3.73Å
440	T	94	Very high	97	Very high	59 Å²	59	34.6 Å²	34.6	36%	0.362	18%	0.176	S	C	.	.			trans	-153	153.6	178.1	-170.8	0	0	0	0	111	I407 R442 A443	I407-T440 HydrophobicContact CG2-CG2 4.31Å; T440-R442 PolarHBondContact O-N 3.18Å; T440-A443 WeakPolarHBondContact O-CA 3.46Å; T440-A443 WeakPolarHBondContact O-CB 3.45Å; T440-A443 PolarHBondContact O-N 3.37Å
441	G	92	Very high	97.1	Very high	43 Å²	43	34.8 Å²	34.8	44%	0.443	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	-130	177.7	0	0	0	0	0	112.6	A443 M444	G441-A443 PolarHBondContact O-N 3.35Å; G441-M444 WeakPolarHBondContact O-CB 3.42Å; G441-M444 VanDerWaalsContact O-CG 3.22Å; G441-M444 WeakPolarHBondContact O-CG 3.22Å; G441-M444 PolarHBondContact O-N 3.19Å
442	R	93.8	Very high	97.2	Very high	88 Å²	88	35 Å²	35	33%	0.332	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-18.6	176.7	65.9	170.5	-86.3	92.8	-4.4	114.4	D406 I407 D418 T440 M444 E445 L446	D406-R442 WeakPolarHBondContact O-CD 3.35Å; I407-R442 HydrophobicContact CB-CG 4.36Å; D418-R442 IonicContact OD2-CZ 3.03Å; D418-R442 IonicContact OD2-NH2 2.69Å; D418-R442 PolarHBondContact OD2-NH2 2.74Å; T440-R442 PolarHBondContact O-N 3.18Å; R442-M444 PolarHBondContact O-N 2.86Å; R442-E445 PolarHBondContact O-N 3.21Å; R442-L446 PolarHBondContact O-N 3.32Å
443	A	95.9	Very high	97.3	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-71.6	-8.3	178.9	0	0	0	0	0	112.4	W405 V439 T440 G441 E445 G447	W405-A443 HydrophobicContact CB-CB 3.91Å; W405-A443 HydrophobicContact CD2-CB 3.52Å; W405-A443 HydrophobicContact CE3-CB 4.14Å; W405-A443 HydrophobicContact CG-CB 3.41Å; W405-A443 VanDerWaalsContact CG-CB 3.41Å; V439-A443 VanDerWaalsContact CG1-O 3.31Å; V439-A443 WeakPolarHBondContact CG1-O 3.34Å; T440-A443 WeakPolarHBondContact O-CA 3.46Å; T440-A443 WeakPolarHBondContact O-CB 3.45Å; T440-A443 PolarHBondContact O-N 3.37Å; G441-A443 PolarHBondContact O-N 3.35Å; A443-E445 VanDerWaalsContact C-N 3.29Å; A443-E445 PolarHBondContact O-N 3Å; A443-G447 WeakPolarHBondContact O-CA 3.15Å; A443-G447 PolarHBondContact O-N 3.12Å
444	M	96.1	Very high	97.3	Very high	27 Å²	27	36.3 Å²	36.3	13%	0.133	19%	0.188	C	C	.	.	H	α-helix	trans	-57.6	-43.5	168.8	-67	-62.6	-64.3	0	0	111.3	V439 G441 R442 R448 H489	V439-M444 HydrophobicContact CB-SD 3.96Å; V439-M444 HydrophobicContact CG2-CE 4.25Å; V439-M444 HydrophobicContact CG2-SD 3.37Å; V439-M444 WeakPolarHBondContact CG2-SD 3.23Å; G441-M444 WeakPolarHBondContact O-CB 3.42Å; G441-M444 VanDerWaalsContact O-CG 3.22Å; G441-M444 WeakPolarHBondContact O-CG 3.22Å; G441-M444 PolarHBondContact O-N 3.19Å; R442-M444 PolarHBondContact O-N 2.86Å; M444-R448 WeakPolarHBondContact O-CD 3.38Å; M444-R448 VanDerWaalsContact O-CG 3.27Å; M444-R448 WeakPolarHBondContact O-CG 3.18Å; M444-R448 PolarHBondContact O-NE 3.41Å; M444-H489 HydrophobicContact CE-CB 3.92Å; M444-H489 HydrophobicContact SD-CB 3.74Å
445	E	97.8	Very high	97.3	Very high	126 Å²	126	37.9 Å²	37.9	59%	0.589	21%	0.208	S	C	*	.	H	α-helix	trans	-82.6	-45.7	178.8	-67.8	68.3	-135.7	0	0	111.7	R442 A443 G447 R448 E449	R442-E445 PolarHBondContact O-N 3.21Å; A443-E445 VanDerWaalsContact C-N 3.29Å; A443-E445 PolarHBondContact O-N 3Å; E445-G447 VanDerWaalsContact C-N 3.3Å; E445-G447 PolarHBondContact O-N 2.88Å; E445-R448 WeakPolarHBondContact O-CB 3.38Å; E445-R448 PolarHBondContact O-N 3.32Å; E445-R448 VanDerWaalsContact O-N 3.13Å; E445-E449 PolarHBondContact O-N 2.77Å
446	L	97.8	Very high	97.3	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-38.4	178.7	179.9	65	0	0	0	111.9	W405 D418 R442 R448 E449 C450	W405-L446 HydrophobicContact CE3-CD2 3.78Å; W405-L446 HydrophobicContact CE3-CG 4.42Å; W405-L446 HydrophobicContact CZ3-CD2 3.72Å; W405-L446 HydrophobicContact CZ3-CG 3.94Å; D418-L446 HydrophobicContact CB-CD1 4.29Å; D418-L446 HydrophobicContact CB-CD2 4.06Å; D418-L446 VanDerWaalsContact OD1-CD2 3.28Å; D418-L446 WeakPolarHBondContact OD1-CD2 3.47Å; R442-L446 PolarHBondContact O-N 3.32Å; L446-R448 VanDerWaalsContact C-N 3.31Å; L446-R448 PolarHBondContact O-N 2.99Å; L446-E449 WeakPolarHBondContact O-CB 3.49Å; L446-E449 PolarHBondContact O-N 2.69Å; L446-C450 PolarHBondContact O-N 2.84Å; L446-C450 PolarHBondContact O-SG 3.32Å; L446-C450 VanDerWaalsContact O-SG 3.39Å
447	G	98.2	Very high	97.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-36.3	175.7	0	0	0	0	0	112.4	A443 E445 L451	A443-G447 WeakPolarHBondContact O-CA 3.15Å; A443-G447 PolarHBondContact O-N 3.12Å; E445-G447 VanDerWaalsContact C-N 3.3Å; E445-G447 PolarHBondContact O-N 2.88Å; G447-L451 WeakPolarHBondContact O-CB 3.48Å; G447-L451 PolarHBondContact O-N 3.21Å
448	R	98.3	Very high	97.2	Very high	85 Å²	85	49.7 Å²	49.7	32%	0.321	26%	0.258	S	S	.	.	H	α-helix	trans	-66.7	-40.5	173.1	-68.4	172.9	-163.8	-64.5	-0.3	111.6	M444 E445 L446 S452 E461 L491	M444-R448 WeakPolarHBondContact O-CD 3.38Å; M444-R448 VanDerWaalsContact O-CG 3.27Å; M444-R448 WeakPolarHBondContact O-CG 3.18Å; M444-R448 PolarHBondContact O-NE 3.41Å; E445-R448 WeakPolarHBondContact O-CB 3.38Å; E445-R448 PolarHBondContact O-N 3.32Å; E445-R448 VanDerWaalsContact O-N 3.13Å; L446-R448 VanDerWaalsContact C-N 3.31Å; L446-R448 PolarHBondContact O-N 2.99Å; R448-S452 PolarHBondContact O-N 2.81Å; R448-S452 VanDerWaalsContact O-N 3.09Å; R448-E461 IonicContact CZ-OE2 2.81Å; R448-E461 IonicContact NH1-OE2 3.22Å; R448-E461 IonicContact NH2-OE1 2.75Å; R448-E461 IonicContact NH2-OE2 2.81Å; R448-E461 PolarHBondContact NH2-OE2 2.98Å; R448-L491 HydrophobicContact CG-CD1 3.84Å
449	E	98.3	Very high	97.2	Very high	90 Å²	90	52.9 Å²	52.9	42%	0.421	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-52	174.5	-170.8	-166.7	153.9	0	0	111.1	R422 E445 L446 L451 S452 Q453	R422-E449 IonicContact CZ-OE1 2.67Å; R422-E449 IonicContact CZ-OE2 3.36Å; R422-E449 IonicContact NE-OE1 3.63Å; R422-E449 PolarHBondContact NE-OE1 3.19Å; R422-E449 IonicContact NE-OE2 3.56Å; R422-E449 IonicContact NH2-OE1 3.48Å; R422-E449 PolarHBondContact NH2-OE1 2.89Å; R422-E449 VanDerWaalsContact NH2-OE1 3.17Å; R422-E449 IonicContact NH2-OE2 3.71Å; R422-E449 PolarHBondContact NH2-OE2 3.22Å; E445-E449 PolarHBondContact O-N 2.77Å; L446-E449 WeakPolarHBondContact O-CB 3.49Å; L446-E449 PolarHBondContact O-N 2.69Å; E449-L451 VanDerWaalsContact C-N 3.34Å; E449-L451 PolarHBondContact O-N 3.03Å; E449-S452 PolarHBondContact O-N 3.48Å; E449-Q453 WeakPolarHBondContact O-CB 3.32Å; E449-Q453 PolarHBondContact O-N 3.21Å
450	C	98.3	Very high	97.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.3	-44.8	177.6	-71.8	0	0	0	0	111.9	L446 S452 Q453 W454	L446-C450 PolarHBondContact O-N 2.84Å; L446-C450 PolarHBondContact O-SG 3.32Å; L446-C450 VanDerWaalsContact O-SG 3.39Å; C450-S452 VanDerWaalsContact C-N 3.34Å; C450-S452 PolarHBondContact O-N 2.87Å; C450-Q453 PolarHBondContact O-N 3.06Å; C450-W454 HydrophobicContact CB-CD2 4.26Å; C450-W454 HydrophobicContact CB-CE3 4.18Å; C450-W454 HydrophobicContact CB-CH2 3.74Å; C450-W454 HydrophobicContact CB-CZ2 3.81Å; C450-W454 HydrophobicContact CB-CZ3 3.93Å; C450-W454 WeakPolarHBondContact O-CB 2.95Å; C450-W454 PolarHBondContact O-N 2.79Å
451	L	98.1	Very high	97.4	Very high	4 Å²	4	55.4 Å²	55.4	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-58.7	-46.1	178.8	-169	152.9	0	0	0	110.9	L435 G447 E449 W454 G455 Y456 R458 L491	L435-L451 HydrophobicContact CD2-CG 4.41Å; G447-L451 WeakPolarHBondContact O-CB 3.48Å; G447-L451 PolarHBondContact O-N 3.21Å; E449-L451 VanDerWaalsContact C-N 3.34Å; E449-L451 PolarHBondContact O-N 3.03Å; L451-W454 PolarHBondContact O-N 3.06Å; L451-G455 PolarHBondContact O-N 3.16Å; L451-Y456 VanDerWaalsContact CD2-CB 3.4Å; L451-Y456 WeakPolarHBondContact CD2-O 3.44Å; L451-Y456 WeakPolarHBondContact O-CB 3.38Å; L451-Y456 PolarHBondContact O-N 2.6Å; L451-R458 HydrophobicContact CD1-CB 4.49Å; L451-R458 HydrophobicContact CD2-CB 4.05Å; L451-L491 HydrophobicContact CD1-CB 4.01Å
452	S	97.8	Very high	97.7	Very high	86 Å²	86	53.7 Å²	53.7	60%	0.601	27%	0.268	S	S	*	.	H	α-helix	trans	-64.7	-44.2	175.1	-178.3	0	0	0	0	112.4	R448 E449 C450 W454 G455	R448-S452 PolarHBondContact O-N 2.81Å; R448-S452 VanDerWaalsContact O-N 3.09Å; E449-S452 PolarHBondContact O-N 3.48Å; C450-S452 VanDerWaalsContact C-N 3.34Å; C450-S452 PolarHBondContact O-N 2.87Å; S452-W454 VanDerWaalsContact C-N 3.28Å; S452-W454 PolarHBondContact O-N 3.32Å; S452-G455 PolarHBondContact O-N 2.89Å
453	Q	97.7	Very high	97.9	Very high	108 Å²	108	51.5 Å²	51.5	51%	0.505	26%	0.263	S	S	.	.	H	α-helix	trans	-62.6	-35.4	178.6	-175.3	176.7	6.5	0	0	112.3	R422 E449 C450 G455	R422-Q453 VanDerWaalsContact CG-OE1 3.26Å; E449-Q453 WeakPolarHBondContact O-CB 3.32Å; E449-Q453 PolarHBondContact O-N 3.21Å; C450-Q453 PolarHBondContact O-N 3.06Å; Q453-G455 PolarHBondContact O-N 3.1Å
454	W	98.3	Very high	98	Very high	8 Å²	8	51.7 Å²	51.7	3%	0.03	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-0.8	176.7	-60.4	-30.1	0	0	0	113.7	M421 L424 I426 P427 L435 L437 C450 L451 S452 Y456	M421-W454 HydrophobicContact CE-CH2 4.42Å; M421-W454 WeakPolarHBondContact O-CZ2 3.42Å; L424-W454 HydrophobicContact CB-CZ2 4.22Å; L424-W454 HydrophobicContact CD1-CZ2 4.38Å; I426-W454 HydrophobicContact CB-CB 4.3Å; I426-W454 HydrophobicContact CB-CD2 3.8Å; I426-W454 HydrophobicContact CB-CE3 4.19Å; I426-W454 HydrophobicContact CB-CG 3.86Å; I426-W454 HydrophobicContact CG1-CD2 3.69Å; I426-W454 HydrophobicContact CG1-CE3 3.97Å; I426-W454 HydrophobicContact CG1-CG 4.22Å; I426-W454 HydrophobicContact CG1-CH2 4.04Å; I426-W454 HydrophobicContact CG1-CZ2 3.76Å; I426-W454 HydrophobicContact CG1-CZ3 4.14Å; I426-W454 HydrophobicContact CG2-CB 4.43Å; I426-W454 HydrophobicContact CG2-CD2 4.2Å; I426-W454 HydrophobicContact CG2-CE3 4.14Å; I426-W454 HydrophobicContact CG2-CG 4.36Å; P427-W454 HydrophobicContact CG-CB 4.14Å; P427-W454 HydrophobicContact CG-CG 4.48Å; L435-W454 HydrophobicContact CD2-CE3 3.77Å; L435-W454 HydrophobicContact CD2-CZ3 4.03Å; L437-W454 HydrophobicContact CD1-CZ3 4.36Å; L437-W454 HydrophobicContact CD2-CZ3 4.08Å; C450-W454 HydrophobicContact CB-CD2 4.26Å; C450-W454 HydrophobicContact CB-CE3 4.18Å; C450-W454 HydrophobicContact CB-CH2 3.74Å; C450-W454 HydrophobicContact CB-CZ2 3.81Å; C450-W454 HydrophobicContact CB-CZ3 3.93Å; C450-W454 WeakPolarHBondContact O-CB 2.95Å; C450-W454 PolarHBondContact O-N 2.79Å; L451-W454 PolarHBondContact O-N 3.06Å; S452-W454 VanDerWaalsContact C-N 3.28Å; S452-W454 PolarHBondContact O-N 3.32Å; W454-Y456 HydrophobicContact CB-CD2 3.81Å; W454-Y456 HydrophobicContact CB-CE2 3.96Å
455	G	97.9	Very high	98	Very high	47 Å²	47	51.9 Å²	51.9	49%	0.485	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	24.5	175.9	0	0	0	0	0	114.2	L451 S452 Q453 K495	L451-G455 PolarHBondContact O-N 3.16Å; S452-G455 PolarHBondContact O-N 2.89Å; Q453-G455 PolarHBondContact O-N 3.1Å; G455-K495 WeakPolarHBondContact O-CG 3.38Å
456	Y	98.6	Very high	97.8	Very high	9 Å²	9	48.1 Å²	48.1	4%	0.035	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-101.2	148.5	174.6	-65	-102	0	0	0	110.8	I426 Q430 L435 L451 W454 V494 K495	I426-Y456 HydrophobicContact CG2-CE2 4.05Å; Q430-Y456 VanDerWaalsContact NE2-CE1 3.34Å; Q430-Y456 PolarHBondContact NE2-OH 2.83Å; L435-Y456 HydrophobicContact CB-CD1 3.63Å; L435-Y456 HydrophobicContact CB-CE1 3.39Å; L435-Y456 HydrophobicContact CB-CE2 4.41Å; L435-Y456 HydrophobicContact CB-CG 4.24Å; L435-Y456 HydrophobicContact CD2-CD1 4.44Å; L435-Y456 HydrophobicContact CD2-CD2 4.02Å; L435-Y456 HydrophobicContact CD2-CE1 4.47Å; L435-Y456 HydrophobicContact CD2-CE2 4.06Å; L435-Y456 HydrophobicContact CD2-CG 4.23Å; L451-Y456 VanDerWaalsContact CD2-CB 3.4Å; L451-Y456 WeakPolarHBondContact CD2-O 3.44Å; L451-Y456 WeakPolarHBondContact O-CB 3.38Å; L451-Y456 PolarHBondContact O-N 2.6Å; W454-Y456 HydrophobicContact CB-CD2 3.81Å; W454-Y456 HydrophobicContact CB-CE2 3.96Å; Y456-V494 CarbonylContact C-O 3.57Å; Y456-V494 VanDerWaalsContact CA-O 3.28Å; Y456-V494 WeakPolarHBondContact CA-O 3.5Å; Y456-K495 HydrophobicContact CD1-CB 3.59Å; Y456-K495 HydrophobicContact CE1-CB 3.59Å; Y456-K495 HydrophobicContact CE1-CD 4.35Å; Y456-K495 HydrophobicContact CE2-CD 4.13Å; Y456-K495 HydrophobicContact CG-CB 4.13Å
457	E	98.2	Very high	97.5	Very high	139 Å²	139	47.9 Å²	47.9	65%	0.65	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101	131.3	164.6	-177.3	-177.3	175	0	0	108.8	V459 G493 V494	E457-V459 PolarHBondContact O-N 2.75Å; E457-G493 CarbonylContact O-C 3.55Å; E457-G493 VanDerWaalsContact O-CA 3.26Å; E457-G493 WeakPolarHBondContact O-CA 3.5Å; E457-V494 HydrophobicContact CB-CG1 4.16Å; E457-V494 PolarHBondContact N-O 2.91Å; E457-V494 PolarHBondContact O-N 2.68Å
458	R	98.3	Very high	96.9	Very high	107 Å²	107	49.2 Å²	49.2	40%	0.404	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	119.3	176.1	-174.4	-161.3	67.3	86.4	4.2	110.2	L451 V492	L451-R458 HydrophobicContact CD1-CB 4.49Å; L451-R458 HydrophobicContact CD2-CB 4.05Å; R458-V492 WeakPolarHBondContact CA-O 3.3Å
459	V	97.7	Very high	96.2	Very high	73 Å²	73	46 Å²	46	44%	0.442	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-22.3	-178.6	-68.6	0	0	0	0	113.9	F434 E457 V492 V494	F434-V459 HydrophobicContact CE1-CG2 4.32Å; E457-V459 PolarHBondContact O-N 2.75Å; V459-V492 HydrophobicContact CG2-CG1 4.43Å; V459-V492 PolarHBondContact N-O 3.24Å; V459-V494 HydrophobicContact CG1-CB 4.2Å; V459-V494 HydrophobicContact CG1-CG1 3.47Å; V459-V494 VanDerWaalsContact CG1-CG1 3.47Å; V459-V494 HydrophobicContact CG2-CB 4.07Å; V459-V494 HydrophobicContact CG2-CG1 4.27Å
460	D	98.3	Very high	95.5	Very high	75 Å²	75	42.8 Å²	42.8	40%	0.401	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	170.8	180	-141.6	-34.1	0	0	0	111.9	V492	D460-V492 HydrophobicContact CB-CB 3.67Å; D460-V492 HydrophobicContact CB-CG1 4.28Å; D460-V492 HydrophobicContact CB-CG2 3.93Å; D460-V492 PolarHBondContact N-O 3.49Å; D460-V492 PolarHBondContact O-N 2.85Å
461	E	98.5	Very high	94.8	Very high	40 Å²	40	46.2 Å²	46.2	19%	0.187	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	103.2	175.7	-174.8	170	148.1	0	0	111	R448 H489 L491	R448-E461 IonicContact CZ-OE2 2.81Å; R448-E461 IonicContact NH1-OE2 3.22Å; R448-E461 IonicContact NH2-OE1 2.75Å; R448-E461 IonicContact NH2-OE2 2.81Å; R448-E461 PolarHBondContact NH2-OE2 2.98Å; E461-H489 IonicContact OE1-CE1 2.78Å; E461-H489 PolarHBondContact OE1-CE1 3.34Å; E461-H489 IonicContact OE1-CG 2.62Å; E461-H489 IonicContact OE1-ND1 3.89Å; E461-H489 PolarHBondContact OE1-ND1 3.15Å; E461-L491 HydrophobicContact CG-CD2 4.09Å
462	I	98.7	Very high	94.3	Very high	7 Å²	7	52.9 Å²	52.9	4%	0.036	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	137.7	177.5	-65.1	168.3	0	0	0	109.5	F436 H489 C490 V492 D508 I510 I524 M527	F436-I462 HydrophobicContact CD1-CD1 4.11Å; F436-I462 HydrophobicContact CE1-CD1 3.73Å; I462-H489 CarbonylContact O-C 3.58Å; I462-H489 WeakPolarHBondContact O-CA 3.37Å; I462-C490 HydrophobicContact CB-CB 4.22Å; I462-C490 PolarHBondContact N-O 3.45Å; I462-C490 PolarHBondContact O-N 2.9Å; I462-V492 HydrophobicContact CD1-CG2 3.98Å; I462-V492 HydrophobicContact CG1-CG2 4.06Å; I462-D508 CarbonylContact C-O 3.48Å; I462-D508 VanDerWaalsContact CA-O 3.28Å; I462-D508 WeakPolarHBondContact CA-O 3.44Å; I462-I510 HydrophobicContact CG2-CD1 3.88Å; I462-I510 HydrophobicContact CG2-CG1 4.01Å; I462-I524 HydrophobicContact CD1-CD1 3.78Å; I462-M527 HydrophobicContact CD1-CE 3.81Å; I462-M527 HydrophobicContact CG1-CE 4.44Å
463	I	98.3	Very high	93.9	Very high	43 Å²	43	52.4 Å²	52.4	22%	0.221	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131	168.4	59.1	168.2	0	0	0	110.9	V465 K487 E488 D508 V509 I510	I463-V465 HydrophobicContact CD1-CG2 4.49Å; I463-K487 HydrophobicContact CB-CD 4.03Å; I463-K487 HydrophobicContact CD1-CD 4.24Å; I463-K487 HydrophobicContact CG2-CD 3.95Å; I463-E488 WeakPolarHBondContact CA-O 3.2Å; I463-D508 PolarHBondContact N-O 3.32Å; I463-V509 HydrophobicContact CD1-CG1 4.45Å; I463-V509 HydrophobicContact CD1-CG2 4.08Å; I463-V509 HydrophobicContact CG1-CB 4.36Å; I463-V509 HydrophobicContact CG1-CG1 4.25Å; I463-V509 HydrophobicContact CG1-CG2 3.89Å; I463-V509 WeakPolarHBondContact O-CA 3.31Å; I463-I510 PolarHBondContact O-N 2.81Å
464	W	97.6	Very high	93.2	Very high	5 Å²	5	49.9 Å²	49.9	2%	0.019	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	110	167.6	167.2	33.7	0	0	0	109.5	W438 K466 K487 E488 I510 A512 V514 H519 K520 P521	W438-W464 HydrophobicContact CH2-CB 4.12Å; W438-W464 HydrophobicContact CZ3-CB 4.12Å; W438-W464 HydrophobicContact CZ3-CE3 4.43Å; W464-K466 HydrophobicContact CD2-CG 4.16Å; W464-K466 HydrophobicContact CE3-CG 4.48Å; W464-K466 HydrophobicContact CH2-CG 4.45Å; W464-K466 HydrophobicContact CZ2-CG 4.1Å; W464-K487 CarbonylContact O-C 3.52Å; W464-K487 WeakPolarHBondContact O-CA 3.25Å; W464-K487 WeakPolarHBondContact O-CB 3.2Å; W464-E488 HydrophobicContact CE3-CB 4.07Å; W464-E488 HydrophobicContact CE3-CG 4.48Å; W464-E488 PolarHBondContact N-O 3.46Å; W464-E488 PolarHBondContact O-N 2.99Å; W464-I510 CarbonylContact C-O 3.48Å; W464-I510 WeakPolarHBondContact CA-O 3.27Å; W464-I510 HydrophobicContact CB-CB 4.43Å; W464-A512 PolarHBondContact NE1-O 3.3Å; W464-V514 HydrophobicContact CZ2-CG2 4.2Å; W464-H519 WeakPolarHBondContact CH2-O 3.48Å; W464-K520 HydrophobicContact CE3-CD 4.29Å; W464-K520 HydrophobicContact CZ3-CD 4.11Å; W464-P521 HydrophobicContact CB-CG 4.19Å; W464-P521 VanDerWaalsContact CD2-CD 3.49Å; W464-P521 HydrophobicContact CD2-CG 3.79Å; W464-P521 VanDerWaalsContact CE3-CD 3.44Å; W464-P521 HydrophobicContact CE3-CG 4.22Å; W464-P521 HydrophobicContact CG-CG 3.76Å
465	V	96.3	Very high	92.4	Very high	30 Å²	30	58.6 Å²	58.6	18%	0.182	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	119.5	170.9	-178.8	0	0	0	0	109.2	I463 T467 I473 V509 I510 V511 A512	I463-V465 HydrophobicContact CD1-CG2 4.49Å; V465-T467 PolarHBondContact O-N 3.35Å; V465-I473 HydrophobicContact CG1-CD1 4.32Å; V465-I473 HydrophobicContact CG1-CG1 4.07Å; V465-V509 HydrophobicContact CG2-CG1 4.02Å; V465-I510 PolarHBondContact N-O 3.11Å; V465-V511 HydrophobicContact CB-CG2 4.38Å; V465-A512 PolarHBondContact O-N 3.16Å
466	K	92.3	Very high	91.1	Very high	47 Å²	47	60.3 Å²	60.3	20%	0.204	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	109.6	-177.3	-67.7	179.8	177.8	-178.9	0	110.7	W464 G486 E488 V514	W464-K466 HydrophobicContact CD2-CG 4.16Å; W464-K466 HydrophobicContact CE3-CG 4.48Å; W464-K466 HydrophobicContact CH2-CG 4.45Å; W464-K466 HydrophobicContact CZ2-CG 4.1Å; K466-G486 PolarHBondContact N-O 3.05Å; K466-E488 WeakPolarHBondContact CE-OE1 3.48Å; K466-E488 IonicContact NZ-OE1 2.97Å; K466-E488 PolarHBondContact NZ-OE1 3.19Å; K466-V514 HydrophobicContact CB-CG2 3.66Å; K466-V514 HydrophobicContact CD-CG2 3.93Å; K466-V514 HydrophobicContact CG-CG2 3.82Å
467	T	91.2	Very high	89.9	Confident	3 Å²	3	62.6 Å²	62.6	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	160.3	173.6	58.1	0	0	0	0	111.4	V465 R472 V511 A512 E513 V514	V465-T467 PolarHBondContact O-N 3.35Å; T467-R472 CarbonylContact C-O 3.57Å; T467-R472 WeakPolarHBondContact CA-O 3.2Å; T467-V511 HydrophobicContact CG2-CG1 3.56Å; T467-A512 PolarHBondContact N-O 3.25Å; T467-A512 VanDerWaalsContact OG1-C 3.28Å; T467-A512 PolarHBondContact OG1-O 2.95Å; T467-E513 WeakPolarHBondContact O-CA 3.38Å; T467-E513 PolarHBondContact OG1-N 3.33Å; T467-V514 PolarHBondContact O-N 2.81Å
468	N	86.4	Confident	88.6	Confident	28 Å²	28	67.3 Å²	67.3	15%	0.15	32%	0.32	C	S	.	.			trans	-93	179	163.8	70.6	4.7	0	0	0	110.3	L325 L470 Q471 R472 I474	L325-N468 HydrophobicContact CD1-CB 4.01Å; L325-N468 WeakPolarHBondContact CD1-ND2 3.11Å; N468-L470 PolarHBondContact O-N 3.38Å; N468-L470 WeakPolarHBondContact OD1-CA 3.34Å; N468-L470 PolarHBondContact OD1-N 2.62Å; N468-Q471 WeakPolarHBondContact O-CA 3.31Å; N468-Q471 PolarHBondContact O-N 2.93Å; N468-Q471 PolarHBondContact OD1-N 2.96Å; N468-R472 PolarHBondContact N-O 2.93Å; N468-R472 WeakPolarHBondContact OD1-CB 3.47Å; N468-R472 PolarHBondContact OD1-N 2.8Å; N468-R472 PolarHBondContact OD1-O 2.9Å; N468-I474 HydrophobicContact CB-CG1 4.19Å
469	Q	83.7	Confident	87.8	Confident	16 Å²	16	65.3 Å²	65.3	8%	0.075	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-32.2	177.8	-168.4	-177.2	13.3	0	0	114.2	F307 L325 Y339 Q471	F307-Q469 HydrophobicContact CE1-CG 4.03Å; F307-Q469 WeakPolarHBondContact CE1-O 3.29Å; F307-Q469 WeakPolarHBondContact CZ-O 3.32Å; L325-Q469 HydrophobicContact CB-CB 4.41Å; L325-Q469 HydrophobicContact CD1-CB 3.98Å; Y339-Q469 PolarHBondContact O-NE2 2.87Å; Y339-Q469 PolarHBondContact O-OE1 3.16Å; Q469-Q471 PolarHBondContact O-N 2.68Å; Q469-Q471 PolarHBondContact O-NE2 3.47Å
470	L	83.3	Confident	87.2	Confident	23 Å²	23	62.5 Å²	62.5	12%	0.12	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	15.6	178.7	-59.6	178	0	0	0	113.1	F307 L325 Y339 N468 R472	F307-L470 HydrophobicContact CB-CD2 4.34Å; F307-L470 HydrophobicContact CD1-CD2 3.97Å; F307-L470 HydrophobicContact CD2-CD2 3.53Å; F307-L470 HydrophobicContact CE1-CD2 4.11Å; F307-L470 HydrophobicContact CE2-CD2 3.68Å; F307-L470 HydrophobicContact CG-CD2 3.67Å; F307-L470 HydrophobicContact CZ-CD2 3.97Å; L325-L470 HydrophobicContact CD1-CB 4.4Å; L325-L470 HydrophobicContact CD1-CD1 3.99Å; L325-L470 HydrophobicContact CD1-CG 3.74Å; Y339-L470 HydrophobicContact CD1-CD2 4.37Å; Y339-L470 HydrophobicContact CD2-CD1 4.05Å; Y339-L470 HydrophobicContact CD2-CD2 4.08Å; Y339-L470 HydrophobicContact CD2-CG 4.36Å; Y339-L470 HydrophobicContact CE2-CD1 3.83Å; Y339-L470 HydrophobicContact CE2-CD2 4.48Å; Y339-L470 HydrophobicContact CG-CD2 4.04Å; N468-L470 PolarHBondContact O-N 3.38Å; N468-L470 WeakPolarHBondContact OD1-CA 3.34Å; N468-L470 PolarHBondContact OD1-N 2.62Å; L470-R472 HydrophobicContact CB-CG 4.35Å; L470-R472 PolarHBondContact O-N 2.94Å; L470-R472 VanDerWaalsContact O-N 3.14Å
471	Q	84.2	Confident	86.6	Confident	72 Å²	72	65.4 Å²	65.4	34%	0.336	32%	0.316	S	S	.	.	S	Bend	trans	57.7	25.4	-177.5	-49.8	-50	-49.1	0	0	114	F283 N468 Q469 E513	F283-Q471 HydrophobicContact CD2-CG 3.55Å; F283-Q471 HydrophobicContact CE2-CG 3.69Å; F283-Q471 HydrophobicContact CG-CG 4.33Å; N468-Q471 WeakPolarHBondContact O-CA 3.31Å; N468-Q471 PolarHBondContact O-N 2.93Å; N468-Q471 PolarHBondContact OD1-N 2.96Å; Q469-Q471 PolarHBondContact O-N 2.68Å; Q469-Q471 PolarHBondContact O-NE2 3.47Å; Q471-E513 PolarHBondContact NE2-OE1 3.24Å
472	R	87.1	Confident	86.2	Confident	145 Å²	145	75.1 Å²	75.1	55%	0.547	35%	0.352	S	S	.	.			trans	-99.3	143.8	176.4	-62	175.9	-178.5	164.4	0.9	110.1	D321 T467 N468 L470 I474	D321-R472 IonicContact OD2-NH1 3.9Å; D321-R472 PolarHBondContact OD2-NH1 3.48Å; T467-R472 CarbonylContact C-O 3.57Å; T467-R472 WeakPolarHBondContact CA-O 3.2Å; N468-R472 PolarHBondContact N-O 2.93Å; N468-R472 WeakPolarHBondContact OD1-CB 3.47Å; N468-R472 PolarHBondContact OD1-N 2.8Å; N468-R472 PolarHBondContact OD1-O 2.9Å; L470-R472 HydrophobicContact CB-CG 4.35Å; L470-R472 PolarHBondContact O-N 2.94Å; L470-R472 VanDerWaalsContact O-N 3.14Å; R472-I474 PolarHBondContact O-N 2.85Å
473	I	88.6	Confident	86	Confident	76 Å²	76	81.3 Å²	81.3	39%	0.39	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-64.4	133.6	172.2	-60.7	172.5	0	0	0	109.2	V465 R475	V465-I473 HydrophobicContact CG1-CD1 4.32Å; V465-I473 HydrophobicContact CG1-CG1 4.07Å; I473-R475 HydrophobicContact CB-CG 4.44Å; I473-R475 HydrophobicContact CG2-CG 4.18Å; I473-R475 PolarHBondContact O-N 2.8Å; I473-R475 VanDerWaalsContact O-N 3.14Å
474	I	84	Confident	85.6	Confident	55 Å²	55	83 Å²	83	28%	0.282	39%	0.393	S	S	.	.			trans	-72.2	106.2	173.6	-56.5	172.1	0	0	0	108.5	N468 R472 V514	N468-I474 HydrophobicContact CB-CG1 4.19Å; R472-I474 PolarHBondContact O-N 2.85Å; I474-V514 HydrophobicContact CD1-CG2 4Å
475	R	82.3	Confident	85.3	Confident	190 Å²	190	87 Å²	87	72%	0.717	41%	0.412	S	S	*	.			trans	-106.2	-17.1	-175.9	-66.9	179.2	-176.6	-139.9	0.7	114.1	I473 N484	I473-R475 HydrophobicContact CB-CG 4.44Å; I473-R475 HydrophobicContact CG2-CG 4.18Å; I473-R475 PolarHBondContact O-N 2.8Å; I473-R475 VanDerWaalsContact O-N 3.14Å; R475-N484 PolarHBondContact O-ND2 2.81Å
476	T	69.8	Low	85.2	Confident	83 Å²	83	86.5 Å²	86.5	51%	0.509	41%	0.413	S	S	.	.			trans	-90.6	161	-178.1	52.9	0	0	0	0	111.2
477	G	73.1	Confident	85.3	Confident	57 Å²	57	88.4 Å²	88.4	59%	0.588	42%	0.422	S	S	*	.	S	Bend	trans	92.2	172.8	-173.1	0	0	0	0	0	113.7	N484	G477-N484 PolarHBondContact O-ND2 2.61Å; G477-N484 PolarHBondContact O-OD1 3.42Å; G477-N484 VanDerWaalsContact O-OD1 3.09Å
478	R	71.6	Confident	85.5	Confident	239 Å²	239	89.7 Å²	89.7	90%	0.902	43%	0.428	S	S	*	.			trans	-105.1	84.3	172.3	-175.5	-176.5	-69.7	158.9	-1.4	108.2
479	T	81.3	Confident	86.1	Confident	65 Å²	65	89.9 Å²	89.9	40%	0.399	43%	0.427	S	S	.	.			trans	-98.2	-3.3	-174.1	58.2	0	0	0	0	113.6	N484 H485	T479-N484 PolarHBondContact N-OD1 3.22Å; T479-N484 WeakPolarHBondContact OG1-CA 3.2Å; T479-H485 PolarHBondContact O-ND1 3.14Å; T479-H485 PolarHBondContact OG1-N 2.93Å; T479-H485 PolarHBondContact OG1-O 2.68Å
480	G	84.6	Confident	86.8	Confident	13 Å²	13	89.1 Å²	89.1	13%	0.134	42%	0.424	C	S	.	.	S	Bend	trans	-149.5	173.8	173.7	0	0	0	0	0	112.2	L483	G480-L483 WeakPolarHBondContact CA-O 3.43Å
481	H	86.1	Confident	87.5	Confident	136 Å²	136	88 Å²	88	63%	0.63	42%	0.418	S	S	*	.	S	Bend	trans	-75.8	-38.4	-174.9	-67.7	88.4	0	0	0	113.1	M409	M409-H481 PolarHBondContact SD-CE1 3.09Å
482	W	90.1	Very high	88.2	Confident	244 Å²	244	85.1 Å²	85.1	92%	0.924	41%	0.405	S	S	*	.	S	Bend	trans	-123.2	-43.9	-175.9	-56.8	106.1	0	0	0	112.1
483	L	93.3	Very high	88.8	Confident	138 Å²	138	78.2 Å²	78.2	72%	0.723	38%	0.379	S	S	*	.	S	Bend	trans	-121.5	149	175.5	-61.9	176.5	0	0	0	108.8	G480 H485	G480-L483 WeakPolarHBondContact CA-O 3.43Å; L483-H485 PolarHBondContact O-CD2 3.5Å; L483-H485 VanDerWaalsContact O-CD2 3.28Å
484	N	90.1	Very high	89.2	Confident	77 Å²	77	75.4 Å²	75.4	41%	0.412	37%	0.366	S	S	.	.			trans	-66.4	135.4	172.2	-77.4	-11.8	0	0	0	110.3	R475 G477 T479	R475-N484 PolarHBondContact O-ND2 2.81Å; G477-N484 PolarHBondContact O-ND2 2.61Å; G477-N484 PolarHBondContact O-OD1 3.42Å; G477-N484 VanDerWaalsContact O-OD1 3.09Å; T479-N484 PolarHBondContact N-OD1 3.22Å; T479-N484 WeakPolarHBondContact OG1-CA 3.2Å
485	H	92.2	Very high	89.9	Confident	89 Å²	89	74.6 Å²	74.6	41%	0.412	36%	0.36	S	S	.	.			trans	-91.3	110.2	179.8	-65.6	175.3	0	0	0	110	T479 L483	T479-H485 PolarHBondContact O-ND1 3.14Å; T479-H485 PolarHBondContact OG1-N 2.93Å; T479-H485 PolarHBondContact OG1-O 2.68Å; L483-H485 PolarHBondContact O-CD2 3.5Å; L483-H485 VanDerWaalsContact O-CD2 3.28Å
486	G	93.2	Very high	90.5	Very high	20 Å²	20	68.2 Å²	68.2	21%	0.206	35%	0.353	C	S	.	.			trans	-97.5	6	175.3	0	0	0	0	0	114.3	K466	K466-G486 PolarHBondContact N-O 3.05Å
487	K	94.7	Very high	91.4	Very high	88 Å²	88	66.7 Å²	66.7	38%	0.383	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	159.8	-176.8	57.2	165.6	168.1	58.2	0	113.8	I463 W464 H489	I463-K487 HydrophobicContact CB-CD 4.03Å; I463-K487 HydrophobicContact CD1-CD 4.24Å; I463-K487 HydrophobicContact CG2-CD 3.95Å; W464-K487 CarbonylContact O-C 3.52Å; W464-K487 WeakPolarHBondContact O-CA 3.25Å; W464-K487 WeakPolarHBondContact O-CB 3.2Å; K487-H489 PolarHBondContact NZ-CE1 3.45Å; K487-H489 VanDerWaalsContact NZ-CE1 3.35Å; K487-H489 PolarHBondContact NZ-NE2 3.24Å
488	E	95.9	Very high	91.7	Very high	30 Å²	30	66.3 Å²	66.3	14%	0.14	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	155.7	164.4	-80.2	-178.3	-133.9	0	0	110.5	W438 I463 W464 K466 K520	W438-E488 HydrophobicContact CE3-CB 4.33Å; W438-E488 HydrophobicContact CZ3-CB 4.13Å; I463-E488 WeakPolarHBondContact CA-O 3.2Å; W464-E488 HydrophobicContact CE3-CB 4.07Å; W464-E488 HydrophobicContact CE3-CG 4.48Å; W464-E488 PolarHBondContact N-O 3.46Å; W464-E488 PolarHBondContact O-N 2.99Å; K466-E488 WeakPolarHBondContact CE-OE1 3.48Å; K466-E488 IonicContact NZ-OE1 2.97Å; K466-E488 PolarHBondContact NZ-OE1 3.19Å; E488-K520 WeakPolarHBondContact OE2-CE 3.43Å; E488-K520 IonicContact OE2-NZ 3.38Å; E488-K520 PolarHBondContact OE2-NZ 3.41Å
489	H	98.5	Very high	92.2	Very high	32 Å²	32	63 Å²	63	15%	0.148	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	144	-176.8	-69.8	-106.5	0	0	0	110.9	W438 V439 M444 E461 I462 K487	W438-H489 WeakPolarHBondContact CA-O 3.28Å; V439-H489 HydrophobicContact CG2-CB 3.82Å; V439-H489 PolarHBondContact N-O 3.48Å; M444-H489 HydrophobicContact CE-CB 3.92Å; M444-H489 HydrophobicContact SD-CB 3.74Å; E461-H489 IonicContact OE1-CE1 2.78Å; E461-H489 PolarHBondContact OE1-CE1 3.34Å; E461-H489 IonicContact OE1-CG 2.62Å; E461-H489 IonicContact OE1-ND1 3.89Å; E461-H489 PolarHBondContact OE1-ND1 3.15Å; I462-H489 CarbonylContact O-C 3.58Å; I462-H489 WeakPolarHBondContact O-CA 3.37Å; K487-H489 PolarHBondContact NZ-CE1 3.45Å; K487-H489 VanDerWaalsContact NZ-CE1 3.35Å; K487-H489 PolarHBondContact NZ-NE2 3.24Å
490	C	98.8	Very high	92.2	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	113.1	172.4	-174.8	0	0	0	0	109.2	L437 W438 I462	L437-C490 CarbonylContact O-C 3.6Å; L437-C490 WeakPolarHBondContact O-CA 3.3Å; W438-C490 HydrophobicContact CD2-CB 3.82Å; W438-C490 HydrophobicContact CE3-CB 3.74Å; W438-C490 HydrophobicContact CG-CB 4.43Å; W438-C490 HydrophobicContact CH2-CB 4.22Å; W438-C490 HydrophobicContact CZ2-CB 4.29Å; W438-C490 HydrophobicContact CZ3-CB 3.95Å; I462-C490 HydrophobicContact CB-CB 4.22Å; I462-C490 PolarHBondContact N-O 3.45Å; I462-C490 PolarHBondContact O-N 2.9Å
491	L	98.8	Very high	92.5	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	136.8	177.2	-55	-179.1	0	0	0	109.6	F436 L437 V439 R448 L451 E461	F436-L491 WeakPolarHBondContact CA-O 3.39Å; L437-L491 HydrophobicContact CB-CB 4.45Å; L437-L491 PolarHBondContact N-O 3.27Å; L437-L491 PolarHBondContact O-N 2.86Å; V439-L491 HydrophobicContact CG1-CD1 3.98Å; V439-L491 HydrophobicContact CG1-CG 4.19Å; V439-L491 HydrophobicContact CG2-CD1 4.23Å; V439-L491 HydrophobicContact CG2-CD2 4.08Å; V439-L491 HydrophobicContact CG2-CG 3.73Å; R448-L491 HydrophobicContact CG-CD1 3.84Å; L451-L491 HydrophobicContact CD1-CB 4.01Å; E461-L491 HydrophobicContact CG-CD2 4.09Å
492	V	98.8	Very high	92.7	Very high	10 Å²	10	59 Å²	59	6%	0.061	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	111.6	174.4	-172.5	0	0	0	0	109.2	F434 L435 F436 R458 V459 D460 I462	F434-V492 HydrophobicContact CD1-CG1 4.08Å; L435-V492 CarbonylContact O-C 3.5Å; L435-V492 WeakPolarHBondContact O-CA 3.31Å; F436-V492 HydrophobicContact CD1-CG2 3.99Å; F436-V492 HydrophobicContact CE1-CG1 4.24Å; F436-V492 HydrophobicContact CE1-CG2 3.84Å; F436-V492 HydrophobicContact CZ-CG1 4.2Å; R458-V492 WeakPolarHBondContact CA-O 3.3Å; V459-V492 HydrophobicContact CG2-CG1 4.43Å; V459-V492 PolarHBondContact N-O 3.24Å; D460-V492 HydrophobicContact CB-CB 3.67Å; D460-V492 HydrophobicContact CB-CG1 4.28Å; D460-V492 HydrophobicContact CB-CG2 3.93Å; D460-V492 PolarHBondContact N-O 3.49Å; D460-V492 PolarHBondContact O-N 2.85Å; I462-V492 HydrophobicContact CD1-CG2 3.98Å; I462-V492 HydrophobicContact CG1-CG2 4.06Å
493	G	98.5	Very high	92.7	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	142.9	176.2	0	0	0	0	0	111.8	F434 L435 E457	F434-G493 CarbonylContact C-O 3.6Å; F434-G493 VanDerWaalsContact CA-O 3.23Å; F434-G493 WeakPolarHBondContact CA-O 3.37Å; L435-G493 PolarHBondContact N-O 3.46Å; L435-G493 PolarHBondContact O-N 2.63Å; E457-G493 CarbonylContact O-C 3.55Å; E457-G493 VanDerWaalsContact O-CA 3.26Å; E457-G493 WeakPolarHBondContact O-CA 3.5Å
494	V	98.3	Very high	92.4	Very high	18 Å²	18	52.9 Å²	52.9	11%	0.109	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.1	169.9	71.7	0	0	0	0	110	G433 F434 Y456 E457 V459 T498	G433-V494 WeakPolarHBondContact O-CA 3.35Å; F434-V494 HydrophobicContact CD1-CB 4.17Å; F434-V494 HydrophobicContact CD1-CG2 4.26Å; F434-V494 HydrophobicContact CE1-CB 3.95Å; F434-V494 HydrophobicContact CE1-CG2 3.82Å; F434-V494 HydrophobicContact CZ-CG2 4.18Å; Y456-V494 CarbonylContact C-O 3.57Å; Y456-V494 VanDerWaalsContact CA-O 3.28Å; Y456-V494 WeakPolarHBondContact CA-O 3.5Å; E457-V494 HydrophobicContact CB-CG1 4.16Å; E457-V494 PolarHBondContact N-O 2.91Å; E457-V494 PolarHBondContact O-N 2.68Å; V459-V494 HydrophobicContact CG1-CB 4.2Å; V459-V494 HydrophobicContact CG1-CG1 3.47Å; V459-V494 VanDerWaalsContact CG1-CG1 3.47Å; V459-V494 HydrophobicContact CG2-CB 4.07Å; V459-V494 HydrophobicContact CG2-CG1 4.27Å; V494-T498 HydrophobicContact CG2-CG2 3.44Å; V494-T498 VanDerWaalsContact CG2-CG2 3.44Å
495	K	97.7	Very high	92.3	Very high	38 Å²	38	51.6 Å²	51.6	17%	0.165	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.8	171	-175	178.2	179.1	-173.4	0	108.7	P427 Q430 D431 D432 G433 G455 Y456	P427-K495 PolarHBondContact O-NZ 3.22Å; Q430-K495 WeakPolarHBondContact O-CE 3.39Å; Q430-K495 PolarHBondContact O-NZ 3.05Å; D431-K495 WeakPolarHBondContact O-CG 3.38Å; D432-K495 CarbonylContact C-O 3.58Å; D432-K495 VanDerWaalsContact CA-O 3.28Å; D432-K495 WeakPolarHBondContact CA-O 3.26Å; G433-K495 PolarHBondContact N-O 3.01Å; G433-K495 PolarHBondContact O-N 3.34Å; G455-K495 WeakPolarHBondContact O-CG 3.38Å; Y456-K495 HydrophobicContact CD1-CB 3.59Å; Y456-K495 HydrophobicContact CE1-CB 3.59Å; Y456-K495 HydrophobicContact CE1-CD 4.35Å; Y456-K495 HydrophobicContact CE2-CD 4.13Å; Y456-K495 HydrophobicContact CG-CB 4.13Å
496	G	94.4	Very high	92.4	Very high	56 Å²	56	50.2 Å²	50.2	58%	0.577	30%	0.302	S	S	*	.	S	Bend	trans	66.2	-143.5	177.9	0	0	0	0	0	114.1	D432	D432-G496 VanDerWaalsContact OD1-CA 3.25Å; D432-G496 WeakPolarHBondContact OD1-CA 3.48Å
497	S	88.8	Confident	92.5	Very high	51 Å²	51	53.3 Å²	53.3	36%	0.357	32%	0.319	S	S	.	.			trans	-82.5	140.4	-176.2	-176.6	0	0	0	0	113.1	D432 Q499	D432-S497 PolarHBondContact OD1-N 3.16Å; S497-Q499 WeakPolarHBondContact OG-CG 3.49Å; S497-Q499 PolarHBondContact OG-N 2.86Å
498	T	79.8	Confident	92.6	Very high	49 Å²	49	52.9 Å²	52.9	30%	0.301	32%	0.321	S	S	.	.			trans	-97.2	18.7	177	53.3	0	0	0	0	113.5	F434 V494	F434-T498 HydrophobicContact CZ-CG2 4.06Å; V494-T498 HydrophobicContact CG2-CG2 3.44Å; V494-T498 VanDerWaalsContact CG2-CG2 3.44Å
499	Q	81.7	Confident	92.8	Very high	169 Å²	169	54.2 Å²	54.2	79%	0.79	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	135.7	178.9	-69.9	-175.7	10.2	0	0	111.4	S497	S497-Q499 WeakPolarHBondContact OG-CG 3.49Å; S497-Q499 PolarHBondContact OG-N 2.86Å
500	G	82.1	Confident	92.7	Very high	75 Å²	75	53 Å²	53	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	0.5	175.4	0	0	0	0	0	115.9
501	F	90.3	Very high	92.5	Very high	28 Å²	28	57.1 Å²	57.1	12%	0.123	35%	0.351	C	S	.	.			trans	-99.1	143.4	178.1	-60.9	-88.5	0	0	0	112.8	F434 R503 L531 S532	F434-F501 AromaticContact CD2-CD1 3.79Å; F434-F501 HydrophobicContact CD2-CD1 3.79Å; F434-F501 HydrophobicContact CD2-CD2 4.47Å; F434-F501 AromaticContact CD2-CE1 3.73Å; F434-F501 HydrophobicContact CD2-CE1 3.73Å; F434-F501 HydrophobicContact CD2-CE2 4.43Å; F434-F501 HydrophobicContact CD2-CG 4.17Å; F434-F501 HydrophobicContact CD2-CZ 4.08Å; F434-F501 HydrophobicContact CE2-CB 4Å; F434-F501 AromaticContact CE2-CD1 3.64Å; F434-F501 HydrophobicContact CE2-CD1 3.64Å; F434-F501 AromaticContact CE2-CD2 3.79Å; F434-F501 HydrophobicContact CE2-CD2 3.79Å; F434-F501 AromaticContact CE2-CE1 3.96Å; F434-F501 HydrophobicContact CE2-CE1 3.96Å; F434-F501 HydrophobicContact CE2-CE2 4.11Å; F434-F501 AromaticContact CE2-CG 3.54Å; F434-F501 HydrophobicContact CE2-CG 3.54Å; F434-F501 HydrophobicContact CE2-CZ 4.19Å; F501-R503 PolarHBondContact O-N 2.87Å; F501-L531 WeakPolarHBondContact CA-O 3.35Å; F501-L531 HydrophobicContact CB-CD1 4.17Å; F501-L531 HydrophobicContact CD1-CG 4.34Å; F501-S532 WeakPolarHBondContact CE1-OG 3.5Å
502	N	90.3	Very high	92.1	Very high	28 Å²	28	57.4 Å²	57.4	15%	0.15	35%	0.353	C	S	.	.			trans	-91.2	85.8	178.7	-54.4	-43.1	0	0	0	110.5	I268 F272 L505 R530 L531	I268-N502 HydrophobicContact CG2-CB 4.08Å; F272-N502 WeakPolarHBondContact CE2-ND2 3.48Å; N502-L505 HydrophobicContact CB-CD1 3.5Å; N502-L505 HydrophobicContact CB-CG 4.03Å; N502-R530 WeakPolarHBondContact CB-O 3.27Å; N502-R530 PolarHBondContact ND2-O 3.25Å; N502-L531 PolarHBondContact N-O 3.36Å; N502-L531 WeakPolarHBondContact O-CD1 3.34Å
503	R	90.4	Very high	91.7	Very high	173 Å²	173	59.5 Å²	59.5	65%	0.653	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	145.8	179.6	-61.5	179	-66.6	-174	1	111.3	F501 L505	F501-R503 PolarHBondContact O-N 2.87Å; R503-L505 PolarHBondContact O-N 2.76Å
504	G	88	Confident	91.2	Very high	79 Å²	79	61.5 Å²	61.5	81%	0.814	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	12.2	171.7	0	0	0	0	0	116.2
505	L	88.4	Confident	90.5	Very high	50 Å²	50	65.4 Å²	65.4	26%	0.262	39%	0.387	S	S	.	.	S	Bend	trans	-75.2	-37.3	174.5	-67.6	-175.5	0	0	0	113.1	I268 V269 F272 N502 R503 R530	I268-L505 HydrophobicContact CG2-CD1 3.95Å; I268-L505 HydrophobicContact CG2-CD2 4.05Å; I268-L505 HydrophobicContact CG2-CG 4.47Å; V269-L505 HydrophobicContact CB-CD2 4.42Å; V269-L505 HydrophobicContact CG2-CD2 3.45Å; V269-L505 VanDerWaalsContact CG2-CD2 3.45Å; F272-L505 HydrophobicContact CD2-CD1 4.03Å; N502-L505 HydrophobicContact CB-CD1 3.5Å; N502-L505 HydrophobicContact CB-CG 4.03Å; R503-L505 PolarHBondContact O-N 2.76Å; L505-R530 HydrophobicContact CD1-CB 4.15Å
506	D	93.3	Very high	89.7	Confident	60 Å²	60	66.5 Å²	66.5	32%	0.321	40%	0.399	S	S	.	.	S	Bend	trans	-115.5	153.7	-178.2	-71.9	-81.9	0	0	0	110.5	M527 R530	D506-M527 HydrophobicContact CB-CB 4.47Å; D506-M527 HydrophobicContact CB-CE 4.06Å; D506-M527 HydrophobicContact CB-CG 4.08Å; D506-R530 IonicContact OD1-CZ 3.91Å; D506-R530 IonicContact OD1-NE 3.77Å; D506-R530 PolarHBondContact OD1-NE 3.12Å; D506-R530 IonicContact OD1-NH2 3.35Å; D506-R530 PolarHBondContact OD1-NH2 3Å; D506-R530 IonicContact OD2-CZ 2.74Å; D506-R530 IonicContact OD2-NE 2.69Å; D506-R530 PolarHBondContact OD2-NE 3.2Å; D506-R530 IonicContact OD2-NH2 3.55Å; D506-R530 PolarHBondContact OD2-NH2 3.15Å
507	C	95.5	Very high	89	Confident	85 Å²	85	69.2 Å²	69.2	57%	0.574	41%	0.405	S	S	*	.			trans	-84.5	169.2	172.2	61.3	0	0	0	0	112	V509 M527	C507-V509 VanDerWaalsContact C-N 3.28Å; C507-V509 PolarHBondContact O-N 3.08Å; C507-V509 PolarHBondContact SG-O 2.63Å; C507-M527 WeakPolarHBondContact O-CE 3.35Å
508	D	97.6	Very high	88.7	Confident	79 Å²	79	68.9 Å²	68.9	42%	0.422	40%	0.403	S	S	.	.	S	Bend	trans	-84.8	8.5	179.6	60.9	-16.8	0	0	0	113.8	I462 I463	I462-D508 CarbonylContact C-O 3.48Å; I462-D508 VanDerWaalsContact CA-O 3.28Å; I462-D508 WeakPolarHBondContact CA-O 3.44Å; I463-D508 PolarHBondContact N-O 3.32Å
509	V	98.3	Very high	89.3	Confident	58 Å²	58	67.6 Å²	67.6	35%	0.352	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	116.1	-178.7	-175.5	0	0	0	0	110.9	I463 V465 C507 V511	I463-V509 HydrophobicContact CD1-CG1 4.45Å; I463-V509 HydrophobicContact CD1-CG2 4.08Å; I463-V509 HydrophobicContact CG1-CB 4.36Å; I463-V509 HydrophobicContact CG1-CG1 4.25Å; I463-V509 HydrophobicContact CG1-CG2 3.89Å; I463-V509 WeakPolarHBondContact O-CA 3.31Å; V465-V509 HydrophobicContact CG2-CG1 4.02Å; C507-V509 VanDerWaalsContact C-N 3.28Å; C507-V509 PolarHBondContact O-N 3.08Å; C507-V509 PolarHBondContact SG-O 2.63Å; V509-V511 HydrophobicContact CG1-CG2 4.17Å
510	I	96.5	Very high	89.9	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.041	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.2	169.7	-58.8	174.1	0	0	0	108.5	I462 I463 W464 V465 A512 P521 E523 I524 M527	I462-I510 HydrophobicContact CG2-CD1 3.88Å; I462-I510 HydrophobicContact CG2-CG1 4.01Å; I463-I510 PolarHBondContact O-N 2.81Å; W464-I510 CarbonylContact C-O 3.48Å; W464-I510 WeakPolarHBondContact CA-O 3.27Å; W464-I510 HydrophobicContact CB-CB 4.43Å; V465-I510 PolarHBondContact N-O 3.11Å; I510-A512 HydrophobicContact CG2-CB 4.03Å; I510-P521 HydrophobicContact CD1-CG 4.19Å; I510-P521 HydrophobicContact CG2-CB 3.93Å; I510-P521 HydrophobicContact CG2-CG 3.91Å; I510-E523 HydrophobicContact CG2-CB 4.03Å; I510-E523 HydrophobicContact CG2-CG 4.45Å; I510-I524 HydrophobicContact CD1-CB 4.26Å; I510-I524 HydrophobicContact CD1-CD1 3.95Å; I510-M527 HydrophobicContact CD1-SD 3.59Å; I510-M527 VanDerWaalsContact CD1-SD 3.59Å; I510-M527 HydrophobicContact CG1-CE 4.4Å; I510-M527 HydrophobicContact CG1-SD 3.58Å; I510-M527 VanDerWaalsContact CG1-SD 3.58Å
511	V	95.1	Very high	90.5	Very high	86 Å²	86	57 Å²	57	52%	0.521	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	109.6	170.7	-175.7	0	0	0	0	107.3	V465 T467 V509	V465-V511 HydrophobicContact CB-CG2 4.38Å; T467-V511 HydrophobicContact CG2-CG1 3.56Å; V509-V511 HydrophobicContact CG1-CG2 4.17Å
512	A	90.5	Very high	90.7	Very high	6 Å²	6	58.3 Å²	58.3	5%	0.05	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	151.7	-175.6	0	0	0	0	0	111.6	W464 V465 T467 I510 P521	W464-A512 PolarHBondContact NE1-O 3.3Å; V465-A512 PolarHBondContact O-N 3.16Å; T467-A512 PolarHBondContact N-O 3.25Å; T467-A512 VanDerWaalsContact OG1-C 3.28Å; T467-A512 PolarHBondContact OG1-O 2.95Å; I510-A512 HydrophobicContact CG2-CB 4.03Å; A512-P521 HydrophobicContact CB-CB 3.83Å
513	E	89.8	Confident	90.9	Very high	54 Å²	54	61 Å²	61	25%	0.252	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	144.8	179.5	-67.2	-178.1	-157.2	0	0	112	T467 Q471 R515	T467-E513 WeakPolarHBondContact O-CA 3.38Å; T467-E513 PolarHBondContact OG1-N 3.33Å; Q471-E513 PolarHBondContact NE2-OE1 3.24Å; E513-R515 PolarHBondContact O-N 3.21Å
514	V	87.8	Confident	91.2	Very high	41 Å²	41	52.8 Å²	52.8	25%	0.248	31%	0.312	C	S	.	.			trans	-72.5	127.4	168.3	-176	0	0	0	0	109.1	W464 K466 T467 I474	W464-V514 HydrophobicContact CZ2-CG2 4.2Å; K466-V514 HydrophobicContact CB-CG2 3.66Å; K466-V514 HydrophobicContact CD-CG2 3.93Å; K466-V514 HydrophobicContact CG-CG2 3.82Å; T467-V514 PolarHBondContact O-N 2.81Å; I474-V514 HydrophobicContact CD1-CG2 4Å
515	R	84.6	Confident	91.6	Very high	100 Å²	100	49.9 Å²	49.9	38%	0.377	28%	0.277	S	S	.	.			trans	-101.8	-122.1	177.9	-57	179.5	-167.3	152	-9.6	110.3	E513 H519 D522	E513-R515 PolarHBondContact O-N 3.21Å; R515-H519 PolarHBondContact NH1-NE2 3.25Å; R515-D522 IonicContact CZ-OD2 3.05Å; R515-D522 IonicContact NH1-OD1 3.54Å; R515-D522 PolarHBondContact NH1-OD1 2.82Å; R515-D522 VanDerWaalsContact NH1-OD1 3.14Å; R515-D522 IonicContact NH1-OD2 3.14Å; R515-D522 PolarHBondContact NH1-OD2 2.59Å; R515-D522 IonicContact NH2-OD2 3.93Å; R515-D522 PolarHBondContact NH2-OD2 3.25Å
516	S	81.8	Confident	91.7	Very high	61 Å²	61	48.8 Å²	48.8	43%	0.427	28%	0.277	S	S	.	.	S	Bend	trans	-75.6	161.8	174.9	69.6	0	0	0	0	112	S518 H519	S516-S518 PolarHBondContact O-N 3.42Å; S516-H519 WeakPolarHBondContact O-CB 3.38Å; S516-H519 PolarHBondContact O-N 3.32Å; S516-H519 VanDerWaalsContact OG-CB 3.31Å; S516-H519 WeakPolarHBondContact OG-CB 3.41Å
517	T	78.8	Confident	91.8	Very high	114 Å²	114	47 Å²	47	70%	0.699	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	123.9	-178.1	-53.9	0	0	0	0	111.7	H519 R543	T517-H519 PolarHBondContact O-N 3.39Å; T517-R543 PolarHBondContact O-NH1 3.46Å
518	S	83	Confident	91.9	Very high	44 Å²	44	42.9 Å²	42.9	31%	0.308	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	18.2	-177.2	-49.1	0	0	0	0	115.2	S516 K520	S516-S518 PolarHBondContact O-N 3.42Å; S518-K520 PolarHBondContact O-N 3.19Å
519	H	91	Very high	91.6	Very high	21 Å²	21	41.3 Å²	41.3	10%	0.097	23%	0.23	C	C	.	.			trans	-82.9	110.9	171.3	-173.1	178.3	0	0	0	109.5	W464 R515 S516 T517 D522 H545	W464-H519 WeakPolarHBondContact CH2-O 3.48Å; R515-H519 PolarHBondContact NH1-NE2 3.25Å; S516-H519 WeakPolarHBondContact O-CB 3.38Å; S516-H519 PolarHBondContact O-N 3.32Å; S516-H519 VanDerWaalsContact OG-CB 3.31Å; S516-H519 WeakPolarHBondContact OG-CB 3.41Å; T517-H519 PolarHBondContact O-N 3.39Å; H519-D522 IonicContact CE1-OD1 3.4Å; H519-D522 IonicContact NE2-OD1 2.63Å; H519-D522 PolarHBondContact NE2-OD1 2.8Å; H519-H545 AromaticContact CD2-CD2 3.45Å; H519-H545 PolarHBondContact CD2-CD2 2.79Å; H519-H545 VanDerWaalsContact CD2-CD2 3.45Å; H519-H545 AromaticContact CD2-NE2 3.24Å; H519-H545 PolarHBondContact CD2-NE2 3.4Å; H519-H545 AromaticContact CE1-CD2 3.62Å; H519-H545 AromaticContact CG-CD2 3.95Å; H519-H545 AromaticContact CG-NE2 3.54Å; H519-H545 AromaticContact NE2-CD2 3.27Å; H519-H545 PolarHBondContact NE2-CD2 3.22Å; H519-H545 VanDerWaalsContact NE2-CD2 3.27Å; H519-H545 AromaticContact NE2-NE2 3.61Å
520	K	95.6	Very high	91.3	Very high	21 Å²	21	42.3 Å²	42.3	9%	0.091	23%	0.227	C	C	.	.			trans	-68.4	155.4	174.2	-61.9	-59.7	-165.6	-79.2	0	111.4	D402 W438 W464 E488 S518 D522	D402-K520 VanDerWaalsContact OD1-CE 3.32Å; D402-K520 WeakPolarHBondContact OD1-CE 3.26Å; D402-K520 IonicContact OD1-NZ 3.01Å; D402-K520 PolarHBondContact OD1-NZ 3.41Å; D402-K520 WeakPolarHBondContact OD2-CE 3.34Å; D402-K520 IonicContact OD2-NZ 2.75Å; D402-K520 PolarHBondContact OD2-NZ 2.79Å; W438-K520 HydrophobicContact CD2-CD 3.61Å; W438-K520 HydrophobicContact CD2-CG 4.04Å; W438-K520 HydrophobicContact CE3-CD 3.67Å; W438-K520 HydrophobicContact CG-CD 4.17Å; W438-K520 VanDerWaalsContact CG-CE 3.45Å; W438-K520 HydrophobicContact CG-CG 4.35Å; W438-K520 HydrophobicContact CH2-CD 4.08Å; W438-K520 HydrophobicContact CZ2-CB 3.95Å; W438-K520 HydrophobicContact CZ2-CD 4.01Å; W438-K520 HydrophobicContact CZ2-CG 4.11Å; W438-K520 HydrophobicContact CZ3-CD 3.91Å; W464-K520 HydrophobicContact CE3-CD 4.29Å; W464-K520 HydrophobicContact CZ3-CD 4.11Å; E488-K520 WeakPolarHBondContact OE2-CE 3.43Å; E488-K520 IonicContact OE2-NZ 3.38Å; E488-K520 PolarHBondContact OE2-NZ 3.41Å; S518-K520 PolarHBondContact O-N 3.19Å; K520-D522 PolarHBondContact O-N 2.92Å
521	P	95.2	Very high	91.2	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.013	23%	0.232	C	C	.	.			trans	-65.9	130.9	-178	26.3	-35.6	0	0	0	111.5	W438 W464 I510 A512 E523 I524	W438-P521 HydrophobicContact CH2-CG 4.09Å; W438-P521 HydrophobicContact CZ2-CG 4.49Å; W464-P521 HydrophobicContact CB-CG 4.19Å; W464-P521 VanDerWaalsContact CD2-CD 3.49Å; W464-P521 HydrophobicContact CD2-CG 3.79Å; W464-P521 VanDerWaalsContact CE3-CD 3.44Å; W464-P521 HydrophobicContact CE3-CG 4.22Å; W464-P521 HydrophobicContact CG-CG 3.76Å; I510-P521 HydrophobicContact CD1-CG 4.19Å; I510-P521 HydrophobicContact CG2-CB 3.93Å; I510-P521 HydrophobicContact CG2-CG 3.91Å; A512-P521 HydrophobicContact CB-CB 3.83Å; P521-E523 WeakPolarHBondContact CB-OE2 3.34Å; P521-E523 PolarHBondContact O-N 3.23Å; P521-I524 VanDerWaalsContact O-CG2 3.22Å; P521-I524 WeakPolarHBondContact O-CG2 3.33Å; P521-I524 PolarHBondContact O-N 3.47Å
522	D	93.8	Very high	91.1	Very high	55 Å²	55	39.2 Å²	39.2	29%	0.294	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-16.7	179.2	-61.3	-18.7	0	0	0	112.4	R515 H519 K520 I524 Y525	R515-D522 IonicContact CZ-OD2 3.05Å; R515-D522 IonicContact NH1-OD1 3.54Å; R515-D522 PolarHBondContact NH1-OD1 2.82Å; R515-D522 VanDerWaalsContact NH1-OD1 3.14Å; R515-D522 IonicContact NH1-OD2 3.14Å; R515-D522 PolarHBondContact NH1-OD2 2.59Å; R515-D522 IonicContact NH2-OD2 3.93Å; R515-D522 PolarHBondContact NH2-OD2 3.25Å; H519-D522 IonicContact CE1-OD1 3.4Å; H519-D522 IonicContact NE2-OD1 2.63Å; H519-D522 PolarHBondContact NE2-OD1 2.8Å; K520-D522 PolarHBondContact O-N 2.92Å; D522-I524 PolarHBondContact O-N 3.26Å; D522-I524 VanDerWaalsContact O-N 3.1Å; D522-Y525 HydrophobicContact CB-CD2 4.15Å; D522-Y525 WeakPolarHBondContact O-CB 3.35Å; D522-Y525 WeakPolarHBondContact O-CD2 3.31Å; D522-Y525 PolarHBondContact O-N 3.13Å
523	E	93.9	Very high	91.1	Very high	83 Å²	83	41.5 Å²	41.5	39%	0.388	22%	0.222	S	C	.	.	H	α-helix	trans	-52.6	-30.6	175.1	-70.1	77.7	-176.9	0	0	111.9	I510 P521 Y525 G526 M527	I510-E523 HydrophobicContact CG2-CB 4.03Å; I510-E523 HydrophobicContact CG2-CG 4.45Å; P521-E523 WeakPolarHBondContact CB-OE2 3.34Å; P521-E523 PolarHBondContact O-N 3.23Å; E523-Y525 VanDerWaalsContact C-N 3.28Å; E523-Y525 PolarHBondContact O-N 3.22Å; E523-G526 PolarHBondContact O-N 3.17Å; E523-G526 VanDerWaalsContact O-N 3.14Å; E523-M527 WeakPolarHBondContact O-CG 3.4Å; E523-M527 PolarHBondContact O-N 3.22Å
524	I	97.5	Very high	91.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-60.1	-35.9	177.3	-163.5	65.6	0	0	0	112.4	M400 F436 W438 I462 I510 P521 D522 G526 M527 I528	M400-I524 HydrophobicContact CE-CG2 4.37Å; M400-I524 HydrophobicContact SD-CG1 4.11Å; M400-I524 HydrophobicContact SD-CG2 4.01Å; F436-I524 HydrophobicContact CD1-CD1 4.15Å; F436-I524 HydrophobicContact CE1-CD1 4.35Å; W438-I524 HydrophobicContact CZ2-CG1 4.48Å; I462-I524 HydrophobicContact CD1-CD1 3.78Å; I510-I524 HydrophobicContact CD1-CB 4.26Å; I510-I524 HydrophobicContact CD1-CD1 3.95Å; P521-I524 VanDerWaalsContact O-CG2 3.22Å; P521-I524 WeakPolarHBondContact O-CG2 3.33Å; P521-I524 PolarHBondContact O-N 3.47Å; D522-I524 PolarHBondContact O-N 3.26Å; D522-I524 VanDerWaalsContact O-N 3.1Å; I524-G526 VanDerWaalsContact C-N 3.34Å; I524-G526 PolarHBondContact O-N 3.45Å; I524-M527 HydrophobicContact CD1-SD 4.37Å; I524-M527 PolarHBondContact O-N 3.48Å; I524-I528 HydrophobicContact CG1-CD1 3.91Å; I524-I528 HydrophobicContact CG1-CG1 4.43Å; I524-I528 WeakPolarHBondContact O-CB 3.27Å; I524-I528 VanDerWaalsContact O-CG1 3.23Å; I524-I528 WeakPolarHBondContact O-CG1 3.25Å; I524-I528 PolarHBondContact O-N 3.04Å
525	Y	95.8	Very high	91.4	Very high	19 Å²	19	41.3 Å²	41.3	8%	0.075	24%	0.236	C	C	.	.	H	α-helix	trans	-65.9	-39.9	177.6	-63	-72.5	0	0	0	111	M400 D522 E523 I528 E529 E539 N546 Q548 W551	M400-Y525 HydrophobicContact CE-CD1 4.22Å; M400-Y525 HydrophobicContact CE-CE1 3.45Å; M400-Y525 VanDerWaalsContact CE-CE1 3.45Å; D522-Y525 HydrophobicContact CB-CD2 4.15Å; D522-Y525 WeakPolarHBondContact O-CB 3.35Å; D522-Y525 WeakPolarHBondContact O-CD2 3.31Å; D522-Y525 PolarHBondContact O-N 3.13Å; E523-Y525 VanDerWaalsContact C-N 3.28Å; E523-Y525 PolarHBondContact O-N 3.22Å; Y525-I528 PolarHBondContact O-N 2.93Å; Y525-E529 WeakPolarHBondContact O-CB 3.44Å; Y525-E529 PolarHBondContact O-N 3.41Å; Y525-E539 VanDerWaalsContact CE1-OE2 3.27Å; Y525-E539 WeakPolarHBondContact CE1-OE2 3.22Å; Y525-E539 VanDerWaalsContact OH-CD 3.27Å; Y525-E539 PolarHBondContact OH-OE1 2.69Å; Y525-E539 PolarHBondContact OH-OE2 3.17Å; Y525-N546 VanDerWaalsContact OH-CB 3.26Å; Y525-N546 WeakPolarHBondContact OH-CB 3.46Å; Y525-N546 PolarHBondContact OH-ND2 2.93Å; Y525-Q548 HydrophobicContact CD1-CG 4.02Å; Y525-Q548 HydrophobicContact CD2-CG 4.37Å; Y525-Q548 HydrophobicContact CE1-CG 4.08Å; Y525-Q548 HydrophobicContact CE2-CG 4.45Å; Y525-Q548 HydrophobicContact CG-CG 4.19Å; Y525-W551 HydrophobicContact CD1-CD2 4.46Å; Y525-W551 AromaticContact CD1-CE2 3.78Å; Y525-W551 HydrophobicContact CD1-CH2 4.46Å; Y525-W551 AromaticContact CD1-CZ2 3.79Å; Y525-W551 HydrophobicContact CD1-CZ2 3.79Å; Y525-W551 AromaticContact CD1-NE1 3.9Å; Y525-W551 HydrophobicContact CE1-CD2 4.47Å; Y525-W551 HydrophobicContact CE1-CZ2 4.28Å
526	G	90.9	Very high	91.9	Very high	26 Å²	26	41.2 Å²	41.2	27%	0.268	24%	0.235	S	C	.	.	H	α-helix	trans	-65.1	-42.8	176.1	0	0	0	0	0	112.3	E523 I524 E529 R530	E523-G526 PolarHBondContact O-N 3.17Å; E523-G526 VanDerWaalsContact O-N 3.14Å; I524-G526 VanDerWaalsContact C-N 3.34Å; I524-G526 PolarHBondContact O-N 3.45Å; G526-E529 PolarHBondContact O-N 3Å; G526-R530 WeakPolarHBondContact O-CG 3.46Å; G526-R530 PolarHBondContact O-N 2.89Å; G526-R530 PolarHBondContact O-NH1 3.35Å
527	M	95.3	Very high	92.7	Very high	22 Å²	22	38.3 Å²	38.3	11%	0.108	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-46.8	175	-66.4	170.4	65.2	0	0	111.1	I462 D506 C507 I510 E523 I524 E529 R530 L531	I462-M527 HydrophobicContact CD1-CE 3.81Å; I462-M527 HydrophobicContact CG1-CE 4.44Å; D506-M527 HydrophobicContact CB-CB 4.47Å; D506-M527 HydrophobicContact CB-CE 4.06Å; D506-M527 HydrophobicContact CB-CG 4.08Å; C507-M527 WeakPolarHBondContact O-CE 3.35Å; I510-M527 HydrophobicContact CD1-SD 3.59Å; I510-M527 VanDerWaalsContact CD1-SD 3.59Å; I510-M527 HydrophobicContact CG1-CE 4.4Å; I510-M527 HydrophobicContact CG1-SD 3.58Å; I510-M527 VanDerWaalsContact CG1-SD 3.58Å; E523-M527 WeakPolarHBondContact O-CG 3.4Å; E523-M527 PolarHBondContact O-N 3.22Å; I524-M527 HydrophobicContact CD1-SD 4.37Å; I524-M527 PolarHBondContact O-N 3.48Å; M527-E529 PolarHBondContact O-N 3.18Å; M527-R530 PolarHBondContact O-N 2.86Å; M527-L531 WeakPolarHBondContact O-CB 3.45Å; M527-L531 PolarHBondContact O-N 3.39Å
528	I	96.7	Very high	93.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-38.5	179.5	-70.3	172.8	0	0	0	111.5	V398 M400 F436 I524 Y525 L531 S532 K537 W551	V398-I528 HydrophobicContact CB-CG2 4.13Å; V398-I528 HydrophobicContact CG1-CD1 4.34Å; V398-I528 HydrophobicContact CG1-CG2 3.78Å; V398-I528 HydrophobicContact CG2-CG2 3.99Å; M400-I528 HydrophobicContact SD-CD1 3.98Å; F436-I528 HydrophobicContact CD1-CD1 4.17Å; F436-I528 HydrophobicContact CD1-CG1 4.4Å; F436-I528 HydrophobicContact CD2-CD1 3.8Å; F436-I528 HydrophobicContact CD2-CG1 4.13Å; F436-I528 HydrophobicContact CE1-CD1 4.32Å; F436-I528 HydrophobicContact CE1-CG1 4.04Å; F436-I528 HydrophobicContact CE2-CD1 3.98Å; F436-I528 HydrophobicContact CE2-CG1 3.77Å; F436-I528 HydrophobicContact CG-CD1 3.91Å; F436-I528 HydrophobicContact CG-CG1 4.44Å; F436-I528 HydrophobicContact CZ-CD1 4.24Å; F436-I528 HydrophobicContact CZ-CG1 3.72Å; I524-I528 HydrophobicContact CG1-CD1 3.91Å; I524-I528 HydrophobicContact CG1-CG1 4.43Å; I524-I528 WeakPolarHBondContact O-CB 3.27Å; I524-I528 VanDerWaalsContact O-CG1 3.23Å; I524-I528 WeakPolarHBondContact O-CG1 3.25Å; I524-I528 PolarHBondContact O-N 3.04Å; Y525-I528 PolarHBondContact O-N 2.93Å; I528-L531 PolarHBondContact O-N 3Å; I528-S532 PolarHBondContact O-N 2.78Å; I528-K537 HydrophobicContact CG2-CD 3.69Å; I528-W551 HydrophobicContact CB-CZ2 4.3Å; I528-W551 HydrophobicContact CD1-CH2 3.89Å; I528-W551 HydrophobicContact CD1-CZ2 4.14Å; I528-W551 HydrophobicContact CG2-CH2 4.13Å; I528-W551 HydrophobicContact CG2-CZ2 3.73Å
529	E	92.4	Very high	94.4	Very high	46 Å²	46	31.1 Å²	31.1	22%	0.215	17%	0.169	C	C	.	.	H	α-helix	trans	-68.7	-36	177.4	-167.4	63.1	-150.7	0	0	111.9	Y525 G526 M527 S532 P533 G534 K537 N550	Y525-E529 WeakPolarHBondContact O-CB 3.44Å; Y525-E529 PolarHBondContact O-N 3.41Å; G526-E529 PolarHBondContact O-N 3Å; M527-E529 PolarHBondContact O-N 3.18Å; E529-S532 CarbonylContact O-C 3.54Å; E529-P533 WeakPolarHBondContact O-CA 3.41Å; E529-P533 WeakPolarHBondContact O-CB 3.25Å; E529-G534 PolarHBondContact OE1-N 3.47Å; E529-K537 IonicContact OE1-NZ 3.74Å; E529-K537 WeakPolarHBondContact OE2-CE 3.4Å; E529-K537 IonicContact OE2-NZ 3.17Å; E529-K537 PolarHBondContact OE2-NZ 3Å; E529-N550 PolarHBondContact OE1-ND2 3.5Å
530	R	91.3	Very high	94.8	Very high	79 Å²	79	30.1 Å²	30.1	30%	0.298	16%	0.164	S	C	.	.	H	α-helix	trans	-68.1	-38.9	172	-74.4	-174.2	-66.8	-84	5.6	112.1	F272 N502 L505 D506 G526 M527	F272-R530 HydrophobicContact CB-CG 4.37Å; F272-R530 HydrophobicContact CD1-CG 3.95Å; F272-R530 HydrophobicContact CG-CG 4.27Å; N502-R530 WeakPolarHBondContact CB-O 3.27Å; N502-R530 PolarHBondContact ND2-O 3.25Å; L505-R530 HydrophobicContact CD1-CB 4.15Å; D506-R530 IonicContact OD1-CZ 3.91Å; D506-R530 IonicContact OD1-NE 3.77Å; D506-R530 PolarHBondContact OD1-NE 3.12Å; D506-R530 IonicContact OD1-NH2 3.35Å; D506-R530 PolarHBondContact OD1-NH2 3Å; D506-R530 IonicContact OD2-CZ 2.74Å; D506-R530 IonicContact OD2-NE 2.69Å; D506-R530 PolarHBondContact OD2-NE 3.2Å; D506-R530 IonicContact OD2-NH2 3.55Å; D506-R530 PolarHBondContact OD2-NH2 3.15Å; G526-R530 WeakPolarHBondContact O-CG 3.46Å; G526-R530 PolarHBondContact O-N 2.89Å; G526-R530 PolarHBondContact O-NH1 3.35Å; M527-R530 PolarHBondContact O-N 2.86Å
531	L	94.1	Very high	94.9	Very high	27 Å²	27	31.1 Å²	31.1	14%	0.141	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-45	175.6	177.6	65.2	0	0	0	112	F434 F436 F501 N502 M527 I528	F434-L531 HydrophobicContact CD2-CD2 4.08Å; F434-L531 HydrophobicContact CE2-CD2 4.41Å; F434-L531 HydrophobicContact CG-CD2 4.33Å; F436-L531 HydrophobicContact CE2-CD2 4.24Å; F436-L531 HydrophobicContact CZ-CD2 3.86Å; F501-L531 WeakPolarHBondContact CA-O 3.35Å; F501-L531 HydrophobicContact CB-CD1 4.17Å; F501-L531 HydrophobicContact CD1-CG 4.34Å; N502-L531 PolarHBondContact N-O 3.36Å; N502-L531 WeakPolarHBondContact O-CD1 3.34Å; M527-L531 WeakPolarHBondContact O-CB 3.45Å; M527-L531 PolarHBondContact O-N 3.39Å; I528-L531 PolarHBondContact O-N 3Å
532	S	93.4	Very high	95	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.014	17%	0.169	C	C	.	.	S	Bend	trans	-136.3	75.5	-174	-166.8	0	0	0	0	111.5	F501 I528 E529 T535 K537	F501-S532 WeakPolarHBondContact CE1-OG 3.5Å; I528-S532 PolarHBondContact O-N 2.78Å; E529-S532 CarbonylContact O-C 3.54Å; S532-T535 PolarHBondContact O-OG1 3.38Å; S532-T535 VanDerWaalsContact O-OG1 3.09Å; S532-T535 VanDerWaalsContact OG-CG2 3.24Å; S532-T535 WeakPolarHBondContact OG-CG2 3.46Å; S532-T535 PolarHBondContact OG-OG1 3.07Å; S532-K537 WeakPolarHBondContact O-CE 3.33Å; S532-K537 PolarHBondContact O-NZ 2.91Å
533	P	91.3	Very high	95.1	Very high	54 Å²	54	32 Å²	32	35%	0.351	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	134.5	-172.2	29.2	-37.7	0	0	0	112.7	F272 E529 T535	F272-P533 HydrophobicContact CE1-CB 4.08Å; F272-P533 HydrophobicContact CZ-CB 3.77Å; F272-P533 HydrophobicContact CZ-CG 3.83Å; E529-P533 WeakPolarHBondContact O-CA 3.41Å; E529-P533 WeakPolarHBondContact O-CB 3.25Å; P533-T535 PolarHBondContact O-N 3.09Å; P533-T535 VanDerWaalsContact O-N 3.09Å
534	G	88.9	Confident	95.3	Very high	54 Å²	54	31.9 Å²	31.9	56%	0.557	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.1	2.5	173.4	0	0	0	0	0	115.7	E529	E529-G534 PolarHBondContact OE1-N 3.47Å
535	T	93.8	Very high	95.1	Very high	37 Å²	37	35.1 Å²	35.1	23%	0.227	19%	0.189	C	C	.	.			trans	-81.8	155.5	178	64.9	0	0	0	0	111.8	S397 S532 P533 K537	S397-T535 WeakPolarHBondContact OG-CB 3.03Å; S532-T535 PolarHBondContact O-OG1 3.38Å; S532-T535 VanDerWaalsContact O-OG1 3.09Å; S532-T535 VanDerWaalsContact OG-CG2 3.24Å; S532-T535 WeakPolarHBondContact OG-CG2 3.46Å; S532-T535 PolarHBondContact OG-OG1 3.07Å; P533-T535 PolarHBondContact O-N 3.09Å; P533-T535 VanDerWaalsContact O-N 3.09Å; T535-K537 WeakPolarHBondContact O-CG 3.34Å; T535-K537 PolarHBondContact O-NZ 3.02Å; T535-K537 PolarHBondContact OG1-NZ 2.88Å
536	R	95.8	Very high	95.2	Very high	97 Å²	97	34.7 Å²	34.7	37%	0.366	19%	0.189	S	C	.	.			trans	-69.4	135.8	170.4	-61.7	-164.9	-59.1	-146.7	-6.3	110.8	K395 F396 S397 D565	K395-R536 PolarHBondContact O-NH2 3.04Å; F396-R536 HydrophobicContact CD1-CB 4.02Å; F396-R536 HydrophobicContact CE1-CB 4.4Å; S397-R536 PolarHBondContact N-O 3.19Å; R536-D565 IonicContact CZ-OD2 3.85Å; R536-D565 IonicContact NH1-OD2 2.86Å; R536-D565 PolarHBondContact NH1-OD2 2.99Å
537	K	98.1	Very high	95.4	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.3	-177.4	-53.6	176.7	-178.2	73.9	0	109.8	F396 V398 I528 E529 S532 T535 N550 W551 I552	F396-K537 VanDerWaalsContact CD1-C 3.44Å; F396-K537 WeakPolarHBondContact CD1-O 3.43Å; V398-K537 HydrophobicContact CB-CB 4.44Å; V398-K537 HydrophobicContact CB-CD 4.45Å; V398-K537 HydrophobicContact CB-CG 4.1Å; V398-K537 WeakPolarHBondContact O-CA 3.45Å; I528-K537 HydrophobicContact CG2-CD 3.69Å; E529-K537 IonicContact OE1-NZ 3.74Å; E529-K537 WeakPolarHBondContact OE2-CE 3.4Å; E529-K537 IonicContact OE2-NZ 3.17Å; E529-K537 PolarHBondContact OE2-NZ 3Å; S532-K537 WeakPolarHBondContact O-CE 3.33Å; S532-K537 PolarHBondContact O-NZ 2.91Å; T535-K537 WeakPolarHBondContact O-CG 3.34Å; T535-K537 PolarHBondContact O-NZ 3.02Å; T535-K537 PolarHBondContact OG1-NZ 2.88Å; K537-N550 PolarHBondContact N-O 2.96Å; K537-W551 HydrophobicContact CB-CD2 3.47Å; K537-W551 VanDerWaalsContact CB-CD2 3.47Å; K537-W551 HydrophobicContact CB-CE3 3.56Å; K537-W551 HydrophobicContact CB-CG 4.03Å; K537-W551 HydrophobicContact CB-CH2 4.04Å; K537-W551 HydrophobicContact CB-CZ2 3.95Å; K537-W551 HydrophobicContact CB-CZ3 3.85Å; K537-W551 HydrophobicContact CD-CD2 4.21Å; K537-W551 VanDerWaalsContact CD-CE2 3.47Å; K537-W551 HydrophobicContact CD-CH2 4.22Å; K537-W551 HydrophobicContact CD-CZ2 3.49Å; K537-W551 VanDerWaalsContact CD-CZ2 3.49Å; K537-W551 HydrophobicContact CG-CD2 4.45Å; K537-W551 HydrophobicContact CG-CZ2 4.31Å; K537-W551 CarbonylContact O-C 3.52Å; K537-W551 WeakPolarHBondContact O-CA 3.2Å; K537-I552 PolarHBondContact O-N 3.31Å
538	I	98.7	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135.3	178.1	-172	173.1	0	0	0	110.8	L393 F396 V398 V399 M400 L429 L540 W551 I552 L554	L393-I538 HydrophobicContact CD1-CD1 3.66Å; F396-I538 HydrophobicContact CB-CG2 3.94Å; F396-I538 HydrophobicContact CD1-CB 3.74Å; F396-I538 HydrophobicContact CD1-CG2 4.04Å; F396-I538 HydrophobicContact CD2-CB 3.97Å; F396-I538 HydrophobicContact CD2-CD1 4.34Å; F396-I538 HydrophobicContact CD2-CG2 3.63Å; F396-I538 HydrophobicContact CE1-CB 3.84Å; F396-I538 HydrophobicContact CE2-CB 4.08Å; F396-I538 HydrophobicContact CE2-CD1 3.82Å; F396-I538 HydrophobicContact CE2-CG2 4.15Å; F396-I538 HydrophobicContact CG-CB 3.8Å; F396-I538 HydrophobicContact CG-CG2 3.56Å; F396-I538 HydrophobicContact CZ-CB 4.01Å; F396-I538 HydrophobicContact CZ-CD1 3.99Å; F396-I538 HydrophobicContact CZ-CG1 4.41Å; V398-I538 PolarHBondContact O-N 3.43Å; V399-I538 CarbonylContact C-O 3.55Å; V399-I538 WeakPolarHBondContact CA-O 3.37Å; V399-I538 HydrophobicContact CB-CG2 4.15Å; V399-I538 HydrophobicContact CG1-CG2 4.13Å; V399-I538 HydrophobicContact CG2-CG2 3.73Å; M400-I538 PolarHBondContact N-O 2.93Å; L429-I538 HydrophobicContact CD1-CD1 4.25Å; L429-I538 HydrophobicContact CD1-CG2 4.31Å; L429-I538 HydrophobicContact CD2-CD1 3.88Å; I538-L540 HydrophobicContact CD1-CD2 4.08Å; I538-L540 HydrophobicContact CG1-CD2 4.14Å; I538-W551 WeakPolarHBondContact O-CZ3 3.17Å; I538-I552 CarbonylContact C-O 3.44Å; I538-I552 VanDerWaalsContact CA-O 3.31Å; I538-I552 WeakPolarHBondContact CA-O 3.43Å; I538-I552 HydrophobicContact CG1-CB 4.4Å; I538-I552 WeakPolarHBondContact CG1-O 3.28Å; I538-L554 HydrophobicContact CD1-CD1 3.85Å; I538-L554 HydrophobicContact CD1-CG 4.2Å; I538-L554 HydrophobicContact CG1-CG 4.45Å
539	E	98.8	Very high	95.2	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.037	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	129.5	174.7	-175.8	173.6	165.8	0	0	110.4	M400 Y525 N546 W551 I552 T553 L554	M400-E539 VanDerWaalsContact CE-CD 3.45Å; M400-E539 HydrophobicContact CE-CG 3.93Å; M400-E539 WeakPolarHBondContact CE-OE2 3.43Å; M400-E539 CarbonylContact O-C 3.58Å; M400-E539 WeakPolarHBondContact O-CA 3.4Å; Y525-E539 VanDerWaalsContact CE1-OE2 3.27Å; Y525-E539 WeakPolarHBondContact CE1-OE2 3.22Å; Y525-E539 VanDerWaalsContact OH-CD 3.27Å; Y525-E539 PolarHBondContact OH-OE1 2.69Å; Y525-E539 PolarHBondContact OH-OE2 3.17Å; E539-N546 WeakPolarHBondContact OE1-CB 3.37Å; E539-N546 PolarHBondContact OE1-ND2 3.04Å; E539-W551 HydrophobicContact CB-CE3 3.81Å; E539-W551 HydrophobicContact CB-CZ3 4Å; E539-I552 PolarHBondContact N-O 2.68Å; E539-T553 HydrophobicContact CB-CG2 4.43Å; E539-L554 PolarHBondContact O-N 3.48Å
540	L	98.6	Very high	95.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	139.7	177.7	-51.4	-177.1	0	0	0	110.1	I385 M390 V399 M400 A401 D402 I426 L429 I538 G542 L554	I385-L540 HydrophobicContact CD1-CB 4.19Å; M390-L540 HydrophobicContact CE-CD1 4.38Å; M390-L540 HydrophobicContact CE-CD2 4.22Å; V399-L540 HydrophobicContact CG1-CD1 4.26Å; V399-L540 HydrophobicContact CG1-CG 4.48Å; M400-L540 PolarHBondContact O-N 3.26Å; A401-L540 HydrophobicContact CB-CB 3.98Å; A401-L540 HydrophobicContact CB-CD1 4.42Å; D402-L540 PolarHBondContact N-O 3.47Å; I426-L540 HydrophobicContact CD1-CD1 3.16Å; L429-L540 HydrophobicContact CD1-CD1 4.31Å; L429-L540 HydrophobicContact CD1-CD2 4.43Å; I538-L540 HydrophobicContact CD1-CD2 4.08Å; I538-L540 HydrophobicContact CG1-CD2 4.14Å; L540-G542 PolarHBondContact O-N 3.31Å; L540-L554 HydrophobicContact CD2-CB 4.2Å; L540-L554 HydrophobicContact CD2-CD1 3.62Å; L540-L554 HydrophobicContact CD2-CG 4.18Å
541	F	98.3	Very high	95.7	Very high	41 Å²	41	34 Å²	34	18%	0.18	19%	0.188	C	C	.	.	S	Bend	trans	66	24.1	-176.6	-49.4	-85.8	0	0	0	113.3	I385 D402 P403 P404 L416 L424 L554	I385-F541 HydrophobicContact CB-CE1 4.16Å; I385-F541 HydrophobicContact CB-CZ 4.25Å; I385-F541 HydrophobicContact CD1-CB 4.36Å; I385-F541 HydrophobicContact CD1-CD1 3.61Å; I385-F541 HydrophobicContact CD1-CD2 4.02Å; I385-F541 HydrophobicContact CD1-CE1 3.79Å; I385-F541 HydrophobicContact CD1-CE2 4.17Å; I385-F541 HydrophobicContact CD1-CG 3.73Å; I385-F541 HydrophobicContact CD1-CZ 4.06Å; I385-F541 HydrophobicContact CG1-CD1 4.49Å; I385-F541 HydrophobicContact CG1-CE1 4.34Å; I385-F541 HydrophobicContact CG2-CE1 4.49Å; I385-F541 HydrophobicContact CG2-CE2 4.49Å; I385-F541 HydrophobicContact CG2-CZ 4.09Å; D402-F541 WeakPolarHBondContact O-CB 3.41Å; P403-F541 HydrophobicContact CB-CD2 3.76Å; P403-F541 HydrophobicContact CB-CE2 3.63Å; P403-F541 HydrophobicContact CB-CG 4.38Å; P403-F541 HydrophobicContact CB-CZ 4.13Å; P404-F541 VanDerWaalsContact CD-CD1 3.45Å; P404-F541 HydrophobicContact CG-CD1 4.26Å; P404-F541 HydrophobicContact CG-CE1 4.37Å; L416-F541 HydrophobicContact CD1-CE1 4.29Å; L416-F541 HydrophobicContact CD2-CE1 4.03Å; L416-F541 HydrophobicContact CD2-CZ 3.96Å; L424-F541 HydrophobicContact CD1-CE2 4.08Å; L424-F541 HydrophobicContact CD1-CZ 3.92Å; F541-L554 WeakPolarHBondContact CA-O 3.29Å; F541-L554 PolarHBondContact N-O 3.09Å
542	G	97.4	Very high	95.9	Very high	2 Å²	2	32.9 Å²	32.9	2%	0.021	18%	0.182	C	C	.	.			trans	-75.3	159.4	178.4	0	0	0	0	0	113.4	L540 L554	L540-G542 PolarHBondContact O-N 3.31Å; G542-L554 PolarHBondContact N-O 2.9Å
543	R	97	Very high	96.2	Very high	73 Å²	73	32.8 Å²	32.8	28%	0.275	18%	0.181	S	C	.	.			trans	-115.7	172.8	178.5	-59.1	-175.8	-173.8	164.2	3.9	110.3	T517 H545 N546 L558	T517-R543 PolarHBondContact O-NH1 3.46Å; R543-H545 PolarHBondContact O-N 2.77Å; R543-H545 VanDerWaalsContact O-N 3.09Å; R543-N546 WeakPolarHBondContact CA-OD1 3.46Å; R543-N546 WeakPolarHBondContact CB-OD1 3.29Å; R543-N546 PolarHBondContact N-OD1 3.46Å; R543-N546 VanDerWaalsContact O-CB 3.29Å; R543-N546 WeakPolarHBondContact O-CB 3.42Å; R543-N546 PolarHBondContact O-N 3.48Å; R543-N546 PolarHBondContact O-OD1 3.22Å; R543-L558 VanDerWaalsContact C-CD2 3.49Å
544	P	96.9	Very high	96.6	Very high	81 Å²	81	30.2 Å²	30.2	53%	0.526	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-55	-31.5	-177.5	-30.8	37.4	0	0	0	115.4	N546 V547 Q557 L558	P544-N546 PolarHBondContact O-N 3.47Å; P544-V547 WeakPolarHBondContact O-CG2 3.3Å; P544-V547 PolarHBondContact O-N 3.03Å; P544-Q557 WeakPolarHBondContact CD-O 3.48Å; P544-Q557 WeakPolarHBondContact CG-O 3.18Å; P544-L558 HydrophobicContact CG-CD2 4.34Å
545	H	93.8	Very high	97	Very high	69 Å²	69	27.7 Å²	27.7	32%	0.319	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-73.5	-14.1	177.4	64.2	-102.9	0	0	0	114.1	H519 R543	H519-H545 AromaticContact CD2-CD2 3.45Å; H519-H545 PolarHBondContact CD2-CD2 2.79Å; H519-H545 VanDerWaalsContact CD2-CD2 3.45Å; H519-H545 AromaticContact CD2-NE2 3.24Å; H519-H545 PolarHBondContact CD2-NE2 3.4Å; H519-H545 AromaticContact CE1-CD2 3.62Å; H519-H545 AromaticContact CG-CD2 3.95Å; H519-H545 AromaticContact CG-NE2 3.54Å; H519-H545 AromaticContact NE2-CD2 3.27Å; H519-H545 PolarHBondContact NE2-CD2 3.22Å; H519-H545 VanDerWaalsContact NE2-CD2 3.27Å; H519-H545 AromaticContact NE2-NE2 3.61Å; R543-H545 PolarHBondContact O-N 2.77Å; R543-H545 VanDerWaalsContact O-N 3.09Å
546	N	97.1	Very high	97.1	Very high	11 Å²	11	31.8 Å²	31.8	6%	0.059	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-87.5	-7.2	179.4	-60.1	110.3	0	0	0	113	Y525 E539 R543 P544 Q548 T553	Y525-N546 VanDerWaalsContact OH-CB 3.26Å; Y525-N546 WeakPolarHBondContact OH-CB 3.46Å; Y525-N546 PolarHBondContact OH-ND2 2.93Å; E539-N546 WeakPolarHBondContact OE1-CB 3.37Å; E539-N546 PolarHBondContact OE1-ND2 3.04Å; R543-N546 WeakPolarHBondContact CA-OD1 3.46Å; R543-N546 WeakPolarHBondContact CB-OD1 3.29Å; R543-N546 PolarHBondContact N-OD1 3.46Å; R543-N546 VanDerWaalsContact O-CB 3.29Å; R543-N546 WeakPolarHBondContact O-CB 3.42Å; R543-N546 PolarHBondContact O-N 3.48Å; R543-N546 PolarHBondContact O-OD1 3.22Å; P544-N546 PolarHBondContact O-N 3.47Å; N546-Q548 WeakPolarHBondContact O-CG 3.22Å; N546-Q548 PolarHBondContact O-N 3.23Å; N546-T553 HydrophobicContact CB-CG2 4.33Å
547	V	96.8	Very high	97.2	Very high	31 Å²	31	32.6 Å²	32.6	19%	0.188	17%	0.167	C	C	.	.			trans	-70.1	116.9	-176.4	175.3	0	0	0	0	109.3	S378 W380 P544 T553 L558	S378-V547 VanDerWaalsContact OG-CG1 3.27Å; S378-V547 WeakPolarHBondContact OG-CG1 3.4Å; W380-V547 HydrophobicContact CB-CG2 4.47Å; W380-V547 HydrophobicContact CD2-CG1 4.49Å; W380-V547 HydrophobicContact CE3-CG1 3.55Å; W380-V547 HydrophobicContact CE3-CG2 4.34Å; W380-V547 HydrophobicContact CZ3-CG1 3.84Å; P544-V547 WeakPolarHBondContact O-CG2 3.3Å; P544-V547 PolarHBondContact O-N 3.03Å; V547-T553 HydrophobicContact CG2-CG2 4.48Å; V547-L558 HydrophobicContact CG2-CD2 4.01Å
548	Q	93.3	Very high	97.1	Very high	61 Å²	61	33.1 Å²	33.1	29%	0.285	17%	0.17	S	C	.	.			trans	-134.6	153.6	-172	-67.8	-68.2	-14.1	0	0	111.8	S378 Y525 N546 W551	S378-Q548 WeakPolarHBondContact CA-O 3.19Å; S378-Q548 WeakPolarHBondContact CB-O 3.35Å; Y525-Q548 HydrophobicContact CD1-CG 4.02Å; Y525-Q548 HydrophobicContact CD2-CG 4.37Å; Y525-Q548 HydrophobicContact CE1-CG 4.08Å; Y525-Q548 HydrophobicContact CE2-CG 4.45Å; Y525-Q548 HydrophobicContact CG-CG 4.19Å; N546-Q548 WeakPolarHBondContact O-CG 3.22Å; N546-Q548 PolarHBondContact O-N 3.23Å; Q548-W551 HydrophobicContact CB-CB 4.32Å; Q548-W551 HydrophobicContact CB-CG 4.1Å; Q548-W551 WeakPolarHBondContact O-CB 3.08Å; Q548-W551 PolarHBondContact O-N 3.09Å
549	P	94.3	Very high	97.1	Very high	50 Å²	50	39.9 Å²	39.9	33%	0.325	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	145.6	172.5	-21.4	32.6	0	0	0	112	L375 F376 W551	L375-P549 HydrophobicContact CB-CB 3.94Å; L375-P549 HydrophobicContact CD1-CB 4.22Å; L375-P549 HydrophobicContact CD1-CG 4.5Å; F376-P549 CarbonylContact O-C 3.55Å; F376-P549 VanDerWaalsContact O-CA 3.25Å; F376-P549 WeakPolarHBondContact O-CA 3.41Å; F376-P549 WeakPolarHBondContact O-CB 3.48Å; P549-W551 PolarHBondContact O-N 3.02Å
550	N	95.8	Very high	97	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.064	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	-2.4	-172	-55.3	-31.6	0	0	0	115.8	L375 F376 E529 K537	L375-N550 VanDerWaalsContact CD2-ND2 3.26Å; L375-N550 WeakPolarHBondContact CD2-ND2 3.49Å; F376-N550 PolarHBondContact N-OD1 2.95Å; F376-N550 PolarHBondContact O-N 3.34Å; E529-N550 PolarHBondContact OE1-ND2 3.5Å; K537-N550 PolarHBondContact N-O 2.96Å
551	W	98.3	Very high	96.9	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.015	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	140.4	178.4	-67.2	81.8	0	0	0	112.1	Q379 V398 M400 Y525 I528 K537 I538 E539 Q548 P549	Q379-W551 PolarHBondContact N-O 3.18Å; Q379-W551 VanDerWaalsContact N-O 3.17Å; V398-W551 HydrophobicContact CG1-CH2 4.43Å; M400-W551 HydrophobicContact CB-CH2 3.94Å; M400-W551 HydrophobicContact CB-CZ3 3.79Å; M400-W551 HydrophobicContact CE-CH2 4.14Å; M400-W551 HydrophobicContact CE-CZ3 4.26Å; M400-W551 HydrophobicContact SD-CH2 4.5Å; Y525-W551 HydrophobicContact CD1-CD2 4.46Å; Y525-W551 AromaticContact CD1-CE2 3.78Å; Y525-W551 HydrophobicContact CD1-CH2 4.46Å; Y525-W551 AromaticContact CD1-CZ2 3.79Å; Y525-W551 HydrophobicContact CD1-CZ2 3.79Å; Y525-W551 AromaticContact CD1-NE1 3.9Å; Y525-W551 HydrophobicContact CE1-CD2 4.47Å; Y525-W551 HydrophobicContact CE1-CZ2 4.28Å; I528-W551 HydrophobicContact CB-CZ2 4.3Å; I528-W551 HydrophobicContact CD1-CH2 3.89Å; I528-W551 HydrophobicContact CD1-CZ2 4.14Å; I528-W551 HydrophobicContact CG2-CH2 4.13Å; I528-W551 HydrophobicContact CG2-CZ2 3.73Å; K537-W551 HydrophobicContact CB-CD2 3.47Å; K537-W551 VanDerWaalsContact CB-CD2 3.47Å; K537-W551 HydrophobicContact CB-CE3 3.56Å; K537-W551 HydrophobicContact CB-CG 4.03Å; K537-W551 HydrophobicContact CB-CH2 4.04Å; K537-W551 HydrophobicContact CB-CZ2 3.95Å; K537-W551 HydrophobicContact CB-CZ3 3.85Å; K537-W551 HydrophobicContact CD-CD2 4.21Å; K537-W551 VanDerWaalsContact CD-CE2 3.47Å; K537-W551 HydrophobicContact CD-CH2 4.22Å; K537-W551 HydrophobicContact CD-CZ2 3.49Å; K537-W551 VanDerWaalsContact CD-CZ2 3.49Å; K537-W551 HydrophobicContact CG-CD2 4.45Å; K537-W551 HydrophobicContact CG-CZ2 4.31Å; K537-W551 CarbonylContact O-C 3.52Å; K537-W551 WeakPolarHBondContact O-CA 3.2Å; I538-W551 WeakPolarHBondContact O-CZ3 3.17Å; E539-W551 HydrophobicContact CB-CE3 3.81Å; E539-W551 HydrophobicContact CB-CZ3 4Å; Q548-W551 HydrophobicContact CB-CB 4.32Å; Q548-W551 HydrophobicContact CB-CG 4.1Å; Q548-W551 WeakPolarHBondContact O-CB 3.08Å; Q548-W551 PolarHBondContact O-N 3.09Å; P549-W551 PolarHBondContact O-N 3.02Å
552	I	98.6	Very high	96.9	Very high	3 Å²	3	46 Å²	46	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	121.2	157.1	-66.4	177.5	0	0	0	107.4	Q379 F396 K537 I538 E539 L554	Q379-I552 HydrophobicContact CB-CG1 3.88Å; Q379-I552 CarbonylContact O-C 3.57Å; Q379-I552 WeakPolarHBondContact O-CA 3.49Å; F396-I552 HydrophobicContact CE1-CB 4.38Å; F396-I552 HydrophobicContact CE1-CD1 3.92Å; F396-I552 HydrophobicContact CE1-CG1 4.33Å; F396-I552 HydrophobicContact CZ-CD1 3.89Å; K537-I552 PolarHBondContact O-N 3.31Å; I538-I552 CarbonylContact C-O 3.44Å; I538-I552 VanDerWaalsContact CA-O 3.31Å; I538-I552 WeakPolarHBondContact CA-O 3.43Å; I538-I552 HydrophobicContact CG1-CB 4.4Å; I538-I552 WeakPolarHBondContact CG1-O 3.28Å; E539-I552 PolarHBondContact N-O 2.68Å; I552-L554 HydrophobicContact CG2-CD2 4.04Å
553	T	98.8	Very high	96.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.3	179.2	-49.1	0	0	0	0	110.3	Q379 W380 I381 E539 N546 V547 L558	Q379-T553 PolarHBondContact O-N 3.45Å; W380-T553 CarbonylContact C-O 3.36Å; W380-T553 WeakPolarHBondContact CA-O 3.24Å; W380-T553 WeakPolarHBondContact CB-O 3.44Å; I381-T553 PolarHBondContact N-O 3.05Å; E539-T553 HydrophobicContact CB-CG2 4.43Å; N546-T553 HydrophobicContact CB-CG2 4.33Å; V547-T553 HydrophobicContact CG2-CG2 4.48Å; T553-L558 HydrophobicContact CG2-CD1 3.97Å; T553-L558 HydrophobicContact CG2-CD2 4.24Å; T553-L558 VanDerWaalsContact O-CD1 3.28Å; T553-L558 WeakPolarHBondContact O-CD1 3.34Å
554	L	98.7	Very high	96.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	132.4	176.4	-56.2	-173.6	0	0	0	110.4	I381 I385 L388 L393 I538 E539 L540 F541 G542 I552	I381-L554 HydrophobicContact CB-CD2 3.66Å; I381-L554 HydrophobicContact CD1-CD2 3.95Å; I381-L554 HydrophobicContact CG1-CD2 3.85Å; I385-L554 HydrophobicContact CD1-CB 4.15Å; I385-L554 HydrophobicContact CG1-CB 4.39Å; L388-L554 HydrophobicContact CD2-CD1 3.6Å; L388-L554 HydrophobicContact CD2-CD2 3.93Å; L388-L554 HydrophobicContact CD2-CG 4.41Å; L393-L554 HydrophobicContact CD1-CD1 3.8Å; L393-L554 HydrophobicContact CD1-CD2 4.41Å; I538-L554 HydrophobicContact CD1-CD1 3.85Å; I538-L554 HydrophobicContact CD1-CG 4.2Å; I538-L554 HydrophobicContact CG1-CG 4.45Å; E539-L554 PolarHBondContact O-N 3.48Å; L540-L554 HydrophobicContact CD2-CB 4.2Å; L540-L554 HydrophobicContact CD2-CD1 3.62Å; L540-L554 HydrophobicContact CD2-CG 4.18Å; F541-L554 WeakPolarHBondContact CA-O 3.29Å; F541-L554 PolarHBondContact N-O 3.09Å; G542-L554 PolarHBondContact N-O 2.9Å; I552-L554 HydrophobicContact CG2-CD2 4.04Å
555	G	97.9	Very high	96.8	Very high	1 Å²	1	44 Å²	44	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.7	153.1	-179.9	0	0	0	0	0	112.3	I381 C382 C383 Q557 L558	I381-G555 PolarHBondContact O-N 3.11Å; C382-G555 VanDerWaalsContact CA-O 3.29Å; C382-G555 WeakPolarHBondContact CA-O 3.33Å; C383-G555 PolarHBondContact N-O 3.15Å; C383-G555 CarbonylContact O-C 3.52Å; G555-Q557 VanDerWaalsContact C-N 3.28Å; G555-Q557 PolarHBondContact O-N 3.39Å; G555-L558 VanDerWaalsContact N-CD1 3.28Å
556	N	96.9	Very high	96.9	Very high	123 Å²	123	45.4 Å²	45.4	66%	0.658	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-1.9	-176	64.6	-8.2	0	0	0	114.2	C383	C383-N556 PolarHBondContact O-N 2.81Å
557	Q	96.5	Very high	96.9	Very high	115 Å²	115	50.2 Å²	50.2	54%	0.537	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	8.9	177.5	-64.5	-174.2	-37.3	0	0	112.8	P544 G555	P544-Q557 WeakPolarHBondContact CD-O 3.48Å; P544-Q557 WeakPolarHBondContact CG-O 3.18Å; G555-Q557 VanDerWaalsContact C-N 3.28Å; G555-Q557 PolarHBondContact O-N 3.39Å
558	L	97.7	Very high	96.9	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.052	26%	0.264	C	S	.	.	S	Bend	trans	-83.2	156.9	178	-63.1	165.1	0	0	0	110.4	W380 C382 R543 P544 V547 T553 G555 G560	W380-L558 HydrophobicContact CB-CD1 4.04Å; W380-L558 HydrophobicContact CB-CD2 4.49Å; C382-L558 HydrophobicContact CB-CB 4.12Å; C382-L558 VanDerWaalsContact CB-O 3.27Å; C382-L558 WeakPolarHBondContact CB-O 3.29Å; C382-L558 PolarHBondContact SG-O 3.31Å; R543-L558 VanDerWaalsContact C-CD2 3.49Å; P544-L558 HydrophobicContact CG-CD2 4.34Å; V547-L558 HydrophobicContact CG2-CD2 4.01Å; T553-L558 HydrophobicContact CG2-CD1 3.97Å; T553-L558 HydrophobicContact CG2-CD2 4.24Å; T553-L558 VanDerWaalsContact O-CD1 3.28Å; T553-L558 WeakPolarHBondContact O-CD1 3.34Å; G555-L558 VanDerWaalsContact N-CD1 3.28Å; L558-G560 PolarHBondContact O-N 2.83Å
559	D	97.3	Very high	97.1	Very high	143 Å²	143	47.6 Å²	47.6	77%	0.765	26%	0.262	S	S	*	.			trans	-89.9	95.4	-179.1	-172.6	20.7	0	0	0	110.8	W380	W380-D559 PolarHBondContact NE1-O 3Å
560	G	96.9	Very high	97.3	Very high	37 Å²	37	48 Å²	48	38%	0.381	27%	0.269	S	S	.	.	S	Bend	trans	62.3	-146.2	177.3	0	0	0	0	0	113.9	C382 L558	C382-G560 WeakPolarHBondContact CB-O 3.32Å; C382-G560 PolarHBondContact N-O 3.43Å; L558-G560 PolarHBondContact O-N 2.83Å
561	I	97.8	Very high	97.4	Very high	70 Å²	70	50.8 Å²	50.8	36%	0.359	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	125	-176.2	-55.7	-178.9	0	0	0	108.6	I381 L563 F572 I581	I381-I561 HydrophobicContact CG1-CG2 4.29Å; I381-I561 HydrophobicContact CG2-CD1 4.09Å; I381-I561 HydrophobicContact CG2-CG1 3.98Å; I381-I561 HydrophobicContact CG2-CG2 4.35Å; I561-L563 HydrophobicContact CG2-CD1 3.99Å; I561-L563 HydrophobicContact CG2-CG 3.99Å; I561-F572 HydrophobicContact CD1-CE1 4.26Å; I561-F572 HydrophobicContact CD1-CE2 4.14Å; I561-F572 HydrophobicContact CD1-CZ 3.49Å; I561-F572 VanDerWaalsContact CD1-CZ 3.49Å; I561-F572 HydrophobicContact CG2-CZ 4.43Å; I561-I581 HydrophobicContact CD1-CD1 4.13Å
562	H	97.9	Very high	97.3	Very high	71 Å²	71	51.5 Å²	51.5	33%	0.329	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	101.5	178.1	-171	78.9	0	0	0	109.9	Q379 W380	Q379-H562 CarbonylContact C-O 3.58Å; Q379-H562 WeakPolarHBondContact CA-O 3.27Å; Q379-H562 WeakPolarHBondContact CB-O 3.29Å; W380-H562 HydrophobicContact CD2-CB 3.57Å; W380-H562 HydrophobicContact CE3-CB 3.9Å; W380-H562 AromaticContact CE3-CD2 3.98Å; W380-H562 HydrophobicContact CG-CB 4.19Å; W380-H562 HydrophobicContact CH2-CB 3.7Å; W380-H562 AromaticContact CH2-CD2 3.52Å; W380-H562 AromaticContact CH2-CG 3.52Å; W380-H562 HydrophobicContact CZ2-CB 3.36Å; W380-H562 AromaticContact CZ2-CG 3.67Å; W380-H562 HydrophobicContact CZ3-CB 3.95Å; W380-H562 AromaticContact CZ3-CD2 3.42Å; W380-H562 VanDerWaalsContact CZ3-CD2 3.42Å; W380-H562 WeakPolarHBondContact CZ3-CD2 3.48Å; W380-H562 AromaticContact CZ3-CG 3.81Å; W380-H562 PolarHBondContact N-O 3.48Å; W380-H562 PolarHBondContact O-N 2.94Å
563	L	97.5	Very high	97.3	Very high	28 Å²	28	58 Å²	58	15%	0.147	31%	0.31	C	S	.	.			trans	-123.2	136.4	-178.3	-66.2	173.9	0	0	0	109.9	Q379 I381 I561 V568 V569 F572	Q379-L563 HydrophobicContact CB-CD2 4.49Å; I381-L563 HydrophobicContact CD1-CD1 4.15Å; I381-L563 HydrophobicContact CD1-CD2 4.06Å; I381-L563 HydrophobicContact CG1-CD1 4.42Å; I381-L563 HydrophobicContact CG1-CD2 3.92Å; I381-L563 HydrophobicContact CG1-CG 4.33Å; I561-L563 HydrophobicContact CG2-CD1 3.99Å; I561-L563 HydrophobicContact CG2-CG 3.99Å; L563-V568 HydrophobicContact CD1-CG1 4.19Å; L563-V568 HydrophobicContact CD2-CG1 4.07Å; L563-V569 HydrophobicContact CB-CG2 3.66Å; L563-F572 HydrophobicContact CD1-CB 4.02Å; L563-F572 HydrophobicContact CD1-CD2 3.9Å; L563-F572 HydrophobicContact CD1-CG 3.87Å
564	L	96.3	Very high	97.2	Very high	70 Å²	70	65.8 Å²	65.8	37%	0.366	35%	0.346	S	S	.	.			trans	-126.5	-27.8	-173.7	-59.7	175.6	0	0	0	112.4	F376 P377 Q379 P566	F376-L564 HydrophobicContact CE1-CB 3.85Å; F376-L564 HydrophobicContact CZ-CB 4.12Å; P377-L564 HydrophobicContact CB-CD1 3.64Å; P377-L564 HydrophobicContact CG-CD1 4.1Å; Q379-L564 HydrophobicContact CG-CB 4.1Å; Q379-L564 HydrophobicContact CG-CD1 4.33Å; Q379-L564 HydrophobicContact CG-CG 4.18Å; L564-P566 VanDerWaalsContact O-CD 3.24Å; L564-P566 WeakPolarHBondContact O-CD 3.41Å
565	D	95.7	Very high	97	Very high	16 Å²	16	70.7 Å²	70.7	9%	0.086	37%	0.365	C	S	.	.			trans	-64.4	114.2	173.8	-176.2	-35.8	0	0	0	108.9	F376 R536 E567 V568 V569	F376-D565 HydrophobicContact CE1-CB 4.27Å; F376-D565 HydrophobicContact CZ-CB 4.21Å; R536-D565 IonicContact CZ-OD2 3.85Å; R536-D565 IonicContact NH1-OD2 2.86Å; R536-D565 PolarHBondContact NH1-OD2 2.99Å; D565-E567 PolarHBondContact O-N 2.9Å; D565-E567 PolarHBondContact OD1-N 2.86Å; D565-V568 HydrophobicContact CB-CB 4.05Å; D565-V568 HydrophobicContact CB-CG2 3.82Å; D565-V568 PolarHBondContact O-N 3.46Å; D565-V568 VanDerWaalsContact O-N 3.11Å; D565-V569 WeakPolarHBondContact O-CG2 3.44Å; D565-V569 PolarHBondContact O-N 3.3Å
566	P	96	Very high	96.9	Very high	98 Å²	98	71.3 Å²	71.3	64%	0.636	37%	0.367	S	S	*	.	H	α-helix	trans	-58.6	-33.3	-173.7	-25.5	35.1	0	0	0	113.5	L564 A570	L564-P566 VanDerWaalsContact O-CD 3.24Å; L564-P566 WeakPolarHBondContact O-CD 3.41Å; P566-A570 WeakPolarHBondContact O-CB 3.39Å; P566-A570 PolarHBondContact O-N 2.81Å
567	E	96.3	Very high	96.7	Very high	112 Å²	112	70.4 Å²	70.4	52%	0.523	37%	0.367	S	S	.	.	H	α-helix	trans	-71.8	-41.3	179.2	-61.9	-171.7	177.6	0	0	111.5	D565 V569 A570 R571	D565-E567 PolarHBondContact O-N 2.9Å; D565-E567 PolarHBondContact OD1-N 2.86Å; E567-V569 VanDerWaalsContact C-N 3.34Å; E567-A570 PolarHBondContact O-N 3.4Å; E567-R571 WeakPolarHBondContact O-CG 3.3Å; E567-R571 PolarHBondContact O-N 3.05Å; E567-R571 IonicContact OE2-NH1 3.79Å; E567-R571 PolarHBondContact OE2-NH1 3.36Å; E567-R571 IonicContact OE2-NH2 2.92Å
568	V	97.1	Very high	96.6	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-65.9	-41.9	176.4	-178.3	0	0	0	0	109.8	L393 L563 D565 A570 R571 F572	L393-V568 HydrophobicContact CD2-CG1 4.07Å; L563-V568 HydrophobicContact CD1-CG1 4.19Å; L563-V568 HydrophobicContact CD2-CG1 4.07Å; D565-V568 HydrophobicContact CB-CB 4.05Å; D565-V568 HydrophobicContact CB-CG2 3.82Å; D565-V568 PolarHBondContact O-N 3.46Å; D565-V568 VanDerWaalsContact O-N 3.11Å; V568-A570 VanDerWaalsContact C-N 3.35Å; V568-A570 PolarHBondContact O-N 3.34Å; V568-R571 PolarHBondContact O-N 3.28Å; V568-F572 WeakPolarHBondContact O-CB 3.42Å; V568-F572 PolarHBondContact O-N 3.45Å
569	V	97.6	Very high	96.1	Very high	37 Å²	37	73 Å²	73	22%	0.224	39%	0.393	C	S	.	.	H	α-helix	trans	-60	-44	175.5	171.9	0	0	0	0	111.4	L563 D565 E567 F572 K573	L563-V569 HydrophobicContact CB-CG2 3.66Å; D565-V569 WeakPolarHBondContact O-CG2 3.44Å; D565-V569 PolarHBondContact O-N 3.3Å; E567-V569 VanDerWaalsContact C-N 3.34Å; V569-F572 PolarHBondContact O-N 3.28Å; V569-K573 HydrophobicContact CG1-CD 4.23Å; V569-K573 WeakPolarHBondContact O-CG 3.4Å; V569-K573 PolarHBondContact O-N 3.4Å
570	A	97.7	Very high	95.8	Very high	57 Å²	57	70.9 Å²	70.9	47%	0.471	39%	0.385	S	S	.	.	H	α-helix	trans	-62.5	-51.3	178.6	0	0	0	0	0	111.7	P566 E567 V568 F572 K573 E574	P566-A570 WeakPolarHBondContact O-CB 3.39Å; P566-A570 PolarHBondContact O-N 2.81Å; E567-A570 PolarHBondContact O-N 3.4Å; V568-A570 VanDerWaalsContact C-N 3.35Å; V568-A570 PolarHBondContact O-N 3.34Å; A570-F572 VanDerWaalsContact C-N 3.3Å; A570-F572 PolarHBondContact O-N 3.42Å; A570-K573 PolarHBondContact O-N 3.11Å; A570-E574 PolarHBondContact O-N 3.1Å
571	R	97.9	Very high	95.7	Very high	71 Å²	71	70.6 Å²	70.6	27%	0.268	38%	0.375	S	S	.	.	H	α-helix	trans	-62.6	-36.7	177.6	-68.5	-174.1	-65.7	-100.7	-2	112.2	I392 E567 V568 E574 R575	I392-R571 HydrophobicContact CB-CB 3.99Å; I392-R571 HydrophobicContact CG2-CB 4.49Å; I392-R571 PolarHBondContact O-NE 3.46Å; I392-R571 PolarHBondContact O-NH2 3Å; E567-R571 WeakPolarHBondContact O-CG 3.3Å; E567-R571 PolarHBondContact O-N 3.05Å; E567-R571 IonicContact OE2-NH1 3.79Å; E567-R571 PolarHBondContact OE2-NH1 3.36Å; E567-R571 IonicContact OE2-NH2 2.92Å; V568-R571 PolarHBondContact O-N 3.28Å; R571-E574 PolarHBondContact O-N 3.39Å; R571-R575 VanDerWaalsContact O-CB 3.29Å; R571-R575 WeakPolarHBondContact O-CB 3.09Å; R571-R575 PolarHBondContact O-N 2.98Å
572	F	97.4	Very high	95.2	Very high	19 Å²	19	70.6 Å²	70.6	8%	0.083	38%	0.381	C	S	.	.	H	α-helix	trans	-63.3	-48.1	176.1	-175.3	-84.5	0	0	0	111.6	I381 I392 I561 L563 V568 V569 A570 E574 R575 Y576 I581	I381-F572 HydrophobicContact CD1-CD2 4.44Å; I381-F572 HydrophobicContact CD1-CE2 4.47Å; I392-F572 HydrophobicContact CD1-CB 4.34Å; I392-F572 HydrophobicContact CD1-CD2 3.68Å; I392-F572 HydrophobicContact CD1-CE2 4.45Å; I392-F572 HydrophobicContact CD1-CG 4.44Å; I561-F572 HydrophobicContact CD1-CE1 4.26Å; I561-F572 HydrophobicContact CD1-CE2 4.14Å; I561-F572 HydrophobicContact CD1-CZ 3.49Å; I561-F572 VanDerWaalsContact CD1-CZ 3.49Å; I561-F572 HydrophobicContact CG2-CZ 4.43Å; L563-F572 HydrophobicContact CD1-CB 4.02Å; L563-F572 HydrophobicContact CD1-CD2 3.9Å; L563-F572 HydrophobicContact CD1-CG 3.87Å; V568-F572 WeakPolarHBondContact O-CB 3.42Å; V568-F572 PolarHBondContact O-N 3.45Å; V569-F572 PolarHBondContact O-N 3.28Å; A570-F572 VanDerWaalsContact C-N 3.3Å; A570-F572 PolarHBondContact O-N 3.42Å; F572-E574 VanDerWaalsContact C-N 3.32Å; F572-E574 PolarHBondContact O-N 2.82Å; F572-R575 PolarHBondContact O-N 3.29Å; F572-Y576 HydrophobicContact CD2-CD2 4.01Å; F572-Y576 AromaticContact CE2-CD2 3.77Å; F572-Y576 HydrophobicContact CE2-CD2 3.77Å; F572-Y576 HydrophobicContact CE2-CE2 4.41Å; F572-Y576 HydrophobicContact CZ-CD2 4.12Å; F572-Y576 HydrophobicContact CZ-CG 4.42Å; F572-Y576 PolarHBondContact O-N 3.44Å; F572-I581 HydrophobicContact CE2-CD1 4.15Å; F572-I581 HydrophobicContact CE2-CG1 4.39Å; F572-I581 HydrophobicContact CZ-CD1 4.37Å; F572-I581 HydrophobicContact CZ-CG1 4.43Å
573	K	96.6	Very high	94.7	Very high	139 Å²	139	73.4 Å²	73.4	60%	0.604	39%	0.392	S	S	*	.	H	α-helix	trans	-64.1	-36.3	178.4	-74.5	178.4	178.6	179.6	0	112.8	V569 A570 P577	V569-K573 HydrophobicContact CG1-CD 4.23Å; V569-K573 WeakPolarHBondContact O-CG 3.4Å; V569-K573 PolarHBondContact O-N 3.4Å; A570-K573 PolarHBondContact O-N 3.11Å; K573-P577 VanDerWaalsContact O-CA 3.3Å; K573-P577 WeakPolarHBondContact O-CA 3.34Å
574	E	96.8	Very high	93.9	Very high	165 Å²	165	75.3 Å²	75.3	77%	0.771	41%	0.406	S	S	*	.	H	α-helix	trans	-65.8	-44.5	175	-177	177.4	-167.6	0	0	111.5	A570 R571 F572	A570-E574 PolarHBondContact O-N 3.1Å; R571-E574 PolarHBondContact O-N 3.39Å; F572-E574 VanDerWaalsContact C-N 3.32Å; F572-E574 PolarHBondContact O-N 2.82Å
575	R	95.6	Very high	92.8	Very high	103 Å²	103	80.4 Å²	80.4	39%	0.389	43%	0.428	S	S	.	.	H	α-helix	trans	-78.3	-33	-176.1	-176.5	60.6	-176	82.2	-0.9	114.1	D389 I392 R571 F572	D389-R575 HydrophobicContact CB-CG 4.33Å; D389-R575 IonicContact OD2-CZ 3.31Å; D389-R575 IonicContact OD2-NE 3.91Å; D389-R575 PolarHBondContact OD2-NE 3.14Å; D389-R575 IonicContact OD2-NH2 3Å; I392-R575 HydrophobicContact CG2-CB 3.79Å; I392-R575 HydrophobicContact CG2-CG 3.86Å; R571-R575 VanDerWaalsContact O-CB 3.29Å; R571-R575 WeakPolarHBondContact O-CB 3.09Å; R571-R575 PolarHBondContact O-N 2.98Å; F572-R575 PolarHBondContact O-N 3.29Å
576	Y	95.8	Very high	91.1	Very high	14 Å²	14	86.1 Å²	86.1	6%	0.055	46%	0.463	C	S	.	.			trans	-132	71	-176.9	-59.1	-70.5	0	0	0	110.1	L388 D389 I392 F572 D578 G579 V580 I581	L388-Y576 HydrophobicContact CD1-CE2 3.95Å; D389-Y576 WeakPolarHBondContact CB-OH 3.41Å; D389-Y576 PolarHBondContact N-OH 2.92Å; I392-Y576 HydrophobicContact CD1-CD2 4.14Å; I392-Y576 HydrophobicContact CD1-CE2 3.81Å; F572-Y576 HydrophobicContact CD2-CD2 4.01Å; F572-Y576 AromaticContact CE2-CD2 3.77Å; F572-Y576 HydrophobicContact CE2-CD2 3.77Å; F572-Y576 HydrophobicContact CE2-CE2 4.41Å; F572-Y576 HydrophobicContact CZ-CD2 4.12Å; F572-Y576 HydrophobicContact CZ-CG 4.42Å; F572-Y576 PolarHBondContact O-N 3.44Å; Y576-D578 PolarHBondContact O-N 2.96Å; Y576-G579 PolarHBondContact O-N 3.22Å; Y576-V580 WeakPolarHBondContact CD1-O 3.27Å; Y576-I581 HydrophobicContact CD1-CG1 4.29Å; Y576-I581 HydrophobicContact CD2-CG1 4.33Å; Y576-I581 HydrophobicContact CE1-CB 4.34Å; Y576-I581 HydrophobicContact CE1-CG1 4.21Å; Y576-I581 HydrophobicContact CE1-CG2 4.24Å; Y576-I581 HydrophobicContact CE2-CG1 4.22Å; Y576-I581 HydrophobicContact CG-CG1 4.35Å
577	P	93.3	Very high	88.2	Confident	103 Å²	103	93.9 Å²	93.9	67%	0.669	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-32.8	-176.1	23.3	-34	0	0	0	113.1	K573 G579	K573-P577 VanDerWaalsContact O-CA 3.3Å; K573-P577 WeakPolarHBondContact O-CA 3.34Å; P577-G579 VanDerWaalsContact C-N 3.34Å
578	D	92.8	Very high	87.8	Confident	146 Å²	146	93 Å²	93	78%	0.781	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-0.1	178.2	-55.3	-41.9	0	0	0	113.1	Y576 V580	Y576-D578 PolarHBondContact O-N 2.96Å; D578-V580 PolarHBondContact O-N 2.85Å
579	G	88.1	Confident	87.3	Confident	34 Å²	34	97.9 Å²	97.9	35%	0.351	52%	0.515	S	S	.	.	S	Bend	trans	70.6	6.6	-177.3	0	0	0	0	0	115.2	Y576 P577	Y576-G579 PolarHBondContact O-N 3.22Å; P577-G579 VanDerWaalsContact C-N 3.34Å
580	V	91.7	Very high	86.7	Confident	98 Å²	98	101.3 Å²	101.3	59%	0.594	53%	0.532	S	S	*	.			trans	-97.3	117.7	-178.8	-178	0	0	0	0	110.8	Y576 D578 S582	Y576-V580 WeakPolarHBondContact CD1-O 3.27Å; D578-V580 PolarHBondContact O-N 2.85Å; V580-S582 PolarHBondContact O-N 3.11Å
581	I	93.3	Very high	86	Confident	32 Å²	32	103.9 Å²	103.9	16%	0.164	54%	0.535	C	S	.	.			trans	-91.1	93.3	174.1	-56.5	157.5	0	0	0	108.1	I381 C383 L388 I561 F572 Y576	I381-I581 HydrophobicContact CG2-CD1 3.6Å; C383-I581 HydrophobicContact CB-CD1 3.78Å; C383-I581 HydrophobicContact CB-CG2 4.49Å; L388-I581 HydrophobicContact CB-CG2 4.29Å; L388-I581 HydrophobicContact CD1-CD1 3.93Å; L388-I581 HydrophobicContact CD1-CG1 4.26Å; L388-I581 HydrophobicContact CD1-CG2 4.14Å; I561-I581 HydrophobicContact CD1-CD1 4.13Å; F572-I581 HydrophobicContact CE2-CD1 4.15Å; F572-I581 HydrophobicContact CE2-CG1 4.39Å; F572-I581 HydrophobicContact CZ-CD1 4.37Å; F572-I581 HydrophobicContact CZ-CG1 4.43Å; Y576-I581 HydrophobicContact CD1-CG1 4.29Å; Y576-I581 HydrophobicContact CD2-CG1 4.33Å; Y576-I581 HydrophobicContact CE1-CB 4.34Å; Y576-I581 HydrophobicContact CE1-CG1 4.21Å; Y576-I581 HydrophobicContact CE1-CG2 4.24Å; Y576-I581 HydrophobicContact CE2-CG1 4.22Å; Y576-I581 HydrophobicContact CG-CG1 4.35Å
582	S	88.4	Confident	85.3	Confident	70 Å²	70	105.9 Å²	105.9	49%	0.49	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-102.6	161.9	179.7	60.2	0	0	0	0	112.1	V580	V580-S582 PolarHBondContact O-N 3.11Å
583	K	88.1	Confident	84.5	Confident	129 Å²	129	111.7 Å²	111.7	56%	0.561	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-56	128.1	174	-175.8	173.8	-179	177.9	0	109.4	Y387 H585	Y387-K583 HydrophobicContact CD1-CB 4.11Å; Y387-K583 HydrophobicContact CD1-CG 3.87Å; Y387-K583 HydrophobicContact CD2-CB 4.19Å; Y387-K583 HydrophobicContact CE1-CB 4.18Å; Y387-K583 HydrophobicContact CE1-CD 3.92Å; Y387-K583 HydrophobicContact CE1-CG 3.72Å; Y387-K583 HydrophobicContact CE2-CB 4.27Å; Y387-K583 HydrophobicContact CG-CB 4.14Å; Y387-K583 HydrophobicContact CG-CG 4.4Å; K583-H585 PolarHBondContact O-N 3.39Å
584	P	80.8	Confident	83.6	Confident	68 Å²	68	109.8 Å²	109.8	44%	0.442	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-54.6	140.1	178.5	-23.2	31.3	0	0	0	111	T586	P584-T586 PolarHBondContact O-N 3.33Å
585	H	71.8	Confident	82.6	Confident	178 Å²	178	105.5 Å²	105.5	82%	0.824	57%	0.567	S	S	*	*			trans	-67.1	105.7	170.4	-72.1	3.2	0	0	0	108.4	K583 Q587	K583-H585 PolarHBondContact O-N 3.39Å; H585-Q587 PolarHBondContact O-N 3.23Å; H585-Q587 VanDerWaalsContact O-N 3.12Å
586	T	60.6	Low	81.5	Confident	135 Å²	135	105.8 Å²	105.8	83%	0.828	58%	0.582	S	S	*	*			trans	-61	110.8	167	19.9	0	0	0	0	108.1	P584	P584-T586 PolarHBondContact O-N 3.33Å
587	Q	34.1	Very low	80.2	Confident	262 Å²	262	114.1 Å²	114.1	100%	1.224	63%	0.63	S	S	*	*			trans	-75.2	0	164.1	-74.5	-170.3	4.7	0	0	110.5	H585	H585-Q587 PolarHBondContact O-N 3.23Å; H585-Q587 VanDerWaalsContact O-N 3.12Å

Retrieved 587 of 587 residues in 773.7 ms (Link to these results)

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